data_c30497_6e5i ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID c30497_6e5i _Entry.Title ; Heterogeneous-Backbone Mimics of a Designed Disulfide-Rich Protein: Orn turn ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2018-07-20 _Entry.Accession_date 2018-07-20 _Entry.Last_release_date 2018-07-31 _Entry.Original_release_date 2018-07-31 _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' c30497_6e5i 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 C. Cabalteja C. C. . . c30497_6e5i 2 D. Mihalko D. S. . . c30497_6e5i 3 W. Horne W. S. . . c30497_6e5i stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID 'DE NOVO PROTEIN' . c30497_6e5i 'heterogeneous backbone foldamer' . c30497_6e5i stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 c30497_6e5i stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '1H chemical shifts' 201 c30497_6e5i 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 . . 2018-11-12 . original BMRB . c30497_6e5i stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 6E5I . c30497_6e5i stop_ save_ ############### # Citations # ############### save_citation_1 _Citation.Sf_category citations _Citation.Sf_framecode citation_1 _Citation.Entry_ID c30497_6e5i _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 30326175 _Citation.Full_citation . _Citation.Title ; Heterogeneous-Backbone Foldamer Mimics of a Computationally Designed, Disulfide-Rich Miniprotein ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev Chembiochem. _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 2018 _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.ORCID _Citation_author.Entry_ID _Citation_author.Citation_ID 1 C. Cabalteja C. C. . . c30497_6e5i 1 2 D. Mihalko D. S. . . c30497_6e5i 1 3 W. Horne W. S. . . c30497_6e5i 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID c30497_6e5i _Assembly.ID 1 _Assembly.Name 'Designed peptide NC_HEE_D1: Orn turn mutant' _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 . . . . . . c30497_6e5i 1 stop_ loop_ _Bond.ID _Bond.Type _Bond.Value_order _Bond.Assembly_atom_ID_1 _Bond.Entity_assembly_ID_1 _Bond.Entity_assembly_name_1 _Bond.Entity_ID_1 _Bond.Comp_ID_1 _Bond.Comp_index_ID_1 _Bond.Seq_ID_1 _Bond.Atom_ID_1 _Bond.Assembly_atom_ID_2 _Bond.Entity_assembly_ID_2 _Bond.Entity_assembly_name_2 _Bond.Entity_ID_2 _Bond.Comp_ID_2 _Bond.Comp_index_ID_2 _Bond.Seq_ID_2 _Bond.Atom_ID_2 _Bond.Auth_entity_assembly_ID_1 _Bond.Auth_entity_assembly_name_1 _Bond.Auth_asym_ID_1 _Bond.Auth_seq_ID_1 _Bond.Auth_comp_ID_1 _Bond.Auth_atom_ID_1 _Bond.Auth_entity_assembly_ID_2 _Bond.Auth_entity_assembly_name_2 _Bond.Auth_asym_ID_2 _Bond.Auth_seq_ID_2 _Bond.Auth_comp_ID_2 _Bond.Auth_atom_ID_2 _Bond.Entry_ID _Bond.Assembly_ID 1 disulfide single . 1 . 1 CYS 4 4 SG . 1 . 1 CYS 17 17 SG . . . . . . . . . . . . c30497_6e5i 1 2 disulfide single . 1 . 1 CYS 13 13 SG . 1 . 1 CYS 26 26 SG . . . . . . . . . . . . c30497_6e5i 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID c30497_6e5i _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 ; NDKCKELKKRYXCEVRCDXP RYEVHCX ; _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 yes _Entity.Nstd_chirality . _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 27 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all disulfide bound' _Entity.Src_method syn _Entity.Parent_entity_ID 1 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 3232.803 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . 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 . ASN . c30497_6e5i 1 2 . ASP . c30497_6e5i 1 3 . LYS . c30497_6e5i 1 4 . CYS . c30497_6e5i 1 5 . LYS . c30497_6e5i 1 6 . GLU . c30497_6e5i 1 7 . LEU . c30497_6e5i 1 8 . LYS . c30497_6e5i 1 9 . LYS . c30497_6e5i 1 10 . ARG . c30497_6e5i 1 11 . TYR . c30497_6e5i 1 12 . ORN . c30497_6e5i 1 13 . CYS . c30497_6e5i 1 14 . GLU . c30497_6e5i 1 15 . VAL . c30497_6e5i 1 16 . ARG . c30497_6e5i 1 17 . CYS . c30497_6e5i 1 18 . ASP . c30497_6e5i 1 19 . DPR . c30497_6e5i 1 20 . PRO . c30497_6e5i 1 21 . ARG . c30497_6e5i 1 22 . TYR . c30497_6e5i 1 23 . GLU . c30497_6e5i 1 24 . VAL . c30497_6e5i 1 25 . HIS . c30497_6e5i 1 26 . CYS . c30497_6e5i 1 27 . NH2 . c30497_6e5i 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 . ASN 1 1 c30497_6e5i 1 . ASP 2 2 c30497_6e5i 1 . LYS 3 3 c30497_6e5i 1 . CYS 4 4 c30497_6e5i 1 . LYS 5 5 c30497_6e5i 1 . GLU 6 6 c30497_6e5i 1 . LEU 7 7 c30497_6e5i 1 . LYS 8 8 c30497_6e5i 1 . LYS 9 9 c30497_6e5i 1 . ARG 10 10 c30497_6e5i 1 . TYR 11 11 c30497_6e5i 1 . ORN 12 12 c30497_6e5i 1 . CYS 13 13 c30497_6e5i 1 . GLU 14 14 c30497_6e5i 1 . VAL 15 15 c30497_6e5i 1 . ARG 16 16 c30497_6e5i 1 . CYS 17 17 c30497_6e5i 1 . ASP 18 18 c30497_6e5i 1 . DPR 19 19 c30497_6e5i 1 . PRO 20 20 c30497_6e5i 1 . ARG 21 21 c30497_6e5i 1 . TYR 22 22 c30497_6e5i 1 . GLU 23 23 c30497_6e5i 1 . VAL 24 24 c30497_6e5i 1 . HIS 25 25 c30497_6e5i 1 . CYS 26 26 c30497_6e5i 1 . NH2 27 27 c30497_6e5i 1 stop_ save_ #################### # Natural source # #################### save_natural_source _Entity_natural_src_list.Sf_category natural_source _Entity_natural_src_list.Sf_framecode natural_source _Entity_natural_src_list.Entry_ID c30497_6e5i _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 . 32630 'no natural source' . 'synthetic construct' . . . . . . . . . . . . . . . . . . . . c30497_6e5i 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 c30497_6e5i _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 . 'chemical synthesis' . . . . . . . . . . . . . . . . c30497_6e5i 1 stop_ save_ ################################# # Polymer residues and ligands # ################################# save_chem_comp_ORN _Chem_comp.Sf_category chem_comp _Chem_comp.Sf_framecode chem_comp_ORN _Chem_comp.Entry_ID c30497_6e5i _Chem_comp.ID ORN _Chem_comp.Provenance PDB _Chem_comp.Name L-ornithine _Chem_comp.Type 'L-PEPTIDE LINKING' _Chem_comp.BMRB_code ORN _Chem_comp.PDB_code ORN _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 A _Chem_comp.Three_letter_code ORN _Chem_comp.Number_atoms_all 21 _Chem_comp.Number_atoms_nh 9 _Chem_comp.Atom_nomenclature_source . _Chem_comp.PubChem_code . _Chem_comp.Subcomponent_list . _Chem_comp.InChI_code InChI=1S/C5H12N2O2/c6-3-1-2-4(7)5(8)9/h4H,1-3,6-7H2,(H,8,9)/t4-/m0/s1 _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 ALA _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 0 _Chem_comp.Paramagnetic . _Chem_comp.Aromatic no _Chem_comp.Formula 'C5 H12 N2 O2' _Chem_comp.Formula_weight 132.161 _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 Corina _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 AHLPHDHHMVZTML-BYPYZUCNSA-N InChIKey InChI 1.03 c30497_6e5i ORN C(CC(C(=O)O)N)CN SMILES 'OpenEye OEToolkits' 1.7.6 c30497_6e5i ORN C(C[C@@H](C(=O)O)N)CN SMILES_CANONICAL 'OpenEye OEToolkits' 1.7.6 c30497_6e5i ORN InChI=1S/C5H12N2O2/c6-3-1-2-4(7)5(8)9/h4H,1-3,6-7H2,(H,8,9)/t4-/m0/s1 InChI InChI 1.03 c30497_6e5i ORN NCCC[C@H](N)C(O)=O SMILES_CANONICAL CACTVS 3.370 c30497_6e5i ORN NCCC[CH](N)C(O)=O SMILES CACTVS 3.370 c30497_6e5i ORN O=C(O)C(N)CCCN SMILES ACDLabs 12.01 c30497_6e5i ORN 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 '(2S)-2,5-bis(azanyl)pentanoic acid' 'SYSTEMATIC NAME' 'OpenEye OEToolkits' 1.7.6 c30497_6e5i ORN L-ornithine 'SYSTEMATIC NAME' ACDLabs 12.01 c30497_6e5i ORN 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 N N N N . N . . N 0 . . . 1 no no . . . . 60.217 . 198.291 . 50.550 . 0.747 1.775 0.281 1 . c30497_6e5i ORN CA CA CA CA . C . . S 0 . . . 1 no no . . . . 58.991 . 198.276 . 49.700 . 0.791 0.322 0.493 2 . c30497_6e5i ORN CB CB CB CB . C . . N 0 . . . 1 no no . . . . 58.217 . 196.979 . 49.925 . -0.353 -0.340 -0.275 3 . c30497_6e5i ORN CG CG CG CG . C . . N 0 . . . 1 no no . . . . 57.679 . 196.811 . 51.343 . -1.692 0.114 0.310 4 . c30497_6e5i ORN CD CD CD CD . C . . N 0 . . . 1 no no . . . . 56.975 . 195.478 . 51.502 . -2.836 -0.549 -0.459 5 . c30497_6e5i ORN NE NE NE NE . N . . N 0 . . . 1 no no . . . . 56.147 . 195.435 . 52.723 . -4.121 -0.113 0.104 6 . c30497_6e5i ORN C C C C . C . . N 0 . . . 1 no no . . . . 58.092 . 199.492 . 49.963 . 2.108 -0.218 -0.001 7 . c30497_6e5i ORN O O O O . O . . N 0 . . . 1 no no . . . . 58.299 . 200.196 . 50.976 . 2.766 0.421 -0.789 8 . c30497_6e5i ORN OXT OXT OXT OXT . O . . N 0 . . . 1 no yes . . . . 57.212 . 199.757 . 49.119 . 2.551 -1.408 0.433 9 . c30497_6e5i ORN H H H H . H . . N 0 . . . 1 no no . . . . 60.718 . 199.143 . 50.398 . 0.842 2.000 -0.698 10 . c30497_6e5i ORN H2 H2 H2 H2 . H . . N 0 . . . 1 no yes . . . . 59.956 . 198.226 . 51.513 . -0.099 2.171 0.663 11 . c30497_6e5i ORN HA HA HA HA . H . . N 0 . . . 1 no no . . . . 59.300 . 198.307 . 48.645 . 0.687 0.108 1.557 12 . c30497_6e5i ORN HB2 HB2 HB2 HB2 . H . . N 0 . . . 1 no no . . . . 57.366 . 196.960 . 49.228 . -0.300 -0.053 -1.326 13 . c30497_6e5i ORN HB3 HB3 HB3 HB3 . H . . N 0 . . . 1 no no . . . . 58.888 . 196.135 . 49.708 . -0.269 -1.424 -0.191 14 . c30497_6e5i ORN HG2 HG2 HG2 HG2 . H . . N 0 . . . 1 no no . . . . 58.517 . 196.863 . 52.054 . -1.745 -0.174 1.360 15 . c30497_6e5i ORN HG3 HG3 HG3 HG3 . H . . N 0 . . . 1 no no . . . . 56.967 . 197.622 . 51.556 . -1.776 1.197 0.225 16 . c30497_6e5i ORN HD2 HD2 HD2 HD2 . H . . N 0 . . . 1 no no . . . . 56.329 . 195.311 . 50.628 . -2.783 -0.262 -1.509 17 . c30497_6e5i ORN HD3 HD3 HD3 HD3 . H . . N 0 . . . 1 no no . . . . 57.731 . 194.681 . 51.557 . -2.751 -1.633 -0.374 18 . c30497_6e5i ORN HE1 HE1 HE1 HE1 . H . . N 0 . . . 1 no no . . . . 55.700 . 194.543 . 52.792 . -4.197 0.893 0.095 19 . c30497_6e5i ORN HE2 HE2 HE2 HE2 . H . . N 0 . . . 1 no yes . . . . 56.727 . 195.580 . 53.524 . -4.894 -0.537 -0.387 20 . c30497_6e5i ORN HXT HXT HXT HXT . H . . N 0 . . . 1 no yes . . . . 56.755 . 200.549 . 49.376 . 3.401 -1.713 0.087 21 . c30497_6e5i ORN stop_ loop_ _Chem_comp_bond.ID _Chem_comp_bond.Type _Chem_comp_bond.Value_order _Chem_comp_bond.Atom_ID_1 _Chem_comp_bond.Atom_ID_2 _Chem_comp_bond.Aromatic_flag _Chem_comp_bond.Stereo_config _Chem_comp_bond.Ordinal _Chem_comp_bond.Details _Chem_comp_bond.Entry_ID _Chem_comp_bond.Comp_ID 1 . SING N CA no N 1 . c30497_6e5i ORN 2 . SING N H no N 2 . c30497_6e5i ORN 3 . SING N H2 no N 3 . c30497_6e5i ORN 4 . SING CA CB no N 4 . c30497_6e5i ORN 5 . SING CA C no N 5 . c30497_6e5i ORN 6 . SING CA HA no N 6 . c30497_6e5i ORN 7 . SING CB CG no N 7 . c30497_6e5i ORN 8 . SING CB HB2 no N 8 . c30497_6e5i ORN 9 . SING CB HB3 no N 9 . c30497_6e5i ORN 10 . SING CG CD no N 10 . c30497_6e5i ORN 11 . SING CG HG2 no N 11 . c30497_6e5i ORN 12 . SING CG HG3 no N 12 . c30497_6e5i ORN 13 . SING CD NE no N 13 . c30497_6e5i ORN 14 . SING CD HD2 no N 14 . c30497_6e5i ORN 15 . SING CD HD3 no N 15 . c30497_6e5i ORN 16 . SING NE HE1 no N 16 . c30497_6e5i ORN 17 . SING NE HE2 no N 17 . c30497_6e5i ORN 18 . DOUB C O no N 18 . c30497_6e5i ORN 19 . SING C OXT no N 19 . c30497_6e5i ORN 20 . SING OXT HXT no N 20 . c30497_6e5i ORN stop_ save_ save_chem_comp_DPR _Chem_comp.Sf_category chem_comp _Chem_comp.Sf_framecode chem_comp_DPR _Chem_comp.Entry_ID c30497_6e5i _Chem_comp.ID DPR _Chem_comp.Provenance PDB _Chem_comp.Name D-PROLINE _Chem_comp.Type 'D-PEPTIDE LINKING' _Chem_comp.BMRB_code DPR _Chem_comp.PDB_code DPR _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 P _Chem_comp.Three_letter_code DPR _Chem_comp.Number_atoms_all 17 _Chem_comp.Number_atoms_nh 8 _Chem_comp.Atom_nomenclature_source . _Chem_comp.PubChem_code . _Chem_comp.Subcomponent_list . _Chem_comp.InChI_code InChI=1S/C5H9NO2/c7-5(8)4-2-1-3-6-4/h4,6H,1-3H2,(H,7,8)/t4-/m1/s1 _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 0 _Chem_comp.Paramagnetic . _Chem_comp.Aromatic no _Chem_comp.Formula 'C5 H9 N O2' _Chem_comp.Formula_weight 115.130 _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 yes _Chem_comp.Ideal_coordinates_details Corina _Chem_comp.Ideal_coordinates_missing_flag no _Chem_comp.Model_coordinates_db_code . _Chem_comp.Processing_site EBI _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 C1CC(NC1)C(=O)O SMILES 'OpenEye OEToolkits' 1.7.0 c30497_6e5i DPR C1C[C@@H](NC1)C(=O)O SMILES_CANONICAL 'OpenEye OEToolkits' 1.7.0 c30497_6e5i DPR InChI=1S/C5H9NO2/c7-5(8)4-2-1-3-6-4/h4,6H,1-3H2,(H,7,8)/t4-/m1/s1 InChI InChI 1.03 c30497_6e5i DPR O=C(O)C1NCCC1 SMILES ACDLabs 12.01 c30497_6e5i DPR OC(=O)[C@H]1CCCN1 SMILES_CANONICAL CACTVS 3.370 c30497_6e5i DPR OC(=O)[CH]1CCCN1 SMILES CACTVS 3.370 c30497_6e5i DPR ONIBWKKTOPOVIA-SCSAIBSYSA-N InChIKey InChI 1.03 c30497_6e5i DPR 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 '(2R)-pyrrolidine-2-carboxylic acid' 'SYSTEMATIC NAME' 'OpenEye OEToolkits' 1.7.0 c30497_6e5i DPR D-proline 'SYSTEMATIC NAME' ACDLabs 12.01 c30497_6e5i DPR 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 N N N N . N . . N 0 . . . 1 no no . . . . -4.206 . 7.451 . -17.843 . 0.814 0.974 0.670 1 . c30497_6e5i DPR CA CA CA CA . C . . R 0 . . . 1 no no . . . . -3.893 . 8.671 . -18.566 . -0.014 -0.244 0.598 2 . c30497_6e5i DPR CB CB CB CB . C . . N 0 . . . 1 no no . . . . -5.242 . 9.255 . -18.952 . 0.728 -1.247 -0.310 3 . c30497_6e5i DPR CG CG CG CG . C . . N 0 . . . 1 no no . . . . -6.239 . 8.113 . -18.840 . 2.199 -0.759 -0.242 4 . c30497_6e5i DPR CD CD CD CD . C . . N 0 . . . 1 no no . . . . -5.571 . 6.986 . -18.070 . 2.016 0.777 -0.168 5 . c30497_6e5i DPR C C C C . C . . N 0 . . . 1 no no . . . . -2.999 . 8.379 . -19.774 . -1.360 0.086 0.006 6 . c30497_6e5i DPR O O O O . O . . N 0 . . . 1 no no . . . . -3.431 . 7.734 . -20.727 . -1.509 1.105 -0.626 7 . c30497_6e5i DPR OXT OXT OXT OXT . O . . N 0 . . . 1 no yes . . . . . . . . . . -2.393 -0.753 0.180 8 . c30497_6e5i DPR H H H HT1 . H . . N 0 . . . 1 no yes . . . . -3.576 . 6.736 . -18.147 . 0.293 1.784 0.370 9 . c30497_6e5i DPR HA HA HA HA . H . . N 0 . . . 1 no no . . . . -3.318 . 9.388 . -17.962 . -0.138 -0.667 1.595 10 . c30497_6e5i DPR HB2 HB2 HB2 HB1 . H . . N 0 . . . 1 no no . . . . -5.517 . 10.078 . -18.276 . 0.639 -2.260 0.083 11 . c30497_6e5i DPR HB3 HB3 HB3 HB2 . H . . N 0 . . . 1 no no . . . . -5.215 . 9.648 . -19.979 . 0.351 -1.194 -1.331 12 . c30497_6e5i DPR HG2 HG2 HG2 HG1 . H . . N 0 . . . 1 no no . . . . -7.140 . 8.451 . -18.307 . 2.695 -1.137 0.653 13 . c30497_6e5i DPR HG3 HG3 HG3 HG2 . H . . N 0 . . . 1 no no . . . . -6.527 . 7.765 . -19.843 . 2.747 -1.045 -1.140 14 . c30497_6e5i DPR HD2 HD2 HD2 HD1 . H . . N 0 . . . 1 no no . . . . -5.580 . 6.051 . -18.650 . 1.855 1.188 -1.165 15 . c30497_6e5i DPR HD3 HD3 HD3 HD2 . H . . N 0 . . . 1 no no . . . . -6.088 . 6.796 . -17.118 . 2.885 1.241 0.299 16 . c30497_6e5i DPR HXT HXT HXT HXT . H . . N 0 . . . 1 no yes . . . . . . . . . . -3.237 -0.500 -0.219 17 . c30497_6e5i DPR stop_ loop_ _Chem_comp_bond.ID _Chem_comp_bond.Type _Chem_comp_bond.Value_order _Chem_comp_bond.Atom_ID_1 _Chem_comp_bond.Atom_ID_2 _Chem_comp_bond.Aromatic_flag _Chem_comp_bond.Stereo_config _Chem_comp_bond.Ordinal _Chem_comp_bond.Details _Chem_comp_bond.Entry_ID _Chem_comp_bond.Comp_ID 1 . SING N CA no N 1 . c30497_6e5i DPR 2 . SING N CD no N 2 . c30497_6e5i DPR 3 . SING N H no N 3 . c30497_6e5i DPR 4 . SING CA CB no N 4 . c30497_6e5i DPR 5 . SING CA C no N 5 . c30497_6e5i DPR 6 . SING CA HA no N 6 . c30497_6e5i DPR 7 . SING CB CG no N 7 . c30497_6e5i DPR 8 . SING CB HB2 no N 8 . c30497_6e5i DPR 9 . SING CB HB3 no N 9 . c30497_6e5i DPR 10 . SING CG CD no N 10 . c30497_6e5i DPR 11 . SING CG HG2 no N 11 . c30497_6e5i DPR 12 . SING CG HG3 no N 12 . c30497_6e5i DPR 13 . SING CD HD2 no N 13 . c30497_6e5i DPR 14 . SING CD HD3 no N 14 . c30497_6e5i DPR 15 . DOUB C O no N 15 . c30497_6e5i DPR 16 . SING C OXT no N 16 . c30497_6e5i DPR 17 . SING OXT HXT no N 17 . c30497_6e5i DPR stop_ save_ save_chem_comp_NH2 _Chem_comp.Sf_category chem_comp _Chem_comp.Sf_framecode chem_comp_NH2 _Chem_comp.Entry_ID c30497_6e5i _Chem_comp.ID NH2 _Chem_comp.Provenance PDB _Chem_comp.Name 'AMINO GROUP' _Chem_comp.Type NON-POLYMER _Chem_comp.BMRB_code NH2 _Chem_comp.PDB_code NH2 _Chem_comp.Ambiguous_flag yes _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 NH2 _Chem_comp.Number_atoms_all 3 _Chem_comp.Number_atoms_nh 1 _Chem_comp.Atom_nomenclature_source . _Chem_comp.PubChem_code . _Chem_comp.Subcomponent_list . _Chem_comp.InChI_code InChI=1/H3N/h1H3 _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 0 _Chem_comp.Paramagnetic . _Chem_comp.Aromatic no _Chem_comp.Formula 'H2 N' _Chem_comp.Formula_weight 16.023 _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 'OpenEye OEToolkits' _Chem_comp.Ideal_coordinates_missing_flag no _Chem_comp.Model_coordinates_db_code 2FLY _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=1/H3N/h1H3 InChI InChI 1.02b c30497_6e5i NH2 N SMILES ACDLabs 10.04 c30497_6e5i NH2 QGZKDVFQNNGYKY-UHFFFAOYAF InChIKey InChI 1.02b c30497_6e5i NH2 [NH2] SMILES CACTVS 3.341 c30497_6e5i NH2 [NH2] SMILES 'OpenEye OEToolkits' 1.5.0 c30497_6e5i NH2 [NH2] SMILES_CANONICAL CACTVS 3.341 c30497_6e5i NH2 [NH2] SMILES_CANONICAL 'OpenEye OEToolkits' 1.5.0 c30497_6e5i NH2 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 ammonia 'SYSTEMATIC NAME' ACDLabs 10.04 c30497_6e5i NH2 l^{2}-azane 'SYSTEMATIC NAME' 'OpenEye OEToolkits' 1.5.0 c30497_6e5i NH2 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 N N N N . N . . N 0 . . . 1 no no . . . . 10.091 . 8.978 . -7.810 . 0.000 0.000 0.000 1 . c30497_6e5i NH2 HN1 HN1 HN1 1HN . H . . N 0 . . . 1 no no . . . . 9.517 . 8.769 . -7.044 . -0.385 -0.545 -0.771 2 . c30497_6e5i NH2 HN2 HN2 HN2 2HN . H . . N 0 . . . 1 no no . . . . 10.323 . 9.890 . -8.082 . 1.020 0.000 0.000 3 . c30497_6e5i NH2 stop_ loop_ _Chem_comp_bond.ID _Chem_comp_bond.Type _Chem_comp_bond.Value_order _Chem_comp_bond.Atom_ID_1 _Chem_comp_bond.Atom_ID_2 _Chem_comp_bond.Aromatic_flag _Chem_comp_bond.Stereo_config _Chem_comp_bond.Ordinal _Chem_comp_bond.Details _Chem_comp_bond.Entry_ID _Chem_comp_bond.Comp_ID 1 . SING N HN1 no N 1 . c30497_6e5i NH2 2 . SING N HN2 no N 2 . c30497_6e5i NH2 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID c30497_6e5i _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details '0.2 mM NA DSS, 5.7 mM NA Designed peptide NC_HEE_D1: Orn turn mutant, 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 DSS 'natural abundance' . . . . . . 0.2 . . mM . . . . c30497_6e5i 1 2 'Designed peptide NC_HEE_D1: Orn turn mutant' 'natural abundance' 1 $assembly 1 $entity_1 . . 5.7 . . mM . . . . c30497_6e5i 1 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_1 _Sample_condition_list.Entry_ID c30497_6e5i _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' 5 . mM c30497_6e5i 1 pH 4.0 . pH c30497_6e5i 1 pressure 1 . atm c30497_6e5i 1 temperature 275 . K c30497_6e5i 1 stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Software.Sf_category software _Software.Sf_framecode software_1 _Software.Entry_ID c30497_6e5i _Software.ID 1 _Software.Type . _Software.Name SPARKY _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Goddard . . c30497_6e5i 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' c30497_6e5i 1 stop_ save_ save_software_2 _Software.Sf_category software _Software.Sf_framecode software_2 _Software.Entry_ID c30497_6e5i _Software.ID 2 _Software.Type . _Software.Name ARIA _Software.Version 2.3 _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID "Linge, O'Donoghue and Nilges" . . c30497_6e5i 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'structure calculation' c30497_6e5i 2 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 c30497_6e5i _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 700 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 c30497_6e5i _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 . 700 . . . c30497_6e5i 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 c30497_6e5i _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 NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . c30497_6e5i 1 2 '2D TOCSY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . c30497_6e5i 1 3 '2D COSY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . c30497_6e5i 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chem_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chem_shift_reference_1 _Chem_shift_reference.Entry_ID c30497_6e5i _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 0.000 internal direct 1.0 . . . . . c30497_6e5i 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 c30497_6e5i _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chem_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D NOESY' . . . c30497_6e5i 1 2 '2D TOCSY' . . . c30497_6e5i 1 3 '2D COSY' . . . c30497_6e5i 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Ambiguity_set_ID _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 1 1 ASN HA H 1 4.367 0.000 . 1 . . . . A 1 ASN HA . c30497_6e5i 1 2 . 1 1 1 1 ASN HB2 H 1 3.094 0.000 . 2 . . . . A 1 ASN HB2 . c30497_6e5i 1 3 . 1 1 1 1 ASN HB3 H 1 3.030 0.002 . 2 . . . . A 1 ASN HB3 . c30497_6e5i 1 4 . 1 1 1 1 ASN HD21 H 1 7.072 0.000 . 2 . . . . A 1 ASN HD21 . c30497_6e5i 1 5 . 1 1 1 1 ASN HD22 H 1 7.776 0.000 . 2 . . . . A 1 ASN HD22 . c30497_6e5i 1 6 . 1 1 2 2 ASP H H 1 8.895 0.001 . 1 . . . . A 2 ASP H . c30497_6e5i 1 7 . 1 1 2 2 ASP HA H 1 4.751 0.000 . 1 . . . . A 2 ASP HA . c30497_6e5i 1 8 . 1 1 2 2 ASP HB2 H 1 2.926 0.000 . 2 . . . . A 2 ASP HB2 . c30497_6e5i 1 9 . 1 1 2 2 ASP HB3 H 1 2.842 0.000 . 2 . . . . A 2 ASP HB3 . c30497_6e5i 1 10 . 1 1 3 3 LYS H H 1 8.470 0.001 . 1 . . . . A 3 LYS H . c30497_6e5i 1 11 . 1 1 3 3 LYS HA H 1 4.071 0.001 . 1 . . . . A 3 LYS HA . c30497_6e5i 1 12 . 1 1 3 3 LYS HB2 H 1 1.788 0.001 . 1 . . . . A 3 LYS HB2 . c30497_6e5i 1 13 . 1 1 3 3 LYS HB3 H 1 1.788 0.001 . 1 . . . . A 3 LYS HB3 . c30497_6e5i 1 14 . 1 1 3 3 LYS HG2 H 1 1.342 0.000 . 2 . . . . A 3 LYS HG2 . c30497_6e5i 1 15 . 1 1 3 3 LYS HG3 H 1 1.212 0.001 . 2 . . . . A 3 LYS HG3 . c30497_6e5i 1 16 . 1 1 3 3 LYS HD2 H 1 1.600 0.000 . 1 . . . . A 3 LYS HD2 . c30497_6e5i 1 17 . 1 1 3 3 LYS HD3 H 1 1.600 0.000 . 1 . . . . A 3 LYS HD3 . c30497_6e5i 1 18 . 1 1 3 3 LYS HE2 H 1 2.845 0.001 . 1 . . . . A 3 LYS HE2 . c30497_6e5i 1 19 . 1 1 3 3 LYS HE3 H 1 2.845 0.001 . 1 . . . . A 3 LYS HE3 . c30497_6e5i 1 20 . 1 1 3 3 LYS HZ1 H 1 7.587 0.000 . 1 . . . . A 3 LYS HZ1 . c30497_6e5i 1 21 . 1 1 3 3 LYS HZ2 H 1 7.587 0.000 . 1 . . . . A 3 LYS HZ2 . c30497_6e5i 1 22 . 1 1 3 3 LYS HZ3 H 1 7.587 0.000 . 1 . . . . A 3 LYS HZ3 . c30497_6e5i 1 23 . 1 1 4 4 CYS H H 1 8.384 0.000 . 1 . . . . A 4 CYS H . c30497_6e5i 1 24 . 1 1 4 4 CYS HA H 1 4.201 0.001 . 1 . . . . A 4 CYS HA . c30497_6e5i 1 25 . 1 1 4 4 CYS HB2 H 1 3.248 0.000 . 1 . . . . A 4 CYS HB2 . c30497_6e5i 1 26 . 1 1 4 4 CYS HB3 H 1 3.248 0.000 . 1 . . . . A 4 CYS HB3 . c30497_6e5i 1 27 . 1 1 5 5 LYS H H 1 7.869 0.001 . 1 . . . . A 5 LYS H . c30497_6e5i 1 28 . 1 1 5 5 LYS HA H 1 3.934 0.002 . 1 . . . . A 5 LYS HA . c30497_6e5i 1 29 . 1 1 5 5 LYS HB2 H 1 1.867 0.001 . 1 . . . . A 5 LYS HB2 . c30497_6e5i 1 30 . 1 1 5 5 LYS HB3 H 1 1.867 0.001 . 1 . . . . A 5 LYS HB3 . c30497_6e5i 1 31 . 1 1 5 5 LYS HG2 H 1 1.551 0.001 . 2 . . . . A 5 LYS HG2 . c30497_6e5i 1 32 . 1 1 5 5 LYS HG3 H 1 1.390 0.001 . 2 . . . . A 5 LYS HG3 . c30497_6e5i 1 33 . 1 1 5 5 LYS HD2 H 1 1.710 0.000 . 1 . . . . A 5 LYS HD2 . c30497_6e5i 1 34 . 1 1 5 5 LYS HD3 H 1 1.710 0.000 . 1 . . . . A 5 LYS HD3 . c30497_6e5i 1 35 . 1 1 5 5 LYS HE2 H 1 3.001 0.000 . 1 . . . . A 5 LYS HE2 . c30497_6e5i 1 36 . 1 1 5 5 LYS HE3 H 1 3.001 0.000 . 1 . . . . A 5 LYS HE3 . c30497_6e5i 1 37 . 1 1 5 5 LYS HZ1 H 1 7.567 0.000 . 1 . . . . A 5 LYS HZ1 . c30497_6e5i 1 38 . 1 1 5 5 LYS HZ2 H 1 7.567 0.000 . 1 . . . . A 5 LYS HZ2 . c30497_6e5i 1 39 . 1 1 5 5 LYS HZ3 H 1 7.567 0.000 . 1 . . . . A 5 LYS HZ3 . c30497_6e5i 1 40 . 1 1 6 6 GLU H H 1 8.054 0.000 . 1 . . . . A 6 GLU H . c30497_6e5i 1 41 . 1 1 6 6 GLU HA H 1 4.101 0.001 . 1 . . . . A 6 GLU HA . c30497_6e5i 1 42 . 1 1 6 6 GLU HB2 H 1 2.149 0.000 . 1 . . . . A 6 GLU HB2 . c30497_6e5i 1 43 . 1 1 6 6 GLU HB3 H 1 2.149 0.000 . 1 . . . . A 6 GLU HB3 . c30497_6e5i 1 44 . 1 1 6 6 GLU HG2 H 1 2.541 0.000 . 2 . . . . A 6 GLU HG2 . c30497_6e5i 1 45 . 1 1 6 6 GLU HG3 H 1 2.456 0.000 . 2 . . . . A 6 GLU HG3 . c30497_6e5i 1 46 . 1 1 7 7 LEU H H 1 8.262 0.000 . 1 . . . . A 7 LEU H . c30497_6e5i 1 47 . 1 1 7 7 LEU HA H 1 4.085 0.001 . 1 . . . . A 7 LEU HA . c30497_6e5i 1 48 . 1 1 7 7 LEU HB2 H 1 1.918 0.001 . 2 . . . . A 7 LEU HB2 . c30497_6e5i 1 49 . 1 1 7 7 LEU HB3 H 1 1.324 0.001 . 2 . . . . A 7 LEU HB3 . c30497_6e5i 1 50 . 1 1 7 7 LEU HG H 1 1.648 0.000 . 1 . . . . A 7 LEU HG . c30497_6e5i 1 51 . 1 1 7 7 LEU HD11 H 1 0.483 0.001 . 2 . . . . A 7 LEU HD11 . c30497_6e5i 1 52 . 1 1 7 7 LEU HD12 H 1 0.483 0.001 . 2 . . . . A 7 LEU HD12 . c30497_6e5i 1 53 . 1 1 7 7 LEU HD13 H 1 0.483 0.001 . 2 . . . . A 7 LEU HD13 . c30497_6e5i 1 54 . 1 1 7 7 LEU HD21 H 1 0.689 0.001 . 2 . . . . A 7 LEU HD21 . c30497_6e5i 1 55 . 1 1 7 7 LEU HD22 H 1 0.689 0.001 . 2 . . . . A 7 LEU HD22 . c30497_6e5i 1 56 . 1 1 7 7 LEU HD23 H 1 0.689 0.001 . 2 . . . . A 7 LEU HD23 . c30497_6e5i 1 57 . 1 1 8 8 LYS H H 1 8.271 0.000 . 1 . . . . A 8 LYS H . c30497_6e5i 1 58 . 1 1 8 8 LYS HA H 1 4.007 0.001 . 1 . . . . A 8 LYS HA . c30497_6e5i 1 59 . 1 1 8 8 LYS HB2 H 1 1.879 0.000 . 1 . . . . A 8 LYS HB2 . c30497_6e5i 1 60 . 1 1 8 8 LYS HB3 H 1 1.879 0.000 . 1 . . . . A 8 LYS HB3 . c30497_6e5i 1 61 . 1 1 8 8 LYS HG2 H 1 1.474 0.001 . 1 . . . . A 8 LYS HG2 . c30497_6e5i 1 62 . 1 1 8 8 LYS HG3 H 1 1.474 0.001 . 1 . . . . A 8 LYS HG3 . c30497_6e5i 1 63 . 1 1 8 8 LYS HD2 H 1 1.686 0.000 . 1 . . . . A 8 LYS HD2 . c30497_6e5i 1 64 . 1 1 8 8 LYS HD3 H 1 1.686 0.000 . 1 . . . . A 8 LYS HD3 . c30497_6e5i 1 65 . 1 1 8 8 LYS HE2 H 1 3.047 0.002 . 1 . . . . A 8 LYS HE2 . c30497_6e5i 1 66 . 1 1 8 8 LYS HE3 H 1 3.047 0.002 . 1 . . . . A 8 LYS HE3 . c30497_6e5i 1 67 . 1 1 8 8 LYS HZ1 H 1 7.616 0.000 . 1 . . . . A 8 LYS HZ1 . c30497_6e5i 1 68 . 1 1 8 8 LYS HZ2 H 1 7.616 0.000 . 1 . . . . A 8 LYS HZ2 . c30497_6e5i 1 69 . 1 1 8 8 LYS HZ3 H 1 7.616 0.000 . 1 . . . . A 8 LYS HZ3 . c30497_6e5i 1 70 . 1 1 9 9 LYS H H 1 7.651 0.000 . 1 . . . . A 9 LYS H . c30497_6e5i 1 71 . 1 1 9 9 LYS HA H 1 4.151 0.001 . 1 . . . . A 9 LYS HA . c30497_6e5i 1 72 . 1 1 9 9 LYS HB2 H 1 1.905 0.000 . 2 . . . . A 9 LYS HB2 . c30497_6e5i 1 73 . 1 1 9 9 LYS HB3 H 1 1.878 0.000 . 2 . . . . A 9 LYS HB3 . c30497_6e5i 1 74 . 1 1 9 9 LYS HG2 H 1 1.503 0.000 . 2 . . . . A 9 LYS HG2 . c30497_6e5i 1 75 . 1 1 9 9 LYS HG3 H 1 1.407 0.000 . 2 . . . . A 9 LYS HG3 . c30497_6e5i 1 76 . 1 1 9 9 LYS HD2 H 1 1.693 0.000 . 1 . . . . A 9 LYS HD2 . c30497_6e5i 1 77 . 1 1 9 9 LYS HD3 H 1 1.693 0.000 . 1 . . . . A 9 LYS HD3 . c30497_6e5i 1 78 . 1 1 9 9 LYS HE2 H 1 2.982 0.001 . 1 . . . . A 9 LYS HE2 . c30497_6e5i 1 79 . 1 1 9 9 LYS HE3 H 1 2.982 0.001 . 1 . . . . A 9 LYS HE3 . c30497_6e5i 1 80 . 1 1 9 9 LYS HZ1 H 1 7.567 0.000 . 1 . . . . A 9 LYS HZ1 . c30497_6e5i 1 81 . 1 1 9 9 LYS HZ2 H 1 7.567 0.000 . 1 . . . . A 9 LYS HZ2 . c30497_6e5i 1 82 . 1 1 9 9 LYS HZ3 H 1 7.567 0.000 . 1 . . . . A 9 LYS HZ3 . c30497_6e5i 1 83 . 1 1 10 10 ARG H H 1 8.078 0.000 . 1 . . . . A 10 ARG H . c30497_6e5i 1 84 . 1 1 10 10 ARG HA H 1 4.005 0.001 . 1 . . . . A 10 ARG HA . c30497_6e5i 1 85 . 1 1 10 10 ARG HB2 H 1 1.797 0.002 . 2 . . . . A 10 ARG HB2 . c30497_6e5i 1 86 . 1 1 10 10 ARG HB3 H 1 1.631 0.000 . 2 . . . . A 10 ARG HB3 . c30497_6e5i 1 87 . 1 1 10 10 ARG HG2 H 1 1.295 0.000 . 2 . . . . A 10 ARG HG2 . c30497_6e5i 1 88 . 1 1 10 10 ARG HG3 H 1 1.023 0.000 . 2 . . . . A 10 ARG HG3 . c30497_6e5i 1 89 . 1 1 10 10 ARG HD2 H 1 2.941 0.000 . 2 . . . . A 10 ARG HD2 . c30497_6e5i 1 90 . 1 1 10 10 ARG HD3 H 1 2.856 0.000 . 2 . . . . A 10 ARG HD3 . c30497_6e5i 1 91 . 1 1 10 10 ARG HE H 1 7.011 0.001 . 1 . . . . A 10 ARG HE . c30497_6e5i 1 92 . 1 1 11 11 TYR H H 1 8.052 0.000 . 1 . . . . A 11 TYR H . c30497_6e5i 1 93 . 1 1 11 11 TYR HA H 1 4.470 0.000 . 1 . . . . A 11 TYR HA . c30497_6e5i 1 94 . 1 1 11 11 TYR HB2 H 1 3.162 0.000 . 2 . . . . A 11 TYR HB2 . c30497_6e5i 1 95 . 1 1 11 11 TYR HB3 H 1 2.618 0.000 . 2 . . . . A 11 TYR HB3 . c30497_6e5i 1 96 . 1 1 11 11 TYR HD1 H 1 7.256 0.000 . 1 . . . . A 11 TYR HD1 . c30497_6e5i 1 97 . 1 1 11 11 TYR HD2 H 1 7.256 0.000 . 1 . . . . A 11 TYR HD2 . c30497_6e5i 1 98 . 1 1 11 11 TYR HE1 H 1 6.783 0.000 . 1 . . . . A 11 TYR HE1 . c30497_6e5i 1 99 . 1 1 11 11 TYR HE2 H 1 6.783 0.000 . 1 . . . . A 11 TYR HE2 . c30497_6e5i 1 100 . 1 1 12 12 ORN HA H 1 4.454 0.000 . 1 . . . . A 12 ORN HA . c30497_6e5i 1 101 . 1 1 12 12 ORN HB2 H 1 1.858 0.000 . 2 . . . . A 12 ORN HB3 . c30497_6e5i 1 102 . 1 1 12 12 ORN HB3 H 1 1.938 0.000 . 2 . . . . A 12 ORN HB3 . c30497_6e5i 1 103 . 1 1 12 12 ORN HD2 H 1 3.266 0.001 . 2 . . . . A 12 ORN HD3 . c30497_6e5i 1 104 . 1 1 12 12 ORN HD3 H 1 3.491 0.001 . 2 . . . . A 12 ORN HD3 . c30497_6e5i 1 105 . 1 1 12 12 ORN HE1 H 1 7.702 0.000 . 1 . . . . A 12 ORN HE1 . c30497_6e5i 1 106 . 1 1 12 12 ORN HG2 H 1 1.865 0.000 . 2 . . . . A 12 ORN HG3 . c30497_6e5i 1 107 . 1 1 12 12 ORN HG3 H 1 1.933 0.001 . 2 . . . . A 12 ORN HG3 . c30497_6e5i 1 108 . 1 1 13 13 CYS H H 1 8.510 0.001 . 1 . . . . A 13 CYS H . c30497_6e5i 1 109 . 1 1 13 13 CYS HA H 1 4.919 0.000 . 1 . . . . A 13 CYS HA . c30497_6e5i 1 110 . 1 1 13 13 CYS HB2 H 1 3.184 0.000 . 2 . . . . A 13 CYS HB2 . c30497_6e5i 1 111 . 1 1 13 13 CYS HB3 H 1 2.675 0.000 . 2 . . . . A 13 CYS HB3 . c30497_6e5i 1 112 . 1 1 14 14 GLU H H 1 8.287 0.001 . 1 . . . . A 14 GLU H . c30497_6e5i 1 113 . 1 1 14 14 GLU HA H 1 4.379 0.001 . 1 . . . . A 14 GLU HA . c30497_6e5i 1 114 . 1 1 14 14 GLU HB2 H 1 2.202 0.001 . 1 . . . . A 14 GLU HB2 . c30497_6e5i 1 115 . 1 1 14 14 GLU HB3 H 1 2.202 0.001 . 1 . . . . A 14 GLU HB3 . c30497_6e5i 1 116 . 1 1 14 14 GLU HG2 H 1 2.565 0.002 . 2 . . . . A 14 GLU HG2 . c30497_6e5i 1 117 . 1 1 14 14 GLU HG3 H 1 2.436 0.001 . 2 . . . . A 14 GLU HG3 . c30497_6e5i 1 118 . 1 1 15 15 VAL H H 1 8.456 0.000 . 1 . . . . A 15 VAL H . c30497_6e5i 1 119 . 1 1 15 15 VAL HA H 1 4.763 0.000 . 1 . . . . A 15 VAL HA . c30497_6e5i 1 120 . 1 1 15 15 VAL HB H 1 1.891 0.000 . 1 . . . . A 15 VAL HB . c30497_6e5i 1 121 . 1 1 15 15 VAL HG11 H 1 0.818 0.000 . 2 . . . . A 15 VAL HG11 . c30497_6e5i 1 122 . 1 1 15 15 VAL HG12 H 1 0.818 0.000 . 2 . . . . A 15 VAL HG12 . c30497_6e5i 1 123 . 1 1 15 15 VAL HG13 H 1 0.818 0.000 . 2 . . . . A 15 VAL HG13 . c30497_6e5i 1 124 . 1 1 15 15 VAL HG21 H 1 0.847 0.001 . 2 . . . . A 15 VAL HG21 . c30497_6e5i 1 125 . 1 1 15 15 VAL HG22 H 1 0.847 0.001 . 2 . . . . A 15 VAL HG22 . c30497_6e5i 1 126 . 1 1 15 15 VAL HG23 H 1 0.847 0.001 . 2 . . . . A 15 VAL HG23 . c30497_6e5i 1 127 . 1 1 16 16 ARG H H 1 8.923 0.001 . 1 . . . . A 16 ARG H . c30497_6e5i 1 128 . 1 1 16 16 ARG HA H 1 4.682 0.000 . 1 . . . . A 16 ARG HA . c30497_6e5i 1 129 . 1 1 16 16 ARG HB2 H 1 1.833 0.001 . 2 . . . . A 16 ARG HB2 . c30497_6e5i 1 130 . 1 1 16 16 ARG HB3 H 1 1.720 0.001 . 2 . . . . A 16 ARG HB3 . c30497_6e5i 1 131 . 1 1 16 16 ARG HG2 H 1 1.606 0.001 . 2 . . . . A 16 ARG HG2 . c30497_6e5i 1 132 . 1 1 16 16 ARG HG3 H 1 1.524 0.002 . 2 . . . . A 16 ARG HG3 . c30497_6e5i 1 133 . 1 1 16 16 ARG HD2 H 1 3.154 0.000 . 1 . . . . A 16 ARG HD2 . c30497_6e5i 1 134 . 1 1 16 16 ARG HD3 H 1 3.154 0.000 . 1 . . . . A 16 ARG HD3 . c30497_6e5i 1 135 . 1 1 16 16 ARG HE H 1 7.150 0.000 . 1 . . . . A 16 ARG HE . c30497_6e5i 1 136 . 1 1 17 17 CYS H H 1 8.940 0.000 . 1 . . . . A 17 CYS H . c30497_6e5i 1 137 . 1 1 17 17 CYS HA H 1 4.796 0.000 . 1 . . . . A 17 CYS HA . c30497_6e5i 1 138 . 1 1 17 17 CYS HB2 H 1 3.680 0.001 . 2 . . . . A 17 CYS HB2 . c30497_6e5i 1 139 . 1 1 17 17 CYS HB3 H 1 3.097 0.000 . 2 . . . . A 17 CYS HB3 . c30497_6e5i 1 140 . 1 1 18 18 ASP H H 1 8.657 0.001 . 1 . . . . A 18 ASP H . c30497_6e5i 1 141 . 1 1 18 18 ASP HA H 1 5.175 0.000 . 1 . . . . A 18 ASP HA . c30497_6e5i 1 142 . 1 1 18 18 ASP HB2 H 1 2.763 0.000 . 2 . . . . A 18 ASP HB2 . c30497_6e5i 1 143 . 1 1 18 18 ASP HB3 H 1 2.550 0.000 . 2 . . . . A 18 ASP HB3 . c30497_6e5i 1 144 . 1 1 19 19 DPR HA H 1 4.731 0.001 . 1 . . . . A 19 DPR HA . c30497_6e5i 1 145 . 1 1 19 19 DPR HB2 H 1 1.946 0.001 . 2 . . . . A 19 DPR HB2 . c30497_6e5i 1 146 . 1 1 19 19 DPR HB3 H 1 2.339 0.001 . 2 . . . . A 19 DPR HB3 . c30497_6e5i 1 147 . 1 1 19 19 DPR HD2 H 1 3.492 0.001 . 2 . . . . A 19 DPR HD2 . c30497_6e5i 1 148 . 1 1 19 19 DPR HD3 H 1 3.899 0.001 . 2 . . . . A 19 DPR HD3 . c30497_6e5i 1 149 . 1 1 19 19 DPR HG2 H 1 2.043 0.000 . 2 . . . . A 19 DPR HG2 . c30497_6e5i 1 150 . 1 1 19 19 DPR HG3 H 1 2.186 0.002 . 2 . . . . A 19 DPR HG3 . c30497_6e5i 1 151 . 1 1 20 20 PRO HA H 1 4.585 0.000 . 1 . . . . A 20 PRO HA . c30497_6e5i 1 152 . 1 1 20 20 PRO HB2 H 1 2.249 0.000 . 2 . . . . A 20 PRO HB2 . c30497_6e5i 1 153 . 1 1 20 20 PRO HB3 H 1 2.158 0.001 . 2 . . . . A 20 PRO HB3 . c30497_6e5i 1 154 . 1 1 20 20 PRO HG2 H 1 2.106 0.000 . 2 . . . . A 20 PRO HG2 . c30497_6e5i 1 155 . 1 1 20 20 PRO HG3 H 1 1.906 0.000 . 2 . . . . A 20 PRO HG3 . c30497_6e5i 1 156 . 1 1 20 20 PRO HD2 H 1 3.995 0.001 . 2 . . . . A 20 PRO HD2 . c30497_6e5i 1 157 . 1 1 20 20 PRO HD3 H 1 3.730 0.001 . 2 . . . . A 20 PRO HD3 . c30497_6e5i 1 158 . 1 1 21 21 ARG H H 1 7.625 0.001 . 1 . . . . A 21 ARG H . c30497_6e5i 1 159 . 1 1 21 21 ARG HA H 1 4.499 0.001 . 1 . . . . A 21 ARG HA . c30497_6e5i 1 160 . 1 1 21 21 ARG HB2 H 1 1.830 0.002 . 1 . . . . A 21 ARG HB2 . c30497_6e5i 1 161 . 1 1 21 21 ARG HB3 H 1 1.830 0.002 . 1 . . . . A 21 ARG HB3 . c30497_6e5i 1 162 . 1 1 21 21 ARG HG2 H 1 1.585 0.002 . 1 . . . . A 21 ARG HG2 . c30497_6e5i 1 163 . 1 1 21 21 ARG HG3 H 1 1.585 0.002 . 1 . . . . A 21 ARG HG3 . c30497_6e5i 1 164 . 1 1 21 21 ARG HD2 H 1 3.208 0.001 . 1 . . . . A 21 ARG HD2 . c30497_6e5i 1 165 . 1 1 21 21 ARG HD3 H 1 3.208 0.001 . 1 . . . . A 21 ARG HD3 . c30497_6e5i 1 166 . 1 1 21 21 ARG HE H 1 7.201 0.001 . 1 . . . . A 21 ARG HE . c30497_6e5i 1 167 . 1 1 22 22 TYR H H 1 8.216 0.002 . 1 . . . . A 22 TYR H . c30497_6e5i 1 168 . 1 1 22 22 TYR HA H 1 5.207 0.000 . 1 . . . . A 22 TYR HA . c30497_6e5i 1 169 . 1 1 22 22 TYR HB2 H 1 2.802 0.000 . 2 . . . . A 22 TYR HB2 . c30497_6e5i 1 170 . 1 1 22 22 TYR HB3 H 1 2.738 0.000 . 2 . . . . A 22 TYR HB3 . c30497_6e5i 1 171 . 1 1 22 22 TYR HD1 H 1 6.911 0.000 . 1 . . . . A 22 TYR HD1 . c30497_6e5i 1 172 . 1 1 22 22 TYR HD2 H 1 6.911 0.000 . 1 . . . . A 22 TYR HD2 . c30497_6e5i 1 173 . 1 1 22 22 TYR HE1 H 1 6.737 0.000 . 1 . . . . A 22 TYR HE1 . c30497_6e5i 1 174 . 1 1 22 22 TYR HE2 H 1 6.737 0.000 . 1 . . . . A 22 TYR HE2 . c30497_6e5i 1 175 . 1 1 23 23 GLU H H 1 8.728 0.001 . 1 . . . . A 23 GLU H . c30497_6e5i 1 176 . 1 1 23 23 GLU HA H 1 4.634 0.000 . 1 . . . . A 23 GLU HA . c30497_6e5i 1 177 . 1 1 23 23 GLU HB2 H 1 1.950 0.000 . 2 . . . . A 23 GLU HB2 . c30497_6e5i 1 178 . 1 1 23 23 GLU HB3 H 1 1.890 0.001 . 2 . . . . A 23 GLU HB3 . c30497_6e5i 1 179 . 1 1 23 23 GLU HG2 H 1 2.329 0.000 . 1 . . . . A 23 GLU HG2 . c30497_6e5i 1 180 . 1 1 23 23 GLU HG3 H 1 2.329 0.000 . 1 . . . . A 23 GLU HG3 . c30497_6e5i 1 181 . 1 1 24 24 VAL H H 1 8.652 0.001 . 1 . . . . A 24 VAL H . c30497_6e5i 1 182 . 1 1 24 24 VAL HA H 1 4.664 0.001 . 1 . . . . A 24 VAL HA . c30497_6e5i 1 183 . 1 1 24 24 VAL HB H 1 1.733 0.000 . 1 . . . . A 24 VAL HB . c30497_6e5i 1 184 . 1 1 24 24 VAL HG11 H 1 0.482 0.001 . 2 . . . . A 24 VAL HG11 . c30497_6e5i 1 185 . 1 1 24 24 VAL HG12 H 1 0.482 0.001 . 2 . . . . A 24 VAL HG12 . c30497_6e5i 1 186 . 1 1 24 24 VAL HG13 H 1 0.482 0.001 . 2 . . . . A 24 VAL HG13 . c30497_6e5i 1 187 . 1 1 24 24 VAL HG21 H 1 0.583 0.002 . 2 . . . . A 24 VAL HG21 . c30497_6e5i 1 188 . 1 1 24 24 VAL HG22 H 1 0.583 0.002 . 2 . . . . A 24 VAL HG22 . c30497_6e5i 1 189 . 1 1 24 24 VAL HG23 H 1 0.583 0.002 . 2 . . . . A 24 VAL HG23 . c30497_6e5i 1 190 . 1 1 25 25 HIS H H 1 9.175 0.000 . 1 . . . . A 25 HIS H . c30497_6e5i 1 191 . 1 1 25 25 HIS HA H 1 4.993 0.003 . 1 . . . . A 25 HIS HA . c30497_6e5i 1 192 . 1 1 25 25 HIS HB2 H 1 3.251 0.000 . 2 . . . . A 25 HIS HB2 . c30497_6e5i 1 193 . 1 1 25 25 HIS HB3 H 1 3.091 0.000 . 2 . . . . A 25 HIS HB3 . c30497_6e5i 1 194 . 1 1 25 25 HIS HD2 H 1 7.217 0.000 . 1 . . . . A 25 HIS HD2 . c30497_6e5i 1 195 . 1 1 25 25 HIS HE1 H 1 8.614 0.000 . 1 . . . . A 25 HIS HE1 . c30497_6e5i 1 196 . 1 1 26 26 CYS H H 1 9.177 0.000 . 1 . . . . A 26 CYS H . c30497_6e5i 1 197 . 1 1 26 26 CYS HA H 1 4.867 0.000 . 1 . . . . A 26 CYS HA . c30497_6e5i 1 198 . 1 1 26 26 CYS HB2 H 1 3.261 0.000 . 2 . . . . A 26 CYS HB2 . c30497_6e5i 1 199 . 1 1 26 26 CYS HB3 H 1 2.887 0.000 . 2 . . . . A 26 CYS HB3 . c30497_6e5i 1 200 . 1 1 27 27 NH2 HN1 H 1 7.219 0.000 . 2 . . . . A 27 NH2 HN1 . c30497_6e5i 1 201 . 1 1 27 27 NH2 HN2 H 1 7.723 0.000 . 2 . . . . A 27 NH2 HN2 . c30497_6e5i 1 stop_ save_ ############################## # Structure determinations # ############################## ########################## # Conformer statistics # ########################## save_conformer_statistics _Conformer_stat_list.Sf_category conformer_statistics _Conformer_stat_list.Sf_framecode conformer_statistics _Conformer_stat_list.Entry_ID c30497_6e5i _Conformer_stat_list.ID 1 _Conformer_stat_list.Conf_family_coord_set_ID 1 _Conformer_stat_list.Conf_family_coord_set_label $Original_constraints_and_structures _Conformer_stat_list.Conformer_submitted_total_num 10 save_ ##################################### # Conformer family coordinate set # ##################################### save_ensemble_of_conformers _Conformer_family_coord_set.Sf_category conformer_family_coord_set _Conformer_family_coord_set.Sf_framecode ensemble_of_conformers _Conformer_family_coord_set.Entry_ID c30497_6e5i _Conformer_family_coord_set.ID 1 loop_ _Conformer_family_refinement.Refine_method _Conformer_family_refinement.Refine_details _Conformer_family_refinement.Software_ID _Conformer_family_refinement.Software_label _Conformer_family_refinement.Entry_ID _Conformer_family_refinement.Conformer_family_coord_set_ID 1 . . . c30497_6e5i 1 stop_ loop_ _Conformer_family_software.Software_ID _Conformer_family_software.Software_label _Conformer_family_software.Method_ID _Conformer_family_software.Method_label _Conformer_family_software.Entry_ID _Conformer_family_software.Conformer_family_coord_set_ID . . . . c30497_6e5i 1 stop_ loop_ _Atom_site.Assembly_ID _Atom_site.Model_ID _Atom_site.Model_site_ID _Atom_site.ID _Atom_site.Assembly_atom_ID _Atom_site.Label_entity_assembly_ID _Atom_site.Label_entity_ID _Atom_site.Label_comp_index_ID _Atom_site.Label_comp_ID _Atom_site.Label_atom_ID _Atom_site.Type_symbol _Atom_site.Cartn_x _Atom_site.Cartn_y _Atom_site.Cartn_z _Atom_site.Cartn_x_esd _Atom_site.Cartn_y_esd _Atom_site.Cartn_z_esd _Atom_site.Occupancy _Atom_site.Occupancy_esd _Atom_site.Uncertainty _Atom_site.Ordered_flag _Atom_site.Footnote_ID _Atom_site.PDBX_label_asym_ID _Atom_site.PDBX_label_seq_ID _Atom_site.PDBX_label_comp_ID _Atom_site.PDBX_label_atom_ID _Atom_site.PDBX_formal_charge _Atom_site.PDBX_label_entity_ID _Atom_site.PDB_record_ID _Atom_site.PDB_model_num _Atom_site.PDB_strand_ID _Atom_site.PDB_ins_code _Atom_site.PDB_residue_no _Atom_site.PDB_residue_name _Atom_site.PDB_atom_name _Atom_site.Auth_entity_assembly_ID _Atom_site.Auth_asym_ID _Atom_site.Auth_chain_ID _Atom_site.Auth_seq_ID _Atom_site.Auth_comp_ID _Atom_site.Auth_atom_ID _Atom_site.Auth_alt_ID _Atom_site.Auth_atom_name _Atom_site.Details _Atom_site.Entry_ID _Atom_site.Conformer_family_coord_set_ID . 1 . 1 . 1 1 1 ASN C C -7.338 6.164 -1.600 . . . 1.0 . . . . . . . . . . . . A . 1 ASN C . . . . . . . . . c30497_6e5i 1 . 1 . 2 . 1 1 1 ASN CA C -8.790 5.915 -1.214 . . . 1.0 . . . . . . . . . . . . A . 1 ASN CA . . . . . . . . . c30497_6e5i 1 . 1 . 3 . 1 1 1 ASN CB C -9.454 4.987 -2.233 . . . 1.0 . . . . . . . . . . . . A . 1 ASN CB . . . . . . . . . c30497_6e5i 1 . 1 . 4 . 1 1 1 ASN CG C -10.855 4.574 -1.818 . . . 1.0 . . . . . . . . . . . . A . 1 ASN CG . . . . . . . . . c30497_6e5i 1 . 1 . 5 . 1 1 1 ASN H1 H -10.532 7.020 -0.928 . . . 1.0 . . . . . . . . . . . . A . 1 ASN H1 . . . . . . . . . c30497_6e5i 1 . 1 . 6 . 1 1 1 ASN H2 H -9.451 7.713 -2.029 . . . 1.0 . . . . . . . . . . . . A . 1 ASN H2 . . . . . . . . . c30497_6e5i 1 . 1 . 7 . 1 1 1 ASN H3 H -9.134 7.784 -0.371 . . . 1.0 . . . . . . . . . . . . A . 1 ASN H3 . . . . . . . . . c30497_6e5i 1 . 1 . 8 . 1 1 1 ASN HA H -8.815 5.447 -0.241 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HA . . . . . . . . . c30497_6e5i 1 . 1 . 9 . 1 1 1 ASN HB2 H -9.517 5.496 -3.181 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HB2 . . . . . . . . . c30497_6e5i 1 . 1 . 10 . 1 1 1 ASN HB3 H -8.853 4.097 -2.345 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HB3 . . . . . . . . . c30497_6e5i 1 . 1 . 11 . 1 1 1 ASN HD21 H -10.160 2.908 -0.981 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HD21 . . . . . . . . . c30497_6e5i 1 . 1 . 12 . 1 1 1 ASN HD22 H -11.871 3.145 -0.885 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HD22 . . . . . . . . . c30497_6e5i 1 . 1 . 13 . 1 1 1 ASN N N -9.527 7.195 -1.131 . . . 1.0 . . . . . . . . . . . . A . 1 ASN N . . . . . . . . . c30497_6e5i 1 . 1 . 14 . 1 1 1 ASN ND2 N -10.973 3.429 -1.163 . . . 1.0 . . . . . . . . . . . . A . 1 ASN ND2 . . . . . . . . . c30497_6e5i 1 . 1 . 15 . 1 1 1 ASN O O -6.704 5.335 -2.254 . . . 1.0 . . . . . . . . . . . . A . 1 ASN O . . . . . . . . . c30497_6e5i 1 . 1 . 16 . 1 1 1 ASN OD1 O -11.829 5.275 -2.097 . . . 1.0 . . . . . . . . . . . . A . 1 ASN OD1 . . . . . . . . . c30497_6e5i 1 . 1 . 17 . 1 1 2 ASP C C -4.453 7.218 -0.489 . . . 1.0 . . . . . . . . . . . . A . 2 ASP C . . . . . . . . . c30497_6e5i 1 . 1 . 18 . 1 1 2 ASP CA C -5.446 7.696 -1.534 . . . 1.0 . . . . . . . . . . . . A . 2 ASP CA . . . . . . . . . c30497_6e5i 1 . 1 . 19 . 1 1 2 ASP CB C -5.315 9.208 -1.696 . . . 1.0 . . . . . . . . . . . . A . 2 ASP CB . . . . . . . . . c30497_6e5i 1 . 1 . 20 . 1 1 2 ASP CG C -6.058 9.737 -2.901 . . . 1.0 . . . . . . . . . . . . A . 2 ASP CG . . . . . . . . . c30497_6e5i 1 . 1 . 21 . 1 1 2 ASP H H -7.351 7.918 -0.637 . . . 1.0 . . . . . . . . . . . . A . 2 ASP H . . . . . . . . . c30497_6e5i 1 . 1 . 22 . 1 1 2 ASP HA H -5.206 7.227 -2.475 . . . 1.0 . . . . . . . . . . . . A . 2 ASP HA . . . . . . . . . c30497_6e5i 1 . 1 . 23 . 1 1 2 ASP HB2 H -5.705 9.692 -0.816 . . . 1.0 . . . . . . . . . . . . A . 2 ASP HB2 . . . . . . . . . c30497_6e5i 1 . 1 . 24 . 1 1 2 ASP HB3 H -4.272 9.459 -1.802 . . . 1.0 . . . . . . . . . . . . A . 2 ASP HB3 . . . . . . . . . c30497_6e5i 1 . 1 . 25 . 1 1 2 ASP N N -6.811 7.314 -1.190 . . . 1.0 . . . . . . . . . . . . A . 2 ASP N . . . . . . . . . c30497_6e5i 1 . 1 . 26 . 1 1 2 ASP O O -3.247 7.405 -0.647 . . . 1.0 . . . . . . . . . . . . A . 2 ASP O . . . . . . . . . c30497_6e5i 1 . 1 . 27 . 1 1 2 ASP OD1 O -5.584 9.533 -4.036 . . . 1.0 . . . . . . . . . . . . A . 2 ASP OD1 . . . . . . . . . c30497_6e5i 1 . 1 . 28 . 1 1 2 ASP OD2 O -7.121 10.365 -2.718 . . . 1.0 . . . . . . . . . . . . A . 2 ASP OD2 . . . . . . . . . c30497_6e5i 1 . 1 . 29 . 1 1 3 LYS C C -3.172 4.986 0.965 . . . 1.0 . . . . . . . . . . . . A . 3 LYS C . . . . . . . . . c30497_6e5i 1 . 1 . 30 . 1 1 3 LYS CA C -4.074 6.036 1.597 . . . 1.0 . . . . . . . . . . . . A . 3 LYS CA . . . . . . . . . c30497_6e5i 1 . 1 . 31 . 1 1 3 LYS CB C -4.885 5.428 2.745 . . . 1.0 . . . . . . . . . . . . A . 3 LYS CB . . . . . . . . . c30497_6e5i 1 . 1 . 32 . 1 1 3 LYS CD C -4.878 4.282 4.986 . . . 1.0 . . . . . . . . . . . . A . 3 LYS CD . . . . . . . . . c30497_6e5i 1 . 1 . 33 . 1 1 3 LYS CE C -4.018 3.689 6.092 . . . 1.0 . . . . . . . . . . . . A . 3 LYS CE . . . . . . . . . c30497_6e5i 1 . 1 . 34 . 1 1 3 LYS CG C -4.029 4.844 3.858 . . . 1.0 . . . . . . . . . . . . A . 3 LYS CG . . . . . . . . . c30497_6e5i 1 . 1 . 35 . 1 1 3 LYS H H -5.921 6.515 0.679 . . . 1.0 . . . . . . . . . . . . A . 3 LYS H . . . . . . . . . c30497_6e5i 1 . 1 . 36 . 1 1 3 LYS HA H -3.461 6.836 1.980 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HA . . . . . . . . . c30497_6e5i 1 . 1 . 37 . 1 1 3 LYS HB2 H -5.517 6.194 3.169 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HB2 . . . . . . . . . c30497_6e5i 1 . 1 . 38 . 1 1 3 LYS HB3 H -5.508 4.640 2.351 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HB3 . . . . . . . . . c30497_6e5i 1 . 1 . 39 . 1 1 3 LYS HD2 H -5.482 5.077 5.399 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HD2 . . . . . . . . . c30497_6e5i 1 . 1 . 40 . 1 1 3 LYS HD3 H -5.520 3.510 4.589 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HD3 . . . . . . . . . c30497_6e5i 1 . 1 . 41 . 1 1 3 LYS HE2 H -4.662 3.338 6.881 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HE2 . . . . . . . . . c30497_6e5i 1 . 1 . 42 . 1 1 3 LYS HE3 H -3.460 2.859 5.689 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HE3 . . . . . . . . . c30497_6e5i 1 . 1 . 43 . 1 1 3 LYS HG2 H -3.422 4.050 3.451 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HG2 . . . . . . . . . c30497_6e5i 1 . 1 . 44 . 1 1 3 LYS HG3 H -3.391 5.620 4.252 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HG3 . . . . . . . . . c30497_6e5i 1 . 1 . 45 . 1 1 3 LYS HZ1 H -3.584 5.505 7.026 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HZ1 . . . . . . . . . c30497_6e5i 1 . 1 . 46 . 1 1 3 LYS HZ2 H -2.407 5.005 5.920 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HZ2 . . . . . . . . . c30497_6e5i 1 . 1 . 47 . 1 1 3 LYS HZ3 H -2.519 4.256 7.431 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HZ3 . . . . . . . . . c30497_6e5i 1 . 1 . 48 . 1 1 3 LYS N N -4.951 6.596 0.575 . . . 1.0 . . . . . . . . . . . . A . 3 LYS N . . . . . . . . . c30497_6e5i 1 . 1 . 49 . 1 1 3 LYS NZ N -3.066 4.683 6.655 . . . 1.0 . . . . . . . . . . . . A . 3 LYS NZ . . . . . . . . . c30497_6e5i 1 . 1 . 50 . 1 1 3 LYS O O -2.045 4.774 1.400 . . . 1.0 . . . . . . . . . . . . A . 3 LYS O . . . . . . . . . c30497_6e5i 1 . 1 . 51 . 1 1 4 CYS C C -1.664 4.105 -1.445 . . . 1.0 . . . . . . . . . . . . A . 4 CYS C . . . . . . . . . c30497_6e5i 1 . 1 . 52 . 1 1 4 CYS CA C -2.903 3.417 -0.876 . . . 1.0 . . . . . . . . . . . . A . 4 CYS CA . . . . . . . . . c30497_6e5i 1 . 1 . 53 . 1 1 4 CYS CB C -3.766 2.866 -2.011 . . . 1.0 . . . . . . . . . . . . A . 4 CYS CB . . . . . . . . . c30497_6e5i 1 . 1 . 54 . 1 1 4 CYS H H -4.619 4.517 -0.322 . . . 1.0 . . . . . . . . . . . . A . 4 CYS H . . . . . . . . . c30497_6e5i 1 . 1 . 55 . 1 1 4 CYS HA H -2.595 2.606 -0.236 . . . 1.0 . . . . . . . . . . . . A . 4 CYS HA . . . . . . . . . c30497_6e5i 1 . 1 . 56 . 1 1 4 CYS HB2 H -4.608 2.337 -1.590 . . . 1.0 . . . . . . . . . . . . A . 4 CYS HB2 . . . . . . . . . c30497_6e5i 1 . 1 . 57 . 1 1 4 CYS HB3 H -4.128 3.689 -2.608 . . . 1.0 . . . . . . . . . . . . A . 4 CYS HB3 . . . . . . . . . c30497_6e5i 1 . 1 . 58 . 1 1 4 CYS N N -3.682 4.351 -0.081 . . . 1.0 . . . . . . . . . . . . A . 4 CYS N . . . . . . . . . c30497_6e5i 1 . 1 . 59 . 1 1 4 CYS O O -0.549 3.581 -1.365 . . . 1.0 . . . . . . . . . . . . A . 4 CYS O . . . . . . . . . c30497_6e5i 1 . 1 . 60 . 1 1 4 CYS SG S -2.893 1.719 -3.120 . . . 1.0 . . . . . . . . . . . . A . 4 CYS SG . . . . . . . . . c30497_6e5i 1 . 1 . 61 . 1 1 5 LYS C C 0.166 6.525 -1.454 . . . 1.0 . . . . . . . . . . . . A . 5 LYS C . . . . . . . . . c30497_6e5i 1 . 1 . 62 . 1 1 5 LYS CA C -0.777 6.078 -2.557 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CA . . . . . . . . . c30497_6e5i 1 . 1 . 63 . 1 1 5 LYS CB C -1.307 7.308 -3.302 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CB . . . . . . . . . c30497_6e5i 1 . 1 . 64 . 1 1 5 LYS CD C -2.602 8.267 -5.217 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CD . . . . . . . . . c30497_6e5i 1 . 1 . 65 . 1 1 5 LYS CE C -3.611 8.010 -6.324 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CE . . . . . . . . . c30497_6e5i 1 . 1 . 66 . 1 1 5 LYS CG C -2.230 6.996 -4.472 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CG . . . . . . . . . c30497_6e5i 1 . 1 . 67 . 1 1 5 LYS H H -2.769 5.676 -1.989 . . . 1.0 . . . . . . . . . . . . A . 5 LYS H . . . . . . . . . c30497_6e5i 1 . 1 . 68 . 1 1 5 LYS HA H -0.236 5.447 -3.247 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HA . . . . . . . . . c30497_6e5i 1 . 1 . 69 . 1 1 5 LYS HB2 H -1.851 7.925 -2.603 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HB2 . . . . . . . . . c30497_6e5i 1 . 1 . 70 . 1 1 5 LYS HB3 H -0.465 7.871 -3.679 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HB3 . . . . . . . . . c30497_6e5i 1 . 1 . 71 . 1 1 5 LYS HD2 H -3.028 8.968 -4.516 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HD2 . . . . . . . . . c30497_6e5i 1 . 1 . 72 . 1 1 5 LYS HD3 H -1.708 8.691 -5.650 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HD3 . . . . . . . . . c30497_6e5i 1 . 1 . 73 . 1 1 5 LYS HE2 H -3.697 8.899 -6.929 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HE2 . . . . . . . . . c30497_6e5i 1 . 1 . 74 . 1 1 5 LYS HE3 H -3.256 7.193 -6.935 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HE3 . . . . . . . . . c30497_6e5i 1 . 1 . 75 . 1 1 5 LYS HG2 H -1.727 6.322 -5.150 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HG2 . . . . . . . . . c30497_6e5i 1 . 1 . 76 . 1 1 5 LYS HG3 H -3.129 6.531 -4.099 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HG3 . . . . . . . . . c30497_6e5i 1 . 1 . 77 . 1 1 5 LYS HZ1 H -4.908 6.765 -5.271 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HZ1 . . . . . . . . . c30497_6e5i 1 . 1 . 78 . 1 1 5 LYS HZ2 H -5.640 7.574 -6.559 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HZ2 . . . . . . . . . c30497_6e5i 1 . 1 . 79 . 1 1 5 LYS HZ3 H -5.278 8.411 -5.130 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HZ3 . . . . . . . . . c30497_6e5i 1 . 1 . 80 . 1 1 5 LYS N N -1.866 5.301 -1.990 . . . 1.0 . . . . . . . . . . . . A . 5 LYS N . . . . . . . . . c30497_6e5i 1 . 1 . 81 . 1 1 5 LYS NZ N -4.950 7.663 -5.786 . . . 1.0 . . . . . . . . . . . . A . 5 LYS NZ . . . . . . . . . c30497_6e5i 1 . 1 . 82 . 1 1 5 LYS O O 1.383 6.487 -1.611 . . . 1.0 . . . . . . . . . . . . A . 5 LYS O . . . . . . . . . c30497_6e5i 1 . 1 . 83 . 1 1 6 GLU C C 1.287 6.280 1.312 . . . 1.0 . . . . . . . . . . . . A . 6 GLU C . . . . . . . . . c30497_6e5i 1 . 1 . 84 . 1 1 6 GLU CA C 0.361 7.386 0.819 . . . 1.0 . . . . . . . . . . . . A . 6 GLU CA . . . . . . . . . c30497_6e5i 1 . 1 . 85 . 1 1 6 GLU CB C -0.576 7.826 1.945 . . . 1.0 . . . . . . . . . . . . A . 6 GLU CB . . . . . . . . . c30497_6e5i 1 . 1 . 86 . 1 1 6 GLU CD C -2.386 9.409 2.710 . . . 1.0 . . . . . . . . . . . . A . 6 GLU CD . . . . . . . . . c30497_6e5i 1 . 1 . 87 . 1 1 6 GLU CG C -1.419 9.043 1.604 . . . 1.0 . . . . . . . . . . . . A . 6 GLU CG . . . . . . . . . c30497_6e5i 1 . 1 . 88 . 1 1 6 GLU H H -1.394 6.923 -0.271 . . . 1.0 . . . . . . . . . . . . A . 6 GLU H . . . . . . . . . c30497_6e5i 1 . 1 . 89 . 1 1 6 GLU HA H 0.960 8.228 0.507 . . . 1.0 . . . . . . . . . . . . A . 6 GLU HA . . . . . . . . . c30497_6e5i 1 . 1 . 90 . 1 1 6 GLU HB2 H -1.241 7.009 2.181 . . . 1.0 . . . . . . . . . . . . A . 6 GLU HB2 . . . . . . . . . c30497_6e5i 1 . 1 . 91 . 1 1 6 GLU HB3 H 0.015 8.057 2.819 . . . 1.0 . . . . . . . . . . . . A . 6 GLU HB3 . . . . . . . . . c30497_6e5i 1 . 1 . 92 . 1 1 6 GLU HG2 H -0.763 9.882 1.430 . . . 1.0 . . . . . . . . . . . . A . 6 GLU HG2 . . . . . . . . . c30497_6e5i 1 . 1 . 93 . 1 1 6 GLU HG3 H -1.982 8.839 0.707 . . . 1.0 . . . . . . . . . . . . A . 6 GLU HG3 . . . . . . . . . c30497_6e5i 1 . 1 . 94 . 1 1 6 GLU N N -0.412 6.933 -0.329 . . . 1.0 . . . . . . . . . . . . A . 6 GLU N . . . . . . . . . c30497_6e5i 1 . 1 . 95 . 1 1 6 GLU O O 2.461 6.515 1.596 . . . 1.0 . . . . . . . . . . . . A . 6 GLU O . . . . . . . . . c30497_6e5i 1 . 1 . 96 . 1 1 6 GLU OE1 O -1.922 9.808 3.799 . . . 1.0 . . . . . . . . . . . . A . 6 GLU OE1 . . . . . . . . . c30497_6e5i 1 . 1 . 97 . 1 1 6 GLU OE2 O -3.613 9.314 2.494 . . . 1.0 . . . . . . . . . . . . A . 6 GLU OE2 . . . . . . . . . c30497_6e5i 1 . 1 . 98 . 1 1 7 LEU C C 2.603 3.605 0.768 . . . 1.0 . . . . . . . . . . . . A . 7 LEU C . . . . . . . . . c30497_6e5i 1 . 1 . 99 . 1 1 7 LEU CA C 1.525 3.911 1.798 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CA . . . . . . . . . c30497_6e5i 1 . 1 . 100 . 1 1 7 LEU CB C 0.615 2.694 1.967 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CB . . . . . . . . . c30497_6e5i 1 . 1 . 101 . 1 1 7 LEU CD1 C -1.429 1.655 2.975 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CD1 . . . . . . . . . c30497_6e5i 1 . 1 . 102 . 1 1 7 LEU CD2 C 0.182 2.871 4.435 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CD2 . . . . . . . . . c30497_6e5i 1 . 1 . 103 . 1 1 7 LEU CG C -0.456 2.819 3.055 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CG . . . . . . . . . c30497_6e5i 1 . 1 . 104 . 1 1 7 LEU H H -0.204 4.959 1.177 . . . 1.0 . . . . . . . . . . . . A . 7 LEU H . . . . . . . . . c30497_6e5i 1 . 1 . 105 . 1 1 7 LEU HA H 1.996 4.137 2.740 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HA . . . . . . . . . c30497_6e5i 1 . 1 . 106 . 1 1 7 LEU HB2 H 0.121 2.510 1.024 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HB2 . . . . . . . . . c30497_6e5i 1 . 1 . 107 . 1 1 7 LEU HB3 H 1.234 1.841 2.200 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HB3 . . . . . . . . . c30497_6e5i 1 . 1 . 108 . 1 1 7 LEU HD11 H -0.897 0.731 3.138 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD11 . . . . . . . . . c30497_6e5i 1 . 1 . 109 . 1 1 7 LEU HD12 H -1.890 1.637 1.999 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD12 . . . . . . . . . c30497_6e5i 1 . 1 . 110 . 1 1 7 LEU HD13 H -2.191 1.770 3.730 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD13 . . . . . . . . . c30497_6e5i 1 . 1 . 111 . 1 1 7 LEU HD21 H -0.589 2.965 5.185 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD21 . . . . . . . . . c30497_6e5i 1 . 1 . 112 . 1 1 7 LEU HD22 H 0.848 3.721 4.495 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD22 . . . . . . . . . c30497_6e5i 1 . 1 . 113 . 1 1 7 LEU HD23 H 0.740 1.963 4.607 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD23 . . . . . . . . . c30497_6e5i 1 . 1 . 114 . 1 1 7 LEU HG H -1.012 3.733 2.904 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HG . . . . . . . . . c30497_6e5i 1 . 1 . 115 . 1 1 7 LEU N N 0.749 5.072 1.392 . . . 1.0 . . . . . . . . . . . . A . 7 LEU N . . . . . . . . . c30497_6e5i 1 . 1 . 116 . 1 1 7 LEU O O 3.744 3.309 1.121 . . . 1.0 . . . . . . . . . . . . A . 7 LEU O . . . . . . . . . c30497_6e5i 1 . 1 . 117 . 1 1 8 LYS C C 4.316 4.443 -1.576 . . . 1.0 . . . . . . . . . . . . A . 8 LYS C . . . . . . . . . c30497_6e5i 1 . 1 . 118 . 1 1 8 LYS CA C 3.177 3.425 -1.586 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CA . . . . . . . . . c30497_6e5i 1 . 1 . 119 . 1 1 8 LYS CB C 2.467 3.448 -2.941 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CB . . . . . . . . . c30497_6e5i 1 . 1 . 120 . 1 1 8 LYS CD C 2.642 3.061 -5.424 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CD . . . . . . . . . c30497_6e5i 1 . 1 . 121 . 1 1 8 LYS CE C 2.535 4.515 -5.855 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CE . . . . . . . . . c30497_6e5i 1 . 1 . 122 . 1 1 8 LYS CG C 3.328 2.922 -4.076 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CG . . . . . . . . . c30497_6e5i 1 . 1 . 123 . 1 1 8 LYS H H 1.307 3.925 -0.725 . . . 1.0 . . . . . . . . . . . . A . 8 LYS H . . . . . . . . . c30497_6e5i 1 . 1 . 124 . 1 1 8 LYS HA H 3.593 2.442 -1.424 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HA . . . . . . . . . c30497_6e5i 1 . 1 . 125 . 1 1 8 LYS HB2 H 1.577 2.840 -2.878 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HB2 . . . . . . . . . c30497_6e5i 1 . 1 . 126 . 1 1 8 LYS HB3 H 2.185 4.465 -3.171 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HB3 . . . . . . . . . c30497_6e5i 1 . 1 . 127 . 1 1 8 LYS HD2 H 3.211 2.518 -6.163 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HD2 . . . . . . . . . c30497_6e5i 1 . 1 . 128 . 1 1 8 LYS HD3 H 1.649 2.642 -5.355 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HD3 . . . . . . . . . c30497_6e5i 1 . 1 . 129 . 1 1 8 LYS HE2 H 1.864 5.028 -5.184 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HE2 . . . . . . . . . c30497_6e5i 1 . 1 . 130 . 1 1 8 LYS HE3 H 3.515 4.966 -5.801 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HE3 . . . . . . . . . c30497_6e5i 1 . 1 . 131 . 1 1 8 LYS HG2 H 4.252 3.478 -4.098 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HG2 . . . . . . . . . c30497_6e5i 1 . 1 . 132 . 1 1 8 LYS HG3 H 3.540 1.878 -3.897 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HG3 . . . . . . . . . c30497_6e5i 1 . 1 . 133 . 1 1 8 LYS HZ1 H 1.075 4.211 -7.318 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ1 . . . . . . . . . c30497_6e5i 1 . 1 . 134 . 1 1 8 LYS HZ2 H 2.658 4.163 -7.909 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ2 . . . . . . . . . c30497_6e5i 1 . 1 . 135 . 1 1 8 LYS HZ3 H 1.951 5.644 -7.510 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ3 . . . . . . . . . c30497_6e5i 1 . 1 . 136 . 1 1 8 LYS N N 2.238 3.690 -0.506 . . . 1.0 . . . . . . . . . . . . A . 8 LYS N . . . . . . . . . c30497_6e5i 1 . 1 . 137 . 1 1 8 LYS NZ N 2.020 4.642 -7.243 . . . 1.0 . . . . . . . . . . . . A . 8 LYS NZ . . . . . . . . . c30497_6e5i 1 . 1 . 138 . 1 1 8 LYS O O 5.439 4.138 -1.963 . . . 1.0 . . . . . . . . . . . . A . 8 LYS O . . . . . . . . . c30497_6e5i 1 . 1 . 139 . 1 1 9 LYS C C 5.912 6.417 0.215 . . . 1.0 . . . . . . . . . . . . A . 9 LYS C . . . . . . . . . c30497_6e5i 1 . 1 . 140 . 1 1 9 LYS CA C 5.043 6.685 -1.007 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CA . . . . . . . . . c30497_6e5i 1 . 1 . 141 . 1 1 9 LYS CB C 4.402 8.073 -0.904 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CB . . . . . . . . . c30497_6e5i 1 . 1 . 142 . 1 1 9 LYS CD C 2.903 9.807 -1.931 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CD . . . . . . . . . c30497_6e5i 1 . 1 . 143 . 1 1 9 LYS CE C 2.048 10.177 -3.133 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CE . . . . . . . . . c30497_6e5i 1 . 1 . 144 . 1 1 9 LYS CG C 3.612 8.478 -2.138 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CG . . . . . . . . . c30497_6e5i 1 . 1 . 145 . 1 1 9 LYS H H 3.087 5.873 -0.911 . . . 1.0 . . . . . . . . . . . . A . 9 LYS H . . . . . . . . . c30497_6e5i 1 . 1 . 146 . 1 1 9 LYS HA H 5.664 6.646 -1.889 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HA . . . . . . . . . c30497_6e5i 1 . 1 . 147 . 1 1 9 LYS HB2 H 3.733 8.085 -0.056 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HB2 . . . . . . . . . c30497_6e5i 1 . 1 . 148 . 1 1 9 LYS HB3 H 5.181 8.804 -0.745 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HB3 . . . . . . . . . c30497_6e5i 1 . 1 . 149 . 1 1 9 LYS HD2 H 2.268 9.733 -1.060 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HD2 . . . . . . . . . c30497_6e5i 1 . 1 . 150 . 1 1 9 LYS HD3 H 3.642 10.577 -1.776 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HD3 . . . . . . . . . c30497_6e5i 1 . 1 . 151 . 1 1 9 LYS HE2 H 2.671 10.183 -4.016 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HE2 . . . . . . . . . c30497_6e5i 1 . 1 . 152 . 1 1 9 LYS HE3 H 1.272 9.434 -3.248 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HE3 . . . . . . . . . c30497_6e5i 1 . 1 . 153 . 1 1 9 LYS HG2 H 4.290 8.570 -2.975 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HG2 . . . . . . . . . c30497_6e5i 1 . 1 . 154 . 1 1 9 LYS HG3 H 2.878 7.715 -2.351 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HG3 . . . . . . . . . c30497_6e5i 1 . 1 . 155 . 1 1 9 LYS HZ1 H 0.841 11.543 -2.114 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HZ1 . . . . . . . . . c30497_6e5i 1 . 1 . 156 . 1 1 9 LYS HZ2 H 0.805 11.723 -3.792 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HZ2 . . . . . . . . . c30497_6e5i 1 . 1 . 157 . 1 1 9 LYS HZ3 H 2.149 12.252 -2.915 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HZ3 . . . . . . . . . c30497_6e5i 1 . 1 . 158 . 1 1 9 LYS N N 4.020 5.658 -1.138 . . . 1.0 . . . . . . . . . . . . A . 9 LYS N . . . . . . . . . c30497_6e5i 1 . 1 . 159 . 1 1 9 LYS NZ N 1.417 11.515 -2.977 . . . 1.0 . . . . . . . . . . . . A . 9 LYS NZ . . . . . . . . . c30497_6e5i 1 . 1 . 160 . 1 1 9 LYS O O 7.138 6.502 0.149 . . . 1.0 . . . . . . . . . . . . A . 9 LYS O . . . . . . . . . c30497_6e5i 1 . 1 . 161 . 1 1 10 ARG C C 6.896 4.609 2.450 . . . 1.0 . . . . . . . . . . . . A . 10 ARG C . . . . . . . . . c30497_6e5i 1 . 1 . 162 . 1 1 10 ARG CA C 5.958 5.808 2.577 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CA . . . . . . . . . c30497_6e5i 1 . 1 . 163 . 1 1 10 ARG CB C 4.943 5.551 3.693 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CB . . . . . . . . . c30497_6e5i 1 . 1 . 164 . 1 1 10 ARG CD C 4.536 4.912 6.097 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CD . . . . . . . . . c30497_6e5i 1 . 1 . 165 . 1 1 10 ARG CG C 5.581 5.179 5.024 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CG . . . . . . . . . c30497_6e5i 1 . 1 . 166 . 1 1 10 ARG CZ C 4.586 4.515 8.535 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CZ . . . . . . . . . c30497_6e5i 1 . 1 . 167 . 1 1 10 ARG H H 4.286 6.007 1.300 . . . 1.0 . . . . . . . . . . . . A . 10 ARG H . . . . . . . . . c30497_6e5i 1 . 1 . 168 . 1 1 10 ARG HA H 6.540 6.680 2.826 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HA . . . . . . . . . c30497_6e5i 1 . 1 . 169 . 1 1 10 ARG HB2 H 4.353 6.444 3.835 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HB2 . . . . . . . . . c30497_6e5i 1 . 1 . 170 . 1 1 10 ARG HB3 H 4.292 4.745 3.393 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HB3 . . . . . . . . . c30497_6e5i 1 . 1 . 171 . 1 1 10 ARG HD2 H 4.021 5.834 6.319 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HD2 . . . . . . . . . c30497_6e5i 1 . 1 . 172 . 1 1 10 ARG HD3 H 3.829 4.188 5.722 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HD3 . . . . . . . . . c30497_6e5i 1 . 1 . 173 . 1 1 10 ARG HE H 6.006 3.935 7.247 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HE . . . . . . . . . c30497_6e5i 1 . 1 . 174 . 1 1 10 ARG HG2 H 6.177 4.287 4.887 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HG2 . . . . . . . . . c30497_6e5i 1 . 1 . 175 . 1 1 10 ARG HG3 H 6.216 5.993 5.345 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HG3 . . . . . . . . . c30497_6e5i 1 . 1 . 176 . 1 1 10 ARG HH11 H 3.002 5.212 9.590 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HH11 . . . . . . . . . c30497_6e5i 1 . 1 . 177 . 1 1 10 ARG HH12 H 2.938 5.495 7.881 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HH12 . . . . . . . . . c30497_6e5i 1 . 1 . 178 . 1 1 10 ARG HH21 H 6.092 3.561 9.496 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HH21 . . . . . . . . . c30497_6e5i 1 . 1 . 179 . 1 1 10 ARG HH22 H 4.795 4.107 10.507 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HH22 . . . . . . . . . c30497_6e5i 1 . 1 . 180 . 1 1 10 ARG N N 5.266 6.075 1.323 . . . 1.0 . . . . . . . . . . . . A . 10 ARG N . . . . . . . . . c30497_6e5i 1 . 1 . 181 . 1 1 10 ARG NE N 5.137 4.398 7.329 . . . 1.0 . . . . . . . . . . . . A . 10 ARG NE . . . . . . . . . c30497_6e5i 1 . 1 . 182 . 1 1 10 ARG NH1 N 3.417 5.123 8.681 . . . 1.0 . . . . . . . . . . . . A . 10 ARG NH1 . . . . . . . . . c30497_6e5i 1 . 1 . 183 . 1 1 10 ARG NH2 N 5.207 4.022 9.597 . . . 1.0 . . . . . . . . . . . . A . 10 ARG NH2 . . . . . . . . . c30497_6e5i 1 . 1 . 184 . 1 1 10 ARG O O 8.082 4.697 2.773 . . . 1.0 . . . . . . . . . . . . A . 10 ARG O . . . . . . . . . c30497_6e5i 1 . 1 . 185 . 1 1 11 TYR C C 7.940 2.171 0.614 . . . 1.0 . . . . . . . . . . . . A . 11 TYR C . . . . . . . . . c30497_6e5i 1 . 1 . 186 . 1 1 11 TYR CA C 7.116 2.254 1.892 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CA . . . . . . . . . c30497_6e5i 1 . 1 . 187 . 1 1 11 TYR CB C 6.171 1.058 1.997 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CB . . . . . . . . . c30497_6e5i 1 . 1 . 188 . 1 1 11 TYR CD1 C 6.212 0.177 4.356 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CD1 . . . . . . . . . c30497_6e5i 1 . 1 . 189 . 1 1 11 TYR CD2 C 4.335 1.478 3.679 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CD2 . . . . . . . . . c30497_6e5i 1 . 1 . 190 . 1 1 11 TYR CE1 C 5.664 0.034 5.616 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CE1 . . . . . . . . . c30497_6e5i 1 . 1 . 191 . 1 1 11 TYR CE2 C 3.779 1.338 4.936 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CE2 . . . . . . . . . c30497_6e5i 1 . 1 . 192 . 1 1 11 TYR CG C 5.559 0.901 3.369 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CG . . . . . . . . . c30497_6e5i 1 . 1 . 193 . 1 1 11 TYR CZ C 4.446 0.615 5.901 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CZ . . . . . . . . . c30497_6e5i 1 . 1 . 194 . 1 1 11 TYR H H 5.430 3.513 1.642 . . . 1.0 . . . . . . . . . . . . A . 11 TYR H . . . . . . . . . c30497_6e5i 1 . 1 . 195 . 1 1 11 TYR HA H 7.790 2.234 2.733 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HA . . . . . . . . . c30497_6e5i 1 . 1 . 196 . 1 1 11 TYR HB2 H 5.368 1.180 1.288 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HB2 . . . . . . . . . c30497_6e5i 1 . 1 . 197 . 1 1 11 TYR HB3 H 6.713 0.155 1.770 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HB3 . . . . . . . . . c30497_6e5i 1 . 1 . 198 . 1 1 11 TYR HD1 H 7.166 -0.275 4.128 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HD1 . . . . . . . . . c30497_6e5i 1 . 1 . 199 . 1 1 11 TYR HD2 H 3.811 2.043 2.920 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HD2 . . . . . . . . . c30497_6e5i 1 . 1 . 200 . 1 1 11 TYR HE1 H 6.188 -0.533 6.370 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HE1 . . . . . . . . . c30497_6e5i 1 . 1 . 201 . 1 1 11 TYR HE2 H 2.828 1.795 5.156 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HE2 . . . . . . . . . c30497_6e5i 1 . 1 . 202 . 1 1 11 TYR HH H 2.941 0.393 7.083 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HH . . . . . . . . . c30497_6e5i 1 . 1 . 203 . 1 1 11 TYR N N 6.362 3.498 1.963 . . . 1.0 . . . . . . . . . . . . A . 11 TYR N . . . . . . . . . c30497_6e5i 1 . 1 . 204 . 1 1 11 TYR O O 8.727 1.241 0.429 . . . 1.0 . . . . . . . . . . . . A . 11 TYR O . . . . . . . . . c30497_6e5i 1 . 1 . 205 . 1 1 11 TYR OH O 3.899 0.481 7.158 . . . 1.0 . . . . . . . . . . . . A . 11 TYR OH . . . . . . . . . c30497_6e5i 1 . 1 . 206 . 1 1 12 ORN C C 9.347 -0.216 -3.118 . . . 1.0 . . . . . . . . . . . . A . 12 ORN C . . . . . . . . . c30497_6e5i 1 . 1 . 207 . 1 1 12 ORN CA C 9.919 1.167 -3.402 . . . 1.0 . . . . . . . . . . . . A . 12 ORN CA . . . . . . . . . c30497_6e5i 1 . 1 . 208 . 1 1 12 ORN CB C 8.776 2.118 -3.767 . . . 1.0 . . . . . . . . . . . . A . 12 ORN CB . . . . . . . . . c30497_6e5i 1 . 1 . 209 . 1 1 12 ORN CD C 8.484 3.212 -1.531 . . . 1.0 . . . . . . . . . . . . A . 12 ORN CD . . . . . . . . . c30497_6e5i 1 . 1 . 210 . 1 1 12 ORN CG C 7.823 2.381 -2.616 . . . 1.0 . . . . . . . . . . . . A . 12 ORN CG . . . . . . . . . c30497_6e5i 1 . 1 . 211 . 1 1 12 ORN H H 11.676 0.458 -4.257 . . . 1.0 . . . . . . . . . . . . A . 12 ORN H . . . . . . . . . c30497_6e5i 1 . 1 . 212 . 1 1 12 ORN HA H 10.420 1.530 -2.519 . . . 1.0 . . . . . . . . . . . . A . 12 ORN HA . . . . . . . . . c30497_6e5i 1 . 1 . 213 . 1 1 12 ORN HB2 H 8.214 1.691 -4.584 . . . 1.0 . . . . . . . . . . . . A . 12 ORN HB2 . . . . . . . . . c30497_6e5i 1 . 1 . 214 . 1 1 12 ORN HB3 H 9.195 3.062 -4.084 . . . 1.0 . . . . . . . . . . . . A . 12 ORN HB3 . . . . . . . . . c30497_6e5i 1 . 1 . 215 . 1 1 12 ORN HD2 H 8.518 4.239 -1.857 . . . 1.0 . . . . . . . . . . . . A . 12 ORN HD2 . . . . . . . . . c30497_6e5i 1 . 1 . 216 . 1 1 12 ORN HD3 H 9.488 2.852 -1.378 . . . 1.0 . . . . . . . . . . . . A . 12 ORN HD3 . . . . . . . . . c30497_6e5i 1 . 1 . 217 . 1 1 12 ORN HE1 H 7.112 3.848 -0.072 . . . 1.0 . . . . . . . . . . . . A . 12 ORN HE1 . . . . . . . . . c30497_6e5i 1 . 1 . 218 . 1 1 12 ORN HG2 H 7.516 1.436 -2.194 . . . 1.0 . . . . . . . . . . . . A . 12 ORN HG2 . . . . . . . . . c30497_6e5i 1 . 1 . 219 . 1 1 12 ORN HG3 H 6.959 2.909 -2.986 . . . 1.0 . . . . . . . . . . . . A . 12 ORN HG3 . . . . . . . . . c30497_6e5i 1 . 1 . 220 . 1 1 12 ORN N N 10.899 1.100 -4.508 . . . 1.0 . . . . . . . . . . . . A . 12 ORN N . . . . . . . . . c30497_6e5i 1 . 1 . 221 . 1 1 12 ORN NE N 7.762 3.142 -0.268 . . . 1.0 . . . . . . . . . . . . A . 12 ORN NE . . . . . . . . . c30497_6e5i 1 . 1 . 222 . 1 1 12 ORN O O 9.162 -1.016 -4.037 . . . 1.0 . . . . . . . . . . . . A . 12 ORN O . . . . . . . . . c30497_6e5i 1 . 1 . 223 . 1 1 13 CYS C C 7.047 -1.851 -1.987 . . . 1.0 . . . . . . . . . . . . A . 13 CYS C . . . . . . . . . c30497_6e5i 1 . 1 . 224 . 1 1 13 CYS CA C 8.470 -1.757 -1.453 . . . 1.0 . . . . . . . . . . . . A . 13 CYS CA . . . . . . . . . c30497_6e5i 1 . 1 . 225 . 1 1 13 CYS CB C 8.486 -1.889 0.069 . . . 1.0 . . . . . . . . . . . . A . 13 CYS CB . . . . . . . . . c30497_6e5i 1 . 1 . 226 . 1 1 13 CYS H H 9.231 0.190 -1.158 . . . 1.0 . . . . . . . . . . . . A . 13 CYS H . . . . . . . . . c30497_6e5i 1 . 1 . 227 . 1 1 13 CYS HA H 9.060 -2.552 -1.886 . . . 1.0 . . . . . . . . . . . . A . 13 CYS HA . . . . . . . . . c30497_6e5i 1 . 1 . 228 . 1 1 13 CYS HB2 H 7.911 -1.083 0.498 . . . 1.0 . . . . . . . . . . . . A . 13 CYS HB2 . . . . . . . . . c30497_6e5i 1 . 1 . 229 . 1 1 13 CYS HB3 H 8.037 -2.831 0.346 . . . 1.0 . . . . . . . . . . . . A . 13 CYS HB3 . . . . . . . . . c30497_6e5i 1 . 1 . 230 . 1 1 13 CYS N N 9.061 -0.490 -1.849 . . . 1.0 . . . . . . . . . . . . A . 13 CYS N . . . . . . . . . c30497_6e5i 1 . 1 . 231 . 1 1 13 CYS O O 6.307 -0.865 -1.978 . . . 1.0 . . . . . . . . . . . . A . 13 CYS O . . . . . . . . . c30497_6e5i 1 . 1 . 232 . 1 1 13 CYS SG S 10.163 -1.828 0.797 . . . 1.0 . . . . . . . . . . . . A . 13 CYS SG . . . . . . . . . c30497_6e5i 1 . 1 . 233 . 1 1 14 GLU C C 4.230 -3.299 -2.187 . . . 1.0 . . . . . . . . . . . . A . 14 GLU C . . . . . . . . . c30497_6e5i 1 . 1 . 234 . 1 1 14 GLU CA C 5.399 -3.193 -3.148 . . . 1.0 . . . . . . . . . . . . A . 14 GLU CA . . . . . . . . . c30497_6e5i 1 . 1 . 235 . 1 1 14 GLU CB C 5.427 -4.416 -4.069 . . . 1.0 . . . . . . . . . . . . A . 14 GLU CB . . . . . . . . . c30497_6e5i 1 . 1 . 236 . 1 1 14 GLU CD C 6.146 -5.388 -6.280 . . . 1.0 . . . . . . . . . . . . A . 14 GLU CD . . . . . . . . . c30497_6e5i 1 . 1 . 237 . 1 1 14 GLU CG C 6.300 -4.244 -5.300 . . . 1.0 . . . . . . . . . . . . A . 14 GLU CG . . . . . . . . . c30497_6e5i 1 . 1 . 238 . 1 1 14 GLU H H 7.226 -3.826 -2.261 . . . 1.0 . . . . . . . . . . . . A . 14 GLU H . . . . . . . . . c30497_6e5i 1 . 1 . 239 . 1 1 14 GLU HA H 5.257 -2.309 -3.751 . . . 1.0 . . . . . . . . . . . . A . 14 GLU HA . . . . . . . . . c30497_6e5i 1 . 1 . 240 . 1 1 14 GLU HB2 H 5.797 -5.260 -3.511 . . . 1.0 . . . . . . . . . . . . A . 14 GLU HB2 . . . . . . . . . c30497_6e5i 1 . 1 . 241 . 1 1 14 GLU HB3 H 4.421 -4.626 -4.395 . . . 1.0 . . . . . . . . . . . . A . 14 GLU HB3 . . . . . . . . . c30497_6e5i 1 . 1 . 242 . 1 1 14 GLU HG2 H 6.024 -3.326 -5.798 . . . 1.0 . . . . . . . . . . . . A . 14 GLU HG2 . . . . . . . . . c30497_6e5i 1 . 1 . 243 . 1 1 14 GLU HG3 H 7.334 -4.188 -4.991 . . . 1.0 . . . . . . . . . . . . A . 14 GLU HG3 . . . . . . . . . c30497_6e5i 1 . 1 . 244 . 1 1 14 GLU N N 6.662 -3.034 -2.439 . . . 1.0 . . . . . . . . . . . . A . 14 GLU N . . . . . . . . . c30497_6e5i 1 . 1 . 245 . 1 1 14 GLU O O 4.021 -4.327 -1.545 . . . 1.0 . . . . . . . . . . . . A . 14 GLU O . . . . . . . . . c30497_6e5i 1 . 1 . 246 . 1 1 14 GLU OE1 O 7.029 -6.270 -6.320 . . . 1.0 . . . . . . . . . . . . A . 14 GLU OE1 . . . . . . . . . c30497_6e5i 1 . 1 . 247 . 1 1 14 GLU OE2 O 5.138 -5.412 -7.018 . . . 1.0 . . . . . . . . . . . . A . 14 GLU OE2 . . . . . . . . . c30497_6e5i 1 . 1 . 248 . 1 1 15 VAL C C 1.085 -2.666 -2.126 . . . 1.0 . . . . . . . . . . . . A . 15 VAL C . . . . . . . . . c30497_6e5i 1 . 1 . 249 . 1 1 15 VAL CA C 2.268 -2.206 -1.287 . . . 1.0 . . . . . . . . . . . . A . 15 VAL CA . . . . . . . . . c30497_6e5i 1 . 1 . 250 . 1 1 15 VAL CB C 1.979 -0.800 -0.719 . . . 1.0 . . . . . . . . . . . . A . 15 VAL CB . . . . . . . . . c30497_6e5i 1 . 1 . 251 . 1 1 15 VAL CG1 C 0.696 -0.798 0.099 . . . 1.0 . . . . . . . . . . . . A . 15 VAL CG1 . . . . . . . . . c30497_6e5i 1 . 1 . 252 . 1 1 15 VAL CG2 C 3.147 -0.308 0.121 . . . 1.0 . . . . . . . . . . . . A . 15 VAL CG2 . . . . . . . . . c30497_6e5i 1 . 1 . 253 . 1 1 15 VAL H H 3.732 -1.414 -2.581 . . . 1.0 . . . . . . . . . . . . A . 15 VAL H . . . . . . . . . c30497_6e5i 1 . 1 . 254 . 1 1 15 VAL HA H 2.403 -2.890 -0.463 . . . 1.0 . . . . . . . . . . . . A . 15 VAL HA . . . . . . . . . c30497_6e5i 1 . 1 . 255 . 1 1 15 VAL HB H 1.851 -0.121 -1.548 . . . 1.0 . . . . . . . . . . . . A . 15 VAL HB . . . . . . . . . c30497_6e5i 1 . 1 . 256 . 1 1 15 VAL HG11 H 0.534 0.188 0.511 . . . 1.0 . . . . . . . . . . . . A . 15 VAL HG11 . . . . . . . . . c30497_6e5i 1 . 1 . 257 . 1 1 15 VAL HG12 H 0.781 -1.515 0.901 . . . 1.0 . . . . . . . . . . . . A . 15 VAL HG12 . . . . . . . . . c30497_6e5i 1 . 1 . 258 . 1 1 15 VAL HG13 H -0.136 -1.065 -0.536 . . . 1.0 . . . . . . . . . . . . A . 15 VAL HG13 . . . . . . . . . c30497_6e5i 1 . 1 . 259 . 1 1 15 VAL HG21 H 2.915 0.667 0.522 . . . 1.0 . . . . . . . . . . . . A . 15 VAL HG21 . . . . . . . . . c30497_6e5i 1 . 1 . 260 . 1 1 15 VAL HG22 H 4.032 -0.244 -0.494 . . . 1.0 . . . . . . . . . . . . A . 15 VAL HG22 . . . . . . . . . c30497_6e5i 1 . 1 . 261 . 1 1 15 VAL HG23 H 3.321 -0.999 0.932 . . . 1.0 . . . . . . . . . . . . A . 15 VAL HG23 . . . . . . . . . c30497_6e5i 1 . 1 . 262 . 1 1 15 VAL N N 3.474 -2.222 -2.092 . . . 1.0 . . . . . . . . . . . . A . 15 VAL N . . . . . . . . . c30497_6e5i 1 . 1 . 263 . 1 1 15 VAL O O 0.678 -1.984 -3.070 . . . 1.0 . . . . . . . . . . . . A . 15 VAL O . . . . . . . . . c30497_6e5i 1 . 1 . 264 . 1 1 16 ARG C C -1.878 -3.902 -1.849 . . . 1.0 . . . . . . . . . . . . A . 16 ARG C . . . . . . . . . c30497_6e5i 1 . 1 . 265 . 1 1 16 ARG CA C -0.590 -4.373 -2.500 . . . 1.0 . . . . . . . . . . . . A . 16 ARG CA . . . . . . . . . c30497_6e5i 1 . 1 . 266 . 1 1 16 ARG CB C -0.550 -5.900 -2.516 . . . 1.0 . . . . . . . . . . . . A . 16 ARG CB . . . . . . . . . c30497_6e5i 1 . 1 . 267 . 1 1 16 ARG CD C -1.819 -8.027 -2.911 . . . 1.0 . . . . . . . . . . . . A . 16 ARG CD . . . . . . . . . c30497_6e5i 1 . 1 . 268 . 1 1 16 ARG CG C -1.802 -6.524 -3.103 . . . 1.0 . . . . . . . . . . . . A . 16 ARG CG . . . . . . . . . c30497_6e5i 1 . 1 . 269 . 1 1 16 ARG CZ C -3.421 -9.895 -3.118 . . . 1.0 . . . . . . . . . . . . A . 16 ARG CZ . . . . . . . . . c30497_6e5i 1 . 1 . 270 . 1 1 16 ARG H H 0.948 -4.341 -1.054 . . . 1.0 . . . . . . . . . . . . A . 16 ARG H . . . . . . . . . c30497_6e5i 1 . 1 . 271 . 1 1 16 ARG HA H -0.561 -4.009 -3.515 . . . 1.0 . . . . . . . . . . . . A . 16 ARG HA . . . . . . . . . c30497_6e5i 1 . 1 . 272 . 1 1 16 ARG HB2 H 0.298 -6.222 -3.102 . . . 1.0 . . . . . . . . . . . . A . 16 ARG HB2 . . . . . . . . . c30497_6e5i 1 . 1 . 273 . 1 1 16 ARG HB3 H -0.435 -6.256 -1.506 . . . 1.0 . . . . . . . . . . . . A . 16 ARG HB3 . . . . . . . . . c30497_6e5i 1 . 1 . 274 . 1 1 16 ARG HD2 H -1.068 -8.467 -3.547 . . . 1.0 . . . . . . . . . . . . A . 16 ARG HD2 . . . . . . . . . c30497_6e5i 1 . 1 . 275 . 1 1 16 ARG HD3 H -1.591 -8.249 -1.878 . . . 1.0 . . . . . . . . . . . . A . 16 ARG HD3 . . . . . . . . . c30497_6e5i 1 . 1 . 276 . 1 1 16 ARG HE H -3.819 -7.988 -3.566 . . . 1.0 . . . . . . . . . . . . A . 16 ARG HE . . . . . . . . . c30497_6e5i 1 . 1 . 277 . 1 1 16 ARG HG2 H -2.667 -6.098 -2.616 . . . 1.0 . . . . . . . . . . . . A . 16 ARG HG2 . . . . . . . . . c30497_6e5i 1 . 1 . 278 . 1 1 16 ARG HG3 H -1.837 -6.303 -4.159 . . . 1.0 . . . . . . . . . . . . A . 16 ARG HG3 . . . . . . . . . c30497_6e5i 1 . 1 . 279 . 1 1 16 ARG HH11 H -1.568 -10.450 -2.509 . . . 1.0 . . . . . . . . . . . . A . 16 ARG HH11 . . . . . . . . . c30497_6e5i 1 . 1 . 280 . 1 1 16 ARG HH12 H -2.724 -11.736 -2.625 . . . 1.0 . . . . . . . . . . . . A . 16 ARG HH12 . . . . . . . . . c30497_6e5i 1 . 1 . 281 . 1 1 16 ARG HH21 H -4.880 -11.289 -3.307 . . . 1.0 . . . . . . . . . . . . A . 16 ARG HH21 . . . . . . . . . c30497_6e5i 1 . 1 . 282 . 1 1 16 ARG HH22 H -5.352 -9.661 -3.702 . . . 1.0 . . . . . . . . . . . . A . 16 ARG HH22 . . . . . . . . . c30497_6e5i 1 . 1 . 283 . 1 1 16 ARG N N 0.558 -3.832 -1.798 . . . 1.0 . . . . . . . . . . . . A . 16 ARG N . . . . . . . . . c30497_6e5i 1 . 1 . 284 . 1 1 16 ARG NE N -3.121 -8.604 -3.244 . . . 1.0 . . . . . . . . . . . . A . 16 ARG NE . . . . . . . . . c30497_6e5i 1 . 1 . 285 . 1 1 16 ARG NH1 N -2.496 -10.762 -2.718 . . . 1.0 . . . . . . . . . . . . A . 16 ARG NH1 . . . . . . . . . c30497_6e5i 1 . 1 . 286 . 1 1 16 ARG NH2 N -4.646 -10.316 -3.399 . . . 1.0 . . . . . . . . . . . . A . 16 ARG NH2 . . . . . . . . . c30497_6e5i 1 . 1 . 287 . 1 1 16 ARG O O -2.248 -4.363 -0.768 . . . 1.0 . . . . . . . . . . . . A . 16 ARG O . . . . . . . . . c30497_6e5i 1 . 1 . 288 . 1 1 17 CYS C C -4.934 -3.342 -2.586 . . . 1.0 . . . . . . . . . . . . A . 17 CYS C . . . . . . . . . c30497_6e5i 1 . 1 . 289 . 1 1 17 CYS CA C -3.814 -2.474 -2.038 . . . 1.0 . . . . . . . . . . . . A . 17 CYS CA . . . . . . . . . c30497_6e5i 1 . 1 . 290 . 1 1 17 CYS CB C -3.998 -1.028 -2.482 . . . 1.0 . . . . . . . . . . . . A . 17 CYS CB . . . . . . . . . c30497_6e5i 1 . 1 . 291 . 1 1 17 CYS H H -2.162 -2.610 -3.332 . . . 1.0 . . . . . . . . . . . . A . 17 CYS H . . . . . . . . . c30497_6e5i 1 . 1 . 292 . 1 1 17 CYS HA H -3.821 -2.523 -0.959 . . . 1.0 . . . . . . . . . . . . A . 17 CYS HA . . . . . . . . . c30497_6e5i 1 . 1 . 293 . 1 1 17 CYS HB2 H -4.064 -0.999 -3.559 . . . 1.0 . . . . . . . . . . . . A . 17 CYS HB2 . . . . . . . . . c30497_6e5i 1 . 1 . 294 . 1 1 17 CYS HB3 H -4.913 -0.640 -2.059 . . . 1.0 . . . . . . . . . . . . A . 17 CYS HB3 . . . . . . . . . c30497_6e5i 1 . 1 . 295 . 1 1 17 CYS N N -2.541 -2.973 -2.505 . . . 1.0 . . . . . . . . . . . . A . 17 CYS N . . . . . . . . . c30497_6e5i 1 . 1 . 296 . 1 1 17 CYS O O -5.407 -3.137 -3.705 . . . 1.0 . . . . . . . . . . . . A . 17 CYS O . . . . . . . . . c30497_6e5i 1 . 1 . 297 . 1 1 17 CYS SG S -2.633 0.067 -1.976 . . . 1.0 . . . . . . . . . . . . A . 17 CYS SG . . . . . . . . . c30497_6e5i 1 . 1 . 298 . 1 1 18 ASP C C -7.625 -4.999 -1.382 . . . 1.0 . . . . . . . . . . . . A . 18 ASP C . . . . . . . . . c30497_6e5i 1 . 1 . 299 . 1 1 18 ASP CA C -6.371 -5.259 -2.205 . . . 1.0 . . . . . . . . . . . . A . 18 ASP CA . . . . . . . . . c30497_6e5i 1 . 1 . 300 . 1 1 18 ASP CB C -5.894 -6.702 -2.010 . . . 1.0 . . . . . . . . . . . . A . 18 ASP CB . . . . . . . . . c30497_6e5i 1 . 1 . 301 . 1 1 18 ASP CG C -6.805 -7.719 -2.669 . . . 1.0 . . . . . . . . . . . . A . 18 ASP CG . . . . . . . . . c30497_6e5i 1 . 1 . 302 . 1 1 18 ASP H H -4.937 -4.408 -0.904 . . . 1.0 . . . . . . . . . . . . A . 18 ASP H . . . . . . . . . c30497_6e5i 1 . 1 . 303 . 1 1 18 ASP HA H -6.587 -5.092 -3.248 . . . 1.0 . . . . . . . . . . . . A . 18 ASP HA . . . . . . . . . c30497_6e5i 1 . 1 . 304 . 1 1 18 ASP HB2 H -4.908 -6.807 -2.432 . . . 1.0 . . . . . . . . . . . . A . 18 ASP HB2 . . . . . . . . . c30497_6e5i 1 . 1 . 305 . 1 1 18 ASP HB3 H -5.851 -6.918 -0.953 . . . 1.0 . . . . . . . . . . . . A . 18 ASP HB3 . . . . . . . . . c30497_6e5i 1 . 1 . 306 . 1 1 18 ASP N N -5.334 -4.325 -1.801 . . . 1.0 . . . . . . . . . . . . A . 18 ASP N . . . . . . . . . c30497_6e5i 1 . 1 . 307 . 1 1 18 ASP O O -7.783 -5.540 -0.285 . . . 1.0 . . . . . . . . . . . . A . 18 ASP O . . . . . . . . . c30497_6e5i 1 . 1 . 308 . 1 1 18 ASP OD1 O -7.860 -8.052 -2.087 . . . 1.0 . . . . . . . . . . . . A . 18 ASP OD1 . . . . . . . . . c30497_6e5i 1 . 1 . 309 . 1 1 18 ASP OD2 O -6.454 -8.220 -3.760 . . . 1.0 . . . . . . . . . . . . A . 18 ASP OD2 . . . . . . . . . c30497_6e5i 1 . 1 . 310 . 1 1 19 DPR C C -9.288 -2.957 0.131 . . . 1.0 . . . . . . . . . . . . A . 19 DPR C . . . . . . . . . c30497_6e5i 1 . 1 . 311 . 1 1 19 DPR CA C -9.698 -3.706 -1.137 . . . 1.0 . . . . . . . . . . . . A . 19 DPR CA . . . . . . . . . c30497_6e5i 1 . 1 . 312 . 1 1 19 DPR CB C -10.437 -2.776 -2.102 . . . 1.0 . . . . . . . . . . . . A . 19 DPR CB . . . . . . . . . c30497_6e5i 1 . 1 . 313 . 1 1 19 DPR CD C -8.490 -3.568 -3.241 . . . 1.0 . . . . . . . . . . . . A . 19 DPR CD . . . . . . . . . c30497_6e5i 1 . 1 . 314 . 1 1 19 DPR CG C -9.903 -3.107 -3.453 . . . 1.0 . . . . . . . . . . . . A . 19 DPR CG . . . . . . . . . c30497_6e5i 1 . 1 . 315 . 1 1 19 DPR HA H -10.338 -4.530 -0.877 . . . 1.0 . . . . . . . . . . . . A . 19 DPR HA . . . . . . . . . c30497_6e5i 1 . 1 . 316 . 1 1 19 DPR HB2 H -10.235 -1.749 -1.840 . . . 1.0 . . . . . . . . . . . . A . 19 DPR HB2 . . . . . . . . . c30497_6e5i 1 . 1 . 317 . 1 1 19 DPR HB3 H -11.498 -2.965 -2.042 . . . 1.0 . . . . . . . . . . . . A . 19 DPR HB3 . . . . . . . . . c30497_6e5i 1 . 1 . 318 . 1 1 19 DPR HD2 H -7.804 -2.733 -3.282 . . . 1.0 . . . . . . . . . . . . A . 19 DPR HD2 . . . . . . . . . c30497_6e5i 1 . 1 . 319 . 1 1 19 DPR HD3 H -8.226 -4.314 -3.975 . . . 1.0 . . . . . . . . . . . . A . 19 DPR HD3 . . . . . . . . . c30497_6e5i 1 . 1 . 320 . 1 1 19 DPR HG2 H -9.920 -2.228 -4.079 . . . 1.0 . . . . . . . . . . . . A . 19 DPR HG2 . . . . . . . . . c30497_6e5i 1 . 1 . 321 . 1 1 19 DPR HG3 H -10.491 -3.896 -3.897 . . . 1.0 . . . . . . . . . . . . A . 19 DPR HG3 . . . . . . . . . c30497_6e5i 1 . 1 . 322 . 1 1 19 DPR N N -8.527 -4.149 -1.891 . . . 1.0 . . . . . . . . . . . . A . 19 DPR N . . . . . . . . . c30497_6e5i 1 . 1 . 323 . 1 1 19 DPR O O -8.595 -1.938 0.066 . . . 1.0 . . . . . . . . . . . . A . 19 DPR O . . . . . . . . . c30497_6e5i 1 . 1 . 324 . 1 1 20 PRO C C -8.002 -3.451 3.104 . . . 1.0 . . . . . . . . . . . . A . 20 PRO C . . . . . . . . . c30497_6e5i 1 . 1 . 325 . 1 1 20 PRO CA C -9.325 -2.884 2.587 . . . 1.0 . . . . . . . . . . . . A . 20 PRO CA . . . . . . . . . c30497_6e5i 1 . 1 . 326 . 1 1 20 PRO CB C -10.478 -3.313 3.488 . . . 1.0 . . . . . . . . . . . . A . 20 PRO CB . . . . . . . . . c30497_6e5i 1 . 1 . 327 . 1 1 20 PRO CD C -10.629 -4.597 1.463 . . . 1.0 . . . . . . . . . . . . A . 20 PRO CD . . . . . . . . . c30497_6e5i 1 . 1 . 328 . 1 1 20 PRO CG C -10.887 -4.641 2.950 . . . 1.0 . . . . . . . . . . . . A . 20 PRO CG . . . . . . . . . c30497_6e5i 1 . 1 . 329 . 1 1 20 PRO HA H -9.269 -1.808 2.549 . . . 1.0 . . . . . . . . . . . . A . 20 PRO HA . . . . . . . . . c30497_6e5i 1 . 1 . 330 . 1 1 20 PRO HB2 H -10.132 -3.385 4.508 . . . 1.0 . . . . . . . . . . . . A . 20 PRO HB2 . . . . . . . . . c30497_6e5i 1 . 1 . 331 . 1 1 20 PRO HB3 H -11.280 -2.595 3.420 . . . 1.0 . . . . . . . . . . . . A . 20 PRO HB3 . . . . . . . . . c30497_6e5i 1 . 1 . 332 . 1 1 20 PRO HD2 H -10.167 -5.513 1.130 . . . 1.0 . . . . . . . . . . . . A . 20 PRO HD2 . . . . . . . . . c30497_6e5i 1 . 1 . 333 . 1 1 20 PRO HD3 H -11.551 -4.424 0.931 . . . 1.0 . . . . . . . . . . . . A . 20 PRO HD3 . . . . . . . . . c30497_6e5i 1 . 1 . 334 . 1 1 20 PRO HG2 H -10.297 -5.419 3.408 . . . 1.0 . . . . . . . . . . . . A . 20 PRO HG2 . . . . . . . . . c30497_6e5i 1 . 1 . 335 . 1 1 20 PRO HG3 H -11.938 -4.805 3.141 . . . 1.0 . . . . . . . . . . . . A . 20 PRO HG3 . . . . . . . . . c30497_6e5i 1 . 1 . 336 . 1 1 20 PRO N N -9.710 -3.454 1.300 . . . 1.0 . . . . . . . . . . . . A . 20 PRO N . . . . . . . . . c30497_6e5i 1 . 1 . 337 . 1 1 20 PRO O O -7.571 -3.138 4.217 . . . 1.0 . . . . . . . . . . . . A . 20 PRO O . . . . . . . . . c30497_6e5i 1 . 1 . 338 . 1 1 21 ARG C C -4.939 -4.184 2.053 . . . 1.0 . . . . . . . . . . . . A . 21 ARG C . . . . . . . . . c30497_6e5i 1 . 1 . 339 . 1 1 21 ARG CA C -6.107 -4.909 2.694 . . . 1.0 . . . . . . . . . . . . A . 21 ARG CA . . . . . . . . . c30497_6e5i 1 . 1 . 340 . 1 1 21 ARG CB C -6.065 -6.386 2.296 . . . 1.0 . . . . . . . . . . . . A . 21 ARG CB . . . . . . . . . c30497_6e5i 1 . 1 . 341 . 1 1 21 ARG CD C -6.978 -8.705 2.590 . . . 1.0 . . . . . . . . . . . . A . 21 ARG CD . . . . . . . . . c30497_6e5i 1 . 1 . 342 . 1 1 21 ARG CG C -7.133 -7.238 2.960 . . . 1.0 . . . . . . . . . . . . A . 21 ARG CG . . . . . . . . . c30497_6e5i 1 . 1 . 343 . 1 1 21 ARG CZ C -6.862 -10.108 0.555 . . . 1.0 . . . . . . . . . . . . A . 21 ARG CZ . . . . . . . . . c30497_6e5i 1 . 1 . 344 . 1 1 21 ARG H H -7.746 -4.504 1.417 . . . 1.0 . . . . . . . . . . . . A . 21 ARG H . . . . . . . . . c30497_6e5i 1 . 1 . 345 . 1 1 21 ARG HA H -6.019 -4.830 3.766 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HA . . . . . . . . . c30497_6e5i 1 . 1 . 346 . 1 1 21 ARG HB2 H -6.192 -6.459 1.227 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HB2 . . . . . . . . . c30497_6e5i 1 . 1 . 347 . 1 1 21 ARG HB3 H -5.098 -6.788 2.561 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HB3 . . . . . . . . . c30497_6e5i 1 . 1 . 348 . 1 1 21 ARG HD2 H -6.001 -9.038 2.905 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HD2 . . . . . . . . . c30497_6e5i 1 . 1 . 349 . 1 1 21 ARG HD3 H -7.735 -9.275 3.112 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HD3 . . . . . . . . . c30497_6e5i 1 . 1 . 350 . 1 1 21 ARG HE H -7.419 -8.183 0.595 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HE . . . . . . . . . c30497_6e5i 1 . 1 . 351 . 1 1 21 ARG HG2 H -7.044 -7.136 4.031 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HG2 . . . . . . . . . c30497_6e5i 1 . 1 . 352 . 1 1 21 ARG HG3 H -8.107 -6.893 2.644 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HG3 . . . . . . . . . c30497_6e5i 1 . 1 . 353 . 1 1 21 ARG HH11 H -6.298 -11.057 2.257 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HH11 . . . . . . . . . c30497_6e5i 1 . 1 . 354 . 1 1 21 ARG HH12 H -6.253 -12.023 0.815 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HH12 . . . . . . . . . c30497_6e5i 1 . 1 . 355 . 1 1 21 ARG HH21 H -7.353 -9.452 -1.301 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HH21 . . . . . . . . . c30497_6e5i 1 . 1 . 356 . 1 1 21 ARG HH22 H -6.838 -11.115 -1.204 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HH22 . . . . . . . . . c30497_6e5i 1 . 1 . 357 . 1 1 21 ARG N N -7.365 -4.298 2.302 . . . 1.0 . . . . . . . . . . . . A . 21 ARG N . . . . . . . . . c30497_6e5i 1 . 1 . 358 . 1 1 21 ARG NE N -7.115 -8.938 1.148 . . . 1.0 . . . . . . . . . . . . A . 21 ARG NE . . . . . . . . . c30497_6e5i 1 . 1 . 359 . 1 1 21 ARG NH1 N -6.435 -11.143 1.266 . . . 1.0 . . . . . . . . . . . . A . 21 ARG NH1 . . . . . . . . . c30497_6e5i 1 . 1 . 360 . 1 1 21 ARG NH2 N -7.032 -10.237 -0.752 . . . 1.0 . . . . . . . . . . . . A . 21 ARG NH2 . . . . . . . . . c30497_6e5i 1 . 1 . 361 . 1 1 21 ARG O O -5.003 -3.785 0.891 . . . 1.0 . . . . . . . . . . . . A . 21 ARG O . . . . . . . . . c30497_6e5i 1 . 1 . 362 . 1 1 22 TYR C C -1.479 -4.266 2.664 . . . 1.0 . . . . . . . . . . . . A . 22 TYR C . . . . . . . . . c30497_6e5i 1 . 1 . 363 . 1 1 22 TYR CA C -2.668 -3.392 2.320 . . . 1.0 . . . . . . . . . . . . A . 22 TYR CA . . . . . . . . . c30497_6e5i 1 . 1 . 364 . 1 1 22 TYR CB C -2.498 -1.994 2.908 . . . 1.0 . . . . . . . . . . . . A . 22 TYR CB . . . . . . . . . c30497_6e5i 1 . 1 . 365 . 1 1 22 TYR CD1 C -3.830 -0.447 1.439 . . . 1.0 . . . . . . . . . . . . A . 22 TYR CD1 . . . . . . . . . c30497_6e5i 1 . 1 . 366 . 1 1 22 TYR CD2 C -4.659 -0.916 3.621 . . . 1.0 . . . . . . . . . . . . A . 22 TYR CD2 . . . . . . . . . c30497_6e5i 1 . 1 . 367 . 1 1 22 TYR CE1 C -4.917 0.364 1.194 . . . 1.0 . . . . . . . . . . . . A . 22 TYR CE1 . . . . . . . . . c30497_6e5i 1 . 1 . 368 . 1 1 22 TYR CE2 C -5.749 -0.106 3.386 . . . 1.0 . . . . . . . . . . . . A . 22 TYR CE2 . . . . . . . . . c30497_6e5i 1 . 1 . 369 . 1 1 22 TYR CG C -3.683 -1.098 2.653 . . . 1.0 . . . . . . . . . . . . A . 22 TYR CG . . . . . . . . . c30497_6e5i 1 . 1 . 370 . 1 1 22 TYR CZ C -5.875 0.531 2.171 . . . 1.0 . . . . . . . . . . . . A . 22 TYR CZ . . . . . . . . . c30497_6e5i 1 . 1 . 371 . 1 1 22 TYR H H -3.911 -4.314 3.749 . . . 1.0 . . . . . . . . . . . . A . 22 TYR H . . . . . . . . . c30497_6e5i 1 . 1 . 372 . 1 1 22 TYR HA H -2.750 -3.317 1.245 . . . 1.0 . . . . . . . . . . . . A . 22 TYR HA . . . . . . . . . c30497_6e5i 1 . 1 . 373 . 1 1 22 TYR HB2 H -2.359 -2.068 3.975 . . . 1.0 . . . . . . . . . . . . A . 22 TYR HB2 . . . . . . . . . c30497_6e5i 1 . 1 . 374 . 1 1 22 TYR HB3 H -1.630 -1.530 2.466 . . . 1.0 . . . . . . . . . . . . A . 22 TYR HB3 . . . . . . . . . c30497_6e5i 1 . 1 . 375 . 1 1 22 TYR HD1 H -3.076 -0.578 0.677 . . . 1.0 . . . . . . . . . . . . A . 22 TYR HD1 . . . . . . . . . c30497_6e5i 1 . 1 . 376 . 1 1 22 TYR HD2 H -4.557 -1.417 4.572 . . . 1.0 . . . . . . . . . . . . A . 22 TYR HD2 . . . . . . . . . c30497_6e5i 1 . 1 . 377 . 1 1 22 TYR HE1 H -5.013 0.861 0.243 . . . 1.0 . . . . . . . . . . . . A . 22 TYR HE1 . . . . . . . . . c30497_6e5i 1 . 1 . 378 . 1 1 22 TYR HE2 H -6.499 0.022 4.152 . . . 1.0 . . . . . . . . . . . . A . 22 TYR HE2 . . . . . . . . . c30497_6e5i 1 . 1 . 379 . 1 1 22 TYR HH H -7.476 0.976 1.205 . . . 1.0 . . . . . . . . . . . . A . 22 TYR HH . . . . . . . . . c30497_6e5i 1 . 1 . 380 . 1 1 22 TYR N N -3.881 -4.010 2.818 . . . 1.0 . . . . . . . . . . . . A . 22 TYR N . . . . . . . . . c30497_6e5i 1 . 1 . 381 . 1 1 22 TYR O O -0.877 -4.137 3.733 . . . 1.0 . . . . . . . . . . . . A . 22 TYR O . . . . . . . . . c30497_6e5i 1 . 1 . 382 . 1 1 22 TYR OH O -6.959 1.339 1.933 . . . 1.0 . . . . . . . . . . . . A . 22 TYR OH . . . . . . . . . c30497_6e5i 1 . 1 . 383 . 1 1 23 GLU C C 1.233 -5.565 1.540 . . . 1.0 . . . . . . . . . . . . A . 23 GLU C . . . . . . . . . c30497_6e5i 1 . 1 . 384 . 1 1 23 GLU CA C -0.102 -6.139 1.979 . . . 1.0 . . . . . . . . . . . . A . 23 GLU CA . . . . . . . . . c30497_6e5i 1 . 1 . 385 . 1 1 23 GLU CB C -0.401 -7.429 1.218 . . . 1.0 . . . . . . . . . . . . A . 23 GLU CB . . . . . . . . . c30497_6e5i 1 . 1 . 386 . 1 1 23 GLU CD C -1.896 -8.441 2.988 . . . 1.0 . . . . . . . . . . . . A . 23 GLU CD . . . . . . . . . c30497_6e5i 1 . 1 . 387 . 1 1 23 GLU CG C -1.762 -8.028 1.537 . . . 1.0 . . . . . . . . . . . . A . 23 GLU CG . . . . . . . . . c30497_6e5i 1 . 1 . 388 . 1 1 23 GLU H H -1.624 -5.155 0.889 . . . 1.0 . . . . . . . . . . . . A . 23 GLU H . . . . . . . . . c30497_6e5i 1 . 1 . 389 . 1 1 23 GLU HA H -0.064 -6.351 3.036 . . . 1.0 . . . . . . . . . . . . A . 23 GLU HA . . . . . . . . . c30497_6e5i 1 . 1 . 390 . 1 1 23 GLU HB2 H -0.358 -7.226 0.160 . . . 1.0 . . . . . . . . . . . . A . 23 GLU HB2 . . . . . . . . . c30497_6e5i 1 . 1 . 391 . 1 1 23 GLU HB3 H 0.355 -8.158 1.464 . . . 1.0 . . . . . . . . . . . . A . 23 GLU HB3 . . . . . . . . . c30497_6e5i 1 . 1 . 392 . 1 1 23 GLU HG2 H -2.525 -7.296 1.316 . . . 1.0 . . . . . . . . . . . . A . 23 GLU HG2 . . . . . . . . . c30497_6e5i 1 . 1 . 393 . 1 1 23 GLU HG3 H -1.912 -8.899 0.915 . . . 1.0 . . . . . . . . . . . . A . 23 GLU HG3 . . . . . . . . . c30497_6e5i 1 . 1 . 394 . 1 1 23 GLU N N -1.155 -5.164 1.753 . . . 1.0 . . . . . . . . . . . . A . 23 GLU N . . . . . . . . . c30497_6e5i 1 . 1 . 395 . 1 1 23 GLU O O 1.485 -5.390 0.348 . . . 1.0 . . . . . . . . . . . . A . 23 GLU O . . . . . . . . . c30497_6e5i 1 . 1 . 396 . 1 1 23 GLU OE1 O -2.357 -7.621 3.806 . . . 1.0 . . . . . . . . . . . . A . 23 GLU OE1 . . . . . . . . . c30497_6e5i 1 . 1 . 397 . 1 1 23 GLU OE2 O -1.546 -9.595 3.317 . . . 1.0 . . . . . . . . . . . . A . 23 GLU OE2 . . . . . . . . . c30497_6e5i 1 . 1 . 398 . 1 1 24 VAL C C 4.447 -5.607 1.978 . . . 1.0 . . . . . . . . . . . . A . 24 VAL C . . . . . . . . . c30497_6e5i 1 . 1 . 399 . 1 1 24 VAL CA C 3.333 -4.599 2.218 . . . 1.0 . . . . . . . . . . . . A . 24 VAL CA . . . . . . . . . c30497_6e5i 1 . 1 . 400 . 1 1 24 VAL CB C 3.742 -3.644 3.358 . . . 1.0 . . . . . . . . . . . . A . 24 VAL CB . . . . . . . . . c30497_6e5i 1 . 1 . 401 . 1 1 24 VAL CG1 C 5.043 -2.934 3.018 . . . 1.0 . . . . . . . . . . . . A . 24 VAL CG1 . . . . . . . . . c30497_6e5i 1 . 1 . 402 . 1 1 24 VAL CG2 C 2.640 -2.632 3.637 . . . 1.0 . . . . . . . . . . . . A . 24 VAL CG2 . . . . . . . . . c30497_6e5i 1 . 1 . 403 . 1 1 24 VAL H H 1.864 -5.509 3.425 . . . 1.0 . . . . . . . . . . . . A . 24 VAL H . . . . . . . . . c30497_6e5i 1 . 1 . 404 . 1 1 24 VAL HA H 3.197 -4.011 1.320 . . . 1.0 . . . . . . . . . . . . A . 24 VAL HA . . . . . . . . . c30497_6e5i 1 . 1 . 405 . 1 1 24 VAL HB H 3.900 -4.232 4.252 . . . 1.0 . . . . . . . . . . . . A . 24 VAL HB . . . . . . . . . c30497_6e5i 1 . 1 . 406 . 1 1 24 VAL HG11 H 4.918 -2.369 2.107 . . . 1.0 . . . . . . . . . . . . A . 24 VAL HG11 . . . . . . . . . c30497_6e5i 1 . 1 . 407 . 1 1 24 VAL HG12 H 5.827 -3.665 2.886 . . . 1.0 . . . . . . . . . . . . A . 24 VAL HG12 . . . . . . . . . c30497_6e5i 1 . 1 . 408 . 1 1 24 VAL HG13 H 5.308 -2.265 3.824 . . . 1.0 . . . . . . . . . . . . A . 24 VAL HG13 . . . . . . . . . c30497_6e5i 1 . 1 . 409 . 1 1 24 VAL HG21 H 2.447 -2.058 2.744 . . . 1.0 . . . . . . . . . . . . A . 24 VAL HG21 . . . . . . . . . c30497_6e5i 1 . 1 . 410 . 1 1 24 VAL HG22 H 2.953 -1.968 4.430 . . . 1.0 . . . . . . . . . . . . A . 24 VAL HG22 . . . . . . . . . c30497_6e5i 1 . 1 . 411 . 1 1 24 VAL HG23 H 1.741 -3.151 3.935 . . . 1.0 . . . . . . . . . . . . A . 24 VAL HG23 . . . . . . . . . c30497_6e5i 1 . 1 . 412 . 1 1 24 VAL N N 2.079 -5.263 2.502 . . . 1.0 . . . . . . . . . . . . A . 24 VAL N . . . . . . . . . c30497_6e5i 1 . 1 . 413 . 1 1 24 VAL O O 4.872 -6.316 2.890 . . . 1.0 . . . . . . . . . . . . A . 24 VAL O . . . . . . . . . c30497_6e5i 1 . 1 . 414 . 1 1 25 HIS C C 7.291 -5.627 0.458 . . . 1.0 . . . . . . . . . . . . A . 25 HIS C . . . . . . . . . c30497_6e5i 1 . 1 . 415 . 1 1 25 HIS CA C 6.043 -6.492 0.386 . . . 1.0 . . . . . . . . . . . . A . 25 HIS CA . . . . . . . . . c30497_6e5i 1 . 1 . 416 . 1 1 25 HIS CB C 5.867 -7.067 -1.023 . . . 1.0 . . . . . . . . . . . . A . 25 HIS CB . . . . . . . . . c30497_6e5i 1 . 1 . 417 . 1 1 25 HIS CD2 C 8.234 -7.966 -1.609 . . . 1.0 . . . . . . . . . . . . A . 25 HIS CD2 . . . . . . . . . c30497_6e5i 1 . 1 . 418 . 1 1 25 HIS CE1 C 7.690 -10.040 -2.031 . . . 1.0 . . . . . . . . . . . . A . 25 HIS CE1 . . . . . . . . . c30497_6e5i 1 . 1 . 419 . 1 1 25 HIS CG C 6.899 -8.082 -1.415 . . . 1.0 . . . . . . . . . . . . A . 25 HIS CG . . . . . . . . . c30497_6e5i 1 . 1 . 420 . 1 1 25 HIS H H 4.455 -5.146 0.041 . . . 1.0 . . . . . . . . . . . . A . 25 HIS H . . . . . . . . . c30497_6e5i 1 . 1 . 421 . 1 1 25 HIS HA H 6.124 -7.298 1.100 . . . 1.0 . . . . . . . . . . . . A . 25 HIS HA . . . . . . . . . c30497_6e5i 1 . 1 . 422 . 1 1 25 HIS HB2 H 4.900 -7.537 -1.092 . . . 1.0 . . . . . . . . . . . . A . 25 HIS HB2 . . . . . . . . . c30497_6e5i 1 . 1 . 423 . 1 1 25 HIS HB3 H 5.914 -6.257 -1.733 . . . 1.0 . . . . . . . . . . . . A . 25 HIS HB3 . . . . . . . . . c30497_6e5i 1 . 1 . 424 . 1 1 25 HIS HD1 H 5.694 -9.796 -1.648 . . . 1.0 . . . . . . . . . . . . A . 25 HIS HD1 . . . . . . . . . c30497_6e5i 1 . 1 . 425 . 1 1 25 HIS HD2 H 8.822 -7.071 -1.480 . . . 1.0 . . . . . . . . . . . . A . 25 HIS HD2 . . . . . . . . . c30497_6e5i 1 . 1 . 426 . 1 1 25 HIS HE1 H 7.750 -11.082 -2.303 . . . 1.0 . . . . . . . . . . . . A . 25 HIS HE1 . . . . . . . . . c30497_6e5i 1 . 1 . 427 . 1 1 25 HIS HE2 H 9.600 -9.379 -2.341 . . . 1.0 . . . . . . . . . . . . A . 25 HIS HE2 . . . . . . . . . c30497_6e5i 1 . 1 . 428 . 1 1 25 HIS N N 4.900 -5.673 0.742 . . . 1.0 . . . . . . . . . . . . A . 25 HIS N . . . . . . . . . c30497_6e5i 1 . 1 . 429 . 1 1 25 HIS ND1 N 6.591 -9.395 -1.690 . . . 1.0 . . . . . . . . . . . . A . 25 HIS ND1 . . . . . . . . . c30497_6e5i 1 . 1 . 430 . 1 1 25 HIS NE2 N 8.699 -9.196 -1.991 . . . 1.0 . . . . . . . . . . . . A . 25 HIS NE2 . . . . . . . . . c30497_6e5i 1 . 1 . 431 . 1 1 25 HIS O O 7.621 -4.913 -0.492 . . . 1.0 . . . . . . . . . . . . A . 25 HIS O . . . . . . . . . c30497_6e5i 1 . 1 . 432 . 1 1 26 CYS C C 10.240 -5.618 2.456 . . . 1.0 . . . . . . . . . . . . A . 26 CYS C . . . . . . . . . c30497_6e5i 1 . 1 . 433 . 1 1 26 CYS CA C 9.109 -4.816 1.831 . . . 1.0 . . . . . . . . . . . . A . 26 CYS CA . . . . . . . . . c30497_6e5i 1 . 1 . 434 . 1 1 26 CYS CB C 8.709 -3.654 2.743 . . . 1.0 . . . . . . . . . . . . A . 26 CYS CB . . . . . . . . . c30497_6e5i 1 . 1 . 435 . 1 1 26 CYS H H 7.676 -6.291 2.299 . . . 1.0 . . . . . . . . . . . . A . 26 CYS H . . . . . . . . . c30497_6e5i 1 . 1 . 436 . 1 1 26 CYS HA H 9.438 -4.425 0.880 . . . 1.0 . . . . . . . . . . . . A . 26 CYS HA . . . . . . . . . c30497_6e5i 1 . 1 . 437 . 1 1 26 CYS HB2 H 7.755 -3.266 2.421 . . . 1.0 . . . . . . . . . . . . A . 26 CYS HB2 . . . . . . . . . c30497_6e5i 1 . 1 . 438 . 1 1 26 CYS HB3 H 8.617 -4.020 3.754 . . . 1.0 . . . . . . . . . . . . A . 26 CYS HB3 . . . . . . . . . c30497_6e5i 1 . 1 . 439 . 1 1 26 CYS N N 7.961 -5.668 1.595 . . . 1.0 . . . . . . . . . . . . A . 26 CYS N . . . . . . . . . c30497_6e5i 1 . 1 . 440 . 1 1 26 CYS O O 10.341 -5.735 3.676 . . . 1.0 . . . . . . . . . . . . A . 26 CYS O . . . . . . . . . c30497_6e5i 1 . 1 . 441 . 1 1 26 CYS SG S 9.887 -2.263 2.761 . . . 1.0 . . . . . . . . . . . . A . 26 CYS SG . . . . . . . . . c30497_6e5i 1 . 1 . 442 . 1 1 27 NH2 HN1 H 10.938 -6.053 0.653 . . . 1.0 . . . . . . . . . . . . A . 27 NH2 HN1 . . . . . . . . . c30497_6e5i 1 . 1 . 443 . 1 1 27 NH2 HN2 H 11.809 -6.727 1.983 . . . 1.0 . . . . . . . . . . . . A . 27 NH2 HN2 . . . . . . . . . c30497_6e5i 1 . 1 . 444 . 1 1 27 NH2 N N 11.080 -6.190 1.616 . . . 1.0 . . . . . . . . . . . . A . 27 NH2 N . . . . . . . . . c30497_6e5i 1 . 2 . 445 . 1 1 1 ASN C C -7.528 6.452 -1.371 . . . 1.0 . . . . . . . . . . . . A . 1 ASN C . . . . . . . . . c30497_6e5i 1 . 2 . 446 . 1 1 1 ASN CA C -8.942 6.259 -0.837 . . . 1.0 . . . . . . . . . . . . A . 1 ASN CA . . . . . . . . . c30497_6e5i 1 . 2 . 447 . 1 1 1 ASN CB C -9.535 4.972 -1.423 . . . 1.0 . . . . . . . . . . . . A . 1 ASN CB . . . . . . . . . c30497_6e5i 1 . 2 . 448 . 1 1 1 ASN CG C -10.911 4.649 -0.876 . . . 1.0 . . . . . . . . . . . . A . 1 ASN CG . . . . . . . . . c30497_6e5i 1 . 2 . 449 . 1 1 1 ASN H1 H -9.837 7.551 -2.207 . . . 1.0 . . . . . . . . . . . . A . 1 ASN H1 . . . . . . . . . c30497_6e5i 1 . 2 . 450 . 1 1 1 ASN H2 H -9.402 8.290 -0.750 . . . 1.0 . . . . . . . . . . . . A . 1 ASN H2 . . . . . . . . . c30497_6e5i 1 . 2 . 451 . 1 1 1 ASN H3 H -10.755 7.286 -0.813 . . . 1.0 . . . . . . . . . . . . A . 1 ASN H3 . . . . . . . . . c30497_6e5i 1 . 2 . 452 . 1 1 1 ASN HA H -8.898 6.171 0.239 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HA . . . . . . . . . c30497_6e5i 1 . 2 . 453 . 1 1 1 ASN HB2 H -9.616 5.080 -2.495 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HB2 . . . . . . . . . c30497_6e5i 1 . 2 . 454 . 1 1 1 ASN HB3 H -8.875 4.147 -1.200 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HB3 . . . . . . . . . c30497_6e5i 1 . 2 . 455 . 1 1 1 ASN HD21 H -10.117 3.548 0.576 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HD21 . . . . . . . . . c30497_6e5i 1 . 2 . 456 . 1 1 1 ASN HD22 H -11.844 3.643 0.557 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HD22 . . . . . . . . . c30497_6e5i 1 . 2 . 457 . 1 1 1 ASN N N -9.791 7.427 -1.175 . . . 1.0 . . . . . . . . . . . . A . 1 ASN N . . . . . . . . . c30497_6e5i 1 . 2 . 458 . 1 1 1 ASN ND2 N -10.963 3.872 0.192 . . . 1.0 . . . . . . . . . . . . A . 1 ASN ND2 . . . . . . . . . c30497_6e5i 1 . 2 . 459 . 1 1 1 ASN O O -7.124 5.811 -2.344 . . . 1.0 . . . . . . . . . . . . A . 1 ASN O . . . . . . . . . c30497_6e5i 1 . 2 . 460 . 1 1 1 ASN OD1 O -11.924 5.090 -1.415 . . . 1.0 . . . . . . . . . . . . A . 1 ASN OD1 . . . . . . . . . c30497_6e5i 1 . 2 . 461 . 1 1 2 ASP C C -4.406 6.760 -0.408 . . . 1.0 . . . . . . . . . . . . A . 2 ASP C . . . . . . . . . c30497_6e5i 1 . 2 . 462 . 1 1 2 ASP CA C -5.406 7.629 -1.161 . . . 1.0 . . . . . . . . . . . . A . 2 ASP CA . . . . . . . . . c30497_6e5i 1 . 2 . 463 . 1 1 2 ASP CB C -5.060 9.103 -0.943 . . . 1.0 . . . . . . . . . . . . A . 2 ASP CB . . . . . . . . . c30497_6e5i 1 . 2 . 464 . 1 1 2 ASP CG C -5.885 10.032 -1.804 . . . 1.0 . . . . . . . . . . . . A . 2 ASP CG . . . . . . . . . c30497_6e5i 1 . 2 . 465 . 1 1 2 ASP H H -7.149 7.829 0.030 . . . 1.0 . . . . . . . . . . . . A . 2 ASP H . . . . . . . . . c30497_6e5i 1 . 2 . 466 . 1 1 2 ASP HA H -5.332 7.408 -2.214 . . . 1.0 . . . . . . . . . . . . A . 2 ASP HA . . . . . . . . . c30497_6e5i 1 . 2 . 467 . 1 1 2 ASP HB2 H -5.232 9.355 0.092 . . . 1.0 . . . . . . . . . . . . A . 2 ASP HB2 . . . . . . . . . c30497_6e5i 1 . 2 . 468 . 1 1 2 ASP HB3 H -4.019 9.257 -1.175 . . . 1.0 . . . . . . . . . . . . A . 2 ASP HB3 . . . . . . . . . c30497_6e5i 1 . 2 . 469 . 1 1 2 ASP N N -6.777 7.346 -0.744 . . . 1.0 . . . . . . . . . . . . A . 2 ASP N . . . . . . . . . c30497_6e5i 1 . 2 . 470 . 1 1 2 ASP O O -3.198 6.977 -0.501 . . . 1.0 . . . . . . . . . . . . A . 2 ASP O . . . . . . . . . c30497_6e5i 1 . 2 . 471 . 1 1 2 ASP OD1 O -5.549 10.200 -2.996 . . . 1.0 . . . . . . . . . . . . A . 2 ASP OD1 . . . . . . . . . c30497_6e5i 1 . 2 . 472 . 1 1 2 ASP OD2 O -6.874 10.601 -1.294 . . . 1.0 . . . . . . . . . . . . A . 2 ASP OD2 . . . . . . . . . c30497_6e5i 1 . 2 . 473 . 1 1 3 LYS C C -2.987 4.223 0.397 . . . 1.0 . . . . . . . . . . . . A . 3 LYS C . . . . . . . . . c30497_6e5i 1 . 2 . 474 . 1 1 3 LYS CA C -4.068 4.948 1.186 . . . 1.0 . . . . . . . . . . . . A . 3 LYS CA . . . . . . . . . c30497_6e5i 1 . 2 . 475 . 1 1 3 LYS CB C -4.896 3.927 1.967 . . . 1.0 . . . . . . . . . . . . A . 3 LYS CB . . . . . . . . . c30497_6e5i 1 . 2 . 476 . 1 1 3 LYS CD C -6.390 3.493 3.932 . . . 1.0 . . . . . . . . . . . . A . 3 LYS CD . . . . . . . . . c30497_6e5i 1 . 2 . 477 . 1 1 3 LYS CE C -7.440 4.065 4.869 . . . 1.0 . . . . . . . . . . . . A . 3 LYS CE . . . . . . . . . c30497_6e5i 1 . 2 . 478 . 1 1 3 LYS CG C -5.859 4.542 2.968 . . . 1.0 . . . . . . . . . . . . A . 3 LYS CG . . . . . . . . . c30497_6e5i 1 . 2 . 479 . 1 1 3 LYS H H -5.872 5.602 0.294 . . . 1.0 . . . . . . . . . . . . A . 3 LYS H . . . . . . . . . c30497_6e5i 1 . 2 . 480 . 1 1 3 LYS HA H -3.586 5.607 1.890 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HA . . . . . . . . . c30497_6e5i 1 . 2 . 481 . 1 1 3 LYS HB2 H -5.469 3.338 1.267 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HB2 . . . . . . . . . c30497_6e5i 1 . 2 . 482 . 1 1 3 LYS HB3 H -4.224 3.273 2.504 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HB3 . . . . . . . . . c30497_6e5i 1 . 2 . 483 . 1 1 3 LYS HD2 H -6.831 2.689 3.365 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HD2 . . . . . . . . . c30497_6e5i 1 . 2 . 484 . 1 1 3 LYS HD3 H -5.567 3.111 4.520 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HD3 . . . . . . . . . c30497_6e5i 1 . 2 . 485 . 1 1 3 LYS HE2 H -8.290 4.385 4.285 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HE2 . . . . . . . . . c30497_6e5i 1 . 2 . 486 . 1 1 3 LYS HE3 H -7.747 3.292 5.557 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HE3 . . . . . . . . . c30497_6e5i 1 . 2 . 487 . 1 1 3 LYS HG2 H -5.341 5.304 3.528 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HG2 . . . . . . . . . c30497_6e5i 1 . 2 . 488 . 1 1 3 LYS HG3 H -6.688 4.983 2.434 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HG3 . . . . . . . . . c30497_6e5i 1 . 2 . 489 . 1 1 3 LYS HZ1 H -6.067 4.954 6.164 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HZ1 . . . . . . . . . c30497_6e5i 1 . 2 . 490 . 1 1 3 LYS HZ2 H -7.639 5.546 6.323 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HZ2 . . . . . . . . . c30497_6e5i 1 . 2 . 491 . 1 1 3 LYS HZ3 H -6.694 6.010 5.003 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HZ3 . . . . . . . . . c30497_6e5i 1 . 2 . 492 . 1 1 3 LYS N N -4.912 5.772 0.325 . . . 1.0 . . . . . . . . . . . . A . 3 LYS N . . . . . . . . . c30497_6e5i 1 . 2 . 493 . 1 1 3 LYS NZ N -6.924 5.223 5.644 . . . 1.0 . . . . . . . . . . . . A . 3 LYS NZ . . . . . . . . . c30497_6e5i 1 . 2 . 494 . 1 1 3 LYS O O -1.861 4.100 0.865 . . . 1.0 . . . . . . . . . . . . A . 3 LYS O . . . . . . . . . c30497_6e5i 1 . 2 . 495 . 1 1 4 CYS C C -1.182 3.946 -1.959 . . . 1.0 . . . . . . . . . . . . A . 4 CYS C . . . . . . . . . c30497_6e5i 1 . 2 . 496 . 1 1 4 CYS CA C -2.354 3.043 -1.621 . . . 1.0 . . . . . . . . . . . . A . 4 CYS CA . . . . . . . . . c30497_6e5i 1 . 2 . 497 . 1 1 4 CYS CB C -3.004 2.531 -2.905 . . . 1.0 . . . . . . . . . . . . A . 4 CYS CB . . . . . . . . . c30497_6e5i 1 . 2 . 498 . 1 1 4 CYS H H -4.222 3.919 -1.143 . . . 1.0 . . . . . . . . . . . . A . 4 CYS H . . . . . . . . . c30497_6e5i 1 . 2 . 499 . 1 1 4 CYS HA H -1.992 2.204 -1.048 . . . 1.0 . . . . . . . . . . . . A . 4 CYS HA . . . . . . . . . c30497_6e5i 1 . 2 . 500 . 1 1 4 CYS HB2 H -3.425 3.363 -3.443 . . . 1.0 . . . . . . . . . . . . A . 4 CYS HB2 . . . . . . . . . c30497_6e5i 1 . 2 . 501 . 1 1 4 CYS HB3 H -2.249 2.060 -3.516 . . . 1.0 . . . . . . . . . . . . A . 4 CYS HB3 . . . . . . . . . c30497_6e5i 1 . 2 . 502 . 1 1 4 CYS N N -3.319 3.761 -0.799 . . . 1.0 . . . . . . . . . . . . A . 4 CYS N . . . . . . . . . c30497_6e5i 1 . 2 . 503 . 1 1 4 CYS O O -0.028 3.521 -1.936 . . . 1.0 . . . . . . . . . . . . A . 4 CYS O . . . . . . . . . c30497_6e5i 1 . 2 . 504 . 1 1 4 CYS SG S -4.333 1.318 -2.639 . . . 1.0 . . . . . . . . . . . . A . 4 CYS SG . . . . . . . . . c30497_6e5i 1 . 2 . 505 . 1 1 5 LYS C C 0.337 6.545 -1.320 . . . 1.0 . . . . . . . . . . . . A . 5 LYS C . . . . . . . . . c30497_6e5i 1 . 2 . 506 . 1 1 5 LYS CA C -0.463 6.183 -2.562 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CA . . . . . . . . . c30497_6e5i 1 . 2 . 507 . 1 1 5 LYS CB C -1.093 7.439 -3.166 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CB . . . . . . . . . c30497_6e5i 1 . 2 . 508 . 1 1 5 LYS CD C -2.337 8.493 -5.074 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CD . . . . . . . . . c30497_6e5i 1 . 2 . 509 . 1 1 5 LYS CE C -2.853 8.314 -6.493 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CE . . . . . . . . . c30497_6e5i 1 . 2 . 510 . 1 1 5 LYS CG C -1.691 7.224 -4.547 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CG . . . . . . . . . c30497_6e5i 1 . 2 . 511 . 1 1 5 LYS H H -2.428 5.483 -2.223 . . . 1.0 . . . . . . . . . . . . A . 5 LYS H . . . . . . . . . c30497_6e5i 1 . 2 . 512 . 1 1 5 LYS HA H 0.204 5.738 -3.287 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HA . . . . . . . . . c30497_6e5i 1 . 2 . 513 . 1 1 5 LYS HB2 H -1.879 7.783 -2.508 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HB2 . . . . . . . . . c30497_6e5i 1 . 2 . 514 . 1 1 5 LYS HB3 H -0.337 8.206 -3.240 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HB3 . . . . . . . . . c30497_6e5i 1 . 2 . 515 . 1 1 5 LYS HD2 H -3.164 8.757 -4.431 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HD2 . . . . . . . . . c30497_6e5i 1 . 2 . 516 . 1 1 5 LYS HD3 H -1.604 9.286 -5.063 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HD3 . . . . . . . . . c30497_6e5i 1 . 2 . 517 . 1 1 5 LYS HE2 H -3.574 7.511 -6.500 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HE2 . . . . . . . . . c30497_6e5i 1 . 2 . 518 . 1 1 5 LYS HE3 H -3.332 9.230 -6.805 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HE3 . . . . . . . . . c30497_6e5i 1 . 2 . 519 . 1 1 5 LYS HG2 H -0.908 6.924 -5.226 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HG2 . . . . . . . . . c30497_6e5i 1 . 2 . 520 . 1 1 5 LYS HG3 H -2.439 6.448 -4.491 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HG3 . . . . . . . . . c30497_6e5i 1 . 2 . 521 . 1 1 5 LYS HZ1 H -1.345 7.065 -7.217 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HZ1 . . . . . . . . . c30497_6e5i 1 . 2 . 522 . 1 1 5 LYS HZ2 H -1.015 8.710 -7.401 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HZ2 . . . . . . . . . c30497_6e5i 1 . 2 . 523 . 1 1 5 LYS HZ3 H -2.132 7.955 -8.418 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HZ3 . . . . . . . . . c30497_6e5i 1 . 2 . 524 . 1 1 5 LYS N N -1.487 5.203 -2.243 . . . 1.0 . . . . . . . . . . . . A . 5 LYS N . . . . . . . . . c30497_6e5i 1 . 2 . 525 . 1 1 5 LYS NZ N -1.760 7.989 -7.448 . . . 1.0 . . . . . . . . . . . . A . 5 LYS NZ . . . . . . . . . c30497_6e5i 1 . 2 . 526 . 1 1 5 LYS O O 1.562 6.628 -1.367 . . . 1.0 . . . . . . . . . . . . A . 5 LYS O . . . . . . . . . c30497_6e5i 1 . 2 . 527 . 1 1 6 GLU C C 1.260 6.011 1.489 . . . 1.0 . . . . . . . . . . . . A . 6 GLU C . . . . . . . . . c30497_6e5i 1 . 2 . 528 . 1 1 6 GLU CA C 0.295 7.106 1.045 . . . 1.0 . . . . . . . . . . . . A . 6 GLU CA . . . . . . . . . c30497_6e5i 1 . 2 . 529 . 1 1 6 GLU CB C -0.738 7.371 2.147 . . . 1.0 . . . . . . . . . . . . A . 6 GLU CB . . . . . . . . . c30497_6e5i 1 . 2 . 530 . 1 1 6 GLU CD C -2.501 8.941 3.052 . . . 1.0 . . . . . . . . . . . . A . 6 GLU CD . . . . . . . . . c30497_6e5i 1 . 2 . 531 . 1 1 6 GLU CG C -1.677 8.530 1.849 . . . 1.0 . . . . . . . . . . . . A . 6 GLU CG . . . . . . . . . c30497_6e5i 1 . 2 . 532 . 1 1 6 GLU H H -1.334 6.620 -0.222 . . . 1.0 . . . . . . . . . . . . A . 6 GLU H . . . . . . . . . c30497_6e5i 1 . 2 . 533 . 1 1 6 GLU HA H 0.857 8.008 0.863 . . . 1.0 . . . . . . . . . . . . A . 6 GLU HA . . . . . . . . . c30497_6e5i 1 . 2 . 534 . 1 1 6 GLU HB2 H -1.334 6.481 2.283 . . . 1.0 . . . . . . . . . . . . A . 6 GLU HB2 . . . . . . . . . c30497_6e5i 1 . 2 . 535 . 1 1 6 GLU HB3 H -0.216 7.587 3.067 . . . 1.0 . . . . . . . . . . . . A . 6 GLU HB3 . . . . . . . . . c30497_6e5i 1 . 2 . 536 . 1 1 6 GLU HG2 H -1.093 9.377 1.528 . . . 1.0 . . . . . . . . . . . . A . 6 GLU HG2 . . . . . . . . . c30497_6e5i 1 . 2 . 537 . 1 1 6 GLU HG3 H -2.349 8.240 1.055 . . . 1.0 . . . . . . . . . . . . A . 6 GLU HG3 . . . . . . . . . c30497_6e5i 1 . 2 . 538 . 1 1 6 GLU N N -0.358 6.735 -0.205 . . . 1.0 . . . . . . . . . . . . A . 6 GLU N . . . . . . . . . c30497_6e5i 1 . 2 . 539 . 1 1 6 GLU O O 2.387 6.289 1.908 . . . 1.0 . . . . . . . . . . . . A . 6 GLU O . . . . . . . . . c30497_6e5i 1 . 2 . 540 . 1 1 6 GLU OE1 O -2.021 9.786 3.838 . . . 1.0 . . . . . . . . . . . . A . 6 GLU OE1 . . . . . . . . . c30497_6e5i 1 . 2 . 541 . 1 1 6 GLU OE2 O -3.633 8.438 3.215 . . . 1.0 . . . . . . . . . . . . A . 6 GLU OE2 . . . . . . . . . c30497_6e5i 1 . 2 . 542 . 1 1 7 LEU C C 2.766 3.407 0.783 . . . 1.0 . . . . . . . . . . . . A . 7 LEU C . . . . . . . . . c30497_6e5i 1 . 2 . 543 . 1 1 7 LEU CA C 1.614 3.620 1.756 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CA . . . . . . . . . c30497_6e5i 1 . 2 . 544 . 1 1 7 LEU CB C 0.732 2.370 1.815 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CB . . . . . . . . . c30497_6e5i 1 . 2 . 545 . 1 1 7 LEU CD1 C -1.376 1.286 2.655 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CD1 . . . . . . . . . c30497_6e5i 1 . 2 . 546 . 1 1 7 LEU CD2 C 0.268 2.210 4.276 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CD2 . . . . . . . . . c30497_6e5i 1 . 2 . 547 . 1 1 7 LEU CG C -0.352 2.384 2.900 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CG . . . . . . . . . c30497_6e5i 1 . 2 . 548 . 1 1 7 LEU H H -0.095 4.625 1.025 . . . 1.0 . . . . . . . . . . . . A . 7 LEU H . . . . . . . . . c30497_6e5i 1 . 2 . 549 . 1 1 7 LEU HA H 2.018 3.812 2.737 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HA . . . . . . . . . c30497_6e5i 1 . 2 . 550 . 1 1 7 LEU HB2 H 0.251 2.254 0.854 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HB2 . . . . . . . . . c30497_6e5i 1 . 2 . 551 . 1 1 7 LEU HB3 H 1.369 1.516 1.983 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HB3 . . . . . . . . . c30497_6e5i 1 . 2 . 552 . 1 1 7 LEU HD11 H -2.134 1.322 3.424 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD11 . . . . . . . . . c30497_6e5i 1 . 2 . 553 . 1 1 7 LEU HD12 H -0.885 0.325 2.678 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD12 . . . . . . . . . c30497_6e5i 1 . 2 . 554 . 1 1 7 LEU HD13 H -1.837 1.432 1.689 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD13 . . . . . . . . . c30497_6e5i 1 . 2 . 555 . 1 1 7 LEU HD21 H 0.971 3.007 4.458 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD21 . . . . . . . . . c30497_6e5i 1 . 2 . 556 . 1 1 7 LEU HD22 H 0.780 1.258 4.321 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD22 . . . . . . . . . c30497_6e5i 1 . 2 . 557 . 1 1 7 LEU HD23 H -0.508 2.235 5.026 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD23 . . . . . . . . . c30497_6e5i 1 . 2 . 558 . 1 1 7 LEU HG H -0.865 3.334 2.879 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HG . . . . . . . . . c30497_6e5i 1 . 2 . 559 . 1 1 7 LEU N N 0.813 4.772 1.373 . . . 1.0 . . . . . . . . . . . . A . 7 LEU N . . . . . . . . . c30497_6e5i 1 . 2 . 560 . 1 1 7 LEU O O 3.905 3.187 1.197 . . . 1.0 . . . . . . . . . . . . A . 7 LEU O . . . . . . . . . c30497_6e5i 1 . 2 . 561 . 1 1 8 LYS C C 4.562 4.365 -1.464 . . . 1.0 . . . . . . . . . . . . A . 8 LYS C . . . . . . . . . c30497_6e5i 1 . 2 . 562 . 1 1 8 LYS CA C 3.489 3.282 -1.538 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CA . . . . . . . . . c30497_6e5i 1 . 2 . 563 . 1 1 8 LYS CB C 2.841 3.258 -2.923 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CB . . . . . . . . . c30497_6e5i 1 . 2 . 564 . 1 1 8 LYS CD C 3.068 2.794 -5.377 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CD . . . . . . . . . c30497_6e5i 1 . 2 . 565 . 1 1 8 LYS CE C 4.014 2.423 -6.506 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CE . . . . . . . . . c30497_6e5i 1 . 2 . 566 . 1 1 8 LYS CG C 3.799 2.913 -4.050 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CG . . . . . . . . . c30497_6e5i 1 . 2 . 567 . 1 1 8 LYS H H 1.550 3.695 -0.785 . . . 1.0 . . . . . . . . . . . . A . 8 LYS H . . . . . . . . . c30497_6e5i 1 . 2 . 568 . 1 1 8 LYS HA H 3.949 2.324 -1.349 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HA . . . . . . . . . c30497_6e5i 1 . 2 . 569 . 1 1 8 LYS HB2 H 2.045 2.528 -2.923 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HB2 . . . . . . . . . c30497_6e5i 1 . 2 . 570 . 1 1 8 LYS HB3 H 2.419 4.232 -3.125 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HB3 . . . . . . . . . c30497_6e5i 1 . 2 . 571 . 1 1 8 LYS HD2 H 2.310 2.030 -5.291 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HD2 . . . . . . . . . c30497_6e5i 1 . 2 . 572 . 1 1 8 LYS HD3 H 2.603 3.741 -5.605 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HD3 . . . . . . . . . c30497_6e5i 1 . 2 . 573 . 1 1 8 LYS HE2 H 3.454 2.386 -7.428 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HE2 . . . . . . . . . c30497_6e5i 1 . 2 . 574 . 1 1 8 LYS HE3 H 4.779 3.182 -6.581 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HE3 . . . . . . . . . c30497_6e5i 1 . 2 . 575 . 1 1 8 LYS HG2 H 4.541 3.692 -4.128 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HG2 . . . . . . . . . c30497_6e5i 1 . 2 . 576 . 1 1 8 LYS HG3 H 4.280 1.973 -3.827 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HG3 . . . . . . . . . c30497_6e5i 1 . 2 . 577 . 1 1 8 LYS HZ1 H 5.275 1.140 -5.444 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ1 . . . . . . . . . c30497_6e5i 1 . 2 . 578 . 1 1 8 LYS HZ2 H 5.241 0.845 -7.106 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ2 . . . . . . . . . c30497_6e5i 1 . 2 . 579 . 1 1 8 LYS HZ3 H 3.942 0.368 -6.139 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ3 . . . . . . . . . c30497_6e5i 1 . 2 . 580 . 1 1 8 LYS N N 2.474 3.492 -0.511 . . . 1.0 . . . . . . . . . . . . A . 8 LYS N . . . . . . . . . c30497_6e5i 1 . 2 . 581 . 1 1 8 LYS NZ N 4.663 1.104 -6.282 . . . 1.0 . . . . . . . . . . . . A . 8 LYS NZ . . . . . . . . . c30497_6e5i 1 . 2 . 582 . 1 1 8 LYS O O 5.724 4.128 -1.793 . . . 1.0 . . . . . . . . . . . . A . 8 LYS O . . . . . . . . . c30497_6e5i 1 . 2 . 583 . 1 1 9 LYS C C 5.936 6.369 0.448 . . . 1.0 . . . . . . . . . . . . A . 9 LYS C . . . . . . . . . c30497_6e5i 1 . 2 . 584 . 1 1 9 LYS CA C 5.120 6.632 -0.809 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CA . . . . . . . . . c30497_6e5i 1 . 2 . 585 . 1 1 9 LYS CB C 4.406 7.978 -0.686 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CB . . . . . . . . . c30497_6e5i 1 . 2 . 586 . 1 1 9 LYS CD C 5.063 8.810 -2.978 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CD . . . . . . . . . c30497_6e5i 1 . 2 . 587 . 1 1 9 LYS CE C 6.134 9.707 -2.372 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CE . . . . . . . . . c30497_6e5i 1 . 2 . 588 . 1 1 9 LYS CG C 3.918 8.554 -2.008 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CG . . . . . . . . . c30497_6e5i 1 . 2 . 589 . 1 1 9 LYS H H 3.210 5.716 -0.880 . . . 1.0 . . . . . . . . . . . . A . 9 LYS H . . . . . . . . . c30497_6e5i 1 . 2 . 590 . 1 1 9 LYS HA H 5.788 6.664 -1.654 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HA . . . . . . . . . c30497_6e5i 1 . 2 . 591 . 1 1 9 LYS HB2 H 3.550 7.856 -0.038 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HB2 . . . . . . . . . c30497_6e5i 1 . 2 . 592 . 1 1 9 LYS HB3 H 5.083 8.687 -0.237 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HB3 . . . . . . . . . c30497_6e5i 1 . 2 . 593 . 1 1 9 LYS HD2 H 5.510 7.866 -3.246 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HD2 . . . . . . . . . c30497_6e5i 1 . 2 . 594 . 1 1 9 LYS HD3 H 4.669 9.286 -3.864 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HD3 . . . . . . . . . c30497_6e5i 1 . 2 . 595 . 1 1 9 LYS HE2 H 6.566 9.203 -1.521 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HE2 . . . . . . . . . c30497_6e5i 1 . 2 . 596 . 1 1 9 LYS HE3 H 6.901 9.879 -3.112 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HE3 . . . . . . . . . c30497_6e5i 1 . 2 . 597 . 1 1 9 LYS HG2 H 3.228 7.859 -2.461 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HG2 . . . . . . . . . c30497_6e5i 1 . 2 . 598 . 1 1 9 LYS HG3 H 3.410 9.487 -1.814 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HG3 . . . . . . . . . c30497_6e5i 1 . 2 . 599 . 1 1 9 LYS HZ1 H 4.877 10.877 -1.181 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HZ1 . . . . . . . . . c30497_6e5i 1 . 2 . 600 . 1 1 9 LYS HZ2 H 5.141 11.507 -2.726 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HZ2 . . . . . . . . . c30497_6e5i 1 . 2 . 601 . 1 1 9 LYS HZ3 H 6.354 11.615 -1.554 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HZ3 . . . . . . . . . c30497_6e5i 1 . 2 . 602 . 1 1 9 LYS N N 4.168 5.554 -1.036 . . . 1.0 . . . . . . . . . . . . A . 9 LYS N . . . . . . . . . c30497_6e5i 1 . 2 . 603 . 1 1 9 LYS NZ N 5.588 11.017 -1.927 . . . 1.0 . . . . . . . . . . . . A . 9 LYS NZ . . . . . . . . . c30497_6e5i 1 . 2 . 604 . 1 1 9 LYS O O 7.161 6.494 0.441 . . . 1.0 . . . . . . . . . . . . A . 9 LYS O . . . . . . . . . c30497_6e5i 1 . 2 . 605 . 1 1 10 ARG C C 6.930 4.624 2.696 . . . 1.0 . . . . . . . . . . . . A . 10 ARG C . . . . . . . . . c30497_6e5i 1 . 2 . 606 . 1 1 10 ARG CA C 5.892 5.736 2.802 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CA . . . . . . . . . c30497_6e5i 1 . 2 . 607 . 1 1 10 ARG CB C 4.843 5.370 3.855 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CB . . . . . . . . . c30497_6e5i 1 . 2 . 608 . 1 1 10 ARG CD C 4.382 4.566 6.204 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CD . . . . . . . . . c30497_6e5i 1 . 2 . 609 . 1 1 10 ARG CG C 5.447 4.921 5.176 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CG . . . . . . . . . c30497_6e5i 1 . 2 . 610 . 1 1 10 ARG CZ C 4.426 3.869 8.573 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CZ . . . . . . . . . c30497_6e5i 1 . 2 . 611 . 1 1 10 ARG H H 4.273 5.891 1.450 . . . 1.0 . . . . . . . . . . . . A . 10 ARG H . . . . . . . . . c30497_6e5i 1 . 2 . 612 . 1 1 10 ARG HA H 6.388 6.643 3.108 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HA . . . . . . . . . c30497_6e5i 1 . 2 . 613 . 1 1 10 ARG HB2 H 4.219 6.231 4.038 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HB2 . . . . . . . . . c30497_6e5i 1 . 2 . 614 . 1 1 10 ARG HB3 H 4.231 4.567 3.473 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HB3 . . . . . . . . . c30497_6e5i 1 . 2 . 615 . 1 1 10 ARG HD2 H 3.919 5.478 6.551 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HD2 . . . . . . . . . c30497_6e5i 1 . 2 . 616 . 1 1 10 ARG HD3 H 3.636 3.942 5.736 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HD3 . . . . . . . . . c30497_6e5i 1 . 2 . 617 . 1 1 10 ARG HE H 5.764 3.325 7.189 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HE . . . . . . . . . c30497_6e5i 1 . 2 . 618 . 1 1 10 ARG HG2 H 6.061 4.050 4.998 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HG2 . . . . . . . . . c30497_6e5i 1 . 2 . 619 . 1 1 10 ARG HG3 H 6.059 5.721 5.566 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HG3 . . . . . . . . . c30497_6e5i 1 . 2 . 620 . 1 1 10 ARG HH11 H 2.960 4.615 9.759 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HH11 . . . . . . . . . c30497_6e5i 1 . 2 . 621 . 1 1 10 ARG HH12 H 2.939 5.169 8.116 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HH12 . . . . . . . . . c30497_6e5i 1 . 2 . 622 . 1 1 10 ARG HH21 H 5.804 2.605 9.359 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HH21 . . . . . . . . . c30497_6e5i 1 . 2 . 623 . 1 1 10 ARG HH22 H 4.595 3.166 10.467 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HH22 . . . . . . . . . c30497_6e5i 1 . 2 . 624 . 1 1 10 ARG N N 5.248 5.994 1.519 . . . 1.0 . . . . . . . . . . . . A . 10 ARG N . . . . . . . . . c30497_6e5i 1 . 2 . 625 . 1 1 10 ARG NE N 4.951 3.855 7.350 . . . 1.0 . . . . . . . . . . . . A . 10 ARG NE . . . . . . . . . c30497_6e5i 1 . 2 . 626 . 1 1 10 ARG NH1 N 3.355 4.608 8.836 . . . 1.0 . . . . . . . . . . . . A . 10 ARG NH1 . . . . . . . . . c30497_6e5i 1 . 2 . 627 . 1 1 10 ARG NH2 N 4.987 3.156 9.543 . . . 1.0 . . . . . . . . . . . . A . 10 ARG NH2 . . . . . . . . . c30497_6e5i 1 . 2 . 628 . 1 1 10 ARG O O 8.047 4.756 3.196 . . . 1.0 . . . . . . . . . . . . A . 10 ARG O . . . . . . . . . c30497_6e5i 1 . 2 . 629 . 1 1 11 TYR C C 8.352 2.395 0.770 . . . 1.0 . . . . . . . . . . . . A . 11 TYR C . . . . . . . . . c30497_6e5i 1 . 2 . 630 . 1 1 11 TYR CA C 7.425 2.364 1.977 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CA . . . . . . . . . c30497_6e5i 1 . 2 . 631 . 1 1 11 TYR CB C 6.578 1.095 1.980 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CB . . . . . . . . . c30497_6e5i 1 . 2 . 632 . 1 1 11 TYR CD1 C 6.544 0.233 4.345 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CD1 . . . . . . . . . c30497_6e5i 1 . 2 . 633 . 1 1 11 TYR CD2 C 4.576 1.280 3.507 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CD2 . . . . . . . . . c30497_6e5i 1 . 2 . 634 . 1 1 11 TYR CE1 C 5.924 0.029 5.561 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CE1 . . . . . . . . . c30497_6e5i 1 . 2 . 635 . 1 1 11 TYR CE2 C 3.948 1.078 4.720 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CE2 . . . . . . . . . c30497_6e5i 1 . 2 . 636 . 1 1 11 TYR CG C 5.883 0.862 3.300 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CG . . . . . . . . . c30497_6e5i 1 . 2 . 637 . 1 1 11 TYR CZ C 4.625 0.453 5.743 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CZ . . . . . . . . . c30497_6e5i 1 . 2 . 638 . 1 1 11 TYR H H 5.690 3.518 1.582 . . . 1.0 . . . . . . . . . . . . A . 11 TYR H . . . . . . . . . c30497_6e5i 1 . 2 . 639 . 1 1 11 TYR HA H 8.033 2.369 2.869 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HA . . . . . . . . . c30497_6e5i 1 . 2 . 640 . 1 1 11 TYR HB2 H 5.823 1.170 1.212 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HB2 . . . . . . . . . c30497_6e5i 1 . 2 . 641 . 1 1 11 TYR HB3 H 7.209 0.245 1.779 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HB3 . . . . . . . . . c30497_6e5i 1 . 2 . 642 . 1 1 11 TYR HD1 H 7.564 -0.096 4.198 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HD1 . . . . . . . . . c30497_6e5i 1 . 2 . 643 . 1 1 11 TYR HD2 H 4.046 1.771 2.703 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HD2 . . . . . . . . . c30497_6e5i 1 . 2 . 644 . 1 1 11 TYR HE1 H 6.455 -0.462 6.363 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HE1 . . . . . . . . . c30497_6e5i 1 . 2 . 645 . 1 1 11 TYR HE2 H 2.933 1.411 4.861 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HE2 . . . . . . . . . c30497_6e5i 1 . 2 . 646 . 1 1 11 TYR HH H 3.089 -0.018 6.806 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HH . . . . . . . . . c30497_6e5i 1 . 2 . 647 . 1 1 11 TYR N N 6.564 3.538 2.036 . . . 1.0 . . . . . . . . . . . . A . 11 TYR N . . . . . . . . . c30497_6e5i 1 . 2 . 648 . 1 1 11 TYR O O 9.135 1.470 0.562 . . . 1.0 . . . . . . . . . . . . A . 11 TYR O . . . . . . . . . c30497_6e5i 1 . 2 . 649 . 1 1 11 TYR OH O 4.003 0.258 6.954 . . . 1.0 . . . . . . . . . . . . A . 11 TYR OH . . . . . . . . . c30497_6e5i 1 . 2 . 650 . 1 1 12 ORN C C 10.126 0.271 -2.926 . . . 1.0 . . . . . . . . . . . . A . 12 ORN C . . . . . . . . . c30497_6e5i 1 . 2 . 651 . 1 1 12 ORN CA C 10.730 1.668 -3.014 . . . 1.0 . . . . . . . . . . . . A . 12 ORN CA . . . . . . . . . c30497_6e5i 1 . 2 . 652 . 1 1 12 ORN CB C 9.658 2.672 -3.457 . . . 1.0 . . . . . . . . . . . . A . 12 ORN CB . . . . . . . . . c30497_6e5i 1 . 2 . 653 . 1 1 12 ORN CD C 9.106 3.638 -1.202 . . . 1.0 . . . . . . . . . . . . A . 12 ORN CD . . . . . . . . . c30497_6e5i 1 . 2 . 654 . 1 1 12 ORN CG C 8.569 2.900 -2.419 . . . 1.0 . . . . . . . . . . . . A . 12 ORN CG . . . . . . . . . c30497_6e5i 1 . 2 . 655 . 1 1 12 ORN H H 12.260 2.627 -4.053 . . . 1.0 . . . . . . . . . . . . A . 12 ORN H . . . . . . . . . c30497_6e5i 1 . 2 . 656 . 1 1 12 ORN HA H 11.101 1.950 -2.042 . . . 1.0 . . . . . . . . . . . . A . 12 ORN HA . . . . . . . . . c30497_6e5i 1 . 2 . 657 . 1 1 12 ORN HB2 H 9.195 2.309 -4.360 . . . 1.0 . . . . . . . . . . . . A . 12 ORN HB2 . . . . . . . . . c30497_6e5i 1 . 2 . 658 . 1 1 12 ORN HB3 H 10.133 3.619 -3.662 . . . 1.0 . . . . . . . . . . . . A . 12 ORN HB3 . . . . . . . . . c30497_6e5i 1 . 2 . 659 . 1 1 12 ORN HD2 H 9.156 4.689 -1.434 . . . 1.0 . . . . . . . . . . . . A . 12 ORN HD2 . . . . . . . . . c30497_6e5i 1 . 2 . 660 . 1 1 12 ORN HD3 H 10.096 3.274 -0.983 . . . 1.0 . . . . . . . . . . . . A . 12 ORN HD3 . . . . . . . . . c30497_6e5i 1 . 2 . 661 . 1 1 12 ORN HE1 H 7.614 4.153 0.190 . . . 1.0 . . . . . . . . . . . . A . 12 ORN HE1 . . . . . . . . . c30497_6e5i 1 . 2 . 662 . 1 1 12 ORN HG2 H 8.179 1.944 -2.103 . . . 1.0 . . . . . . . . . . . . A . 12 ORN HG2 . . . . . . . . . c30497_6e5i 1 . 2 . 663 . 1 1 12 ORN HG3 H 7.777 3.483 -2.861 . . . 1.0 . . . . . . . . . . . . A . 12 ORN HG3 . . . . . . . . . c30497_6e5i 1 . 2 . 664 . 1 1 12 ORN N N 11.864 1.670 -3.967 . . . 1.0 . . . . . . . . . . . . A . 12 ORN N . . . . . . . . . c30497_6e5i 1 . 2 . 665 . 1 1 12 ORN NE N 8.268 3.455 -0.021 . . . 1.0 . . . . . . . . . . . . A . 12 ORN NE . . . . . . . . . c30497_6e5i 1 . 2 . 666 . 1 1 12 ORN O O 10.250 -0.525 -3.857 . . . 1.0 . . . . . . . . . . . . A . 12 ORN O . . . . . . . . . c30497_6e5i 1 . 2 . 667 . 1 1 13 CYS C C 7.398 -1.238 -2.132 . . . 1.0 . . . . . . . . . . . . A . 13 CYS C . . . . . . . . . c30497_6e5i 1 . 2 . 668 . 1 1 13 CYS CA C 8.827 -1.300 -1.607 . . . 1.0 . . . . . . . . . . . . A . 13 CYS CA . . . . . . . . . c30497_6e5i 1 . 2 . 669 . 1 1 13 CYS CB C 8.860 -1.664 -0.127 . . . 1.0 . . . . . . . . . . . . A . 13 CYS CB . . . . . . . . . c30497_6e5i 1 . 2 . 670 . 1 1 13 CYS H H 9.461 0.640 -1.080 . . . 1.0 . . . . . . . . . . . . A . 13 CYS H . . . . . . . . . c30497_6e5i 1 . 2 . 671 . 1 1 13 CYS HA H 9.371 -2.047 -2.166 . . . 1.0 . . . . . . . . . . . . A . 13 CYS HA . . . . . . . . . c30497_6e5i 1 . 2 . 672 . 1 1 13 CYS HB2 H 8.388 -0.877 0.441 . . . 1.0 . . . . . . . . . . . . A . 13 CYS HB2 . . . . . . . . . c30497_6e5i 1 . 2 . 673 . 1 1 13 CYS HB3 H 8.321 -2.587 0.027 . . . 1.0 . . . . . . . . . . . . A . 13 CYS HB3 . . . . . . . . . c30497_6e5i 1 . 2 . 674 . 1 1 13 CYS N N 9.491 -0.024 -1.805 . . . 1.0 . . . . . . . . . . . . A . 13 CYS N . . . . . . . . . c30497_6e5i 1 . 2 . 675 . 1 1 13 CYS O O 6.792 -0.166 -2.184 . . . 1.0 . . . . . . . . . . . . A . 13 CYS O . . . . . . . . . c30497_6e5i 1 . 2 . 676 . 1 1 13 CYS SG S 10.555 -1.883 0.519 . . . 1.0 . . . . . . . . . . . . A . 13 CYS SG . . . . . . . . . c30497_6e5i 1 . 2 . 677 . 1 1 14 GLU C C 4.432 -2.718 -2.271 . . . 1.0 . . . . . . . . . . . . A . 14 GLU C . . . . . . . . . c30497_6e5i 1 . 2 . 678 . 1 1 14 GLU CA C 5.587 -2.434 -3.214 . . . 1.0 . . . . . . . . . . . . A . 14 GLU CA . . . . . . . . . c30497_6e5i 1 . 2 . 679 . 1 1 14 GLU CB C 5.628 -3.490 -4.318 . . . 1.0 . . . . . . . . . . . . A . 14 GLU CB . . . . . . . . . c30497_6e5i 1 . 2 . 680 . 1 1 14 GLU CD C 6.109 -1.842 -6.173 . . . 1.0 . . . . . . . . . . . . A . 14 GLU CD . . . . . . . . . c30497_6e5i 1 . 2 . 681 . 1 1 14 GLU CG C 6.535 -3.123 -5.482 . . . 1.0 . . . . . . . . . . . . A . 14 GLU CG . . . . . . . . . c30497_6e5i 1 . 2 . 682 . 1 1 14 GLU H H 7.317 -3.230 -2.283 . . . 1.0 . . . . . . . . . . . . A . 14 GLU H . . . . . . . . . c30497_6e5i 1 . 2 . 683 . 1 1 14 GLU HA H 5.428 -1.466 -3.668 . . . 1.0 . . . . . . . . . . . . A . 14 GLU HA . . . . . . . . . c30497_6e5i 1 . 2 . 684 . 1 1 14 GLU HB2 H 5.980 -4.419 -3.893 . . . 1.0 . . . . . . . . . . . . A . 14 GLU HB2 . . . . . . . . . c30497_6e5i 1 . 2 . 685 . 1 1 14 GLU HB3 H 4.627 -3.633 -4.698 . . . 1.0 . . . . . . . . . . . . A . 14 GLU HB3 . . . . . . . . . c30497_6e5i 1 . 2 . 686 . 1 1 14 GLU HG2 H 7.542 -2.996 -5.113 . . . 1.0 . . . . . . . . . . . . A . 14 GLU HG2 . . . . . . . . . c30497_6e5i 1 . 2 . 687 . 1 1 14 GLU HG3 H 6.515 -3.926 -6.202 . . . 1.0 . . . . . . . . . . . . A . 14 GLU HG3 . . . . . . . . . c30497_6e5i 1 . 2 . 688 . 1 1 14 GLU N N 6.861 -2.387 -2.510 . . . 1.0 . . . . . . . . . . . . A . 14 GLU N . . . . . . . . . c30497_6e5i 1 . 2 . 689 . 1 1 14 GLU O O 4.420 -3.722 -1.562 . . . 1.0 . . . . . . . . . . . . A . 14 GLU O . . . . . . . . . c30497_6e5i 1 . 2 . 690 . 1 1 14 GLU OE1 O 6.766 -0.801 -5.962 . . . 1.0 . . . . . . . . . . . . A . 14 GLU OE1 . . . . . . . . . c30497_6e5i 1 . 2 . 691 . 1 1 14 GLU OE2 O 5.108 -1.867 -6.920 . . . 1.0 . . . . . . . . . . . . A . 14 GLU OE2 . . . . . . . . . c30497_6e5i 1 . 2 . 692 . 1 1 15 VAL C C 1.106 -2.438 -2.338 . . . 1.0 . . . . . . . . . . . . A . 15 VAL C . . . . . . . . . c30497_6e5i 1 . 2 . 693 . 1 1 15 VAL CA C 2.271 -1.992 -1.465 . . . 1.0 . . . . . . . . . . . . A . 15 VAL CA . . . . . . . . . c30497_6e5i 1 . 2 . 694 . 1 1 15 VAL CB C 1.903 -0.688 -0.732 . . . 1.0 . . . . . . . . . . . . A . 15 VAL CB . . . . . . . . . c30497_6e5i 1 . 2 . 695 . 1 1 15 VAL CG1 C 0.627 -0.864 0.077 . . . 1.0 . . . . . . . . . . . . A . 15 VAL CG1 . . . . . . . . . c30497_6e5i 1 . 2 . 696 . 1 1 15 VAL CG2 C 3.047 -0.243 0.166 . . . 1.0 . . . . . . . . . . . . A . 15 VAL CG2 . . . . . . . . . c30497_6e5i 1 . 2 . 697 . 1 1 15 VAL H H 3.538 -1.042 -2.854 . . . 1.0 . . . . . . . . . . . . A . 15 VAL H . . . . . . . . . c30497_6e5i 1 . 2 . 698 . 1 1 15 VAL HA H 2.473 -2.757 -0.728 . . . 1.0 . . . . . . . . . . . . A . 15 VAL HA . . . . . . . . . c30497_6e5i 1 . 2 . 699 . 1 1 15 VAL HB H 1.734 0.079 -1.471 . . . 1.0 . . . . . . . . . . . . A . 15 VAL HB . . . . . . . . . c30497_6e5i 1 . 2 . 700 . 1 1 15 VAL HG11 H 0.782 -1.618 0.836 . . . 1.0 . . . . . . . . . . . . A . 15 VAL HG11 . . . . . . . . . c30497_6e5i 1 . 2 . 701 . 1 1 15 VAL HG12 H -0.173 -1.173 -0.579 . . . 1.0 . . . . . . . . . . . . A . 15 VAL HG12 . . . . . . . . . c30497_6e5i 1 . 2 . 702 . 1 1 15 VAL HG13 H 0.368 0.071 0.546 . . . 1.0 . . . . . . . . . . . . A . 15 VAL HG13 . . . . . . . . . c30497_6e5i 1 . 2 . 703 . 1 1 15 VAL HG21 H 3.221 -0.990 0.925 . . . 1.0 . . . . . . . . . . . . A . 15 VAL HG21 . . . . . . . . . c30497_6e5i 1 . 2 . 704 . 1 1 15 VAL HG22 H 2.792 0.694 0.635 . . . 1.0 . . . . . . . . . . . . A . 15 VAL HG22 . . . . . . . . . c30497_6e5i 1 . 2 . 705 . 1 1 15 VAL HG23 H 3.943 -0.118 -0.426 . . . 1.0 . . . . . . . . . . . . A . 15 VAL HG23 . . . . . . . . . c30497_6e5i 1 . 2 . 706 . 1 1 15 VAL N N 3.459 -1.828 -2.277 . . . 1.0 . . . . . . . . . . . . A . 15 VAL N . . . . . . . . . c30497_6e5i 1 . 2 . 707 . 1 1 15 VAL O O 0.799 -1.809 -3.354 . . . 1.0 . . . . . . . . . . . . A . 15 VAL O . . . . . . . . . c30497_6e5i 1 . 2 . 708 . 1 1 16 ARG C C -1.941 -3.809 -2.016 . . . 1.0 . . . . . . . . . . . . A . 16 ARG C . . . . . . . . . c30497_6e5i 1 . 2 . 709 . 1 1 16 ARG CA C -0.621 -4.094 -2.712 . . . 1.0 . . . . . . . . . . . . A . 16 ARG CA . . . . . . . . . c30497_6e5i 1 . 2 . 710 . 1 1 16 ARG CB C -0.429 -5.599 -2.888 . . . 1.0 . . . . . . . . . . . . A . 16 ARG CB . . . . . . . . . c30497_6e5i 1 . 2 . 711 . 1 1 16 ARG CD C 0.972 -5.422 -4.978 . . . 1.0 . . . . . . . . . . . . A . 16 ARG CD . . . . . . . . . c30497_6e5i 1 . 2 . 712 . 1 1 16 ARG CG C 0.885 -5.971 -3.561 . . . 1.0 . . . . . . . . . . . . A . 16 ARG CG . . . . . . . . . c30497_6e5i 1 . 2 . 713 . 1 1 16 ARG CZ C -0.045 -5.899 -7.174 . . . 1.0 . . . . . . . . . . . . A . 16 ARG CZ . . . . . . . . . c30497_6e5i 1 . 2 . 714 . 1 1 16 ARG H H 0.742 -3.956 -1.103 . . . 1.0 . . . . . . . . . . . . A . 16 ARG H . . . . . . . . . c30497_6e5i 1 . 2 . 715 . 1 1 16 ARG HA H -0.632 -3.624 -3.683 . . . 1.0 . . . . . . . . . . . . A . 16 ARG HA . . . . . . . . . c30497_6e5i 1 . 2 . 716 . 1 1 16 ARG HB2 H -0.458 -6.069 -1.919 . . . 1.0 . . . . . . . . . . . . A . 16 ARG HB2 . . . . . . . . . c30497_6e5i 1 . 2 . 717 . 1 1 16 ARG HB3 H -1.238 -5.984 -3.489 . . . 1.0 . . . . . . . . . . . . A . 16 ARG HB3 . . . . . . . . . c30497_6e5i 1 . 2 . 718 . 1 1 16 ARG HD2 H 0.846 -4.350 -4.946 . . . 1.0 . . . . . . . . . . . . A . 16 ARG HD2 . . . . . . . . . c30497_6e5i 1 . 2 . 719 . 1 1 16 ARG HD3 H 1.946 -5.656 -5.383 . . . 1.0 . . . . . . . . . . . . A . 16 ARG HD3 . . . . . . . . . c30497_6e5i 1 . 2 . 720 . 1 1 16 ARG HE H -0.789 -6.488 -5.416 . . . 1.0 . . . . . . . . . . . . A . 16 ARG HE . . . . . . . . . c30497_6e5i 1 . 2 . 721 . 1 1 16 ARG HG2 H 1.701 -5.568 -2.982 . . . 1.0 . . . . . . . . . . . . A . 16 ARG HG2 . . . . . . . . . c30497_6e5i 1 . 2 . 722 . 1 1 16 ARG HG3 H 0.966 -7.046 -3.596 . . . 1.0 . . . . . . . . . . . . A . 16 ARG HG3 . . . . . . . . . c30497_6e5i 1 . 2 . 723 . 1 1 16 ARG HH11 H 1.641 -4.776 -7.260 . . . 1.0 . . . . . . . . . . . . A . 16 ARG HH11 . . . . . . . . . c30497_6e5i 1 . 2 . 724 . 1 1 16 ARG HH12 H 0.928 -5.162 -8.793 . . . 1.0 . . . . . . . . . . . . A . 16 ARG HH12 . . . . . . . . . c30497_6e5i 1 . 2 . 725 . 1 1 16 ARG HH21 H -1.003 -6.407 -8.885 . . . 1.0 . . . . . . . . . . . . A . 16 ARG HH21 . . . . . . . . . c30497_6e5i 1 . 2 . 726 . 1 1 16 ARG HH22 H -1.735 -6.991 -7.423 . . . 1.0 . . . . . . . . . . . . A . 16 ARG HH22 . . . . . . . . . c30497_6e5i 1 . 2 . 727 . 1 1 16 ARG N N 0.477 -3.530 -1.948 . . . 1.0 . . . . . . . . . . . . A . 16 ARG N . . . . . . . . . c30497_6e5i 1 . 2 . 728 . 1 1 16 ARG NE N -0.054 -5.995 -5.848 . . . 1.0 . . . . . . . . . . . . A . 16 ARG NE . . . . . . . . . c30497_6e5i 1 . 2 . 729 . 1 1 16 ARG NH1 N 0.916 -5.222 -7.793 . . . 1.0 . . . . . . . . . . . . A . 16 ARG NH1 . . . . . . . . . c30497_6e5i 1 . 2 . 730 . 1 1 16 ARG NH2 N -1.003 -6.477 -7.884 . . . 1.0 . . . . . . . . . . . . A . 16 ARG NH2 . . . . . . . . . c30497_6e5i 1 . 2 . 731 . 1 1 16 ARG O O -2.034 -3.886 -0.792 . . . 1.0 . . . . . . . . . . . . A . 16 ARG O . . . . . . . . . c30497_6e5i 1 . 2 . 732 . 1 1 17 CYS C C -5.314 -4.076 -2.651 . . . 1.0 . . . . . . . . . . . . A . 17 CYS C . . . . . . . . . c30497_6e5i 1 . 2 . 733 . 1 1 17 CYS CA C -4.232 -3.089 -2.253 . . . 1.0 . . . . . . . . . . . . A . 17 CYS CA . . . . . . . . . c30497_6e5i 1 . 2 . 734 . 1 1 17 CYS CB C -4.604 -1.702 -2.765 . . . 1.0 . . . . . . . . . . . . A . 17 CYS CB . . . . . . . . . c30497_6e5i 1 . 2 . 735 . 1 1 17 CYS H H -2.833 -3.514 -3.768 . . . 1.0 . . . . . . . . . . . . A . 17 CYS H . . . . . . . . . c30497_6e5i 1 . 2 . 736 . 1 1 17 CYS HA H -4.148 -3.061 -1.177 . . . 1.0 . . . . . . . . . . . . A . 17 CYS HA . . . . . . . . . c30497_6e5i 1 . 2 . 737 . 1 1 17 CYS HB2 H -4.774 -1.756 -3.828 . . . 1.0 . . . . . . . . . . . . A . 17 CYS HB2 . . . . . . . . . c30497_6e5i 1 . 2 . 738 . 1 1 17 CYS HB3 H -5.511 -1.375 -2.277 . . . 1.0 . . . . . . . . . . . . A . 17 CYS HB3 . . . . . . . . . c30497_6e5i 1 . 2 . 739 . 1 1 17 CYS N N -2.950 -3.484 -2.796 . . . 1.0 . . . . . . . . . . . . A . 17 CYS N . . . . . . . . . c30497_6e5i 1 . 2 . 740 . 1 1 17 CYS O O -5.581 -4.275 -3.837 . . . 1.0 . . . . . . . . . . . . A . 17 CYS O . . . . . . . . . c30497_6e5i 1 . 2 . 741 . 1 1 17 CYS SG S -3.328 -0.436 -2.477 . . . 1.0 . . . . . . . . . . . . A . 17 CYS SG . . . . . . . . . c30497_6e5i 1 . 2 . 742 . 1 1 18 ASP C C -8.241 -5.079 -1.070 . . . 1.0 . . . . . . . . . . . . A . 18 ASP C . . . . . . . . . c30497_6e5i 1 . 2 . 743 . 1 1 18 ASP CA C -7.067 -5.561 -1.905 . . . 1.0 . . . . . . . . . . . . A . 18 ASP CA . . . . . . . . . c30497_6e5i 1 . 2 . 744 . 1 1 18 ASP CB C -6.737 -7.018 -1.571 . . . 1.0 . . . . . . . . . . . . A . 18 ASP CB . . . . . . . . . c30497_6e5i 1 . 2 . 745 . 1 1 18 ASP CG C -7.837 -7.966 -2.007 . . . 1.0 . . . . . . . . . . . . A . 18 ASP CG . . . . . . . . . c30497_6e5i 1 . 2 . 746 . 1 1 18 ASP H H -5.626 -4.548 -0.739 . . . 1.0 . . . . . . . . . . . . A . 18 ASP H . . . . . . . . . c30497_6e5i 1 . 2 . 747 . 1 1 18 ASP HA H -7.326 -5.487 -2.950 . . . 1.0 . . . . . . . . . . . . A . 18 ASP HA . . . . . . . . . c30497_6e5i 1 . 2 . 748 . 1 1 18 ASP HB2 H -5.823 -7.299 -2.069 . . . 1.0 . . . . . . . . . . . . A . 18 ASP HB2 . . . . . . . . . c30497_6e5i 1 . 2 . 749 . 1 1 18 ASP HB3 H -6.605 -7.114 -0.503 . . . 1.0 . . . . . . . . . . . . A . 18 ASP HB3 . . . . . . . . . c30497_6e5i 1 . 2 . 750 . 1 1 18 ASP N N -5.932 -4.692 -1.664 . . . 1.0 . . . . . . . . . . . . A . 18 ASP N . . . . . . . . . c30497_6e5i 1 . 2 . 751 . 1 1 18 ASP O O -8.426 -5.513 0.068 . . . 1.0 . . . . . . . . . . . . A . 18 ASP O . . . . . . . . . c30497_6e5i 1 . 2 . 752 . 1 1 18 ASP OD1 O -8.549 -8.502 -1.132 . . . 1.0 . . . . . . . . . . . . A . 18 ASP OD1 . . . . . . . . . c30497_6e5i 1 . 2 . 753 . 1 1 18 ASP OD2 O -7.999 -8.182 -3.227 . . . 1.0 . . . . . . . . . . . . A . 18 ASP OD2 . . . . . . . . . c30497_6e5i 1 . 2 . 754 . 1 1 19 DPR C C -9.641 -2.836 0.389 . . . 1.0 . . . . . . . . . . . . A . 19 DPR C . . . . . . . . . c30497_6e5i 1 . 2 . 755 . 1 1 19 DPR CA C -10.132 -3.517 -0.885 . . . 1.0 . . . . . . . . . . . . A . 19 DPR CA . . . . . . . . . c30497_6e5i 1 . 2 . 756 . 1 1 19 DPR CB C -10.691 -2.481 -1.858 . . . 1.0 . . . . . . . . . . . . A . 19 DPR CB . . . . . . . . . c30497_6e5i 1 . 2 . 757 . 1 1 19 DPR CD C -8.920 -3.629 -2.990 . . . 1.0 . . . . . . . . . . . . A . 19 DPR CD . . . . . . . . . c30497_6e5i 1 . 2 . 758 . 1 1 19 DPR CG C -10.223 -2.910 -3.203 . . . 1.0 . . . . . . . . . . . . A . 19 DPR CG . . . . . . . . . c30497_6e5i 1 . 2 . 759 . 1 1 19 DPR HA H -10.904 -4.228 -0.642 . . . 1.0 . . . . . . . . . . . . A . 19 DPR HA . . . . . . . . . c30497_6e5i 1 . 2 . 760 . 1 1 19 DPR HB2 H -10.310 -1.504 -1.602 . . . 1.0 . . . . . . . . . . . . A . 19 DPR HB2 . . . . . . . . . c30497_6e5i 1 . 2 . 761 . 1 1 19 DPR HB3 H -11.767 -2.478 -1.797 . . . 1.0 . . . . . . . . . . . . A . 19 DPR HB3 . . . . . . . . . c30497_6e5i 1 . 2 . 762 . 1 1 19 DPR HD2 H -8.089 -2.944 -3.079 . . . 1.0 . . . . . . . . . . . . A . 19 DPR HD2 . . . . . . . . . c30497_6e5i 1 . 2 . 763 . 1 1 19 DPR HD3 H -8.821 -4.438 -3.696 . . . 1.0 . . . . . . . . . . . . A . 19 DPR HD3 . . . . . . . . . c30497_6e5i 1 . 2 . 764 . 1 1 19 DPR HG2 H -10.074 -2.046 -3.832 . . . 1.0 . . . . . . . . . . . . A . 19 DPR HG2 . . . . . . . . . c30497_6e5i 1 . 2 . 765 . 1 1 19 DPR HG3 H -10.948 -3.574 -3.647 . . . 1.0 . . . . . . . . . . . . A . 19 DPR HG3 . . . . . . . . . c30497_6e5i 1 . 2 . 766 . 1 1 19 DPR N N -9.031 -4.143 -1.617 . . . 1.0 . . . . . . . . . . . . A . 19 DPR N . . . . . . . . . c30497_6e5i 1 . 2 . 767 . 1 1 19 DPR O O -8.859 -1.885 0.334 . . . 1.0 . . . . . . . . . . . . A . 19 DPR O . . . . . . . . . c30497_6e5i 1 . 2 . 768 . 1 1 20 PRO C C -8.351 -3.292 3.331 . . . 1.0 . . . . . . . . . . . . A . 20 PRO C . . . . . . . . . c30497_6e5i 1 . 2 . 769 . 1 1 20 PRO CA C -9.705 -2.771 2.847 . . . 1.0 . . . . . . . . . . . . A . 20 PRO CA . . . . . . . . . c30497_6e5i 1 . 2 . 770 . 1 1 20 PRO CB C -10.820 -3.259 3.764 . . . 1.0 . . . . . . . . . . . . A . 20 PRO CB . . . . . . . . . c30497_6e5i 1 . 2 . 771 . 1 1 20 PRO CD C -11.066 -4.421 1.689 . . . 1.0 . . . . . . . . . . . . A . 20 PRO CD . . . . . . . . . c30497_6e5i 1 . 2 . 772 . 1 1 20 PRO CG C -11.236 -4.562 3.177 . . . 1.0 . . . . . . . . . . . . A . 20 PRO CG . . . . . . . . . c30497_6e5i 1 . 2 . 773 . 1 1 20 PRO HA H -9.693 -1.694 2.834 . . . 1.0 . . . . . . . . . . . . A . 20 PRO HA . . . . . . . . . c30497_6e5i 1 . 2 . 774 . 1 1 20 PRO HB2 H -10.440 -3.379 4.767 . . . 1.0 . . . . . . . . . . . . A . 20 PRO HB2 . . . . . . . . . c30497_6e5i 1 . 2 . 775 . 1 1 20 PRO HB3 H -11.632 -2.548 3.761 . . . 1.0 . . . . . . . . . . . . A . 20 PRO HB3 . . . . . . . . . c30497_6e5i 1 . 2 . 776 . 1 1 20 PRO HD2 H -10.674 -5.335 1.265 . . . 1.0 . . . . . . . . . . . . A . 20 PRO HD2 . . . . . . . . . c30497_6e5i 1 . 2 . 777 . 1 1 20 PRO HD3 H -12.006 -4.164 1.228 . . . 1.0 . . . . . . . . . . . . A . 20 PRO HD3 . . . . . . . . . c30497_6e5i 1 . 2 . 778 . 1 1 20 PRO HG2 H -10.603 -5.352 3.553 . . . 1.0 . . . . . . . . . . . . A . 20 PRO HG2 . . . . . . . . . c30497_6e5i 1 . 2 . 779 . 1 1 20 PRO HG3 H -12.268 -4.761 3.418 . . . 1.0 . . . . . . . . . . . . A . 20 PRO HG3 . . . . . . . . . c30497_6e5i 1 . 2 . 780 . 1 1 20 PRO N N -10.098 -3.319 1.551 . . . 1.0 . . . . . . . . . . . . A . 20 PRO N . . . . . . . . . c30497_6e5i 1 . 2 . 781 . 1 1 20 PRO O O -7.794 -2.780 4.301 . . . 1.0 . . . . . . . . . . . . A . 20 PRO O . . . . . . . . . c30497_6e5i 1 . 2 . 782 . 1 1 21 ARG C C -5.409 -4.366 2.230 . . . 1.0 . . . . . . . . . . . . A . 21 ARG C . . . . . . . . . c30497_6e5i 1 . 2 . 783 . 1 1 21 ARG CA C -6.558 -4.903 3.060 . . . 1.0 . . . . . . . . . . . . A . 21 ARG CA . . . . . . . . . c30497_6e5i 1 . 2 . 784 . 1 1 21 ARG CB C -6.598 -6.425 2.940 . . . 1.0 . . . . . . . . . . . . A . 21 ARG CB . . . . . . . . . c30497_6e5i 1 . 2 . 785 . 1 1 21 ARG CD C -7.337 -8.619 3.893 . . . 1.0 . . . . . . . . . . . . A . 21 ARG CD . . . . . . . . . c30497_6e5i 1 . 2 . 786 . 1 1 21 ARG CG C -7.455 -7.107 3.990 . . . 1.0 . . . . . . . . . . . . A . 21 ARG CG . . . . . . . . . c30497_6e5i 1 . 2 . 787 . 1 1 21 ARG CZ C -7.868 -10.566 5.308 . . . 1.0 . . . . . . . . . . . . A . 21 ARG CZ . . . . . . . . . c30497_6e5i 1 . 2 . 788 . 1 1 21 ARG H H -8.283 -4.644 1.853 . . . 1.0 . . . . . . . . . . . . A . 21 ARG H . . . . . . . . . c30497_6e5i 1 . 2 . 789 . 1 1 21 ARG HA H -6.389 -4.639 4.092 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HA . . . . . . . . . c30497_6e5i 1 . 2 . 790 . 1 1 21 ARG HB2 H -6.985 -6.684 1.966 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HB2 . . . . . . . . . c30497_6e5i 1 . 2 . 791 . 1 1 21 ARG HB3 H -5.591 -6.804 3.027 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HB3 . . . . . . . . . c30497_6e5i 1 . 2 . 792 . 1 1 21 ARG HD2 H -7.721 -8.937 2.935 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HD2 . . . . . . . . . c30497_6e5i 1 . 2 . 793 . 1 1 21 ARG HD3 H -6.295 -8.889 3.968 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HD3 . . . . . . . . . c30497_6e5i 1 . 2 . 794 . 1 1 21 ARG HE H -8.777 -8.785 5.418 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HE . . . . . . . . . c30497_6e5i 1 . 2 . 795 . 1 1 21 ARG HG2 H -7.128 -6.791 4.970 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HG2 . . . . . . . . . c30497_6e5i 1 . 2 . 796 . 1 1 21 ARG HG3 H -8.486 -6.822 3.842 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HG3 . . . . . . . . . c30497_6e5i 1 . 2 . 797 . 1 1 21 ARG HH11 H -6.399 -10.891 3.948 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HH11 . . . . . . . . . c30497_6e5i 1 . 2 . 798 . 1 1 21 ARG HH12 H -6.786 -12.245 4.960 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HH12 . . . . . . . . . c30497_6e5i 1 . 2 . 799 . 1 1 21 ARG HH21 H -9.286 -10.571 6.753 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HH21 . . . . . . . . . c30497_6e5i 1 . 2 . 800 . 1 1 21 ARG HH22 H -8.424 -12.062 6.553 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HH22 . . . . . . . . . c30497_6e5i 1 . 2 . 801 . 1 1 21 ARG N N -7.823 -4.304 2.654 . . . 1.0 . . . . . . . . . . . . A . 21 ARG N . . . . . . . . . c30497_6e5i 1 . 2 . 802 . 1 1 21 ARG NE N -8.082 -9.301 4.950 . . . 1.0 . . . . . . . . . . . . A . 21 ARG NE . . . . . . . . . c30497_6e5i 1 . 2 . 803 . 1 1 21 ARG NH1 N -6.944 -11.292 4.689 . . . 1.0 . . . . . . . . . . . . A . 21 ARG NH1 . . . . . . . . . c30497_6e5i 1 . 2 . 804 . 1 1 21 ARG NH2 N -8.583 -11.109 6.283 . . . 1.0 . . . . . . . . . . . . A . 21 ARG NH2 . . . . . . . . . c30497_6e5i 1 . 2 . 805 . 1 1 21 ARG O O -5.564 -4.081 1.043 . . . 1.0 . . . . . . . . . . . . A . 21 ARG O . . . . . . . . . c30497_6e5i 1 . 2 . 806 . 1 1 22 TYR C C -1.869 -4.624 2.595 . . . 1.0 . . . . . . . . . . . . A . 22 TYR C . . . . . . . . . c30497_6e5i 1 . 2 . 807 . 1 1 22 TYR CA C -3.060 -3.760 2.206 . . . 1.0 . . . . . . . . . . . . A . 22 TYR CA . . . . . . . . . c30497_6e5i 1 . 2 . 808 . 1 1 22 TYR CB C -2.782 -2.298 2.562 . . . 1.0 . . . . . . . . . . . . A . 22 TYR CB . . . . . . . . . c30497_6e5i 1 . 2 . 809 . 1 1 22 TYR CD1 C -3.800 -0.691 0.908 . . . 1.0 . . . . . . . . . . . . A . 22 TYR CD1 . . . . . . . . . c30497_6e5i 1 . 2 . 810 . 1 1 22 TYR CD2 C -4.974 -1.116 2.933 . . . 1.0 . . . . . . . . . . . . A . 22 TYR CD2 . . . . . . . . . c30497_6e5i 1 . 2 . 811 . 1 1 22 TYR CE1 C -4.790 0.183 0.511 . . . 1.0 . . . . . . . . . . . . A . 22 TYR CE1 . . . . . . . . . c30497_6e5i 1 . 2 . 812 . 1 1 22 TYR CE2 C -5.970 -0.248 2.543 . . . 1.0 . . . . . . . . . . . . A . 22 TYR CE2 . . . . . . . . . c30497_6e5i 1 . 2 . 813 . 1 1 22 TYR CG C -3.874 -1.354 2.124 . . . 1.0 . . . . . . . . . . . . A . 22 TYR CG . . . . . . . . . c30497_6e5i 1 . 2 . 814 . 1 1 22 TYR CZ C -5.894 0.364 1.302 . . . 1.0 . . . . . . . . . . . . A . 22 TYR CZ . . . . . . . . . c30497_6e5i 1 . 2 . 815 . 1 1 22 TYR H H -4.222 -4.439 3.825 . . . 1.0 . . . . . . . . . . . . A . 22 TYR H . . . . . . . . . c30497_6e5i 1 . 2 . 816 . 1 1 22 TYR HA H -3.216 -3.838 1.139 . . . 1.0 . . . . . . . . . . . . A . 22 TYR HA . . . . . . . . . c30497_6e5i 1 . 2 . 817 . 1 1 22 TYR HB2 H -2.674 -2.208 3.630 . . . 1.0 . . . . . . . . . . . . A . 22 TYR HB2 . . . . . . . . . c30497_6e5i 1 . 2 . 818 . 1 1 22 TYR HB3 H -1.864 -1.990 2.085 . . . 1.0 . . . . . . . . . . . . A . 22 TYR HB3 . . . . . . . . . c30497_6e5i 1 . 2 . 819 . 1 1 22 TYR HD1 H -2.948 -0.866 0.268 . . . 1.0 . . . . . . . . . . . . A . 22 TYR HD1 . . . . . . . . . c30497_6e5i 1 . 2 . 820 . 1 1 22 TYR HD2 H -5.047 -1.627 3.883 . . . 1.0 . . . . . . . . . . . . A . 22 TYR HD2 . . . . . . . . . c30497_6e5i 1 . 2 . 821 . 1 1 22 TYR HE1 H -4.709 0.689 -0.438 . . . 1.0 . . . . . . . . . . . . A . 22 TYR HE1 . . . . . . . . . c30497_6e5i 1 . 2 . 822 . 1 1 22 TYR HE2 H -6.817 -0.078 3.190 . . . 1.0 . . . . . . . . . . . . A . 22 TYR HE2 . . . . . . . . . c30497_6e5i 1 . 2 . 823 . 1 1 22 TYR HH H -7.078 1.863 1.686 . . . 1.0 . . . . . . . . . . . . A . 22 TYR HH . . . . . . . . . c30497_6e5i 1 . 2 . 824 . 1 1 22 TYR N N -4.262 -4.227 2.870 . . . 1.0 . . . . . . . . . . . . A . 22 TYR N . . . . . . . . . c30497_6e5i 1 . 2 . 825 . 1 1 22 TYR O O -1.688 -4.965 3.766 . . . 1.0 . . . . . . . . . . . . A . 22 TYR O . . . . . . . . . c30497_6e5i 1 . 2 . 826 . 1 1 22 TYR OH O -6.865 1.275 0.948 . . . 1.0 . . . . . . . . . . . . A . 22 TYR OH . . . . . . . . . c30497_6e5i 1 . 2 . 827 . 1 1 23 GLU C C 1.356 -4.943 1.574 . . . 1.0 . . . . . . . . . . . . A . 23 GLU C . . . . . . . . . c30497_6e5i 1 . 2 . 828 . 1 1 23 GLU CA C 0.118 -5.778 1.827 . . . 1.0 . . . . . . . . . . . . A . 23 GLU CA . . . . . . . . . c30497_6e5i 1 . 2 . 829 . 1 1 23 GLU CB C 0.153 -6.992 0.904 . . . 1.0 . . . . . . . . . . . . A . 23 GLU CB . . . . . . . . . c30497_6e5i 1 . 2 . 830 . 1 1 23 GLU CD C -0.816 -9.198 0.224 . . . 1.0 . . . . . . . . . . . . A . 23 GLU CD . . . . . . . . . c30497_6e5i 1 . 2 . 831 . 1 1 23 GLU CG C -0.923 -8.027 1.174 . . . 1.0 . . . . . . . . . . . . A . 23 GLU CG . . . . . . . . . c30497_6e5i 1 . 2 . 832 . 1 1 23 GLU H H -1.295 -4.698 0.692 . . . 1.0 . . . . . . . . . . . . A . 23 GLU H . . . . . . . . . c30497_6e5i 1 . 2 . 833 . 1 1 23 GLU HA H 0.118 -6.110 2.854 . . . 1.0 . . . . . . . . . . . . A . 23 GLU HA . . . . . . . . . c30497_6e5i 1 . 2 . 834 . 1 1 23 GLU HB2 H 0.042 -6.654 -0.112 . . . 1.0 . . . . . . . . . . . . A . 23 GLU HB2 . . . . . . . . . c30497_6e5i 1 . 2 . 835 . 1 1 23 GLU HB3 H 1.114 -7.473 1.006 . . . 1.0 . . . . . . . . . . . . A . 23 GLU HB3 . . . . . . . . . c30497_6e5i 1 . 2 . 836 . 1 1 23 GLU HG2 H -0.817 -8.388 2.186 . . . 1.0 . . . . . . . . . . . . A . 23 GLU HG2 . . . . . . . . . c30497_6e5i 1 . 2 . 837 . 1 1 23 GLU HG3 H -1.892 -7.568 1.050 . . . 1.0 . . . . . . . . . . . . A . 23 GLU HG3 . . . . . . . . . c30497_6e5i 1 . 2 . 838 . 1 1 23 GLU N N -1.077 -4.986 1.604 . . . 1.0 . . . . . . . . . . . . A . 23 GLU N . . . . . . . . . c30497_6e5i 1 . 2 . 839 . 1 1 23 GLU O O 1.413 -4.180 0.612 . . . 1.0 . . . . . . . . . . . . A . 23 GLU O . . . . . . . . . c30497_6e5i 1 . 2 . 840 . 1 1 23 GLU OE1 O -1.851 -9.615 -0.333 . . . 1.0 . . . . . . . . . . . . A . 23 GLU OE1 . . . . . . . . . c30497_6e5i 1 . 2 . 841 . 1 1 23 GLU OE2 O 0.316 -9.692 0.010 . . . 1.0 . . . . . . . . . . . . A . 23 GLU OE2 . . . . . . . . . c30497_6e5i 1 . 2 . 842 . 1 1 24 VAL C C 4.695 -5.368 1.850 . . . 1.0 . . . . . . . . . . . . A . 24 VAL C . . . . . . . . . c30497_6e5i 1 . 2 . 843 . 1 1 24 VAL CA C 3.598 -4.395 2.249 . . . 1.0 . . . . . . . . . . . . A . 24 VAL CA . . . . . . . . . c30497_6e5i 1 . 2 . 844 . 1 1 24 VAL CB C 4.010 -3.627 3.522 . . . 1.0 . . . . . . . . . . . . A . 24 VAL CB . . . . . . . . . c30497_6e5i 1 . 2 . 845 . 1 1 24 VAL CG1 C 5.349 -2.932 3.318 . . . 1.0 . . . . . . . . . . . . A . 24 VAL CG1 . . . . . . . . . c30497_6e5i 1 . 2 . 846 . 1 1 24 VAL CG2 C 2.936 -2.615 3.900 . . . 1.0 . . . . . . . . . . . . A . 24 VAL CG2 . . . . . . . . . c30497_6e5i 1 . 2 . 847 . 1 1 24 VAL H H 2.245 -5.716 3.174 . . . 1.0 . . . . . . . . . . . . A . 24 VAL H . . . . . . . . . c30497_6e5i 1 . 2 . 848 . 1 1 24 VAL HA H 3.464 -3.679 1.450 . . . 1.0 . . . . . . . . . . . . A . 24 VAL HA . . . . . . . . . c30497_6e5i 1 . 2 . 849 . 1 1 24 VAL HB H 4.111 -4.337 4.330 . . . 1.0 . . . . . . . . . . . . A . 24 VAL HB . . . . . . . . . c30497_6e5i 1 . 2 . 850 . 1 1 24 VAL HG11 H 6.103 -3.667 3.079 . . . 1.0 . . . . . . . . . . . . A . 24 VAL HG11 . . . . . . . . . c30497_6e5i 1 . 2 . 851 . 1 1 24 VAL HG12 H 5.627 -2.414 4.224 . . . 1.0 . . . . . . . . . . . . A . 24 VAL HG12 . . . . . . . . . c30497_6e5i 1 . 2 . 852 . 1 1 24 VAL HG13 H 5.268 -2.222 2.509 . . . 1.0 . . . . . . . . . . . . A . 24 VAL HG13 . . . . . . . . . c30497_6e5i 1 . 2 . 853 . 1 1 24 VAL HG21 H 2.804 -1.912 3.090 . . . 1.0 . . . . . . . . . . . . A . 24 VAL HG21 . . . . . . . . . c30497_6e5i 1 . 2 . 854 . 1 1 24 VAL HG22 H 3.237 -2.085 4.790 . . . 1.0 . . . . . . . . . . . . A . 24 VAL HG22 . . . . . . . . . c30497_6e5i 1 . 2 . 855 . 1 1 24 VAL HG23 H 2.004 -3.131 4.084 . . . 1.0 . . . . . . . . . . . . A . 24 VAL HG23 . . . . . . . . . c30497_6e5i 1 . 2 . 856 . 1 1 24 VAL N N 2.349 -5.099 2.421 . . . 1.0 . . . . . . . . . . . . A . 24 VAL N . . . . . . . . . c30497_6e5i 1 . 2 . 857 . 1 1 24 VAL O O 5.255 -6.082 2.683 . . . 1.0 . . . . . . . . . . . . A . 24 VAL O . . . . . . . . . c30497_6e5i 1 . 2 . 858 . 1 1 25 HIS C C 7.320 -5.482 -0.014 . . . 1.0 . . . . . . . . . . . . A . 25 HIS C . . . . . . . . . c30497_6e5i 1 . 2 . 859 . 1 1 25 HIS CA C 6.019 -6.260 0.031 . . . 1.0 . . . . . . . . . . . . A . 25 HIS CA . . . . . . . . . c30497_6e5i 1 . 2 . 860 . 1 1 25 HIS CB C 5.639 -6.778 -1.361 . . . 1.0 . . . . . . . . . . . . A . 25 HIS CB . . . . . . . . . c30497_6e5i 1 . 2 . 861 . 1 1 25 HIS CD2 C 3.216 -7.687 -1.119 . . . 1.0 . . . . . . . . . . . . A . 25 HIS CD2 . . . . . . . . . c30497_6e5i 1 . 2 . 862 . 1 1 25 HIS CE1 C 3.627 -9.800 -1.513 . . . 1.0 . . . . . . . . . . . . A . 25 HIS CE1 . . . . . . . . . c30497_6e5i 1 . 2 . 863 . 1 1 25 HIS CG C 4.546 -7.806 -1.346 . . . 1.0 . . . . . . . . . . . . A . 25 HIS CG . . . . . . . . . c30497_6e5i 1 . 2 . 864 . 1 1 25 HIS H H 4.491 -4.808 -0.051 . . . 1.0 . . . . . . . . . . . . A . 25 HIS H . . . . . . . . . c30497_6e5i 1 . 2 . 865 . 1 1 25 HIS HA H 6.135 -7.098 0.702 . . . 1.0 . . . . . . . . . . . . A . 25 HIS HA . . . . . . . . . c30497_6e5i 1 . 2 . 866 . 1 1 25 HIS HB2 H 5.302 -5.948 -1.963 . . . 1.0 . . . . . . . . . . . . A . 25 HIS HB2 . . . . . . . . . c30497_6e5i 1 . 2 . 867 . 1 1 25 HIS HB3 H 6.507 -7.218 -1.824 . . . 1.0 . . . . . . . . . . . . A . 25 HIS HB3 . . . . . . . . . c30497_6e5i 1 . 2 . 868 . 1 1 25 HIS HD1 H 5.644 -9.551 -1.785 . . . 1.0 . . . . . . . . . . . . A . 25 HIS HD1 . . . . . . . . . c30497_6e5i 1 . 2 . 869 . 1 1 25 HIS HD2 H 2.684 -6.774 -0.896 . . . 1.0 . . . . . . . . . . . . A . 25 HIS HD2 . . . . . . . . . c30497_6e5i 1 . 2 . 870 . 1 1 25 HIS HE1 H 3.502 -10.861 -1.659 . . . 1.0 . . . . . . . . . . . . A . 25 HIS HE1 . . . . . . . . . c30497_6e5i 1 . 2 . 871 . 1 1 25 HIS HE2 H 1.773 -9.200 -0.876 . . . 1.0 . . . . . . . . . . . . A . 25 HIS HE2 . . . . . . . . . c30497_6e5i 1 . 2 . 872 . 1 1 25 HIS N N 4.979 -5.404 0.562 . . . 1.0 . . . . . . . . . . . . A . 25 HIS N . . . . . . . . . c30497_6e5i 1 . 2 . 873 . 1 1 25 HIS ND1 N 4.770 -9.142 -1.591 . . . 1.0 . . . . . . . . . . . . A . 25 HIS ND1 . . . . . . . . . c30497_6e5i 1 . 2 . 874 . 1 1 25 HIS NE2 N 2.665 -8.942 -1.226 . . . 1.0 . . . . . . . . . . . . A . 25 HIS NE2 . . . . . . . . . c30497_6e5i 1 . 2 . 875 . 1 1 25 HIS O O 7.602 -4.760 -0.977 . . . 1.0 . . . . . . . . . . . . A . 25 HIS O . . . . . . . . . c30497_6e5i 1 . 2 . 876 . 1 1 26 CYS C C 10.470 -5.707 1.582 . . . 1.0 . . . . . . . . . . . . A . 26 CYS C . . . . . . . . . c30497_6e5i 1 . 2 . 877 . 1 1 26 CYS CA C 9.288 -4.815 1.225 . . . 1.0 . . . . . . . . . . . . A . 26 CYS CA . . . . . . . . . c30497_6e5i 1 . 2 . 878 . 1 1 26 CYS CB C 9.040 -3.778 2.325 . . . 1.0 . . . . . . . . . . . . A . 26 CYS CB . . . . . . . . . c30497_6e5i 1 . 2 . 879 . 1 1 26 CYS H H 7.845 -6.258 1.744 . . . 1.0 . . . . . . . . . . . . A . 26 CYS H . . . . . . . . . c30497_6e5i 1 . 2 . 880 . 1 1 26 CYS HA H 9.496 -4.309 0.297 . . . 1.0 . . . . . . . . . . . . A . 26 CYS HA . . . . . . . . . c30497_6e5i 1 . 2 . 881 . 1 1 26 CYS HB2 H 8.092 -3.296 2.142 . . . 1.0 . . . . . . . . . . . . A . 26 CYS HB2 . . . . . . . . . c30497_6e5i 1 . 2 . 882 . 1 1 26 CYS HB3 H 9.000 -4.284 3.278 . . . 1.0 . . . . . . . . . . . . A . 26 CYS HB3 . . . . . . . . . c30497_6e5i 1 . 2 . 883 . 1 1 26 CYS N N 8.092 -5.609 1.049 . . . 1.0 . . . . . . . . . . . . A . 26 CYS N . . . . . . . . . c30497_6e5i 1 . 2 . 884 . 1 1 26 CYS O O 10.785 -5.905 2.757 . . . 1.0 . . . . . . . . . . . . A . 26 CYS O . . . . . . . . . c30497_6e5i 1 . 2 . 885 . 1 1 26 CYS SG S 10.304 -2.476 2.441 . . . 1.0 . . . . . . . . . . . . A . 26 CYS SG . . . . . . . . . c30497_6e5i 1 . 2 . 886 . 1 1 27 NH2 HN1 H 10.807 -6.058 -0.343 . . . 1.0 . . . . . . . . . . . . A . 27 NH2 HN1 . . . . . . . . . c30497_6e5i 1 . 2 . 887 . 1 1 27 NH2 HN2 H 11.872 -6.848 0.764 . . . 1.0 . . . . . . . . . . . . A . 27 NH2 HN2 . . . . . . . . . c30497_6e5i 1 . 2 . 888 . 1 1 27 NH2 N N 11.113 -6.258 0.567 . . . 1.0 . . . . . . . . . . . . A . 27 NH2 N . . . . . . . . . c30497_6e5i 1 . 3 . 889 . 1 1 1 ASN C C -5.352 5.723 -4.181 . . . 1.0 . . . . . . . . . . . . A . 1 ASN C . . . . . . . . . c30497_6e5i 1 . 3 . 890 . 1 1 1 ASN CA C -6.570 4.886 -4.543 . . . 1.0 . . . . . . . . . . . . A . 1 ASN CA . . . . . . . . . c30497_6e5i 1 . 3 . 891 . 1 1 1 ASN CB C -6.698 3.736 -3.545 . . . 1.0 . . . . . . . . . . . . A . 1 ASN CB . . . . . . . . . c30497_6e5i 1 . 3 . 892 . 1 1 1 ASN CG C -7.998 2.974 -3.689 . . . 1.0 . . . . . . . . . . . . A . 1 ASN CG . . . . . . . . . c30497_6e5i 1 . 3 . 893 . 1 1 1 ASN H1 H -5.615 3.769 -6.023 . . . 1.0 . . . . . . . . . . . . A . 1 ASN H1 . . . . . . . . . c30497_6e5i 1 . 3 . 894 . 1 1 1 ASN H2 H -6.377 5.165 -6.596 . . . 1.0 . . . . . . . . . . . . A . 1 ASN H2 . . . . . . . . . c30497_6e5i 1 . 3 . 895 . 1 1 1 ASN H3 H -7.300 3.814 -6.176 . . . 1.0 . . . . . . . . . . . . A . 1 ASN H3 . . . . . . . . . c30497_6e5i 1 . 3 . 896 . 1 1 1 ASN HA H -7.451 5.507 -4.484 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HA . . . . . . . . . c30497_6e5i 1 . 3 . 897 . 1 1 1 ASN HB2 H -5.881 3.046 -3.695 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HB2 . . . . . . . . . c30497_6e5i 1 . 3 . 898 . 1 1 1 ASN HB3 H -6.645 4.134 -2.541 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HB3 . . . . . . . . . c30497_6e5i 1 . 3 . 899 . 1 1 1 ASN HD21 H -7.124 1.303 -3.066 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HD21 . . . . . . . . . c30497_6e5i 1 . 3 . 900 . 1 1 1 ASN HD22 H -8.808 1.178 -3.446 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HD22 . . . . . . . . . c30497_6e5i 1 . 3 . 901 . 1 1 1 ASN N N -6.458 4.372 -5.929 . . . 1.0 . . . . . . . . . . . . A . 1 ASN N . . . . . . . . . c30497_6e5i 1 . 3 . 902 . 1 1 1 ASN ND2 N -7.973 1.690 -3.370 . . . 1.0 . . . . . . . . . . . . A . 1 ASN ND2 . . . . . . . . . c30497_6e5i 1 . 3 . 903 . 1 1 1 ASN O O -4.211 5.291 -4.353 . . . 1.0 . . . . . . . . . . . . A . 1 ASN O . . . . . . . . . c30497_6e5i 1 . 3 . 904 . 1 1 1 ASN OD1 O -9.018 3.534 -4.089 . . . 1.0 . . . . . . . . . . . . A . 1 ASN OD1 . . . . . . . . . c30497_6e5i 1 . 3 . 905 . 1 1 2 ASP C C -3.841 7.325 -2.013 . . . 1.0 . . . . . . . . . . . . A . 2 ASP C . . . . . . . . . c30497_6e5i 1 . 3 . 906 . 1 1 2 ASP CA C -4.528 7.828 -3.278 . . . 1.0 . . . . . . . . . . . . A . 2 ASP CA . . . . . . . . . c30497_6e5i 1 . 3 . 907 . 1 1 2 ASP CB C -5.075 9.237 -3.064 . . . 1.0 . . . . . . . . . . . . A . 2 ASP CB . . . . . . . . . c30497_6e5i 1 . 3 . 908 . 1 1 2 ASP CG C -3.987 10.246 -2.762 . . . 1.0 . . . . . . . . . . . . A . 2 ASP CG . . . . . . . . . c30497_6e5i 1 . 3 . 909 . 1 1 2 ASP H H -6.536 7.202 -3.544 . . . 1.0 . . . . . . . . . . . . A . 2 ASP H . . . . . . . . . c30497_6e5i 1 . 3 . 910 . 1 1 2 ASP HA H -3.805 7.850 -4.081 . . . 1.0 . . . . . . . . . . . . A . 2 ASP HA . . . . . . . . . c30497_6e5i 1 . 3 . 911 . 1 1 2 ASP HB2 H -5.595 9.554 -3.954 . . . 1.0 . . . . . . . . . . . . A . 2 ASP HB2 . . . . . . . . . c30497_6e5i 1 . 3 . 912 . 1 1 2 ASP HB3 H -5.767 9.225 -2.235 . . . 1.0 . . . . . . . . . . . . A . 2 ASP HB3 . . . . . . . . . c30497_6e5i 1 . 3 . 913 . 1 1 2 ASP N N -5.601 6.920 -3.669 . . . 1.0 . . . . . . . . . . . . A . 2 ASP N . . . . . . . . . c30497_6e5i 1 . 3 . 914 . 1 1 2 ASP O O -2.651 7.567 -1.798 . . . 1.0 . . . . . . . . . . . . A . 2 ASP O . . . . . . . . . c30497_6e5i 1 . 3 . 915 . 1 1 2 ASP OD1 O -3.148 10.504 -3.652 . . . 1.0 . . . . . . . . . . . . A . 2 ASP OD1 . . . . . . . . . c30497_6e5i 1 . 3 . 916 . 1 1 2 ASP OD2 O -3.978 10.805 -1.645 . . . 1.0 . . . . . . . . . . . . A . 2 ASP OD2 . . . . . . . . . c30497_6e5i 1 . 3 . 917 . 1 1 3 LYS C C -2.971 4.970 -0.360 . . . 1.0 . . . . . . . . . . . . A . 3 LYS C . . . . . . . . . c30497_6e5i 1 . 3 . 918 . 1 1 3 LYS CA C -4.050 5.976 0.007 . . . 1.0 . . . . . . . . . . . . A . 3 LYS CA . . . . . . . . . c30497_6e5i 1 . 3 . 919 . 1 1 3 LYS CB C -5.153 5.283 0.807 . . . 1.0 . . . . . . . . . . . . A . 3 LYS CB . . . . . . . . . c30497_6e5i 1 . 3 . 920 . 1 1 3 LYS CD C -7.190 5.485 2.253 . . . 1.0 . . . . . . . . . . . . A . 3 LYS CD . . . . . . . . . c30497_6e5i 1 . 3 . 921 . 1 1 3 LYS CE C -7.951 6.369 3.226 . . . 1.0 . . . . . . . . . . . . A . 3 LYS CE . . . . . . . . . c30497_6e5i 1 . 3 . 922 . 1 1 3 LYS CG C -6.052 6.234 1.582 . . . 1.0 . . . . . . . . . . . . A . 3 LYS CG . . . . . . . . . c30497_6e5i 1 . 3 . 923 . 1 1 3 LYS H H -5.543 6.475 -1.406 . . . 1.0 . . . . . . . . . . . . A . 3 LYS H . . . . . . . . . c30497_6e5i 1 . 3 . 924 . 1 1 3 LYS HA H -3.608 6.752 0.612 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HA . . . . . . . . . c30497_6e5i 1 . 3 . 925 . 1 1 3 LYS HB2 H -5.770 4.715 0.127 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HB2 . . . . . . . . . c30497_6e5i 1 . 3 . 926 . 1 1 3 LYS HB3 H -4.694 4.605 1.512 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HB3 . . . . . . . . . c30497_6e5i 1 . 3 . 927 . 1 1 3 LYS HD2 H -7.874 5.136 1.493 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HD2 . . . . . . . . . c30497_6e5i 1 . 3 . 928 . 1 1 3 LYS HD3 H -6.785 4.641 2.788 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HD3 . . . . . . . . . c30497_6e5i 1 . 3 . 929 . 1 1 3 LYS HE2 H -8.369 7.203 2.684 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HE2 . . . . . . . . . c30497_6e5i 1 . 3 . 930 . 1 1 3 LYS HE3 H -8.750 5.791 3.667 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HE3 . . . . . . . . . c30497_6e5i 1 . 3 . 931 . 1 1 3 LYS HG2 H -5.467 6.733 2.340 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HG2 . . . . . . . . . c30497_6e5i 1 . 3 . 932 . 1 1 3 LYS HG3 H -6.464 6.966 0.902 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HG3 . . . . . . . . . c30497_6e5i 1 . 3 . 933 . 1 1 3 LYS HZ1 H -6.567 6.101 4.766 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HZ1 . . . . . . . . . c30497_6e5i 1 . 3 . 934 . 1 1 3 LYS HZ2 H -7.642 7.377 5.028 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HZ2 . . . . . . . . . c30497_6e5i 1 . 3 . 935 . 1 1 3 LYS HZ3 H -6.377 7.554 3.919 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HZ3 . . . . . . . . . c30497_6e5i 1 . 3 . 936 . 1 1 3 LYS N N -4.594 6.596 -1.195 . . . 1.0 . . . . . . . . . . . . A . 3 LYS N . . . . . . . . . c30497_6e5i 1 . 3 . 937 . 1 1 3 LYS NZ N -7.073 6.886 4.309 . . . 1.0 . . . . . . . . . . . . A . 3 LYS NZ . . . . . . . . . c30497_6e5i 1 . 3 . 938 . 1 1 3 LYS O O -1.994 4.797 0.364 . . . 1.0 . . . . . . . . . . . . A . 3 LYS O . . . . . . . . . c30497_6e5i 1 . 3 . 939 . 1 1 4 CYS C C -0.869 4.108 -2.337 . . . 1.0 . . . . . . . . . . . . A . 4 CYS C . . . . . . . . . c30497_6e5i 1 . 3 . 940 . 1 1 4 CYS CA C -2.166 3.384 -2.010 . . . 1.0 . . . . . . . . . . . . A . 4 CYS CA . . . . . . . . . c30497_6e5i 1 . 3 . 941 . 1 1 4 CYS CB C -2.700 2.677 -3.254 . . . 1.0 . . . . . . . . . . . . A . 4 CYS CB . . . . . . . . . c30497_6e5i 1 . 3 . 942 . 1 1 4 CYS H H -3.967 4.481 -2.019 . . . 1.0 . . . . . . . . . . . . A . 4 CYS H . . . . . . . . . c30497_6e5i 1 . 3 . 943 . 1 1 4 CYS HA H -1.976 2.653 -1.241 . . . 1.0 . . . . . . . . . . . . A . 4 CYS HA . . . . . . . . . c30497_6e5i 1 . 3 . 944 . 1 1 4 CYS HB2 H -2.984 3.419 -3.984 . . . 1.0 . . . . . . . . . . . . A . 4 CYS HB2 . . . . . . . . . c30497_6e5i 1 . 3 . 945 . 1 1 4 CYS HB3 H -1.922 2.052 -3.665 . . . 1.0 . . . . . . . . . . . . A . 4 CYS HB3 . . . . . . . . . c30497_6e5i 1 . 3 . 946 . 1 1 4 CYS N N -3.150 4.323 -1.504 . . . 1.0 . . . . . . . . . . . . A . 4 CYS N . . . . . . . . . c30497_6e5i 1 . 3 . 947 . 1 1 4 CYS O O 0.221 3.566 -2.173 . . . 1.0 . . . . . . . . . . . . A . 4 CYS O . . . . . . . . . c30497_6e5i 1 . 3 . 948 . 1 1 4 CYS SG S -4.151 1.625 -2.938 . . . 1.0 . . . . . . . . . . . . A . 4 CYS SG . . . . . . . . . c30497_6e5i 1 . 3 . 949 . 1 1 5 LYS C C 0.824 6.686 -1.850 . . . 1.0 . . . . . . . . . . . . A . 5 LYS C . . . . . . . . . c30497_6e5i 1 . 3 . 950 . 1 1 5 LYS CA C 0.156 6.164 -3.115 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CA . . . . . . . . . c30497_6e5i 1 . 3 . 951 . 1 1 5 LYS CB C -0.244 7.326 -4.023 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CB . . . . . . . . . c30497_6e5i 1 . 3 . 952 . 1 1 5 LYS CD C -1.038 8.076 -6.278 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CD . . . . . . . . . c30497_6e5i 1 . 3 . 953 . 1 1 5 LYS CE C -1.723 7.673 -7.574 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CE . . . . . . . . . c30497_6e5i 1 . 3 . 954 . 1 1 5 LYS CG C -0.848 6.891 -5.349 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CG . . . . . . . . . c30497_6e5i 1 . 3 . 955 . 1 1 5 LYS H H -1.895 5.737 -2.862 . . . 1.0 . . . . . . . . . . . . A . 5 LYS H . . . . . . . . . c30497_6e5i 1 . 3 . 956 . 1 1 5 LYS HA H 0.859 5.533 -3.640 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HA . . . . . . . . . c30497_6e5i 1 . 3 . 957 . 1 1 5 LYS HB2 H -0.971 7.934 -3.504 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HB2 . . . . . . . . . c30497_6e5i 1 . 3 . 958 . 1 1 5 LYS HB3 H 0.631 7.924 -4.230 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HB3 . . . . . . . . . c30497_6e5i 1 . 3 . 959 . 1 1 5 LYS HD2 H -1.644 8.817 -5.779 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HD2 . . . . . . . . . c30497_6e5i 1 . 3 . 960 . 1 1 5 LYS HD3 H -0.070 8.497 -6.509 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HD3 . . . . . . . . . c30497_6e5i 1 . 3 . 961 . 1 1 5 LYS HE2 H -1.663 8.497 -8.268 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HE2 . . . . . . . . . c30497_6e5i 1 . 3 . 962 . 1 1 5 LYS HE3 H -1.207 6.819 -7.986 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HE3 . . . . . . . . . c30497_6e5i 1 . 3 . 963 . 1 1 5 LYS HG2 H -0.189 6.179 -5.822 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HG2 . . . . . . . . . c30497_6e5i 1 . 3 . 964 . 1 1 5 LYS HG3 H -1.808 6.432 -5.166 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HG3 . . . . . . . . . c30497_6e5i 1 . 3 . 965 . 1 1 5 LYS HZ1 H -3.602 7.117 -8.282 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HZ1 . . . . . . . . . c30497_6e5i 1 . 3 . 966 . 1 1 5 LYS HZ2 H -3.655 8.111 -6.917 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HZ2 . . . . . . . . . c30497_6e5i 1 . 3 . 967 . 1 1 5 LYS HZ3 H -3.232 6.481 -6.763 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HZ3 . . . . . . . . . c30497_6e5i 1 . 3 . 968 . 1 1 5 LYS N N -0.999 5.353 -2.777 . . . 1.0 . . . . . . . . . . . . A . 5 LYS N . . . . . . . . . c30497_6e5i 1 . 3 . 969 . 1 1 5 LYS NZ N -3.151 7.321 -7.368 . . . 1.0 . . . . . . . . . . . . A . 5 LYS NZ . . . . . . . . . c30497_6e5i 1 . 3 . 970 . 1 1 5 LYS O O 2.045 6.822 -1.800 . . . 1.0 . . . . . . . . . . . . A . 5 LYS O . . . . . . . . . c30497_6e5i 1 . 3 . 971 . 1 1 6 GLU C C 1.330 6.264 1.113 . . . 1.0 . . . . . . . . . . . . A . 6 GLU C . . . . . . . . . c30497_6e5i 1 . 3 . 972 . 1 1 6 GLU CA C 0.547 7.397 0.463 . . . 1.0 . . . . . . . . . . . . A . 6 GLU CA . . . . . . . . . c30497_6e5i 1 . 3 . 973 . 1 1 6 GLU CB C -0.576 7.842 1.402 . . . 1.0 . . . . . . . . . . . . A . 6 GLU CB . . . . . . . . . c30497_6e5i 1 . 3 . 974 . 1 1 6 GLU CD C -2.226 9.630 2.040 . . . 1.0 . . . . . . . . . . . . A . 6 GLU CD . . . . . . . . . c30497_6e5i 1 . 3 . 975 . 1 1 6 GLU CG C -1.292 9.110 0.968 . . . 1.0 . . . . . . . . . . . . A . 6 GLU CG . . . . . . . . . c30497_6e5i 1 . 3 . 976 . 1 1 6 GLU H H -0.955 6.907 -0.956 . . . 1.0 . . . . . . . . . . . . A . 6 GLU H . . . . . . . . . c30497_6e5i 1 . 3 . 977 . 1 1 6 GLU HA H 1.217 8.226 0.291 . . . 1.0 . . . . . . . . . . . . A . 6 GLU HA . . . . . . . . . c30497_6e5i 1 . 3 . 978 . 1 1 6 GLU HB2 H -1.308 7.051 1.467 . . . 1.0 . . . . . . . . . . . . A . 6 GLU HB2 . . . . . . . . . c30497_6e5i 1 . 3 . 979 . 1 1 6 GLU HB3 H -0.159 8.011 2.385 . . . 1.0 . . . . . . . . . . . . A . 6 GLU HB3 . . . . . . . . . c30497_6e5i 1 . 3 . 980 . 1 1 6 GLU HG2 H -0.557 9.868 0.752 . . . 1.0 . . . . . . . . . . . . A . 6 GLU HG2 . . . . . . . . . c30497_6e5i 1 . 3 . 981 . 1 1 6 GLU HG3 H -1.868 8.901 0.078 . . . 1.0 . . . . . . . . . . . . A . 6 GLU HG3 . . . . . . . . . c30497_6e5i 1 . 3 . 982 . 1 1 6 GLU N N 0.019 6.973 -0.831 . . . 1.0 . . . . . . . . . . . . A . 6 GLU N . . . . . . . . . c30497_6e5i 1 . 3 . 983 . 1 1 6 GLU O O 2.422 6.468 1.647 . . . 1.0 . . . . . . . . . . . . A . 6 GLU O . . . . . . . . . c30497_6e5i 1 . 3 . 984 . 1 1 6 GLU OE1 O -1.756 10.365 2.938 . . . 1.0 . . . . . . . . . . . . A . 6 GLU OE1 . . . . . . . . . c30497_6e5i 1 . 3 . 985 . 1 1 6 GLU OE2 O -3.432 9.308 2.002 . . . 1.0 . . . . . . . . . . . . A . 6 GLU OE2 . . . . . . . . . c30497_6e5i 1 . 3 . 986 . 1 1 7 LEU C C 2.658 3.546 0.798 . . . 1.0 . . . . . . . . . . . . A . 7 LEU C . . . . . . . . . c30497_6e5i 1 . 3 . 987 . 1 1 7 LEU CA C 1.413 3.888 1.605 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CA . . . . . . . . . c30497_6e5i 1 . 3 . 988 . 1 1 7 LEU CB C 0.438 2.712 1.615 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CB . . . . . . . . . c30497_6e5i 1 . 3 . 989 . 1 1 7 LEU CD1 C -1.782 1.795 2.334 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CD1 . . . . . . . . . c30497_6e5i 1 . 3 . 990 . 1 1 7 LEU CD2 C -0.213 2.699 4.039 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CD2 . . . . . . . . . c30497_6e5i 1 . 3 . 991 . 1 1 7 LEU CG C -0.717 2.840 2.611 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CG . . . . . . . . . c30497_6e5i 1 . 3 . 992 . 1 1 7 LEU H H -0.135 4.983 0.666 . . . 1.0 . . . . . . . . . . . . A . 7 LEU H . . . . . . . . . c30497_6e5i 1 . 3 . 993 . 1 1 7 LEU HA H 1.709 4.110 2.617 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HA . . . . . . . . . c30497_6e5i 1 . 3 . 994 . 1 1 7 LEU HB2 H 0.024 2.610 0.624 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HB2 . . . . . . . . . c30497_6e5i 1 . 3 . 995 . 1 1 7 LEU HB3 H 0.990 1.816 1.850 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HB3 . . . . . . . . . c30497_6e5i 1 . 3 . 996 . 1 1 7 LEU HD11 H -2.581 1.896 3.054 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD11 . . . . . . . . . c30497_6e5i 1 . 3 . 997 . 1 1 7 LEU HD12 H -1.348 0.809 2.413 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD12 . . . . . . . . . c30497_6e5i 1 . 3 . 998 . 1 1 7 LEU HD13 H -2.177 1.937 1.338 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD13 . . . . . . . . . c30497_6e5i 1 . 3 . 999 . 1 1 7 LEU HD21 H 0.236 1.726 4.167 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD21 . . . . . . . . . c30497_6e5i 1 . 3 . 1000 . 1 1 7 LEU HD22 H -1.040 2.806 4.723 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD22 . . . . . . . . . c30497_6e5i 1 . 3 . 1001 . 1 1 7 LEU HD23 H 0.519 3.464 4.240 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD23 . . . . . . . . . c30497_6e5i 1 . 3 . 1002 . 1 1 7 LEU HG H -1.169 3.817 2.507 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HG . . . . . . . . . c30497_6e5i 1 . 3 . 1003 . 1 1 7 LEU N N 0.761 5.069 1.065 . . . 1.0 . . . . . . . . . . . . A . 7 LEU N . . . . . . . . . c30497_6e5i 1 . 3 . 1004 . 1 1 7 LEU O O 3.691 3.181 1.360 . . . 1.0 . . . . . . . . . . . . A . 7 LEU O . . . . . . . . . c30497_6e5i 1 . 3 . 1005 . 1 1 8 LYS C C 4.802 4.493 -1.038 . . . 1.0 . . . . . . . . . . . . A . 8 LYS C . . . . . . . . . c30497_6e5i 1 . 3 . 1006 . 1 1 8 LYS CA C 3.706 3.495 -1.395 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CA . . . . . . . . . c30497_6e5i 1 . 3 . 1007 . 1 1 8 LYS CB C 3.291 3.661 -2.860 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CB . . . . . . . . . c30497_6e5i 1 . 3 . 1008 . 1 1 8 LYS CD C 4.008 3.882 -5.263 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CD . . . . . . . . . c30497_6e5i 1 . 3 . 1009 . 1 1 8 LYS CE C 3.098 2.821 -5.861 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CE . . . . . . . . . c30497_6e5i 1 . 3 . 1010 . 1 1 8 LYS CG C 4.441 3.535 -3.846 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CG . . . . . . . . . c30497_6e5i 1 . 3 . 1011 . 1 1 8 LYS H H 1.684 3.898 -0.914 . . . 1.0 . . . . . . . . . . . . A . 8 LYS H . . . . . . . . . c30497_6e5i 1 . 3 . 1012 . 1 1 8 LYS HA H 4.082 2.495 -1.242 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HA . . . . . . . . . c30497_6e5i 1 . 3 . 1013 . 1 1 8 LYS HB2 H 2.555 2.906 -3.101 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HB2 . . . . . . . . . c30497_6e5i 1 . 3 . 1014 . 1 1 8 LYS HB3 H 2.843 4.636 -2.985 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HB3 . . . . . . . . . c30497_6e5i 1 . 3 . 1015 . 1 1 8 LYS HD2 H 3.476 4.822 -5.242 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HD2 . . . . . . . . . c30497_6e5i 1 . 3 . 1016 . 1 1 8 LYS HD3 H 4.887 3.979 -5.883 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HD3 . . . . . . . . . c30497_6e5i 1 . 3 . 1017 . 1 1 8 LYS HE2 H 2.251 2.680 -5.205 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HE2 . . . . . . . . . c30497_6e5i 1 . 3 . 1018 . 1 1 8 LYS HE3 H 2.750 3.166 -6.824 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HE3 . . . . . . . . . c30497_6e5i 1 . 3 . 1019 . 1 1 8 LYS HG2 H 5.232 4.206 -3.547 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HG2 . . . . . . . . . c30497_6e5i 1 . 3 . 1020 . 1 1 8 LYS HG3 H 4.805 2.518 -3.828 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HG3 . . . . . . . . . c30497_6e5i 1 . 3 . 1021 . 1 1 8 LYS HZ1 H 4.668 1.647 -6.587 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ1 . . . . . . . . . c30497_6e5i 1 . 3 . 1022 . 1 1 8 LYS HZ2 H 3.180 0.846 -6.537 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ2 . . . . . . . . . c30497_6e5i 1 . 3 . 1023 . 1 1 8 LYS HZ3 H 4.039 1.115 -5.109 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ3 . . . . . . . . . c30497_6e5i 1 . 3 . 1024 . 1 1 8 LYS N N 2.558 3.680 -0.519 . . . 1.0 . . . . . . . . . . . . A . 8 LYS N . . . . . . . . . c30497_6e5i 1 . 3 . 1025 . 1 1 8 LYS NZ N 3.795 1.517 -6.034 . . . 1.0 . . . . . . . . . . . . A . 8 LYS NZ . . . . . . . . . c30497_6e5i 1 . 3 . 1026 . 1 1 8 LYS O O 5.978 4.155 -1.027 . . . 1.0 . . . . . . . . . . . . A . 8 LYS O . . . . . . . . . c30497_6e5i 1 . 3 . 1027 . 1 1 9 LYS C C 6.012 6.370 0.998 . . . 1.0 . . . . . . . . . . . . A . 9 LYS C . . . . . . . . . c30497_6e5i 1 . 3 . 1028 . 1 1 9 LYS CA C 5.329 6.760 -0.310 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CA . . . . . . . . . c30497_6e5i 1 . 3 . 1029 . 1 1 9 LYS CB C 4.584 8.089 -0.136 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CB . . . . . . . . . c30497_6e5i 1 . 3 . 1030 . 1 1 9 LYS CD C 4.607 10.428 0.791 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CD . . . . . . . . . c30497_6e5i 1 . 3 . 1031 . 1 1 9 LYS CE C 3.986 11.106 -0.421 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CE . . . . . . . . . c30497_6e5i 1 . 3 . 1032 . 1 1 9 LYS CG C 5.446 9.218 0.406 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CG . . . . . . . . . c30497_6e5i 1 . 3 . 1033 . 1 1 9 LYS H H 3.442 5.938 -0.798 . . . 1.0 . . . . . . . . . . . . A . 9 LYS H . . . . . . . . . c30497_6e5i 1 . 3 . 1034 . 1 1 9 LYS HA H 6.077 6.869 -1.079 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HA . . . . . . . . . c30497_6e5i 1 . 3 . 1035 . 1 1 9 LYS HB2 H 4.196 8.393 -1.095 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HB2 . . . . . . . . . c30497_6e5i 1 . 3 . 1036 . 1 1 9 LYS HB3 H 3.758 7.938 0.543 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HB3 . . . . . . . . . c30497_6e5i 1 . 3 . 1037 . 1 1 9 LYS HD2 H 3.815 10.107 1.451 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HD2 . . . . . . . . . c30497_6e5i 1 . 3 . 1038 . 1 1 9 LYS HD3 H 5.237 11.139 1.304 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HD3 . . . . . . . . . c30497_6e5i 1 . 3 . 1039 . 1 1 9 LYS HE2 H 3.432 10.369 -0.983 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HE2 . . . . . . . . . c30497_6e5i 1 . 3 . 1040 . 1 1 9 LYS HE3 H 3.312 11.877 -0.079 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HE3 . . . . . . . . . c30497_6e5i 1 . 3 . 1041 . 1 1 9 LYS HG2 H 5.972 8.867 1.279 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HG2 . . . . . . . . . c30497_6e5i 1 . 3 . 1042 . 1 1 9 LYS HG3 H 6.156 9.511 -0.353 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HG3 . . . . . . . . . c30497_6e5i 1 . 3 . 1043 . 1 1 9 LYS HZ1 H 4.552 12.220 -2.093 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HZ1 . . . . . . . . . c30497_6e5i 1 . 3 . 1044 . 1 1 9 LYS HZ2 H 5.632 10.982 -1.702 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HZ2 . . . . . . . . . c30497_6e5i 1 . 3 . 1045 . 1 1 9 LYS HZ3 H 5.593 12.394 -0.771 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HZ3 . . . . . . . . . c30497_6e5i 1 . 3 . 1046 . 1 1 9 LYS N N 4.398 5.721 -0.733 . . . 1.0 . . . . . . . . . . . . A . 9 LYS N . . . . . . . . . c30497_6e5i 1 . 3 . 1047 . 1 1 9 LYS NZ N 5.013 11.716 -1.308 . . . 1.0 . . . . . . . . . . . . A . 9 LYS NZ . . . . . . . . . c30497_6e5i 1 . 3 . 1048 . 1 1 9 LYS O O 7.227 6.499 1.142 . . . 1.0 . . . . . . . . . . . . A . 9 LYS O . . . . . . . . . c30497_6e5i 1 . 3 . 1049 . 1 1 10 ARG C C 6.728 4.348 3.135 . . . 1.0 . . . . . . . . . . . . A . 10 ARG C . . . . . . . . . c30497_6e5i 1 . 3 . 1050 . 1 1 10 ARG CA C 5.720 5.486 3.250 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CA . . . . . . . . . c30497_6e5i 1 . 3 . 1051 . 1 1 10 ARG CB C 4.565 5.058 4.158 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CB . . . . . . . . . c30497_6e5i 1 . 3 . 1052 . 1 1 10 ARG CD C 3.869 4.041 6.361 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CD . . . . . . . . . c30497_6e5i 1 . 3 . 1053 . 1 1 10 ARG CG C 5.030 4.517 5.501 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CG . . . . . . . . . c30497_6e5i 1 . 3 . 1054 . 1 1 10 ARG CZ C 3.614 3.097 8.632 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CZ . . . . . . . . . c30497_6e5i 1 . 3 . 1055 . 1 1 10 ARG H H 4.257 5.790 1.757 . . . 1.0 . . . . . . . . . . . . A . 10 ARG H . . . . . . . . . c30497_6e5i 1 . 3 . 1056 . 1 1 10 ARG HA H 6.210 6.339 3.688 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HA . . . . . . . . . c30497_6e5i 1 . 3 . 1057 . 1 1 10 ARG HB2 H 3.927 5.910 4.334 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HB2 . . . . . . . . . c30497_6e5i 1 . 3 . 1058 . 1 1 10 ARG HB3 H 3.995 4.287 3.661 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HB3 . . . . . . . . . c30497_6e5i 1 . 3 . 1059 . 1 1 10 ARG HD2 H 3.298 4.898 6.684 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HD2 . . . . . . . . . c30497_6e5i 1 . 3 . 1060 . 1 1 10 ARG HD3 H 3.242 3.389 5.772 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HD3 . . . . . . . . . c30497_6e5i 1 . 3 . 1061 . 1 1 10 ARG HE H 5.260 2.953 7.507 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HE . . . . . . . . . c30497_6e5i 1 . 3 . 1062 . 1 1 10 ARG HG2 H 5.699 3.686 5.329 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HG2 . . . . . . . . . c30497_6e5i 1 . 3 . 1063 . 1 1 10 ARG HG3 H 5.556 5.303 6.024 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HG3 . . . . . . . . . c30497_6e5i 1 . 3 . 1064 . 1 1 10 ARG HH11 H 1.830 3.384 9.549 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HH11 . . . . . . . . . c30497_6e5i 1 . 3 . 1065 . 1 1 10 ARG HH12 H 1.962 4.058 7.955 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HH12 . . . . . . . . . c30497_6e5i 1 . 3 . 1066 . 1 1 10 ARG HH21 H 5.078 2.066 9.580 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HH21 . . . . . . . . . c30497_6e5i 1 . 3 . 1067 . 1 1 10 ARG HH22 H 3.596 2.246 10.469 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HH22 . . . . . . . . . c30497_6e5i 1 . 3 . 1068 . 1 1 10 ARG N N 5.216 5.883 1.943 . . . 1.0 . . . . . . . . . . . . A . 10 ARG N . . . . . . . . . c30497_6e5i 1 . 3 . 1069 . 1 1 10 ARG NE N 4.341 3.311 7.538 . . . 1.0 . . . . . . . . . . . . A . 10 ARG NE . . . . . . . . . c30497_6e5i 1 . 3 . 1070 . 1 1 10 ARG NH1 N 2.370 3.551 8.719 . . . 1.0 . . . . . . . . . . . . A . 10 ARG NH1 . . . . . . . . . c30497_6e5i 1 . 3 . 1071 . 1 1 10 ARG NH2 N 4.138 2.417 9.642 . . . 1.0 . . . . . . . . . . . . A . 10 ARG NH2 . . . . . . . . . c30497_6e5i 1 . 3 . 1072 . 1 1 10 ARG O O 7.824 4.417 3.691 . . . 1.0 . . . . . . . . . . . . A . 10 ARG O . . . . . . . . . c30497_6e5i 1 . 3 . 1073 . 1 1 11 TYR C C 8.215 2.179 1.219 . . . 1.0 . . . . . . . . . . . . A . 11 TYR C . . . . . . . . . c30497_6e5i 1 . 3 . 1074 . 1 1 11 TYR CA C 7.174 2.107 2.330 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CA . . . . . . . . . c30497_6e5i 1 . 3 . 1075 . 1 1 11 TYR CB C 6.287 0.879 2.146 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CB . . . . . . . . . c30497_6e5i 1 . 3 . 1076 . 1 1 11 TYR CD1 C 5.975 -0.240 4.391 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CD1 . . . . . . . . . c30497_6e5i 1 . 3 . 1077 . 1 1 11 TYR CD2 C 4.165 1.021 3.491 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CD2 . . . . . . . . . c30497_6e5i 1 . 3 . 1078 . 1 1 11 TYR CE1 C 5.216 -0.540 5.506 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CE1 . . . . . . . . . c30497_6e5i 1 . 3 . 1079 . 1 1 11 TYR CE2 C 3.401 0.726 4.601 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CE2 . . . . . . . . . c30497_6e5i 1 . 3 . 1080 . 1 1 11 TYR CG C 5.462 0.545 3.367 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CG . . . . . . . . . c30497_6e5i 1 . 3 . 1081 . 1 1 11 TYR CZ C 3.960 -0.088 5.617 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CZ . . . . . . . . . c30497_6e5i 1 . 3 . 1082 . 1 1 11 TYR H H 5.520 3.355 1.887 . . . 1.0 . . . . . . . . . . . . A . 11 TYR H . . . . . . . . . c30497_6e5i 1 . 3 . 1083 . 1 1 11 TYR HA H 7.689 2.016 3.272 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HA . . . . . . . . . c30497_6e5i 1 . 3 . 1084 . 1 1 11 TYR HB2 H 5.611 1.050 1.323 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HB2 . . . . . . . . . c30497_6e5i 1 . 3 . 1085 . 1 1 11 TYR HB3 H 6.909 0.029 1.925 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HB3 . . . . . . . . . c30497_6e5i 1 . 3 . 1086 . 1 1 11 TYR HD1 H 6.985 -0.621 4.309 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HD1 . . . . . . . . . c30497_6e5i 1 . 3 . 1087 . 1 1 11 TYR HD2 H 3.754 1.631 2.698 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HD2 . . . . . . . . . c30497_6e5i 1 . 3 . 1088 . 1 1 11 TYR HE1 H 5.632 -1.153 6.290 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HE1 . . . . . . . . . c30497_6e5i 1 . 3 . 1089 . 1 1 11 TYR HE2 H 2.394 1.108 4.677 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HE2 . . . . . . . . . c30497_6e5i 1 . 3 . 1090 . 1 1 11 TYR HH H 3.680 -0.146 7.516 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HH . . . . . . . . . c30497_6e5i 1 . 3 . 1091 . 1 1 11 TYR N N 6.361 3.311 2.399 . . . 1.0 . . . . . . . . . . . . A . 11 TYR N . . . . . . . . . c30497_6e5i 1 . 3 . 1092 . 1 1 11 TYR O O 8.973 1.228 1.006 . . . 1.0 . . . . . . . . . . . . A . 11 TYR O . . . . . . . . . c30497_6e5i 1 . 3 . 1093 . 1 1 11 TYR OH O 3.171 -0.345 6.718 . . . 1.0 . . . . . . . . . . . . A . 11 TYR OH . . . . . . . . . c30497_6e5i 1 . 3 . 1094 . 1 1 12 ORN C C 9.635 0.315 -2.680 . . . 1.0 . . . . . . . . . . . . A . 12 ORN C . . . . . . . . . c30497_6e5i 1 . 3 . 1095 . 1 1 12 ORN CA C 10.533 1.536 -2.558 . . . 1.0 . . . . . . . . . . . . A . 12 ORN CA . . . . . . . . . c30497_6e5i 1 . 3 . 1096 . 1 1 12 ORN CB C 9.745 2.797 -2.918 . . . 1.0 . . . . . . . . . . . . A . 12 ORN CB . . . . . . . . . c30497_6e5i 1 . 3 . 1097 . 1 1 12 ORN CD C 9.198 3.521 -0.579 . . . 1.0 . . . . . . . . . . . . A . 12 ORN CD . . . . . . . . . c30497_6e5i 1 . 3 . 1098 . 1 1 12 ORN CG C 8.635 3.110 -1.929 . . . 1.0 . . . . . . . . . . . . A . 12 ORN CG . . . . . . . . . c30497_6e5i 1 . 3 . 1099 . 1 1 12 ORN H H 11.381 1.292 -4.438 . . . 1.0 . . . . . . . . . . . . A . 12 ORN H . . . . . . . . . c30497_6e5i 1 . 3 . 1100 . 1 1 12 ORN HA H 10.888 1.611 -1.544 . . . 1.0 . . . . . . . . . . . . A . 12 ORN HA . . . . . . . . . c30497_6e5i 1 . 3 . 1101 . 1 1 12 ORN HB2 H 9.302 2.666 -3.894 . . . 1.0 . . . . . . . . . . . . A . 12 ORN HB2 . . . . . . . . . c30497_6e5i 1 . 3 . 1102 . 1 1 12 ORN HB3 H 10.422 3.636 -2.946 . . . 1.0 . . . . . . . . . . . . A . 12 ORN HB3 . . . . . . . . . c30497_6e5i 1 . 3 . 1103 . 1 1 12 ORN HD2 H 9.445 4.569 -0.615 . . . 1.0 . . . . . . . . . . . . A . 12 ORN HD2 . . . . . . . . . c30497_6e5i 1 . 3 . 1104 . 1 1 12 ORN HD3 H 10.091 2.951 -0.384 . . . 1.0 . . . . . . . . . . . . A . 12 ORN HD3 . . . . . . . . . c30497_6e5i 1 . 3 . 1105 . 1 1 12 ORN HE1 H 7.604 4.006 0.705 . . . 1.0 . . . . . . . . . . . . A . 12 ORN HE1 . . . . . . . . . c30497_6e5i 1 . 3 . 1106 . 1 1 12 ORN HG2 H 8.022 2.231 -1.798 . . . 1.0 . . . . . . . . . . . . A . 12 ORN HG2 . . . . . . . . . c30497_6e5i 1 . 3 . 1107 . 1 1 12 ORN HG3 H 8.034 3.917 -2.317 . . . 1.0 . . . . . . . . . . . . A . 12 ORN HG3 . . . . . . . . . c30497_6e5i 1 . 3 . 1108 . 1 1 12 ORN N N 11.699 1.388 -3.453 . . . 1.0 . . . . . . . . . . . . A . 12 ORN N . . . . . . . . . c30497_6e5i 1 . 3 . 1109 . 1 1 12 ORN NE N 8.251 3.295 0.507 . . . 1.0 . . . . . . . . . . . . A . 12 ORN NE . . . . . . . . . c30497_6e5i 1 . 3 . 1110 . 1 1 12 ORN O O 9.519 -0.268 -3.757 . . . 1.0 . . . . . . . . . . . . A . 12 ORN O . . . . . . . . . c30497_6e5i 1 . 3 . 1111 . 1 1 13 CYS C C 6.827 -0.983 -2.254 . . . 1.0 . . . . . . . . . . . . A . 13 CYS C . . . . . . . . . c30497_6e5i 1 . 3 . 1112 . 1 1 13 CYS CA C 8.156 -1.251 -1.564 . . . 1.0 . . . . . . . . . . . . A . 13 CYS CA . . . . . . . . . c30497_6e5i 1 . 3 . 1113 . 1 1 13 CYS CB C 7.900 -1.714 -0.132 . . . 1.0 . . . . . . . . . . . . A . 13 CYS CB . . . . . . . . . c30497_6e5i 1 . 3 . 1114 . 1 1 13 CYS H H 9.095 0.460 -0.752 . . . 1.0 . . . . . . . . . . . . A . 13 CYS H . . . . . . . . . c30497_6e5i 1 . 3 . 1115 . 1 1 13 CYS HA H 8.673 -2.032 -2.097 . . . 1.0 . . . . . . . . . . . . A . 13 CYS HA . . . . . . . . . c30497_6e5i 1 . 3 . 1116 . 1 1 13 CYS HB2 H 7.365 -0.942 0.391 . . . 1.0 . . . . . . . . . . . . A . 13 CYS HB2 . . . . . . . . . c30497_6e5i 1 . 3 . 1117 . 1 1 13 CYS HB3 H 7.294 -2.608 -0.157 . . . 1.0 . . . . . . . . . . . . A . 13 CYS HB3 . . . . . . . . . c30497_6e5i 1 . 3 . 1118 . 1 1 13 CYS N N 9.000 -0.070 -1.577 . . . 1.0 . . . . . . . . . . . . A . 13 CYS N . . . . . . . . . c30497_6e5i 1 . 3 . 1119 . 1 1 13 CYS O O 6.307 0.133 -2.230 . . . 1.0 . . . . . . . . . . . . A . 13 CYS O . . . . . . . . . c30497_6e5i 1 . 3 . 1120 . 1 1 13 CYS SG S 9.408 -2.087 0.817 . . . 1.0 . . . . . . . . . . . . A . 13 CYS SG . . . . . . . . . c30497_6e5i 1 . 3 . 1121 . 1 1 14 GLU C C 3.927 -2.490 -2.613 . . . 1.0 . . . . . . . . . . . . A . 14 GLU C . . . . . . . . . c30497_6e5i 1 . 3 . 1122 . 1 1 14 GLU CA C 5.012 -1.960 -3.533 . . . 1.0 . . . . . . . . . . . . A . 14 GLU CA . . . . . . . . . c30497_6e5i 1 . 3 . 1123 . 1 1 14 GLU CB C 5.061 -2.798 -4.811 . . . 1.0 . . . . . . . . . . . . A . 14 GLU CB . . . . . . . . . c30497_6e5i 1 . 3 . 1124 . 1 1 14 GLU CD C 3.762 -4.049 -6.567 . . . 1.0 . . . . . . . . . . . . A . 14 GLU CD . . . . . . . . . c30497_6e5i 1 . 3 . 1125 . 1 1 14 GLU CG C 3.704 -3.028 -5.453 . . . 1.0 . . . . . . . . . . . . A . 14 GLU CG . . . . . . . . . c30497_6e5i 1 . 3 . 1126 . 1 1 14 GLU H H 6.771 -2.877 -2.853 . . . 1.0 . . . . . . . . . . . . A . 14 GLU H . . . . . . . . . c30497_6e5i 1 . 3 . 1127 . 1 1 14 GLU HA H 4.802 -0.929 -3.781 . . . 1.0 . . . . . . . . . . . . A . 14 GLU HA . . . . . . . . . c30497_6e5i 1 . 3 . 1128 . 1 1 14 GLU HB2 H 5.693 -2.300 -5.529 . . . 1.0 . . . . . . . . . . . . A . 14 GLU HB2 . . . . . . . . . c30497_6e5i 1 . 3 . 1129 . 1 1 14 GLU HB3 H 5.489 -3.761 -4.573 . . . 1.0 . . . . . . . . . . . . A . 14 GLU HB3 . . . . . . . . . c30497_6e5i 1 . 3 . 1130 . 1 1 14 GLU HG2 H 3.017 -3.381 -4.697 . . . 1.0 . . . . . . . . . . . . A . 14 GLU HG2 . . . . . . . . . c30497_6e5i 1 . 3 . 1131 . 1 1 14 GLU HG3 H 3.346 -2.093 -5.856 . . . 1.0 . . . . . . . . . . . . A . 14 GLU HG3 . . . . . . . . . c30497_6e5i 1 . 3 . 1132 . 1 1 14 GLU N N 6.292 -2.023 -2.864 . . . 1.0 . . . . . . . . . . . . A . 14 GLU N . . . . . . . . . c30497_6e5i 1 . 3 . 1133 . 1 1 14 GLU O O 3.882 -3.682 -2.320 . . . 1.0 . . . . . . . . . . . . A . 14 GLU O . . . . . . . . . c30497_6e5i 1 . 3 . 1134 . 1 1 14 GLU OE1 O 3.812 -5.263 -6.265 . . . 1.0 . . . . . . . . . . . . A . 14 GLU OE1 . . . . . . . . . c30497_6e5i 1 . 3 . 1135 . 1 1 14 GLU OE2 O 3.759 -3.646 -7.748 . . . 1.0 . . . . . . . . . . . . A . 14 GLU OE2 . . . . . . . . . c30497_6e5i 1 . 3 . 1136 . 1 1 15 VAL C C 0.854 -2.610 -2.157 . . . 1.0 . . . . . . . . . . . . A . 15 VAL C . . . . . . . . . c30497_6e5i 1 . 3 . 1137 . 1 1 15 VAL CA C 1.978 -2.052 -1.296 . . . 1.0 . . . . . . . . . . . . A . 15 VAL CA . . . . . . . . . c30497_6e5i 1 . 3 . 1138 . 1 1 15 VAL CB C 1.447 -0.929 -0.376 . . . 1.0 . . . . . . . . . . . . A . 15 VAL CB . . . . . . . . . c30497_6e5i 1 . 3 . 1139 . 1 1 15 VAL CG1 C 2.571 -0.362 0.478 . . . 1.0 . . . . . . . . . . . . A . 15 VAL CG1 . . . . . . . . . c30497_6e5i 1 . 3 . 1140 . 1 1 15 VAL CG2 C 0.772 0.170 -1.178 . . . 1.0 . . . . . . . . . . . . A . 15 VAL CG2 . . . . . . . . . c30497_6e5i 1 . 3 . 1141 . 1 1 15 VAL H H 3.161 -0.670 -2.370 . . . 1.0 . . . . . . . . . . . . A . 15 VAL H . . . . . . . . . c30497_6e5i 1 . 3 . 1142 . 1 1 15 VAL HA H 2.353 -2.849 -0.669 . . . 1.0 . . . . . . . . . . . . A . 15 VAL HA . . . . . . . . . c30497_6e5i 1 . 3 . 1143 . 1 1 15 VAL HB H 0.711 -1.359 0.289 . . . 1.0 . . . . . . . . . . . . A . 15 VAL HB . . . . . . . . . c30497_6e5i 1 . 3 . 1144 . 1 1 15 VAL HG11 H 2.174 0.396 1.135 . . . 1.0 . . . . . . . . . . . . A . 15 VAL HG11 . . . . . . . . . c30497_6e5i 1 . 3 . 1145 . 1 1 15 VAL HG12 H 3.326 0.075 -0.159 . . . 1.0 . . . . . . . . . . . . A . 15 VAL HG12 . . . . . . . . . c30497_6e5i 1 . 3 . 1146 . 1 1 15 VAL HG13 H 3.011 -1.153 1.066 . . . 1.0 . . . . . . . . . . . . A . 15 VAL HG13 . . . . . . . . . c30497_6e5i 1 . 3 . 1147 . 1 1 15 VAL HG21 H 0.377 0.915 -0.504 . . . 1.0 . . . . . . . . . . . . A . 15 VAL HG21 . . . . . . . . . c30497_6e5i 1 . 3 . 1148 . 1 1 15 VAL HG22 H -0.035 -0.256 -1.758 . . . 1.0 . . . . . . . . . . . . A . 15 VAL HG22 . . . . . . . . . c30497_6e5i 1 . 3 . 1149 . 1 1 15 VAL HG23 H 1.490 0.626 -1.841 . . . 1.0 . . . . . . . . . . . . A . 15 VAL HG23 . . . . . . . . . c30497_6e5i 1 . 3 . 1150 . 1 1 15 VAL N N 3.068 -1.615 -2.140 . . . 1.0 . . . . . . . . . . . . A . 15 VAL N . . . . . . . . . c30497_6e5i 1 . 3 . 1151 . 1 1 15 VAL O O 0.568 -2.092 -3.239 . . . 1.0 . . . . . . . . . . . . A . 15 VAL O . . . . . . . . . c30497_6e5i 1 . 3 . 1152 . 1 1 16 ARG C C -2.140 -3.935 -1.801 . . . 1.0 . . . . . . . . . . . . A . 16 ARG C . . . . . . . . . c30497_6e5i 1 . 3 . 1153 . 1 1 16 ARG CA C -0.818 -4.326 -2.424 . . . 1.0 . . . . . . . . . . . . A . 16 ARG CA . . . . . . . . . c30497_6e5i 1 . 3 . 1154 . 1 1 16 ARG CB C -0.681 -5.847 -2.407 . . . 1.0 . . . . . . . . . . . . A . 16 ARG CB . . . . . . . . . c30497_6e5i 1 . 3 . 1155 . 1 1 16 ARG CD C 0.703 -7.871 -2.914 . . . 1.0 . . . . . . . . . . . . A . 16 ARG CD . . . . . . . . . c30497_6e5i 1 . 3 . 1156 . 1 1 16 ARG CG C 0.700 -6.357 -2.780 . . . 1.0 . . . . . . . . . . . . A . 16 ARG CG . . . . . . . . . c30497_6e5i 1 . 3 . 1157 . 1 1 16 ARG CZ C -1.119 -9.069 -4.090 . . . 1.0 . . . . . . . . . . . . A . 16 ARG CZ . . . . . . . . . c30497_6e5i 1 . 3 . 1158 . 1 1 16 ARG H H 0.541 -4.054 -0.834 . . . 1.0 . . . . . . . . . . . . A . 16 ARG H . . . . . . . . . c30497_6e5i 1 . 3 . 1159 . 1 1 16 ARG HA H -0.791 -3.975 -3.444 . . . 1.0 . . . . . . . . . . . . A . 16 ARG HA . . . . . . . . . c30497_6e5i 1 . 3 . 1160 . 1 1 16 ARG HB2 H -0.916 -6.206 -1.419 . . . 1.0 . . . . . . . . . . . . A . 16 ARG HB2 . . . . . . . . . c30497_6e5i 1 . 3 . 1161 . 1 1 16 ARG HB3 H -1.391 -6.263 -3.105 . . . 1.0 . . . . . . . . . . . . A . 16 ARG HB3 . . . . . . . . . c30497_6e5i 1 . 3 . 1162 . 1 1 16 ARG HD2 H 1.726 -8.212 -2.978 . . . 1.0 . . . . . . . . . . . . A . 16 ARG HD2 . . . . . . . . . c30497_6e5i 1 . 3 . 1163 . 1 1 16 ARG HD3 H 0.236 -8.298 -2.040 . . . 1.0 . . . . . . . . . . . . A . 16 ARG HD3 . . . . . . . . . c30497_6e5i 1 . 3 . 1164 . 1 1 16 ARG HE H 0.345 -8.033 -4.980 . . . 1.0 . . . . . . . . . . . . A . 16 ARG HE . . . . . . . . . c30497_6e5i 1 . 3 . 1165 . 1 1 16 ARG HG2 H 0.994 -5.919 -3.721 . . . 1.0 . . . . . . . . . . . . A . 16 ARG HG2 . . . . . . . . . c30497_6e5i 1 . 3 . 1166 . 1 1 16 ARG HG3 H 1.401 -6.070 -2.010 . . . 1.0 . . . . . . . . . . . . A . 16 ARG HG3 . . . . . . . . . c30497_6e5i 1 . 3 . 1167 . 1 1 16 ARG HH11 H -1.283 -9.145 -2.063 . . . 1.0 . . . . . . . . . . . . A . 16 ARG HH11 . . . . . . . . . c30497_6e5i 1 . 3 . 1168 . 1 1 16 ARG HH12 H -2.506 -10.000 -2.945 . . . 1.0 . . . . . . . . . . . . A . 16 ARG HH12 . . . . . . . . . c30497_6e5i 1 . 3 . 1169 . 1 1 16 ARG HH21 H -2.496 -10.019 -5.237 . . . 1.0 . . . . . . . . . . . . A . 16 ARG HH21 . . . . . . . . . c30497_6e5i 1 . 3 . 1170 . 1 1 16 ARG HH22 H -1.257 -9.169 -6.110 . . . 1.0 . . . . . . . . . . . . A . 16 ARG HH22 . . . . . . . . . c30497_6e5i 1 . 3 . 1171 . 1 1 16 ARG N N 0.259 -3.688 -1.697 . . . 1.0 . . . . . . . . . . . . A . 16 ARG N . . . . . . . . . c30497_6e5i 1 . 3 . 1172 . 1 1 16 ARG NE N -0.022 -8.310 -4.107 . . . 1.0 . . . . . . . . . . . . A . 16 ARG NE . . . . . . . . . c30497_6e5i 1 . 3 . 1173 . 1 1 16 ARG NH1 N -1.678 -9.434 -2.942 . . . 1.0 . . . . . . . . . . . . A . 16 ARG NH1 . . . . . . . . . c30497_6e5i 1 . 3 . 1174 . 1 1 16 ARG NH2 N -1.670 -9.450 -5.237 . . . 1.0 . . . . . . . . . . . . A . 16 ARG NH2 . . . . . . . . . c30497_6e5i 1 . 3 . 1175 . 1 1 16 ARG O O -2.436 -4.315 -0.667 . . . 1.0 . . . . . . . . . . . . A . 16 ARG O . . . . . . . . . c30497_6e5i 1 . 3 . 1176 . 1 1 17 CYS C C -5.251 -3.777 -2.425 . . . 1.0 . . . . . . . . . . . . A . 17 CYS C . . . . . . . . . c30497_6e5i 1 . 3 . 1177 . 1 1 17 CYS CA C -4.211 -2.738 -2.053 . . . 1.0 . . . . . . . . . . . . A . 17 CYS CA . . . . . . . . . c30497_6e5i 1 . 3 . 1178 . 1 1 17 CYS CB C -4.560 -1.376 -2.641 . . . 1.0 . . . . . . . . . . . . A . 17 CYS CB . . . . . . . . . c30497_6e5i 1 . 3 . 1179 . 1 1 17 CYS H H -2.615 -2.877 -3.416 . . . 1.0 . . . . . . . . . . . . A . 17 CYS H . . . . . . . . . c30497_6e5i 1 . 3 . 1180 . 1 1 17 CYS HA H -4.161 -2.660 -0.977 . . . 1.0 . . . . . . . . . . . . A . 17 CYS HA . . . . . . . . . c30497_6e5i 1 . 3 . 1181 . 1 1 17 CYS HB2 H -4.627 -1.462 -3.715 . . . 1.0 . . . . . . . . . . . . A . 17 CYS HB2 . . . . . . . . . c30497_6e5i 1 . 3 . 1182 . 1 1 17 CYS HB3 H -5.511 -1.050 -2.248 . . . 1.0 . . . . . . . . . . . . A . 17 CYS HB3 . . . . . . . . . c30497_6e5i 1 . 3 . 1183 . 1 1 17 CYS N N -2.915 -3.163 -2.529 . . . 1.0 . . . . . . . . . . . . A . 17 CYS N . . . . . . . . . c30497_6e5i 1 . 3 . 1184 . 1 1 17 CYS O O -5.649 -3.896 -3.585 . . . 1.0 . . . . . . . . . . . . A . 17 CYS O . . . . . . . . . c30497_6e5i 1 . 3 . 1185 . 1 1 17 CYS SG S -3.323 -0.094 -2.259 . . . 1.0 . . . . . . . . . . . . A . 17 CYS SG . . . . . . . . . c30497_6e5i 1 . 3 . 1186 . 1 1 18 ASP C C -7.866 -5.369 -0.856 . . . 1.0 . . . . . . . . . . . . A . 18 ASP C . . . . . . . . . c30497_6e5i 1 . 3 . 1187 . 1 1 18 ASP CA C -6.594 -5.639 -1.649 . . . 1.0 . . . . . . . . . . . . A . 18 ASP CA . . . . . . . . . c30497_6e5i 1 . 3 . 1188 . 1 1 18 ASP CB C -5.952 -6.959 -1.219 . . . 1.0 . . . . . . . . . . . . A . 18 ASP CB . . . . . . . . . c30497_6e5i 1 . 3 . 1189 . 1 1 18 ASP CG C -6.850 -8.156 -1.437 . . . 1.0 . . . . . . . . . . . . A . 18 ASP CG . . . . . . . . . c30497_6e5i 1 . 3 . 1190 . 1 1 18 ASP H H -5.310 -4.392 -0.534 . . . 1.0 . . . . . . . . . . . . A . 18 ASP H . . . . . . . . . c30497_6e5i 1 . 3 . 1191 . 1 1 18 ASP HA H -6.834 -5.685 -2.701 . . . 1.0 . . . . . . . . . . . . A . 18 ASP HA . . . . . . . . . c30497_6e5i 1 . 3 . 1192 . 1 1 18 ASP HB2 H -5.046 -7.110 -1.783 . . . 1.0 . . . . . . . . . . . . A . 18 ASP HB2 . . . . . . . . . c30497_6e5i 1 . 3 . 1193 . 1 1 18 ASP HB3 H -5.709 -6.904 -0.169 . . . 1.0 . . . . . . . . . . . . A . 18 ASP HB3 . . . . . . . . . c30497_6e5i 1 . 3 . 1194 . 1 1 18 ASP N N -5.652 -4.555 -1.442 . . . 1.0 . . . . . . . . . . . . A . 18 ASP N . . . . . . . . . c30497_6e5i 1 . 3 . 1195 . 1 1 18 ASP O O -8.022 -5.839 0.274 . . . 1.0 . . . . . . . . . . . . A . 18 ASP O . . . . . . . . . c30497_6e5i 1 . 3 . 1196 . 1 1 18 ASP OD1 O -7.122 -8.893 -0.466 . . . 1.0 . . . . . . . . . . . . A . 18 ASP OD1 . . . . . . . . . c30497_6e5i 1 . 3 . 1197 . 1 1 18 ASP OD2 O -7.320 -8.344 -2.575 . . . 1.0 . . . . . . . . . . . . A . 18 ASP OD2 . . . . . . . . . c30497_6e5i 1 . 3 . 1198 . 1 1 19 DPR C C -9.680 -3.340 0.497 . . . 1.0 . . . . . . . . . . . . A . 19 DPR C . . . . . . . . . c30497_6e5i 1 . 3 . 1199 . 1 1 19 DPR CA C -10.006 -4.167 -0.744 . . . 1.0 . . . . . . . . . . . . A . 19 DPR CA . . . . . . . . . c30497_6e5i 1 . 3 . 1200 . 1 1 19 DPR CB C -10.763 -3.331 -1.777 . . . 1.0 . . . . . . . . . . . . A . 19 DPR CB . . . . . . . . . c30497_6e5i 1 . 3 . 1201 . 1 1 19 DPR CD C -8.718 -4.045 -2.801 . . . 1.0 . . . . . . . . . . . . A . 19 DPR CD . . . . . . . . . c30497_6e5i 1 . 3 . 1202 . 1 1 19 DPR CG C -9.744 -2.947 -2.796 . . . 1.0 . . . . . . . . . . . . A . 19 DPR CG . . . . . . . . . c30497_6e5i 1 . 3 . 1203 . 1 1 19 DPR HA H -10.608 -5.014 -0.463 . . . 1.0 . . . . . . . . . . . . A . 19 DPR HA . . . . . . . . . c30497_6e5i 1 . 3 . 1204 . 1 1 19 DPR HB2 H -11.187 -2.462 -1.299 . . . 1.0 . . . . . . . . . . . . A . 19 DPR HB2 . . . . . . . . . c30497_6e5i 1 . 3 . 1205 . 1 1 19 DPR HB3 H -11.551 -3.927 -2.212 . . . 1.0 . . . . . . . . . . . . A . 19 DPR HB3 . . . . . . . . . c30497_6e5i 1 . 3 . 1206 . 1 1 19 DPR HD2 H -7.736 -3.641 -3.006 . . . 1.0 . . . . . . . . . . . . A . 19 DPR HD2 . . . . . . . . . c30497_6e5i 1 . 3 . 1207 . 1 1 19 DPR HD3 H -8.976 -4.802 -3.527 . . . 1.0 . . . . . . . . . . . . A . 19 DPR HD3 . . . . . . . . . c30497_6e5i 1 . 3 . 1208 . 1 1 19 DPR HG2 H -9.286 -2.010 -2.518 . . . 1.0 . . . . . . . . . . . . A . 19 DPR HG2 . . . . . . . . . c30497_6e5i 1 . 3 . 1209 . 1 1 19 DPR HG3 H -10.211 -2.865 -3.766 . . . 1.0 . . . . . . . . . . . . A . 19 DPR HG3 . . . . . . . . . c30497_6e5i 1 . 3 . 1210 . 1 1 19 DPR N N -8.788 -4.583 -1.434 . . . 1.0 . . . . . . . . . . . . A . 19 DPR N . . . . . . . . . c30497_6e5i 1 . 3 . 1211 . 1 1 19 DPR O O -9.041 -2.289 0.407 . . . 1.0 . . . . . . . . . . . . A . 19 DPR O . . . . . . . . . c30497_6e5i 1 . 3 . 1212 . 1 1 20 PRO C C -8.439 -3.581 3.496 . . . 1.0 . . . . . . . . . . . . A . 20 PRO C . . . . . . . . . c30497_6e5i 1 . 3 . 1213 . 1 1 20 PRO CA C -9.803 -3.167 2.943 . . . 1.0 . . . . . . . . . . . . A . 20 PRO CA . . . . . . . . . c30497_6e5i 1 . 3 . 1214 . 1 1 20 PRO CB C -10.922 -3.672 3.848 . . . 1.0 . . . . . . . . . . . . A . 20 PRO CB . . . . . . . . . c30497_6e5i 1 . 3 . 1215 . 1 1 20 PRO CD C -10.959 -5.008 1.853 . . . 1.0 . . . . . . . . . . . . A . 20 PRO CD . . . . . . . . . c30497_6e5i 1 . 3 . 1216 . 1 1 20 PRO CG C -11.224 -5.040 3.337 . . . 1.0 . . . . . . . . . . . . A . 20 PRO CG . . . . . . . . . c30497_6e5i 1 . 3 . 1217 . 1 1 20 PRO HA H -9.852 -2.092 2.866 . . . 1.0 . . . . . . . . . . . . A . 20 PRO HA . . . . . . . . . c30497_6e5i 1 . 3 . 1218 . 1 1 20 PRO HB2 H -10.579 -3.697 4.870 . . . 1.0 . . . . . . . . . . . . A . 20 PRO HB2 . . . . . . . . . c30497_6e5i 1 . 3 . 1219 . 1 1 20 PRO HB3 H -11.781 -3.023 3.764 . . . 1.0 . . . . . . . . . . . . A . 20 PRO HB3 . . . . . . . . . c30497_6e5i 1 . 3 . 1220 . 1 1 20 PRO HD2 H -10.437 -5.901 1.541 . . . 1.0 . . . . . . . . . . . . A . 20 PRO HD2 . . . . . . . . . c30497_6e5i 1 . 3 . 1221 . 1 1 20 PRO HD3 H -11.885 -4.903 1.310 . . . 1.0 . . . . . . . . . . . . A . 20 PRO HD3 . . . . . . . . . c30497_6e5i 1 . 3 . 1222 . 1 1 20 PRO HG2 H -10.577 -5.759 3.816 . . . 1.0 . . . . . . . . . . . . A . 20 PRO HG2 . . . . . . . . . c30497_6e5i 1 . 3 . 1223 . 1 1 20 PRO HG3 H -12.259 -5.283 3.527 . . . 1.0 . . . . . . . . . . . . A . 20 PRO HG3 . . . . . . . . . c30497_6e5i 1 . 3 . 1224 . 1 1 20 PRO N N -10.109 -3.813 1.671 . . . 1.0 . . . . . . . . . . . . A . 20 PRO N . . . . . . . . . c30497_6e5i 1 . 3 . 1225 . 1 1 20 PRO O O -8.029 -3.124 4.562 . . . 1.0 . . . . . . . . . . . . A . 20 PRO O . . . . . . . . . c30497_6e5i 1 . 3 . 1226 . 1 1 21 ARG C C -5.314 -4.323 2.421 . . . 1.0 . . . . . . . . . . . . A . 21 ARG C . . . . . . . . . c30497_6e5i 1 . 3 . 1227 . 1 1 21 ARG CA C -6.449 -4.949 3.215 . . . 1.0 . . . . . . . . . . . . A . 21 ARG CA . . . . . . . . . c30497_6e5i 1 . 3 . 1228 . 1 1 21 ARG CB C -6.404 -6.471 3.071 . . . 1.0 . . . . . . . . . . . . A . 21 ARG CB . . . . . . . . . c30497_6e5i 1 . 3 . 1229 . 1 1 21 ARG CD C -7.402 -8.699 3.700 . . . 1.0 . . . . . . . . . . . . A . 21 ARG CD . . . . . . . . . c30497_6e5i 1 . 3 . 1230 . 1 1 21 ARG CG C -7.419 -7.195 3.940 . . . 1.0 . . . . . . . . . . . . A . 21 ARG CG . . . . . . . . . c30497_6e5i 1 . 3 . 1231 . 1 1 21 ARG CZ C -8.842 -9.806 2.022 . . . 1.0 . . . . . . . . . . . . A . 21 ARG CZ . . . . . . . . . c30497_6e5i 1 . 3 . 1232 . 1 1 21 ARG H H -8.089 -4.735 1.897 . . . 1.0 . . . . . . . . . . . . A . 21 ARG H . . . . . . . . . c30497_6e5i 1 . 3 . 1233 . 1 1 21 ARG HA H -6.331 -4.690 4.255 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HA . . . . . . . . . c30497_6e5i 1 . 3 . 1234 . 1 1 21 ARG HB2 H -6.597 -6.726 2.039 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HB2 . . . . . . . . . c30497_6e5i 1 . 3 . 1235 . 1 1 21 ARG HB3 H -5.417 -6.818 3.339 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HB3 . . . . . . . . . c30497_6e5i 1 . 3 . 1236 . 1 1 21 ARG HD2 H -6.405 -9.067 3.886 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HD2 . . . . . . . . . c30497_6e5i 1 . 3 . 1237 . 1 1 21 ARG HD3 H -8.088 -9.165 4.390 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HD3 . . . . . . . . . c30497_6e5i 1 . 3 . 1238 . 1 1 21 ARG HE H -7.223 -8.708 1.598 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HE . . . . . . . . . c30497_6e5i 1 . 3 . 1239 . 1 1 21 ARG HG2 H -7.188 -7.006 4.978 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HG2 . . . . . . . . . c30497_6e5i 1 . 3 . 1240 . 1 1 21 ARG HG3 H -8.404 -6.815 3.715 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HG3 . . . . . . . . . c30497_6e5i 1 . 3 . 1241 . 1 1 21 ARG HH11 H -9.478 -10.051 3.931 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HH11 . . . . . . . . . c30497_6e5i 1 . 3 . 1242 . 1 1 21 ARG HH12 H -10.444 -10.832 2.724 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HH12 . . . . . . . . . c30497_6e5i 1 . 3 . 1243 . 1 1 21 ARG HH21 H -8.473 -9.733 0.033 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HH21 . . . . . . . . . c30497_6e5i 1 . 3 . 1244 . 1 1 21 ARG HH22 H -9.872 -10.661 0.505 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HH22 . . . . . . . . . c30497_6e5i 1 . 3 . 1245 . 1 1 21 ARG N N -7.738 -4.441 2.766 . . . 1.0 . . . . . . . . . . . . A . 21 ARG N . . . . . . . . . c30497_6e5i 1 . 3 . 1246 . 1 1 21 ARG NE N -7.791 -9.048 2.333 . . . 1.0 . . . . . . . . . . . . A . 21 ARG NE . . . . . . . . . c30497_6e5i 1 . 3 . 1247 . 1 1 21 ARG NH1 N -9.651 -10.268 2.970 . . . 1.0 . . . . . . . . . . . . A . 21 ARG NH1 . . . . . . . . . c30497_6e5i 1 . 3 . 1248 . 1 1 21 ARG NH2 N -9.086 -10.093 0.754 . . . 1.0 . . . . . . . . . . . . A . 21 ARG NH2 . . . . . . . . . c30497_6e5i 1 . 3 . 1249 . 1 1 21 ARG O O -5.483 -3.952 1.261 . . . 1.0 . . . . . . . . . . . . A . 21 ARG O . . . . . . . . . c30497_6e5i 1 . 3 . 1250 . 1 1 22 TYR C C -1.771 -4.524 2.781 . . . 1.0 . . . . . . . . . . . . A . 22 TYR C . . . . . . . . . c30497_6e5i 1 . 3 . 1251 . 1 1 22 TYR CA C -2.974 -3.670 2.413 . . . 1.0 . . . . . . . . . . . . A . 22 TYR CA . . . . . . . . . c30497_6e5i 1 . 3 . 1252 . 1 1 22 TYR CB C -2.718 -2.218 2.818 . . . 1.0 . . . . . . . . . . . . A . 22 TYR CB . . . . . . . . . c30497_6e5i 1 . 3 . 1253 . 1 1 22 TYR CD1 C -3.811 -0.630 1.196 . . . 1.0 . . . . . . . . . . . . A . 22 TYR CD1 . . . . . . . . . c30497_6e5i 1 . 3 . 1254 . 1 1 22 TYR CD2 C -4.880 -1.016 3.290 . . . 1.0 . . . . . . . . . . . . A . 22 TYR CD2 . . . . . . . . . c30497_6e5i 1 . 3 . 1255 . 1 1 22 TYR CE1 C -4.822 0.235 0.832 . . . 1.0 . . . . . . . . . . . . A . 22 TYR CE1 . . . . . . . . . c30497_6e5i 1 . 3 . 1256 . 1 1 22 TYR CE2 C -5.897 -0.153 2.934 . . . 1.0 . . . . . . . . . . . . A . 22 TYR CE2 . . . . . . . . . c30497_6e5i 1 . 3 . 1257 . 1 1 22 TYR CG C -3.824 -1.269 2.428 . . . 1.0 . . . . . . . . . . . . A . 22 TYR CG . . . . . . . . . c30497_6e5i 1 . 3 . 1258 . 1 1 22 TYR CZ C -5.855 0.485 1.714 . . . 1.0 . . . . . . . . . . . . A . 22 TYR CZ . . . . . . . . . c30497_6e5i 1 . 3 . 1259 . 1 1 22 TYR H H -4.114 -4.455 4.004 . . . 1.0 . . . . . . . . . . . . A . 22 TYR H . . . . . . . . . c30497_6e5i 1 . 3 . 1260 . 1 1 22 TYR HA H -3.127 -3.719 1.344 . . . 1.0 . . . . . . . . . . . . A . 22 TYR HA . . . . . . . . . c30497_6e5i 1 . 3 . 1261 . 1 1 22 TYR HB2 H -2.602 -2.166 3.889 . . . 1.0 . . . . . . . . . . . . A . 22 TYR HB2 . . . . . . . . . c30497_6e5i 1 . 3 . 1262 . 1 1 22 TYR HB3 H -1.808 -1.878 2.347 . . . 1.0 . . . . . . . . . . . . A . 22 TYR HB3 . . . . . . . . . c30497_6e5i 1 . 3 . 1263 . 1 1 22 TYR HD1 H -2.992 -0.817 0.516 . . . 1.0 . . . . . . . . . . . . A . 22 TYR HD1 . . . . . . . . . c30497_6e5i 1 . 3 . 1264 . 1 1 22 TYR HD2 H -4.902 -1.506 4.252 . . . 1.0 . . . . . . . . . . . . A . 22 TYR HD2 . . . . . . . . . c30497_6e5i 1 . 3 . 1265 . 1 1 22 TYR HE1 H -4.792 0.724 -0.129 . . . 1.0 . . . . . . . . . . . . A . 22 TYR HE1 . . . . . . . . . c30497_6e5i 1 . 3 . 1266 . 1 1 22 TYR HE2 H -6.711 0.029 3.619 . . . 1.0 . . . . . . . . . . . . A . 22 TYR HE2 . . . . . . . . . c30497_6e5i 1 . 3 . 1267 . 1 1 22 TYR HH H -7.032 1.958 2.062 . . . 1.0 . . . . . . . . . . . . A . 22 TYR HH . . . . . . . . . c30497_6e5i 1 . 3 . 1268 . 1 1 22 TYR N N -4.166 -4.191 3.062 . . . 1.0 . . . . . . . . . . . . A . 22 TYR N . . . . . . . . . c30497_6e5i 1 . 3 . 1269 . 1 1 22 TYR O O -1.515 -4.777 3.958 . . . 1.0 . . . . . . . . . . . . A . 22 TYR O . . . . . . . . . c30497_6e5i 1 . 3 . 1270 . 1 1 22 TYR OH O -6.877 1.330 1.346 . . . 1.0 . . . . . . . . . . . . A . 22 TYR OH . . . . . . . . . c30497_6e5i 1 . 3 . 1271 . 1 1 23 GLU C C 1.373 -5.062 1.549 . . . 1.0 . . . . . . . . . . . . A . 23 GLU C . . . . . . . . . c30497_6e5i 1 . 3 . 1272 . 1 1 23 GLU CA C 0.126 -5.810 1.994 . . . 1.0 . . . . . . . . . . . . A . 23 GLU CA . . . . . . . . . c30497_6e5i 1 . 3 . 1273 . 1 1 23 GLU CB C -0.010 -7.129 1.232 . . . 1.0 . . . . . . . . . . . . A . 23 GLU CB . . . . . . . . . c30497_6e5i 1 . 3 . 1274 . 1 1 23 GLU CD C -1.383 -9.207 0.836 . . . 1.0 . . . . . . . . . . . . A . 23 GLU CD . . . . . . . . . c30497_6e5i 1 . 3 . 1275 . 1 1 23 GLU CG C -1.267 -7.904 1.591 . . . 1.0 . . . . . . . . . . . . A . 23 GLU CG . . . . . . . . . c30497_6e5i 1 . 3 . 1276 . 1 1 23 GLU H H -1.314 -4.747 0.856 . . . 1.0 . . . . . . . . . . . . A . 23 GLU H . . . . . . . . . c30497_6e5i 1 . 3 . 1277 . 1 1 23 GLU HA H 0.198 -6.016 3.051 . . . 1.0 . . . . . . . . . . . . A . 23 GLU HA . . . . . . . . . c30497_6e5i 1 . 3 . 1278 . 1 1 23 GLU HB2 H -0.030 -6.919 0.174 . . . 1.0 . . . . . . . . . . . . A . 23 GLU HB2 . . . . . . . . . c30497_6e5i 1 . 3 . 1279 . 1 1 23 GLU HB3 H 0.843 -7.750 1.451 . . . 1.0 . . . . . . . . . . . . A . 23 GLU HB3 . . . . . . . . . c30497_6e5i 1 . 3 . 1280 . 1 1 23 GLU HG2 H -1.250 -8.121 2.649 . . . 1.0 . . . . . . . . . . . . A . 23 GLU HG2 . . . . . . . . . c30497_6e5i 1 . 3 . 1281 . 1 1 23 GLU HG3 H -2.130 -7.295 1.364 . . . 1.0 . . . . . . . . . . . . A . 23 GLU HG3 . . . . . . . . . c30497_6e5i 1 . 3 . 1282 . 1 1 23 GLU N N -1.051 -4.980 1.775 . . . 1.0 . . . . . . . . . . . . A . 23 GLU N . . . . . . . . . c30497_6e5i 1 . 3 . 1283 . 1 1 23 GLU O O 1.282 -4.089 0.811 . . . 1.0 . . . . . . . . . . . . A . 23 GLU O . . . . . . . . . c30497_6e5i 1 . 3 . 1284 . 1 1 23 GLU OE1 O -2.011 -9.223 -0.241 . . . 1.0 . . . . . . . . . . . . A . 23 GLU OE1 . . . . . . . . . c30497_6e5i 1 . 3 . 1285 . 1 1 23 GLU OE2 O -0.851 -10.228 1.319 . . . 1.0 . . . . . . . . . . . . A . 23 GLU OE2 . . . . . . . . . c30497_6e5i 1 . 3 . 1286 . 1 1 24 VAL C C 4.690 -5.760 0.853 . . . 1.0 . . . . . . . . . . . . A . 24 VAL C . . . . . . . . . c30497_6e5i 1 . 3 . 1287 . 1 1 24 VAL CA C 3.782 -4.837 1.658 . . . 1.0 . . . . . . . . . . . . A . 24 VAL CA . . . . . . . . . c30497_6e5i 1 . 3 . 1288 . 1 1 24 VAL CB C 4.518 -4.343 2.919 . . . 1.0 . . . . . . . . . . . . A . 24 VAL CB . . . . . . . . . c30497_6e5i 1 . 3 . 1289 . 1 1 24 VAL CG1 C 5.806 -3.619 2.550 . . . 1.0 . . . . . . . . . . . . A . 24 VAL CG1 . . . . . . . . . c30497_6e5i 1 . 3 . 1290 . 1 1 24 VAL CG2 C 3.612 -3.432 3.736 . . . 1.0 . . . . . . . . . . . . A . 24 VAL CG2 . . . . . . . . . c30497_6e5i 1 . 3 . 1291 . 1 1 24 VAL H H 2.556 -6.295 2.581 . . . 1.0 . . . . . . . . . . . . A . 24 VAL H . . . . . . . . . c30497_6e5i 1 . 3 . 1292 . 1 1 24 VAL HA H 3.537 -3.977 1.051 . . . 1.0 . . . . . . . . . . . . A . 24 VAL HA . . . . . . . . . c30497_6e5i 1 . 3 . 1293 . 1 1 24 VAL HB H 4.772 -5.201 3.524 . . . 1.0 . . . . . . . . . . . . A . 24 VAL HB . . . . . . . . . c30497_6e5i 1 . 3 . 1294 . 1 1 24 VAL HG11 H 6.311 -3.301 3.450 . . . 1.0 . . . . . . . . . . . . A . 24 VAL HG11 . . . . . . . . . c30497_6e5i 1 . 3 . 1295 . 1 1 24 VAL HG12 H 5.572 -2.755 1.945 . . . 1.0 . . . . . . . . . . . . A . 24 VAL HG12 . . . . . . . . . c30497_6e5i 1 . 3 . 1296 . 1 1 24 VAL HG13 H 6.448 -4.286 1.993 . . . 1.0 . . . . . . . . . . . . A . 24 VAL HG13 . . . . . . . . . c30497_6e5i 1 . 3 . 1297 . 1 1 24 VAL HG21 H 2.720 -3.971 4.020 . . . 1.0 . . . . . . . . . . . . A . 24 VAL HG21 . . . . . . . . . c30497_6e5i 1 . 3 . 1298 . 1 1 24 VAL HG22 H 3.337 -2.573 3.141 . . . 1.0 . . . . . . . . . . . . A . 24 VAL HG22 . . . . . . . . . c30497_6e5i 1 . 3 . 1299 . 1 1 24 VAL HG23 H 4.133 -3.104 4.623 . . . 1.0 . . . . . . . . . . . . A . 24 VAL HG23 . . . . . . . . . c30497_6e5i 1 . 3 . 1300 . 1 1 24 VAL N N 2.534 -5.504 2.001 . . . 1.0 . . . . . . . . . . . . A . 24 VAL N . . . . . . . . . c30497_6e5i 1 . 3 . 1301 . 1 1 24 VAL O O 5.284 -6.694 1.389 . . . 1.0 . . . . . . . . . . . . A . 24 VAL O . . . . . . . . . c30497_6e5i 1 . 3 . 1302 . 1 1 25 HIS C C 6.840 -5.536 -1.765 . . . 1.0 . . . . . . . . . . . . A . 25 HIS C . . . . . . . . . c30497_6e5i 1 . 3 . 1303 . 1 1 25 HIS CA C 5.575 -6.293 -1.355 . . . 1.0 . . . . . . . . . . . . A . 25 HIS CA . . . . . . . . . c30497_6e5i 1 . 3 . 1304 . 1 1 25 HIS CB C 4.720 -6.658 -2.581 . . . 1.0 . . . . . . . . . . . . A . 25 HIS CB . . . . . . . . . c30497_6e5i 1 . 3 . 1305 . 1 1 25 HIS CD2 C 6.271 -8.475 -3.620 . . . 1.0 . . . . . . . . . . . . A . 25 HIS CD2 . . . . . . . . . c30497_6e5i 1 . 3 . 1306 . 1 1 25 HIS CE1 C 6.026 -7.927 -5.725 . . . 1.0 . . . . . . . . . . . . A . 25 HIS CE1 . . . . . . . . . c30497_6e5i 1 . 3 . 1307 . 1 1 25 HIS CG C 5.437 -7.408 -3.668 . . . 1.0 . . . . . . . . . . . . A . 25 HIS CG . . . . . . . . . c30497_6e5i 1 . 3 . 1308 . 1 1 25 HIS H H 4.305 -4.702 -0.792 . . . 1.0 . . . . . . . . . . . . A . 25 HIS H . . . . . . . . . c30497_6e5i 1 . 3 . 1309 . 1 1 25 HIS HA H 5.861 -7.195 -0.839 . . . 1.0 . . . . . . . . . . . . A . 25 HIS HA . . . . . . . . . c30497_6e5i 1 . 3 . 1310 . 1 1 25 HIS HB2 H 3.894 -7.270 -2.257 . . . 1.0 . . . . . . . . . . . . A . 25 HIS HB2 . . . . . . . . . c30497_6e5i 1 . 3 . 1311 . 1 1 25 HIS HB3 H 4.329 -5.748 -3.012 . . . 1.0 . . . . . . . . . . . . A . 25 HIS HB3 . . . . . . . . . c30497_6e5i 1 . 3 . 1312 . 1 1 25 HIS HD1 H 4.754 -6.354 -5.376 . . . 1.0 . . . . . . . . . . . . A . 25 HIS HD1 . . . . . . . . . c30497_6e5i 1 . 3 . 1313 . 1 1 25 HIS HD2 H 6.601 -8.989 -2.731 . . . 1.0 . . . . . . . . . . . . A . 25 HIS HD2 . . . . . . . . . c30497_6e5i 1 . 3 . 1314 . 1 1 25 HIS HE1 H 6.114 -7.916 -6.800 . . . 1.0 . . . . . . . . . . . . A . 25 HIS HE1 . . . . . . . . . c30497_6e5i 1 . 3 . 1315 . 1 1 25 HIS HE2 H 7.027 -9.628 -5.195 . . . 1.0 . . . . . . . . . . . . A . 25 HIS HE2 . . . . . . . . . c30497_6e5i 1 . 3 . 1316 . 1 1 25 HIS N N 4.783 -5.486 -0.438 . . . 1.0 . . . . . . . . . . . . A . 25 HIS N . . . . . . . . . c30497_6e5i 1 . 3 . 1317 . 1 1 25 HIS ND1 N 5.308 -7.090 -5.003 . . . 1.0 . . . . . . . . . . . . A . 25 HIS ND1 . . . . . . . . . c30497_6e5i 1 . 3 . 1318 . 1 1 25 HIS NE2 N 6.622 -8.779 -4.911 . . . 1.0 . . . . . . . . . . . . A . 25 HIS NE2 . . . . . . . . . c30497_6e5i 1 . 3 . 1319 . 1 1 25 HIS O O 6.844 -4.782 -2.739 . . . 1.0 . . . . . . . . . . . . A . 25 HIS O . . . . . . . . . c30497_6e5i 1 . 3 . 1320 . 1 1 26 CYS C C 9.954 -5.815 -2.339 . . . 1.0 . . . . . . . . . . . . A . 26 CYS C . . . . . . . . . c30497_6e5i 1 . 3 . 1321 . 1 1 26 CYS CA C 9.168 -5.062 -1.275 . . . 1.0 . . . . . . . . . . . . A . 26 CYS CA . . . . . . . . . c30497_6e5i 1 . 3 . 1322 . 1 1 26 CYS CB C 9.995 -4.951 0.006 . . . 1.0 . . . . . . . . . . . . A . 26 CYS CB . . . . . . . . . c30497_6e5i 1 . 3 . 1323 . 1 1 26 CYS H H 7.842 -6.345 -0.244 . . . 1.0 . . . . . . . . . . . . A . 26 CYS H . . . . . . . . . c30497_6e5i 1 . 3 . 1324 . 1 1 26 CYS HA H 8.949 -4.070 -1.640 . . . 1.0 . . . . . . . . . . . . A . 26 CYS HA . . . . . . . . . c30497_6e5i 1 . 3 . 1325 . 1 1 26 CYS HB2 H 10.211 -5.943 0.371 . . . 1.0 . . . . . . . . . . . . A . 26 CYS HB2 . . . . . . . . . c30497_6e5i 1 . 3 . 1326 . 1 1 26 CYS HB3 H 10.923 -4.445 -0.217 . . . 1.0 . . . . . . . . . . . . A . 26 CYS HB3 . . . . . . . . . c30497_6e5i 1 . 3 . 1327 . 1 1 26 CYS N N 7.904 -5.730 -1.007 . . . 1.0 . . . . . . . . . . . . A . 26 CYS N . . . . . . . . . c30497_6e5i 1 . 3 . 1328 . 1 1 26 CYS O O 10.778 -6.676 -2.030 . . . 1.0 . . . . . . . . . . . . A . 26 CYS O . . . . . . . . . c30497_6e5i 1 . 3 . 1329 . 1 1 26 CYS SG S 9.169 -4.032 1.345 . . . 1.0 . . . . . . . . . . . . A . 26 CYS SG . . . . . . . . . c30497_6e5i 1 . 3 . 1330 . 1 1 27 NH2 HN1 H 9.021 -4.806 -3.770 . . . 1.0 . . . . . . . . . . . . A . 27 NH2 HN1 . . . . . . . . . c30497_6e5i 1 . 3 . 1331 . 1 1 27 NH2 HN2 H 10.171 -5.981 -4.300 . . . 1.0 . . . . . . . . . . . . A . 27 NH2 HN2 . . . . . . . . . c30497_6e5i 1 . 3 . 1332 . 1 1 27 NH2 N N 9.690 -5.504 -3.594 . . . 1.0 . . . . . . . . . . . . A . 27 NH2 N . . . . . . . . . c30497_6e5i 1 . 4 . 1333 . 1 1 1 ASN C C -6.397 6.081 -2.442 . . . 1.0 . . . . . . . . . . . . A . 1 ASN C . . . . . . . . . c30497_6e5i 1 . 4 . 1334 . 1 1 1 ASN CA C -7.679 5.366 -2.831 . . . 1.0 . . . . . . . . . . . . A . 1 ASN CA . . . . . . . . . c30497_6e5i 1 . 4 . 1335 . 1 1 1 ASN CB C -7.677 3.962 -2.214 . . . 1.0 . . . . . . . . . . . . A . 1 ASN CB . . . . . . . . . c30497_6e5i 1 . 4 . 1336 . 1 1 1 ASN CG C -9.005 3.237 -2.356 . . . 1.0 . . . . . . . . . . . . A . 1 ASN CG . . . . . . . . . c30497_6e5i 1 . 4 . 1337 . 1 1 1 ASN H1 H -7.786 6.253 -4.713 . . . 1.0 . . . . . . . . . . . . A . 1 ASN H1 . . . . . . . . . c30497_6e5i 1 . 4 . 1338 . 1 1 1 ASN H2 H -8.694 4.835 -4.575 . . . 1.0 . . . . . . . . . . . . A . 1 ASN H2 . . . . . . . . . c30497_6e5i 1 . 4 . 1339 . 1 1 1 ASN H3 H -7.011 4.751 -4.705 . . . 1.0 . . . . . . . . . . . . A . 1 ASN H3 . . . . . . . . . c30497_6e5i 1 . 4 . 1340 . 1 1 1 ASN HA H -8.520 5.922 -2.448 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HA . . . . . . . . . c30497_6e5i 1 . 4 . 1341 . 1 1 1 ASN HB2 H -6.918 3.369 -2.697 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HB2 . . . . . . . . . c30497_6e5i 1 . 4 . 1342 . 1 1 1 ASN HB3 H -7.444 4.043 -1.162 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HB3 . . . . . . . . . c30497_6e5i 1 . 4 . 1343 . 1 1 1 ASN HD21 H -10.019 4.936 -2.142 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HD21 . . . . . . . . . c30497_6e5i 1 . 4 . 1344 . 1 1 1 ASN HD22 H -10.973 3.510 -2.362 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HD22 . . . . . . . . . c30497_6e5i 1 . 4 . 1345 . 1 1 1 ASN N N -7.802 5.294 -4.307 . . . 1.0 . . . . . . . . . . . . A . 1 ASN N . . . . . . . . . c30497_6e5i 1 . 4 . 1346 . 1 1 1 ASN ND2 N -10.106 3.969 -2.283 . . . 1.0 . . . . . . . . . . . . A . 1 ASN ND2 . . . . . . . . . c30497_6e5i 1 . 4 . 1347 . 1 1 1 ASN O O -5.300 5.587 -2.705 . . . 1.0 . . . . . . . . . . . . A . 1 ASN O . . . . . . . . . c30497_6e5i 1 . 4 . 1348 . 1 1 1 ASN OD1 O -9.038 2.018 -2.511 . . . 1.0 . . . . . . . . . . . . A . 1 ASN OD1 . . . . . . . . . c30497_6e5i 1 . 4 . 1349 . 1 1 2 ASP C C -4.530 7.292 -0.388 . . . 1.0 . . . . . . . . . . . . A . 2 ASP C . . . . . . . . . c30497_6e5i 1 . 4 . 1350 . 1 1 2 ASP CA C -5.384 8.041 -1.399 . . . 1.0 . . . . . . . . . . . . A . 2 ASP CA . . . . . . . . . c30497_6e5i 1 . 4 . 1351 . 1 1 2 ASP CB C -5.828 9.382 -0.807 . . . 1.0 . . . . . . . . . . . . A . 2 ASP CB . . . . . . . . . c30497_6e5i 1 . 4 . 1352 . 1 1 2 ASP CG C -6.541 9.240 0.525 . . . 1.0 . . . . . . . . . . . . A . 2 ASP CG . . . . . . . . . c30497_6e5i 1 . 4 . 1353 . 1 1 2 ASP H H -7.440 7.566 -1.598 . . . 1.0 . . . . . . . . . . . . A . 2 ASP H . . . . . . . . . c30497_6e5i 1 . 4 . 1354 . 1 1 2 ASP HA H -4.790 8.228 -2.282 . . . 1.0 . . . . . . . . . . . . A . 2 ASP HA . . . . . . . . . c30497_6e5i 1 . 4 . 1355 . 1 1 2 ASP HB2 H -4.958 10.002 -0.659 . . . 1.0 . . . . . . . . . . . . A . 2 ASP HB2 . . . . . . . . . c30497_6e5i 1 . 4 . 1356 . 1 1 2 ASP HB3 H -6.495 9.868 -1.500 . . . 1.0 . . . . . . . . . . . . A . 2 ASP HB3 . . . . . . . . . c30497_6e5i 1 . 4 . 1357 . 1 1 2 ASP N N -6.538 7.238 -1.802 . . . 1.0 . . . . . . . . . . . . A . 2 ASP N . . . . . . . . . c30497_6e5i 1 . 4 . 1358 . 1 1 2 ASP O O -3.329 7.530 -0.284 . . . 1.0 . . . . . . . . . . . . A . 2 ASP O . . . . . . . . . c30497_6e5i 1 . 4 . 1359 . 1 1 2 ASP OD1 O -5.877 9.366 1.577 . . . 1.0 . . . . . . . . . . . . A . 2 ASP OD1 . . . . . . . . . c30497_6e5i 1 . 4 . 1360 . 1 1 2 ASP OD2 O -7.768 8.999 0.523 . . . 1.0 . . . . . . . . . . . . A . 2 ASP OD2 . . . . . . . . . c30497_6e5i 1 . 4 . 1361 . 1 1 3 LYS C C -3.376 4.730 0.595 . . . 1.0 . . . . . . . . . . . . A . 3 LYS C . . . . . . . . . c30497_6e5i 1 . 4 . 1362 . 1 1 3 LYS CA C -4.446 5.549 1.304 . . . 1.0 . . . . . . . . . . . . A . 3 LYS CA . . . . . . . . . c30497_6e5i 1 . 4 . 1363 . 1 1 3 LYS CB C -5.428 4.626 2.027 . . . 1.0 . . . . . . . . . . . . A . 3 LYS CB . . . . . . . . . c30497_6e5i 1 . 4 . 1364 . 1 1 3 LYS CD C -4.321 4.791 4.273 . . . 1.0 . . . . . . . . . . . . A . 3 LYS CD . . . . . . . . . c30497_6e5i 1 . 4 . 1365 . 1 1 3 LYS CE C -3.840 4.026 5.494 . . . 1.0 . . . . . . . . . . . . A . 3 LYS CE . . . . . . . . . c30497_6e5i 1 . 4 . 1366 . 1 1 3 LYS CG C -4.815 3.856 3.182 . . . 1.0 . . . . . . . . . . . . A . 3 LYS CG . . . . . . . . . c30497_6e5i 1 . 4 . 1367 . 1 1 3 LYS H H -6.123 6.271 0.247 . . . 1.0 . . . . . . . . . . . . A . 3 LYS H . . . . . . . . . c30497_6e5i 1 . 4 . 1368 . 1 1 3 LYS HA H -3.973 6.199 2.023 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HA . . . . . . . . . c30497_6e5i 1 . 4 . 1369 . 1 1 3 LYS HB2 H -6.244 5.219 2.414 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HB2 . . . . . . . . . c30497_6e5i 1 . 4 . 1370 . 1 1 3 LYS HB3 H -5.820 3.912 1.317 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HB3 . . . . . . . . . c30497_6e5i 1 . 4 . 1371 . 1 1 3 LYS HD2 H -3.500 5.376 3.885 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HD2 . . . . . . . . . c30497_6e5i 1 . 4 . 1372 . 1 1 3 LYS HD3 H -5.126 5.449 4.564 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HD3 . . . . . . . . . c30497_6e5i 1 . 4 . 1373 . 1 1 3 LYS HE2 H -3.026 3.383 5.201 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HE2 . . . . . . . . . c30497_6e5i 1 . 4 . 1374 . 1 1 3 LYS HE3 H -3.491 4.733 6.230 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HE3 . . . . . . . . . c30497_6e5i 1 . 4 . 1375 . 1 1 3 LYS HG2 H -5.558 3.196 3.598 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HG2 . . . . . . . . . c30497_6e5i 1 . 4 . 1376 . 1 1 3 LYS HG3 H -3.982 3.277 2.813 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HG3 . . . . . . . . . c30497_6e5i 1 . 4 . 1377 . 1 1 3 LYS HZ1 H -5.750 3.781 6.302 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HZ1 . . . . . . . . . c30497_6e5i 1 . 4 . 1378 . 1 1 3 LYS HZ2 H -4.582 2.766 6.979 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HZ2 . . . . . . . . . c30497_6e5i 1 . 4 . 1379 . 1 1 3 LYS HZ3 H -5.195 2.435 5.442 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HZ3 . . . . . . . . . c30497_6e5i 1 . 4 . 1380 . 1 1 3 LYS N N -5.155 6.379 0.345 . . . 1.0 . . . . . . . . . . . . A . 3 LYS N . . . . . . . . . c30497_6e5i 1 . 4 . 1381 . 1 1 3 LYS NZ N -4.918 3.196 6.094 . . . 1.0 . . . . . . . . . . . . A . 3 LYS NZ . . . . . . . . . c30497_6e5i 1 . 4 . 1382 . 1 1 3 LYS O O -2.270 4.555 1.104 . . . 1.0 . . . . . . . . . . . . A . 3 LYS O . . . . . . . . . c30497_6e5i 1 . 4 . 1383 . 1 1 4 CYS C C -1.596 4.346 -1.805 . . . 1.0 . . . . . . . . . . . . A . 4 CYS C . . . . . . . . . c30497_6e5i 1 . 4 . 1384 . 1 1 4 CYS CA C -2.779 3.482 -1.406 . . . 1.0 . . . . . . . . . . . . A . 4 CYS CA . . . . . . . . . c30497_6e5i 1 . 4 . 1385 . 1 1 4 CYS CB C -3.480 2.939 -2.656 . . . 1.0 . . . . . . . . . . . . A . 4 CYS CB . . . . . . . . . c30497_6e5i 1 . 4 . 1386 . 1 1 4 CYS H H -4.599 4.458 -0.959 . . . 1.0 . . . . . . . . . . . . A . 4 CYS H . . . . . . . . . c30497_6e5i 1 . 4 . 1387 . 1 1 4 CYS HA H -2.426 2.655 -0.808 . . . 1.0 . . . . . . . . . . . . A . 4 CYS HA . . . . . . . . . c30497_6e5i 1 . 4 . 1388 . 1 1 4 CYS HB2 H -4.335 2.352 -2.354 . . . 1.0 . . . . . . . . . . . . A . 4 CYS HB2 . . . . . . . . . c30497_6e5i 1 . 4 . 1389 . 1 1 4 CYS HB3 H -3.818 3.769 -3.259 . . . 1.0 . . . . . . . . . . . . A . 4 CYS HB3 . . . . . . . . . c30497_6e5i 1 . 4 . 1390 . 1 1 4 CYS N N -3.709 4.260 -0.601 . . . 1.0 . . . . . . . . . . . . A . 4 CYS N . . . . . . . . . c30497_6e5i 1 . 4 . 1391 . 1 1 4 CYS O O -0.447 3.913 -1.748 . . . 1.0 . . . . . . . . . . . . A . 4 CYS O . . . . . . . . . c30497_6e5i 1 . 4 . 1392 . 1 1 4 CYS SG S -2.429 1.881 -3.702 . . . 1.0 . . . . . . . . . . . . A . 4 CYS SG . . . . . . . . . c30497_6e5i 1 . 4 . 1393 . 1 1 5 LYS C C 0.075 6.818 -1.394 . . . 1.0 . . . . . . . . . . . . A . 5 LYS C . . . . . . . . . c30497_6e5i 1 . 4 . 1394 . 1 1 5 LYS CA C -0.862 6.536 -2.564 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CA . . . . . . . . . c30497_6e5i 1 . 4 . 1395 . 1 1 5 LYS CB C -1.513 7.836 -3.043 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CB . . . . . . . . . c30497_6e5i 1 . 4 . 1396 . 1 1 5 LYS CD C -1.225 10.239 -3.693 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CD . . . . . . . . . c30497_6e5i 1 . 4 . 1397 . 1 1 5 LYS CE C -0.237 11.369 -3.932 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CE . . . . . . . . . c30497_6e5i 1 . 4 . 1398 . 1 1 5 LYS CG C -0.518 8.935 -3.374 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CG . . . . . . . . . c30497_6e5i 1 . 4 . 1399 . 1 1 5 LYS H H -2.828 5.866 -2.191 . . . 1.0 . . . . . . . . . . . . A . 5 LYS H . . . . . . . . . c30497_6e5i 1 . 4 . 1400 . 1 1 5 LYS HA H -0.293 6.104 -3.372 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HA . . . . . . . . . c30497_6e5i 1 . 4 . 1401 . 1 1 5 LYS HB2 H -2.094 7.628 -3.929 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HB2 . . . . . . . . . c30497_6e5i 1 . 4 . 1402 . 1 1 5 LYS HB3 H -2.175 8.200 -2.270 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HB3 . . . . . . . . . c30497_6e5i 1 . 4 . 1403 . 1 1 5 LYS HD2 H -1.823 10.106 -4.582 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HD2 . . . . . . . . . c30497_6e5i 1 . 4 . 1404 . 1 1 5 LYS HD3 H -1.864 10.501 -2.864 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HD3 . . . . . . . . . c30497_6e5i 1 . 4 . 1405 . 1 1 5 LYS HE2 H -0.786 12.289 -4.049 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HE2 . . . . . . . . . c30497_6e5i 1 . 4 . 1406 . 1 1 5 LYS HE3 H 0.413 11.447 -3.074 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HE3 . . . . . . . . . c30497_6e5i 1 . 4 . 1407 . 1 1 5 LYS HG2 H 0.134 9.087 -2.526 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HG2 . . . . . . . . . c30497_6e5i 1 . 4 . 1408 . 1 1 5 LYS HG3 H 0.066 8.633 -4.230 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HG3 . . . . . . . . . c30497_6e5i 1 . 4 . 1409 . 1 1 5 LYS HZ1 H 1.268 11.926 -5.264 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HZ1 . . . . . . . . . c30497_6e5i 1 . 4 . 1410 . 1 1 5 LYS HZ2 H -0.012 11.096 -5.989 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HZ2 . . . . . . . . . c30497_6e5i 1 . 4 . 1411 . 1 1 5 LYS HZ3 H 1.122 10.254 -5.059 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HZ3 . . . . . . . . . c30497_6e5i 1 . 4 . 1412 . 1 1 5 LYS N N -1.889 5.583 -2.179 . . . 1.0 . . . . . . . . . . . . A . 5 LYS N . . . . . . . . . c30497_6e5i 1 . 4 . 1413 . 1 1 5 LYS NZ N 0.591 11.144 -5.145 . . . 1.0 . . . . . . . . . . . . A . 5 LYS NZ . . . . . . . . . c30497_6e5i 1 . 4 . 1414 . 1 1 5 LYS O O 1.297 6.786 -1.544 . . . 1.0 . . . . . . . . . . . . A . 5 LYS O . . . . . . . . . c30497_6e5i 1 . 4 . 1415 . 1 1 6 GLU C C 1.150 6.217 1.363 . . . 1.0 . . . . . . . . . . . . A . 6 GLU C . . . . . . . . . c30497_6e5i 1 . 4 . 1416 . 1 1 6 GLU CA C 0.269 7.390 0.961 . . . 1.0 . . . . . . . . . . . . A . 6 GLU CA . . . . . . . . . c30497_6e5i 1 . 4 . 1417 . 1 1 6 GLU CB C -0.657 7.769 2.117 . . . 1.0 . . . . . . . . . . . . A . 6 GLU CB . . . . . . . . . c30497_6e5i 1 . 4 . 1418 . 1 1 6 GLU CD C -0.649 10.240 1.597 . . . 1.0 . . . . . . . . . . . . A . 6 GLU CD . . . . . . . . . c30497_6e5i 1 . 4 . 1419 . 1 1 6 GLU CG C -1.492 9.008 1.845 . . . 1.0 . . . . . . . . . . . . A . 6 GLU CG . . . . . . . . . c30497_6e5i 1 . 4 . 1420 . 1 1 6 GLU H H -1.487 7.047 -0.167 . . . 1.0 . . . . . . . . . . . . A . 6 GLU H . . . . . . . . . c30497_6e5i 1 . 4 . 1421 . 1 1 6 GLU HA H 0.901 8.233 0.728 . . . 1.0 . . . . . . . . . . . . A . 6 GLU HA . . . . . . . . . c30497_6e5i 1 . 4 . 1422 . 1 1 6 GLU HB2 H -1.328 6.946 2.310 . . . 1.0 . . . . . . . . . . . . A . 6 GLU HB2 . . . . . . . . . c30497_6e5i 1 . 4 . 1423 . 1 1 6 GLU HB3 H -0.059 7.950 2.998 . . . 1.0 . . . . . . . . . . . . A . 6 GLU HB3 . . . . . . . . . c30497_6e5i 1 . 4 . 1424 . 1 1 6 GLU HG2 H -2.102 8.830 0.972 . . . 1.0 . . . . . . . . . . . . A . 6 GLU HG2 . . . . . . . . . c30497_6e5i 1 . 4 . 1425 . 1 1 6 GLU HG3 H -2.128 9.190 2.696 . . . 1.0 . . . . . . . . . . . . A . 6 GLU HG3 . . . . . . . . . c30497_6e5i 1 . 4 . 1426 . 1 1 6 GLU N N -0.506 7.074 -0.229 . . . 1.0 . . . . . . . . . . . . A . 6 GLU N . . . . . . . . . c30497_6e5i 1 . 4 . 1427 . 1 1 6 GLU O O 2.328 6.393 1.664 . . . 1.0 . . . . . . . . . . . . A . 6 GLU O . . . . . . . . . c30497_6e5i 1 . 4 . 1428 . 1 1 6 GLU OE1 O -0.247 10.901 2.580 . . . 1.0 . . . . . . . . . . . . A . 6 GLU OE1 . . . . . . . . . c30497_6e5i 1 . 4 . 1429 . 1 1 6 GLU OE2 O -0.399 10.566 0.420 . . . 1.0 . . . . . . . . . . . . A . 6 GLU OE2 . . . . . . . . . c30497_6e5i 1 . 4 . 1430 . 1 1 7 LEU C C 2.425 3.511 0.731 . . . 1.0 . . . . . . . . . . . . A . 7 LEU C . . . . . . . . . c30497_6e5i 1 . 4 . 1431 . 1 1 7 LEU CA C 1.313 3.820 1.730 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CA . . . . . . . . . c30497_6e5i 1 . 4 . 1432 . 1 1 7 LEU CB C 0.358 2.630 1.846 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CB . . . . . . . . . c30497_6e5i 1 . 4 . 1433 . 1 1 7 LEU CD1 C -1.735 1.649 2.809 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CD1 . . . . . . . . . c30497_6e5i 1 . 4 . 1434 . 1 1 7 LEU CD2 C -0.040 2.645 4.329 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CD2 . . . . . . . . . c30497_6e5i 1 . 4 . 1435 . 1 1 7 LEU CG C -0.691 2.739 2.959 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CG . . . . . . . . . c30497_6e5i 1 . 4 . 1436 . 1 1 7 LEU H H -0.365 4.940 1.083 . . . 1.0 . . . . . . . . . . . . A . 7 LEU H . . . . . . . . . c30497_6e5i 1 . 4 . 1437 . 1 1 7 LEU HA H 1.760 4.004 2.694 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HA . . . . . . . . . c30497_6e5i 1 . 4 . 1438 . 1 1 7 LEU HB2 H -0.156 2.521 0.903 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HB2 . . . . . . . . . c30497_6e5i 1 . 4 . 1439 . 1 1 7 LEU HB3 H 0.947 1.743 2.020 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HB3 . . . . . . . . . c30497_6e5i 1 . 4 . 1440 . 1 1 7 LEU HD11 H -2.454 1.725 3.611 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD11 . . . . . . . . . c30497_6e5i 1 . 4 . 1441 . 1 1 7 LEU HD12 H -1.253 0.683 2.850 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD12 . . . . . . . . . c30497_6e5i 1 . 4 . 1442 . 1 1 7 LEU HD13 H -2.241 1.760 1.862 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD13 . . . . . . . . . c30497_6e5i 1 . 4 . 1443 . 1 1 7 LEU HD21 H 0.702 3.421 4.431 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD21 . . . . . . . . . c30497_6e5i 1 . 4 . 1444 . 1 1 7 LEU HD22 H 0.428 1.678 4.437 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD22 . . . . . . . . . c30497_6e5i 1 . 4 . 1445 . 1 1 7 LEU HD23 H -0.794 2.765 5.093 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD23 . . . . . . . . . c30497_6e5i 1 . 4 . 1446 . 1 1 7 LEU HG H -1.191 3.695 2.886 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HG . . . . . . . . . c30497_6e5i 1 . 4 . 1447 . 1 1 7 LEU N N 0.580 5.020 1.350 . . . 1.0 . . . . . . . . . . . . A . 7 LEU N . . . . . . . . . c30497_6e5i 1 . 4 . 1448 . 1 1 7 LEU O O 3.540 3.164 1.119 . . . 1.0 . . . . . . . . . . . . A . 7 LEU O . . . . . . . . . c30497_6e5i 1 . 4 . 1449 . 1 1 8 LYS C C 4.234 4.426 -1.539 . . . 1.0 . . . . . . . . . . . . A . 8 LYS C . . . . . . . . . c30497_6e5i 1 . 4 . 1450 . 1 1 8 LYS CA C 3.104 3.401 -1.600 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CA . . . . . . . . . c30497_6e5i 1 . 4 . 1451 . 1 1 8 LYS CB C 2.427 3.437 -2.972 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CB . . . . . . . . . c30497_6e5i 1 . 4 . 1452 . 1 1 8 LYS CD C 2.668 3.322 -5.466 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CD . . . . . . . . . c30497_6e5i 1 . 4 . 1453 . 1 1 8 LYS CE C 3.630 3.143 -6.627 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CE . . . . . . . . . c30497_6e5i 1 . 4 . 1454 . 1 1 8 LYS CG C 3.379 3.204 -4.130 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CG . . . . . . . . . c30497_6e5i 1 . 4 . 1455 . 1 1 8 LYS H H 1.213 3.927 -0.807 . . . 1.0 . . . . . . . . . . . . A . 8 LYS H . . . . . . . . . c30497_6e5i 1 . 4 . 1456 . 1 1 8 LYS HA H 3.518 2.418 -1.437 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HA . . . . . . . . . c30497_6e5i 1 . 4 . 1457 . 1 1 8 LYS HB2 H 1.666 2.672 -3.002 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HB2 . . . . . . . . . c30497_6e5i 1 . 4 . 1458 . 1 1 8 LYS HB3 H 1.960 4.401 -3.104 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HB3 . . . . . . . . . c30497_6e5i 1 . 4 . 1459 . 1 1 8 LYS HD2 H 1.903 2.563 -5.524 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HD2 . . . . . . . . . c30497_6e5i 1 . 4 . 1460 . 1 1 8 LYS HD3 H 2.214 4.300 -5.534 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HD3 . . . . . . . . . c30497_6e5i 1 . 4 . 1461 . 1 1 8 LYS HE2 H 3.087 3.269 -7.551 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HE2 . . . . . . . . . c30497_6e5i 1 . 4 . 1462 . 1 1 8 LYS HE3 H 4.401 3.896 -6.559 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HE3 . . . . . . . . . c30497_6e5i 1 . 4 . 1463 . 1 1 8 LYS HG2 H 4.167 3.938 -4.086 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HG2 . . . . . . . . . c30497_6e5i 1 . 4 . 1464 . 1 1 8 LYS HG3 H 3.800 2.213 -4.042 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HG3 . . . . . . . . . c30497_6e5i 1 . 4 . 1465 . 1 1 8 LYS HZ1 H 3.533 1.060 -6.607 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ1 . . . . . . . . . c30497_6e5i 1 . 4 . 1466 . 1 1 8 LYS HZ2 H 4.871 1.690 -5.787 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ2 . . . . . . . . . c30497_6e5i 1 . 4 . 1467 . 1 1 8 LYS HZ3 H 4.847 1.677 -7.475 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ3 . . . . . . . . . c30497_6e5i 1 . 4 . 1468 . 1 1 8 LYS N N 2.123 3.653 -0.553 . . . 1.0 . . . . . . . . . . . . A . 8 LYS N . . . . . . . . . c30497_6e5i 1 . 4 . 1469 . 1 1 8 LYS NZ N 4.265 1.800 -6.623 . . . 1.0 . . . . . . . . . . . . A . 8 LYS NZ . . . . . . . . . c30497_6e5i 1 . 4 . 1470 . 1 1 8 LYS O O 5.395 4.107 -1.792 . . . 1.0 . . . . . . . . . . . . A . 8 LYS O . . . . . . . . . c30497_6e5i 1 . 4 . 1471 . 1 1 9 LYS C C 5.690 6.516 0.223 . . . 1.0 . . . . . . . . . . . . A . 9 LYS C . . . . . . . . . c30497_6e5i 1 . 4 . 1472 . 1 1 9 LYS CA C 4.860 6.722 -1.044 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CA . . . . . . . . . c30497_6e5i 1 . 4 . 1473 . 1 1 9 LYS CB C 4.122 8.063 -0.999 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CB . . . . . . . . . c30497_6e5i 1 . 4 . 1474 . 1 1 9 LYS CD C 4.175 10.537 -0.645 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CD . . . . . . . . . c30497_6e5i 1 . 4 . 1475 . 1 1 9 LYS CE C 4.953 11.695 -0.047 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CE . . . . . . . . . c30497_6e5i 1 . 4 . 1476 . 1 1 9 LYS CG C 4.994 9.258 -0.663 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CG . . . . . . . . . c30497_6e5i 1 . 4 . 1477 . 1 1 9 LYS H H 2.933 5.853 -1.044 . . . 1.0 . . . . . . . . . . . . A . 9 LYS H . . . . . . . . . c30497_6e5i 1 . 4 . 1478 . 1 1 9 LYS HA H 5.512 6.702 -1.903 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HA . . . . . . . . . c30497_6e5i 1 . 4 . 1479 . 1 1 9 LYS HB2 H 3.671 8.240 -1.962 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HB2 . . . . . . . . . c30497_6e5i 1 . 4 . 1480 . 1 1 9 LYS HB3 H 3.341 7.999 -0.256 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HB3 . . . . . . . . . c30497_6e5i 1 . 4 . 1481 . 1 1 9 LYS HD2 H 3.898 10.789 -1.658 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HD2 . . . . . . . . . c30497_6e5i 1 . 4 . 1482 . 1 1 9 LYS HD3 H 3.283 10.372 -0.057 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HD3 . . . . . . . . . c30497_6e5i 1 . 4 . 1483 . 1 1 9 LYS HE2 H 5.859 11.836 -0.616 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HE2 . . . . . . . . . c30497_6e5i 1 . 4 . 1484 . 1 1 9 LYS HE3 H 4.348 12.588 -0.108 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HE3 . . . . . . . . . c30497_6e5i 1 . 4 . 1485 . 1 1 9 LYS HG2 H 5.436 9.110 0.310 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HG2 . . . . . . . . . c30497_6e5i 1 . 4 . 1486 . 1 1 9 LYS HG3 H 5.772 9.348 -1.407 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HG3 . . . . . . . . . c30497_6e5i 1 . 4 . 1487 . 1 1 9 LYS HZ1 H 4.447 11.262 1.930 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HZ1 . . . . . . . . . c30497_6e5i 1 . 4 . 1488 . 1 1 9 LYS HZ2 H 5.789 12.278 1.776 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HZ2 . . . . . . . . . c30497_6e5i 1 . 4 . 1489 . 1 1 9 LYS HZ3 H 5.940 10.627 1.452 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HZ3 . . . . . . . . . c30497_6e5i 1 . 4 . 1490 . 1 1 9 LYS N N 3.884 5.653 -1.195 . . . 1.0 . . . . . . . . . . . . A . 9 LYS N . . . . . . . . . c30497_6e5i 1 . 4 . 1491 . 1 1 9 LYS NZ N 5.307 11.447 1.376 . . . 1.0 . . . . . . . . . . . . A . 9 LYS NZ . . . . . . . . . c30497_6e5i 1 . 4 . 1492 . 1 1 9 LYS O O 6.881 6.832 0.265 . . . 1.0 . . . . . . . . . . . . A . 9 LYS O . . . . . . . . . c30497_6e5i 1 . 4 . 1493 . 1 1 10 ARG C C 6.649 4.582 2.499 . . . 1.0 . . . . . . . . . . . . A . 10 ARG C . . . . . . . . . c30497_6e5i 1 . 4 . 1494 . 1 1 10 ARG CA C 5.659 5.741 2.541 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CA . . . . . . . . . c30497_6e5i 1 . 4 . 1495 . 1 1 10 ARG CB C 4.556 5.446 3.557 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CB . . . . . . . . . c30497_6e5i 1 . 4 . 1496 . 1 1 10 ARG CD C 3.870 4.887 5.886 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CD . . . . . . . . . c30497_6e5i 1 . 4 . 1497 . 1 1 10 ARG CG C 5.046 5.163 4.964 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CG . . . . . . . . . c30497_6e5i 1 . 4 . 1498 . 1 1 10 ARG CZ C 3.449 4.488 8.276 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CZ . . . . . . . . . c30497_6e5i 1 . 4 . 1499 . 1 1 10 ARG H H 4.102 5.718 1.119 . . . 1.0 . . . . . . . . . . . . A . 10 ARG H . . . . . . . . . c30497_6e5i 1 . 4 . 1500 . 1 1 10 ARG HA H 6.175 6.639 2.832 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HA . . . . . . . . . c30497_6e5i 1 . 4 . 1501 . 1 1 10 ARG HB2 H 3.892 6.295 3.597 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HB2 . . . . . . . . . c30497_6e5i 1 . 4 . 1502 . 1 1 10 ARG HB3 H 3.997 4.587 3.217 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HB3 . . . . . . . . . c30497_6e5i 1 . 4 . 1503 . 1 1 10 ARG HD2 H 3.269 5.782 5.954 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HD2 . . . . . . . . . c30497_6e5i 1 . 4 . 1504 . 1 1 10 ARG HD3 H 3.275 4.094 5.457 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HD3 . . . . . . . . . c30497_6e5i 1 . 4 . 1505 . 1 1 10 ARG HE H 5.211 4.213 7.365 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HE . . . . . . . . . c30497_6e5i 1 . 4 . 1506 . 1 1 10 ARG HG2 H 5.696 4.300 4.944 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HG2 . . . . . . . . . c30497_6e5i 1 . 4 . 1507 . 1 1 10 ARG HG3 H 5.587 6.026 5.327 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HG3 . . . . . . . . . c30497_6e5i 1 . 4 . 1508 . 1 1 10 ARG HH11 H 1.562 4.876 8.914 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HH11 . . . . . . . . . c30497_6e5i 1 . 4 . 1509 . 1 1 10 ARG HH12 H 1.853 5.188 7.233 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HH12 . . . . . . . . . c30497_6e5i 1 . 4 . 1510 . 1 1 10 ARG HH21 H 4.839 3.808 9.584 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HH21 . . . . . . . . . c30497_6e5i 1 . 4 . 1511 . 1 1 10 ARG HH22 H 3.263 4.086 10.254 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HH22 . . . . . . . . . c30497_6e5i 1 . 4 . 1512 . 1 1 10 ARG N N 5.044 5.969 1.241 . . . 1.0 . . . . . . . . . . . . A . 10 ARG N . . . . . . . . . c30497_6e5i 1 . 4 . 1513 . 1 1 10 ARG NE N 4.276 4.494 7.234 . . . 1.0 . . . . . . . . . . . . A . 10 ARG NE . . . . . . . . . c30497_6e5i 1 . 4 . 1514 . 1 1 10 ARG NH1 N 2.186 4.880 8.129 . . . 1.0 . . . . . . . . . . . . A . 10 ARG NH1 . . . . . . . . . c30497_6e5i 1 . 4 . 1515 . 1 1 10 ARG NH2 N 3.885 4.098 9.466 . . . 1.0 . . . . . . . . . . . . A . 10 ARG NH2 . . . . . . . . . c30497_6e5i 1 . 4 . 1516 . 1 1 10 ARG O O 7.792 4.710 2.940 . . . 1.0 . . . . . . . . . . . . A . 10 ARG O . . . . . . . . . c30497_6e5i 1 . 4 . 1517 . 1 1 11 TYR C C 7.917 2.142 0.762 . . . 1.0 . . . . . . . . . . . . A . 11 TYR C . . . . . . . . . c30497_6e5i 1 . 4 . 1518 . 1 1 11 TYR CA C 7.008 2.242 1.980 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CA . . . . . . . . . c30497_6e5i 1 . 4 . 1519 . 1 1 11 TYR CB C 6.107 1.013 2.065 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CB . . . . . . . . . c30497_6e5i 1 . 4 . 1520 . 1 1 11 TYR CD1 C 6.023 0.322 4.493 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CD1 . . . . . . . . . c30497_6e5i 1 . 4 . 1521 . 1 1 11 TYR CD2 C 4.086 1.320 3.533 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CD2 . . . . . . . . . c30497_6e5i 1 . 4 . 1522 . 1 1 11 TYR CE1 C 5.366 0.201 5.701 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CE1 . . . . . . . . . c30497_6e5i 1 . 4 . 1523 . 1 1 11 TYR CE2 C 3.422 1.203 4.737 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CE2 . . . . . . . . . c30497_6e5i 1 . 4 . 1524 . 1 1 11 TYR CG C 5.394 0.882 3.390 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CG . . . . . . . . . c30497_6e5i 1 . 4 . 1525 . 1 1 11 TYR CZ C 4.096 0.636 5.835 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CZ . . . . . . . . . c30497_6e5i 1 . 4 . 1526 . 1 1 11 TYR H H 5.310 3.434 1.554 . . . 1.0 . . . . . . . . . . . . A . 11 TYR H . . . . . . . . . c30497_6e5i 1 . 4 . 1527 . 1 1 11 TYR HA H 7.625 2.275 2.863 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HA . . . . . . . . . c30497_6e5i 1 . 4 . 1528 . 1 1 11 TYR HB2 H 5.359 1.067 1.288 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HB2 . . . . . . . . . c30497_6e5i 1 . 4 . 1529 . 1 1 11 TYR HB3 H 6.704 0.129 1.923 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HB3 . . . . . . . . . c30497_6e5i 1 . 4 . 1530 . 1 1 11 TYR HD1 H 7.044 -0.024 4.398 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HD1 . . . . . . . . . c30497_6e5i 1 . 4 . 1531 . 1 1 11 TYR HD2 H 3.584 1.755 2.682 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HD2 . . . . . . . . . c30497_6e5i 1 . 4 . 1532 . 1 1 11 TYR HE1 H 5.872 -0.236 6.546 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HE1 . . . . . . . . . c30497_6e5i 1 . 4 . 1533 . 1 1 11 TYR HE2 H 2.405 1.551 4.827 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HE2 . . . . . . . . . c30497_6e5i 1 . 4 . 1534 . 1 1 11 TYR HH H 2.516 0.180 6.863 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HH . . . . . . . . . c30497_6e5i 1 . 4 . 1535 . 1 1 11 TYR N N 6.205 3.455 1.965 . . . 1.0 . . . . . . . . . . . . A . 11 TYR N . . . . . . . . . c30497_6e5i 1 . 4 . 1536 . 1 1 11 TYR O O 8.747 1.237 0.671 . . . 1.0 . . . . . . . . . . . . A . 11 TYR O . . . . . . . . . c30497_6e5i 1 . 4 . 1537 . 1 1 11 TYR OH O 3.406 0.526 7.023 . . . 1.0 . . . . . . . . . . . . A . 11 TYR OH . . . . . . . . . c30497_6e5i 1 . 4 . 1538 . 1 1 12 ORN C C 9.356 -0.568 -2.614 . . . 1.0 . . . . . . . . . . . . A . 12 ORN C . . . . . . . . . c30497_6e5i 1 . 4 . 1539 . 1 1 12 ORN CA C 10.048 0.768 -2.861 . . . 1.0 . . . . . . . . . . . . A . 12 ORN CA . . . . . . . . . c30497_6e5i 1 . 4 . 1540 . 1 1 12 ORN CB C 9.052 1.768 -3.461 . . . 1.0 . . . . . . . . . . . . A . 12 ORN CB . . . . . . . . . c30497_6e5i 1 . 4 . 1541 . 1 1 12 ORN CD C 8.557 3.096 -1.394 . . . 1.0 . . . . . . . . . . . . A . 12 ORN CD . . . . . . . . . c30497_6e5i 1 . 4 . 1542 . 1 1 12 ORN CG C 7.979 2.211 -2.483 . . . 1.0 . . . . . . . . . . . . A . 12 ORN CG . . . . . . . . . c30497_6e5i 1 . 4 . 1543 . 1 1 12 ORN H H 10.866 0.205 -4.690 . . . 1.0 . . . . . . . . . . . . A . 12 ORN H . . . . . . . . . c30497_6e5i 1 . 4 . 1544 . 1 1 12 ORN HA H 10.419 1.150 -1.922 . . . 1.0 . . . . . . . . . . . . A . 12 ORN HA . . . . . . . . . c30497_6e5i 1 . 4 . 1545 . 1 1 12 ORN HB2 H 8.570 1.311 -4.313 . . . 1.0 . . . . . . . . . . . . A . 12 ORN HB2 . . . . . . . . . c30497_6e5i 1 . 4 . 1546 . 1 1 12 ORN HB3 H 9.592 2.643 -3.791 . . . 1.0 . . . . . . . . . . . . A . 12 ORN HB3 . . . . . . . . . c30497_6e5i 1 . 4 . 1547 . 1 1 12 ORN HD2 H 8.596 4.111 -1.757 . . . 1.0 . . . . . . . . . . . . A . 12 ORN HD2 . . . . . . . . . c30497_6e5i 1 . 4 . 1548 . 1 1 12 ORN HD3 H 9.556 2.760 -1.165 . . . 1.0 . . . . . . . . . . . . A . 12 ORN HD3 . . . . . . . . . c30497_6e5i 1 . 4 . 1549 . 1 1 12 ORN HE1 H 7.072 3.750 -0.058 . . . 1.0 . . . . . . . . . . . . A . 12 ORN HE1 . . . . . . . . . c30497_6e5i 1 . 4 . 1550 . 1 1 12 ORN HG2 H 7.538 1.338 -2.028 . . . 1.0 . . . . . . . . . . . . A . 12 ORN HG2 . . . . . . . . . c30497_6e5i 1 . 4 . 1551 . 1 1 12 ORN HG3 H 7.220 2.761 -3.019 . . . 1.0 . . . . . . . . . . . . A . 12 ORN HG3 . . . . . . . . . c30497_6e5i 1 . 4 . 1552 . 1 1 12 ORN N N 11.194 0.575 -3.776 . . . 1.0 . . . . . . . . . . . . A . 12 ORN N . . . . . . . . . c30497_6e5i 1 . 4 . 1553 . 1 1 12 ORN NE N 7.758 3.060 -0.177 . . . 1.0 . . . . . . . . . . . . A . 12 ORN NE . . . . . . . . . c30497_6e5i 1 . 4 . 1554 . 1 1 12 ORN O O 9.307 -1.419 -3.504 . . . 1.0 . . . . . . . . . . . . A . 12 ORN O . . . . . . . . . c30497_6e5i 1 . 4 . 1555 . 1 1 13 CYS C C 6.898 -2.170 -1.907 . . . 1.0 . . . . . . . . . . . . A . 13 CYS C . . . . . . . . . c30497_6e5i 1 . 4 . 1556 . 1 1 13 CYS CA C 8.148 -1.992 -1.061 . . . 1.0 . . . . . . . . . . . . A . 13 CYS CA . . . . . . . . . c30497_6e5i 1 . 4 . 1557 . 1 1 13 CYS CB C 7.762 -1.995 0.413 . . . 1.0 . . . . . . . . . . . . A . 13 CYS CB . . . . . . . . . c30497_6e5i 1 . 4 . 1558 . 1 1 13 CYS H H 8.904 -0.042 -0.733 . . . 1.0 . . . . . . . . . . . . A . 13 CYS H . . . . . . . . . c30497_6e5i 1 . 4 . 1559 . 1 1 13 CYS HA H 8.821 -2.812 -1.251 . . . 1.0 . . . . . . . . . . . . A . 13 CYS HA . . . . . . . . . c30497_6e5i 1 . 4 . 1560 . 1 1 13 CYS HB2 H 7.075 -1.186 0.595 . . . 1.0 . . . . . . . . . . . . A . 13 CYS HB2 . . . . . . . . . c30497_6e5i 1 . 4 . 1561 . 1 1 13 CYS HB3 H 7.276 -2.930 0.645 . . . 1.0 . . . . . . . . . . . . A . 13 CYS HB3 . . . . . . . . . c30497_6e5i 1 . 4 . 1562 . 1 1 13 CYS N N 8.831 -0.756 -1.409 . . . 1.0 . . . . . . . . . . . . A . 13 CYS N . . . . . . . . . c30497_6e5i 1 . 4 . 1563 . 1 1 13 CYS O O 6.173 -1.208 -2.171 . . . 1.0 . . . . . . . . . . . . A . 13 CYS O . . . . . . . . . c30497_6e5i 1 . 4 . 1564 . 1 1 13 CYS SG S 9.167 -1.797 1.557 . . . 1.0 . . . . . . . . . . . . A . 13 CYS SG . . . . . . . . . c30497_6e5i 1 . 4 . 1565 . 1 1 14 GLU C C 4.261 -3.846 -2.208 . . . 1.0 . . . . . . . . . . . . A . 14 GLU C . . . . . . . . . c30497_6e5i 1 . 4 . 1566 . 1 1 14 GLU CA C 5.476 -3.721 -3.111 . . . 1.0 . . . . . . . . . . . . A . 14 GLU CA . . . . . . . . . c30497_6e5i 1 . 4 . 1567 . 1 1 14 GLU CB C 5.681 -5.026 -3.882 . . . 1.0 . . . . . . . . . . . . A . 14 GLU CB . . . . . . . . . c30497_6e5i 1 . 4 . 1568 . 1 1 14 GLU CD C 6.923 -6.257 -5.698 . . . 1.0 . . . . . . . . . . . . A . 14 GLU CD . . . . . . . . . c30497_6e5i 1 . 4 . 1569 . 1 1 14 GLU CG C 6.677 -4.922 -5.026 . . . 1.0 . . . . . . . . . . . . A . 14 GLU CG . . . . . . . . . c30497_6e5i 1 . 4 . 1570 . 1 1 14 GLU H H 7.270 -4.123 -2.075 . . . 1.0 . . . . . . . . . . . . A . 14 GLU H . . . . . . . . . c30497_6e5i 1 . 4 . 1571 . 1 1 14 GLU HA H 5.311 -2.915 -3.811 . . . 1.0 . . . . . . . . . . . . A . 14 GLU HA . . . . . . . . . c30497_6e5i 1 . 4 . 1572 . 1 1 14 GLU HB2 H 6.034 -5.780 -3.195 . . . 1.0 . . . . . . . . . . . . A . 14 GLU HB2 . . . . . . . . . c30497_6e5i 1 . 4 . 1573 . 1 1 14 GLU HB3 H 4.732 -5.338 -4.288 . . . 1.0 . . . . . . . . . . . . A . 14 GLU HB3 . . . . . . . . . c30497_6e5i 1 . 4 . 1574 . 1 1 14 GLU HG2 H 6.292 -4.230 -5.760 . . . 1.0 . . . . . . . . . . . . A . 14 GLU HG2 . . . . . . . . . c30497_6e5i 1 . 4 . 1575 . 1 1 14 GLU HG3 H 7.615 -4.551 -4.639 . . . 1.0 . . . . . . . . . . . . A . 14 GLU HG3 . . . . . . . . . c30497_6e5i 1 . 4 . 1576 . 1 1 14 GLU N N 6.650 -3.400 -2.323 . . . 1.0 . . . . . . . . . . . . A . 14 GLU N . . . . . . . . . c30497_6e5i 1 . 4 . 1577 . 1 1 14 GLU O O 3.935 -4.933 -1.732 . . . 1.0 . . . . . . . . . . . . A . 14 GLU O . . . . . . . . . c30497_6e5i 1 . 4 . 1578 . 1 1 14 GLU OE1 O 8.026 -6.818 -5.529 . . . 1.0 . . . . . . . . . . . . A . 14 GLU OE1 . . . . . . . . . c30497_6e5i 1 . 4 . 1579 . 1 1 14 GLU OE2 O 6.010 -6.761 -6.392 . . . 1.0 . . . . . . . . . . . . A . 14 GLU OE2 . . . . . . . . . c30497_6e5i 1 . 4 . 1580 . 1 1 15 VAL C C 1.185 -2.907 -2.011 . . . 1.0 . . . . . . . . . . . . A . 15 VAL C . . . . . . . . . c30497_6e5i 1 . 4 . 1581 . 1 1 15 VAL CA C 2.418 -2.715 -1.135 . . . 1.0 . . . . . . . . . . . . A . 15 VAL CA . . . . . . . . . c30497_6e5i 1 . 4 . 1582 . 1 1 15 VAL CB C 2.300 -1.427 -0.278 . . . 1.0 . . . . . . . . . . . . A . 15 VAL CB . . . . . . . . . c30497_6e5i 1 . 4 . 1583 . 1 1 15 VAL CG1 C 2.594 -0.186 -1.100 . . . 1.0 . . . . . . . . . . . . A . 15 VAL CG1 . . . . . . . . . c30497_6e5i 1 . 4 . 1584 . 1 1 15 VAL CG2 C 0.927 -1.320 0.370 . . . 1.0 . . . . . . . . . . . . A . 15 VAL CG2 . . . . . . . . . c30497_6e5i 1 . 4 . 1585 . 1 1 15 VAL H H 3.959 -1.882 -2.310 . . . 1.0 . . . . . . . . . . . . A . 15 VAL H . . . . . . . . . c30497_6e5i 1 . 4 . 1586 . 1 1 15 VAL HA H 2.482 -3.556 -0.460 . . . 1.0 . . . . . . . . . . . . A . 15 VAL HA . . . . . . . . . c30497_6e5i 1 . 4 . 1587 . 1 1 15 VAL HB H 3.037 -1.481 0.509 . . . 1.0 . . . . . . . . . . . . A . 15 VAL HB . . . . . . . . . c30497_6e5i 1 . 4 . 1588 . 1 1 15 VAL HG11 H 3.610 -0.231 -1.463 . . . 1.0 . . . . . . . . . . . . A . 15 VAL HG11 . . . . . . . . . c30497_6e5i 1 . 4 . 1589 . 1 1 15 VAL HG12 H 2.469 0.690 -0.480 . . . 1.0 . . . . . . . . . . . . A . 15 VAL HG12 . . . . . . . . . c30497_6e5i 1 . 4 . 1590 . 1 1 15 VAL HG13 H 1.913 -0.139 -1.936 . . . 1.0 . . . . . . . . . . . . A . 15 VAL HG13 . . . . . . . . . c30497_6e5i 1 . 4 . 1591 . 1 1 15 VAL HG21 H 0.739 -2.202 0.965 . . . 1.0 . . . . . . . . . . . . A . 15 VAL HG21 . . . . . . . . . c30497_6e5i 1 . 4 . 1592 . 1 1 15 VAL HG22 H 0.172 -1.235 -0.398 . . . 1.0 . . . . . . . . . . . . A . 15 VAL HG22 . . . . . . . . . c30497_6e5i 1 . 4 . 1593 . 1 1 15 VAL HG23 H 0.896 -0.445 1.003 . . . 1.0 . . . . . . . . . . . . A . 15 VAL HG23 . . . . . . . . . c30497_6e5i 1 . 4 . 1594 . 1 1 15 VAL N N 3.619 -2.724 -1.944 . . . 1.0 . . . . . . . . . . . . A . 15 VAL N . . . . . . . . . c30497_6e5i 1 . 4 . 1595 . 1 1 15 VAL O O 0.839 -2.056 -2.833 . . . 1.0 . . . . . . . . . . . . A . 15 VAL O . . . . . . . . . c30497_6e5i 1 . 4 . 1596 . 1 1 16 ARG C C -1.851 -3.695 -2.012 . . . 1.0 . . . . . . . . . . . . A . 16 ARG C . . . . . . . . . c30497_6e5i 1 . 4 . 1597 . 1 1 16 ARG CA C -0.644 -4.389 -2.600 . . . 1.0 . . . . . . . . . . . . A . 16 ARG CA . . . . . . . . . c30497_6e5i 1 . 4 . 1598 . 1 1 16 ARG CB C -0.893 -5.895 -2.606 . . . 1.0 . . . . . . . . . . . . A . 16 ARG CB . . . . . . . . . c30497_6e5i 1 . 4 . 1599 . 1 1 16 ARG CD C -0.310 -8.165 -3.474 . . . 1.0 . . . . . . . . . . . . A . 16 ARG CD . . . . . . . . . c30497_6e5i 1 . 4 . 1600 . 1 1 16 ARG CG C 0.048 -6.688 -3.489 . . . 1.0 . . . . . . . . . . . . A . 16 ARG CG . . . . . . . . . c30497_6e5i 1 . 4 . 1601 . 1 1 16 ARG CZ C -2.273 -9.611 -3.890 . . . 1.0 . . . . . . . . . . . . A . 16 ARG CZ . . . . . . . . . c30497_6e5i 1 . 4 . 1602 . 1 1 16 ARG H H 0.890 -4.692 -1.181 . . . 1.0 . . . . . . . . . . . . A . 16 ARG H . . . . . . . . . c30497_6e5i 1 . 4 . 1603 . 1 1 16 ARG HA H -0.504 -4.049 -3.614 . . . 1.0 . . . . . . . . . . . . A . 16 ARG HA . . . . . . . . . c30497_6e5i 1 . 4 . 1604 . 1 1 16 ARG HB2 H -0.796 -6.265 -1.600 . . . 1.0 . . . . . . . . . . . . A . 16 ARG HB2 . . . . . . . . . c30497_6e5i 1 . 4 . 1605 . 1 1 16 ARG HB3 H -1.902 -6.074 -2.945 . . . 1.0 . . . . . . . . . . . . A . 16 ARG HB3 . . . . . . . . . c30497_6e5i 1 . 4 . 1606 . 1 1 16 ARG HD2 H 0.315 -8.680 -4.188 . . . 1.0 . . . . . . . . . . . . A . 16 ARG HD2 . . . . . . . . . c30497_6e5i 1 . 4 . 1607 . 1 1 16 ARG HD3 H -0.121 -8.555 -2.485 . . . 1.0 . . . . . . . . . . . . A . 16 ARG HD3 . . . . . . . . . c30497_6e5i 1 . 4 . 1608 . 1 1 16 ARG HE H -2.278 -7.610 -4.007 . . . 1.0 . . . . . . . . . . . . A . 16 ARG HE . . . . . . . . . c30497_6e5i 1 . 4 . 1609 . 1 1 16 ARG HG2 H -0.021 -6.317 -4.501 . . . 1.0 . . . . . . . . . . . . A . 16 ARG HG2 . . . . . . . . . c30497_6e5i 1 . 4 . 1610 . 1 1 16 ARG HG3 H 1.058 -6.567 -3.126 . . . 1.0 . . . . . . . . . . . . A . 16 ARG HG3 . . . . . . . . . c30497_6e5i 1 . 4 . 1611 . 1 1 16 ARG HH11 H -0.592 -10.606 -3.339 . . . 1.0 . . . . . . . . . . . . A . 16 ARG HH11 . . . . . . . . . c30497_6e5i 1 . 4 . 1612 . 1 1 16 ARG HH12 H -1.976 -11.603 -3.656 . . . 1.0 . . . . . . . . . . . . A . 16 ARG HH12 . . . . . . . . . c30497_6e5i 1 . 4 . 1613 . 1 1 16 ARG HH21 H -3.977 -10.641 -4.283 . . . 1.0 . . . . . . . . . . . . A . 16 ARG HH21 . . . . . . . . . c30497_6e5i 1 . 4 . 1614 . 1 1 16 ARG HH22 H -4.104 -8.917 -4.426 . . . 1.0 . . . . . . . . . . . . A . 16 ARG HH22 . . . . . . . . . c30497_6e5i 1 . 4 . 1615 . 1 1 16 ARG N N 0.548 -4.054 -1.843 . . . 1.0 . . . . . . . . . . . . A . 16 ARG N . . . . . . . . . c30497_6e5i 1 . 4 . 1616 . 1 1 16 ARG NE N -1.717 -8.401 -3.818 . . . 1.0 . . . . . . . . . . . . A . 16 ARG NE . . . . . . . . . c30497_6e5i 1 . 4 . 1617 . 1 1 16 ARG NH1 N -1.556 -10.694 -3.608 . . . 1.0 . . . . . . . . . . . . A . 16 ARG NH1 . . . . . . . . . c30497_6e5i 1 . 4 . 1618 . 1 1 16 ARG NH2 N -3.553 -9.733 -4.228 . . . 1.0 . . . . . . . . . . . . A . 16 ARG NH2 . . . . . . . . . c30497_6e5i 1 . 4 . 1619 . 1 1 16 ARG O O -2.183 -3.893 -0.846 . . . 1.0 . . . . . . . . . . . . A . 16 ARG O . . . . . . . . . c30497_6e5i 1 . 4 . 1620 . 1 1 17 CYS C C -4.917 -2.963 -2.856 . . . 1.0 . . . . . . . . . . . . A . 17 CYS C . . . . . . . . . c30497_6e5i 1 . 4 . 1621 . 1 1 17 CYS CA C -3.690 -2.186 -2.412 . . . 1.0 . . . . . . . . . . . . A . 17 CYS CA . . . . . . . . . c30497_6e5i 1 . 4 . 1622 . 1 1 17 CYS CB C -3.696 -0.785 -3.014 . . . 1.0 . . . . . . . . . . . . A . 17 CYS CB . . . . . . . . . c30497_6e5i 1 . 4 . 1623 . 1 1 17 CYS H H -2.166 -2.768 -3.736 . . . 1.0 . . . . . . . . . . . . A . 17 CYS H . . . . . . . . . c30497_6e5i 1 . 4 . 1624 . 1 1 17 CYS HA H -3.684 -2.115 -1.333 . . . 1.0 . . . . . . . . . . . . A . 17 CYS HA . . . . . . . . . c30497_6e5i 1 . 4 . 1625 . 1 1 17 CYS HB2 H -3.747 -0.868 -4.089 . . . 1.0 . . . . . . . . . . . . A . 17 CYS HB2 . . . . . . . . . c30497_6e5i 1 . 4 . 1626 . 1 1 17 CYS HB3 H -4.563 -0.248 -2.656 . . . 1.0 . . . . . . . . . . . . A . 17 CYS HB3 . . . . . . . . . c30497_6e5i 1 . 4 . 1627 . 1 1 17 CYS N N -2.496 -2.888 -2.823 . . . 1.0 . . . . . . . . . . . . A . 17 CYS N . . . . . . . . . c30497_6e5i 1 . 4 . 1628 . 1 1 17 CYS O O -5.440 -2.748 -3.950 . . . 1.0 . . . . . . . . . . . . A . 17 CYS O . . . . . . . . . c30497_6e5i 1 . 4 . 1629 . 1 1 17 CYS SG S -2.215 0.193 -2.599 . . . 1.0 . . . . . . . . . . . . A . 17 CYS SG . . . . . . . . . c30497_6e5i 1 . 4 . 1630 . 1 1 18 ASP C C -7.608 -4.515 -1.323 . . . 1.0 . . . . . . . . . . . . A . 18 ASP C . . . . . . . . . c30497_6e5i 1 . 4 . 1631 . 1 1 18 ASP CA C -6.488 -4.738 -2.327 . . . 1.0 . . . . . . . . . . . . A . 18 ASP CA . . . . . . . . . c30497_6e5i 1 . 4 . 1632 . 1 1 18 ASP CB C -6.069 -6.211 -2.328 . . . 1.0 . . . . . . . . . . . . A . 18 ASP CB . . . . . . . . . c30497_6e5i 1 . 4 . 1633 . 1 1 18 ASP CG C -5.175 -6.569 -3.501 . . . 1.0 . . . . . . . . . . . . A . 18 ASP CG . . . . . . . . . c30497_6e5i 1 . 4 . 1634 . 1 1 18 ASP H H -4.908 -3.986 -1.141 . . . 1.0 . . . . . . . . . . . . A . 18 ASP H . . . . . . . . . c30497_6e5i 1 . 4 . 1635 . 1 1 18 ASP HA H -6.844 -4.472 -3.311 . . . 1.0 . . . . . . . . . . . . A . 18 ASP HA . . . . . . . . . c30497_6e5i 1 . 4 . 1636 . 1 1 18 ASP HB2 H -5.537 -6.423 -1.415 . . . 1.0 . . . . . . . . . . . . A . 18 ASP HB2 . . . . . . . . . c30497_6e5i 1 . 4 . 1637 . 1 1 18 ASP HB3 H -6.955 -6.826 -2.372 . . . 1.0 . . . . . . . . . . . . A . 18 ASP HB3 . . . . . . . . . c30497_6e5i 1 . 4 . 1638 . 1 1 18 ASP N N -5.354 -3.884 -2.013 . . . 1.0 . . . . . . . . . . . . A . 18 ASP N . . . . . . . . . c30497_6e5i 1 . 4 . 1639 . 1 1 18 ASP O O -7.725 -5.245 -0.331 . . . 1.0 . . . . . . . . . . . . A . 18 ASP O . . . . . . . . . c30497_6e5i 1 . 4 . 1640 . 1 1 18 ASP OD1 O -5.698 -6.960 -4.567 . . . 1.0 . . . . . . . . . . . . A . 18 ASP OD1 . . . . . . . . . c30497_6e5i 1 . 4 . 1641 . 1 1 18 ASP OD2 O -3.941 -6.448 -3.370 . . . 1.0 . . . . . . . . . . . . A . 18 ASP OD2 . . . . . . . . . c30497_6e5i 1 . 4 . 1642 . 1 1 19 DPR C C -9.053 -2.795 0.726 . . . 1.0 . . . . . . . . . . . . A . 19 DPR C . . . . . . . . . c30497_6e5i 1 . 4 . 1643 . 1 1 19 DPR CA C -9.548 -3.140 -0.674 . . . 1.0 . . . . . . . . . . . . A . 19 DPR CA . . . . . . . . . c30497_6e5i 1 . 4 . 1644 . 1 1 19 DPR CB C -10.197 -1.922 -1.337 . . . 1.0 . . . . . . . . . . . . A . 19 DPR CB . . . . . . . . . c30497_6e5i 1 . 4 . 1645 . 1 1 19 DPR CD C -8.378 -2.598 -2.730 . . . 1.0 . . . . . . . . . . . . A . 19 DPR CD . . . . . . . . . c30497_6e5i 1 . 4 . 1646 . 1 1 19 DPR CG C -9.174 -1.405 -2.287 . . . 1.0 . . . . . . . . . . . . A . 19 DPR CG . . . . . . . . . c30497_6e5i 1 . 4 . 1647 . 1 1 19 DPR HA H -10.272 -3.933 -0.613 . . . 1.0 . . . . . . . . . . . . A . 19 DPR HA . . . . . . . . . c30497_6e5i 1 . 4 . 1648 . 1 1 19 DPR HB2 H -10.443 -1.188 -0.584 . . . 1.0 . . . . . . . . . . . . A . 19 DPR HB2 . . . . . . . . . c30497_6e5i 1 . 4 . 1649 . 1 1 19 DPR HB3 H -11.096 -2.229 -1.852 . . . 1.0 . . . . . . . . . . . . A . 19 DPR HB3 . . . . . . . . . c30497_6e5i 1 . 4 . 1650 . 1 1 19 DPR HD2 H -7.357 -2.315 -2.942 . . . 1.0 . . . . . . . . . . . . A . 19 DPR HD2 . . . . . . . . . c30497_6e5i 1 . 4 . 1651 . 1 1 19 DPR HD3 H -8.834 -3.059 -3.595 . . . 1.0 . . . . . . . . . . . . A . 19 DPR HD3 . . . . . . . . . c30497_6e5i 1 . 4 . 1652 . 1 1 19 DPR HG2 H -8.535 -0.694 -1.787 . . . 1.0 . . . . . . . . . . . . A . 19 DPR HG2 . . . . . . . . . c30497_6e5i 1 . 4 . 1653 . 1 1 19 DPR HG3 H -9.660 -0.944 -3.133 . . . 1.0 . . . . . . . . . . . . A . 19 DPR HG3 . . . . . . . . . c30497_6e5i 1 . 4 . 1654 . 1 1 19 DPR N N -8.443 -3.492 -1.565 . . . 1.0 . . . . . . . . . . . . A . 19 DPR N . . . . . . . . . c30497_6e5i 1 . 4 . 1655 . 1 1 19 DPR O O -8.264 -1.867 0.909 . . . 1.0 . . . . . . . . . . . . A . 19 DPR O . . . . . . . . . c30497_6e5i 1 . 4 . 1656 . 1 1 20 PRO C C -7.701 -3.875 3.411 . . . 1.0 . . . . . . . . . . . . A . 20 PRO C . . . . . . . . . c30497_6e5i 1 . 4 . 1657 . 1 1 20 PRO CA C -9.103 -3.347 3.117 . . . 1.0 . . . . . . . . . . . . A . 20 PRO CA . . . . . . . . . c30497_6e5i 1 . 4 . 1658 . 1 1 20 PRO CB C -10.147 -4.143 3.896 . . . 1.0 . . . . . . . . . . . . A . 20 PRO CB . . . . . . . . . c30497_6e5i 1 . 4 . 1659 . 1 1 20 PRO CD C -10.456 -4.671 1.585 . . . 1.0 . . . . . . . . . . . . A . 20 PRO CD . . . . . . . . . c30497_6e5i 1 . 4 . 1660 . 1 1 20 PRO CG C -10.545 -5.240 2.974 . . . 1.0 . . . . . . . . . . . . A . 20 PRO CG . . . . . . . . . c30497_6e5i 1 . 4 . 1661 . 1 1 20 PRO HA H -9.162 -2.307 3.392 . . . 1.0 . . . . . . . . . . . . A . 20 PRO HA . . . . . . . . . c30497_6e5i 1 . 4 . 1662 . 1 1 20 PRO HB2 H -9.705 -4.528 4.803 . . . 1.0 . . . . . . . . . . . . A . 20 PRO HB2 . . . . . . . . . c30497_6e5i 1 . 4 . 1663 . 1 1 20 PRO HB3 H -10.985 -3.508 4.138 . . . 1.0 . . . . . . . . . . . . A . 20 PRO HB3 . . . . . . . . . c30497_6e5i 1 . 4 . 1664 . 1 1 20 PRO HD2 H -10.080 -5.414 0.897 . . . 1.0 . . . . . . . . . . . . A . 20 PRO HD2 . . . . . . . . . c30497_6e5i 1 . 4 . 1665 . 1 1 20 PRO HD3 H -11.422 -4.312 1.262 . . . 1.0 . . . . . . . . . . . . A . 20 PRO HD3 . . . . . . . . . c30497_6e5i 1 . 4 . 1666 . 1 1 20 PRO HG2 H -9.866 -6.073 3.081 . . . 1.0 . . . . . . . . . . . . A . 20 PRO HG2 . . . . . . . . . c30497_6e5i 1 . 4 . 1667 . 1 1 20 PRO HG3 H -11.555 -5.549 3.187 . . . 1.0 . . . . . . . . . . . . A . 20 PRO HG3 . . . . . . . . . c30497_6e5i 1 . 4 . 1668 . 1 1 20 PRO N N -9.503 -3.555 1.727 . . . 1.0 . . . . . . . . . . . . A . 20 PRO N . . . . . . . . . c30497_6e5i 1 . 4 . 1669 . 1 1 20 PRO O O -7.134 -3.596 4.470 . . . 1.0 . . . . . . . . . . . . A . 20 PRO O . . . . . . . . . c30497_6e5i 1 . 4 . 1670 . 1 1 21 ARG C C -4.755 -4.476 1.910 . . . 1.0 . . . . . . . . . . . . A . 21 ARG C . . . . . . . . . c30497_6e5i 1 . 4 . 1671 . 1 1 21 ARG CA C -5.822 -5.220 2.687 . . . 1.0 . . . . . . . . . . . . A . 21 ARG CA . . . . . . . . . c30497_6e5i 1 . 4 . 1672 . 1 1 21 ARG CB C -5.794 -6.694 2.287 . . . 1.0 . . . . . . . . . . . . A . 21 ARG CB . . . . . . . . . c30497_6e5i 1 . 4 . 1673 . 1 1 21 ARG CD C -6.320 -9.064 2.926 . . . 1.0 . . . . . . . . . . . . A . 21 ARG CD . . . . . . . . . c30497_6e5i 1 . 4 . 1674 . 1 1 21 ARG CG C -6.615 -7.595 3.192 . . . 1.0 . . . . . . . . . . . . A . 21 ARG CG . . . . . . . . . c30497_6e5i 1 . 4 . 1675 . 1 1 21 ARG CZ C -4.468 -10.664 3.315 . . . 1.0 . . . . . . . . . . . . A . 21 ARG CZ . . . . . . . . . c30497_6e5i 1 . 4 . 1676 . 1 1 21 ARG H H -7.605 -4.788 1.624 . . . 1.0 . . . . . . . . . . . . A . 21 ARG H . . . . . . . . . c30497_6e5i 1 . 4 . 1677 . 1 1 21 ARG HA H -5.595 -5.142 3.739 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HA . . . . . . . . . c30497_6e5i 1 . 4 . 1678 . 1 1 21 ARG HB2 H -6.176 -6.788 1.281 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HB2 . . . . . . . . . c30497_6e5i 1 . 4 . 1679 . 1 1 21 ARG HB3 H -4.771 -7.038 2.306 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HB3 . . . . . . . . . c30497_6e5i 1 . 4 . 1680 . 1 1 21 ARG HD2 H -6.963 -9.667 3.552 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HD2 . . . . . . . . . c30497_6e5i 1 . 4 . 1681 . 1 1 21 ARG HD3 H -6.530 -9.276 1.888 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HD3 . . . . . . . . . c30497_6e5i 1 . 4 . 1682 . 1 1 21 ARG HE H -4.279 -8.667 3.329 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HE . . . . . . . . . c30497_6e5i 1 . 4 . 1683 . 1 1 21 ARG HG2 H -6.381 -7.368 4.221 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HG2 . . . . . . . . . c30497_6e5i 1 . 4 . 1684 . 1 1 21 ARG HG3 H -7.663 -7.408 3.009 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HG3 . . . . . . . . . c30497_6e5i 1 . 4 . 1685 . 1 1 21 ARG HH11 H -6.252 -11.537 2.926 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HH11 . . . . . . . . . c30497_6e5i 1 . 4 . 1686 . 1 1 21 ARG HH12 H -4.939 -12.631 3.224 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HH12 . . . . . . . . . c30497_6e5i 1 . 4 . 1687 . 1 1 21 ARG HH21 H -2.558 -10.102 3.705 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HH21 . . . . . . . . . c30497_6e5i 1 . 4 . 1688 . 1 1 21 ARG HH22 H -2.835 -11.819 3.665 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HH22 . . . . . . . . . c30497_6e5i 1 . 4 . 1689 . 1 1 21 ARG N N -7.136 -4.634 2.478 . . . 1.0 . . . . . . . . . . . . A . 21 ARG N . . . . . . . . . c30497_6e5i 1 . 4 . 1690 . 1 1 21 ARG NE N -4.920 -9.414 3.207 . . . 1.0 . . . . . . . . . . . . A . 21 ARG NE . . . . . . . . . c30497_6e5i 1 . 4 . 1691 . 1 1 21 ARG NH1 N -5.284 -11.693 3.139 . . . 1.0 . . . . . . . . . . . . A . 21 ARG NH1 . . . . . . . . . c30497_6e5i 1 . 4 . 1692 . 1 1 21 ARG NH2 N -3.186 -10.880 3.581 . . . 1.0 . . . . . . . . . . . . A . 21 ARG NH2 . . . . . . . . . c30497_6e5i 1 . 4 . 1693 . 1 1 21 ARG O O -4.834 -4.338 0.692 . . . 1.0 . . . . . . . . . . . . A . 21 ARG O . . . . . . . . . c30497_6e5i 1 . 4 . 1694 . 1 1 22 TYR C C -1.368 -4.179 2.393 . . . 1.0 . . . . . . . . . . . . A . 22 TYR C . . . . . . . . . c30497_6e5i 1 . 4 . 1695 . 1 1 22 TYR CA C -2.604 -3.384 2.018 . . . 1.0 . . . . . . . . . . . . A . 22 TYR CA . . . . . . . . . c30497_6e5i 1 . 4 . 1696 . 1 1 22 TYR CB C -2.472 -1.927 2.445 . . . 1.0 . . . . . . . . . . . . A . 22 TYR CB . . . . . . . . . c30497_6e5i 1 . 4 . 1697 . 1 1 22 TYR CD1 C -3.694 -0.483 0.778 . . . 1.0 . . . . . . . . . . . . A . 22 TYR CD1 . . . . . . . . . c30497_6e5i 1 . 4 . 1698 . 1 1 22 TYR CD2 C -4.717 -0.879 2.890 . . . 1.0 . . . . . . . . . . . . A . 22 TYR CD2 . . . . . . . . . c30497_6e5i 1 . 4 . 1699 . 1 1 22 TYR CE1 C -4.769 0.295 0.398 . . . 1.0 . . . . . . . . . . . . A . 22 TYR CE1 . . . . . . . . . c30497_6e5i 1 . 4 . 1700 . 1 1 22 TYR CE2 C -5.796 -0.104 2.518 . . . 1.0 . . . . . . . . . . . . A . 22 TYR CE2 . . . . . . . . . c30497_6e5i 1 . 4 . 1701 . 1 1 22 TYR CG C -3.651 -1.082 2.028 . . . 1.0 . . . . . . . . . . . . A . 22 TYR CG . . . . . . . . . c30497_6e5i 1 . 4 . 1702 . 1 1 22 TYR CZ C -5.821 0.468 1.250 . . . 1.0 . . . . . . . . . . . . A . 22 TYR CZ . . . . . . . . . c30497_6e5i 1 . 4 . 1703 . 1 1 22 TYR H H -3.804 -4.069 3.606 . . . 1.0 . . . . . . . . . . . . A . 22 TYR H . . . . . . . . . c30497_6e5i 1 . 4 . 1704 . 1 1 22 TYR HA H -2.735 -3.429 0.946 . . . 1.0 . . . . . . . . . . . . A . 22 TYR HA . . . . . . . . . c30497_6e5i 1 . 4 . 1705 . 1 1 22 TYR HB2 H -2.386 -1.876 3.519 . . . 1.0 . . . . . . . . . . . . A . 22 TYR HB2 . . . . . . . . . c30497_6e5i 1 . 4 . 1706 . 1 1 22 TYR HB3 H -1.585 -1.508 1.995 . . . 1.0 . . . . . . . . . . . . A . 22 TYR HB3 . . . . . . . . . c30497_6e5i 1 . 4 . 1707 . 1 1 22 TYR HD1 H -2.869 -0.630 0.098 . . . 1.0 . . . . . . . . . . . . A . 22 TYR HD1 . . . . . . . . . c30497_6e5i 1 . 4 . 1708 . 1 1 22 TYR HD2 H -4.697 -1.339 3.867 . . . 1.0 . . . . . . . . . . . . A . 22 TYR HD2 . . . . . . . . . c30497_6e5i 1 . 4 . 1709 . 1 1 22 TYR HE1 H -4.783 0.752 -0.580 . . . 1.0 . . . . . . . . . . . . A . 22 TYR HE1 . . . . . . . . . c30497_6e5i 1 . 4 . 1710 . 1 1 22 TYR HE2 H -6.614 0.040 3.204 . . . 1.0 . . . . . . . . . . . . A . 22 TYR HE2 . . . . . . . . . c30497_6e5i 1 . 4 . 1711 . 1 1 22 TYR HH H -7.030 1.949 1.562 . . . 1.0 . . . . . . . . . . . . A . 22 TYR HH . . . . . . . . . c30497_6e5i 1 . 4 . 1712 . 1 1 22 TYR N N -3.761 -3.998 2.629 . . . 1.0 . . . . . . . . . . . . A . 22 TYR N . . . . . . . . . c30497_6e5i 1 . 4 . 1713 . 1 1 22 TYR O O -0.809 -4.017 3.477 . . . 1.0 . . . . . . . . . . . . A . 22 TYR O . . . . . . . . . c30497_6e5i 1 . 4 . 1714 . 1 1 22 TYR OH O -6.896 1.259 0.902 . . . 1.0 . . . . . . . . . . . . A . 22 TYR OH . . . . . . . . . c30497_6e5i 1 . 4 . 1715 . 1 1 23 GLU C C 1.455 -5.427 1.408 . . . 1.0 . . . . . . . . . . . . A . 23 GLU C . . . . . . . . . c30497_6e5i 1 . 4 . 1716 . 1 1 23 GLU CA C 0.101 -6.005 1.772 . . . 1.0 . . . . . . . . . . . . A . 23 GLU CA . . . . . . . . . c30497_6e5i 1 . 4 . 1717 . 1 1 23 GLU CB C -0.121 -7.307 1.004 . . . 1.0 . . . . . . . . . . . . A . 23 GLU CB . . . . . . . . . c30497_6e5i 1 . 4 . 1718 . 1 1 23 GLU CD C -1.561 -8.370 2.776 . . . 1.0 . . . . . . . . . . . . A . 23 GLU CD . . . . . . . . . c30497_6e5i 1 . 4 . 1719 . 1 1 23 GLU CG C -1.436 -7.993 1.319 . . . 1.0 . . . . . . . . . . . . A . 23 GLU CG . . . . . . . . . c30497_6e5i 1 . 4 . 1720 . 1 1 23 GLU H H -1.376 -5.038 0.599 . . . 1.0 . . . . . . . . . . . . A . 23 GLU H . . . . . . . . . c30497_6e5i 1 . 4 . 1721 . 1 1 23 GLU HA H 0.086 -6.215 2.830 . . . 1.0 . . . . . . . . . . . . A . 23 GLU HA . . . . . . . . . c30497_6e5i 1 . 4 . 1722 . 1 1 23 GLU HB2 H -0.094 -7.096 -0.052 . . . 1.0 . . . . . . . . . . . . A . 23 GLU HB2 . . . . . . . . . c30497_6e5i 1 . 4 . 1723 . 1 1 23 GLU HB3 H 0.681 -7.989 1.243 . . . 1.0 . . . . . . . . . . . . A . 23 GLU HB3 . . . . . . . . . c30497_6e5i 1 . 4 . 1724 . 1 1 23 GLU HG2 H -2.247 -7.324 1.067 . . . 1.0 . . . . . . . . . . . . A . 23 GLU HG2 . . . . . . . . . c30497_6e5i 1 . 4 . 1725 . 1 1 23 GLU HG3 H -1.512 -8.890 0.723 . . . 1.0 . . . . . . . . . . . . A . 23 GLU HG3 . . . . . . . . . c30497_6e5i 1 . 4 . 1726 . 1 1 23 GLU N N -0.961 -5.052 1.491 . . . 1.0 . . . . . . . . . . . . A . 23 GLU N . . . . . . . . . c30497_6e5i 1 . 4 . 1727 . 1 1 23 GLU O O 1.834 -5.402 0.240 . . . 1.0 . . . . . . . . . . . . A . 23 GLU O . . . . . . . . . c30497_6e5i 1 . 4 . 1728 . 1 1 23 GLU OE1 O -2.550 -7.964 3.417 . . . 1.0 . . . . . . . . . . . . A . 23 GLU OE1 . . . . . . . . . c30497_6e5i 1 . 4 . 1729 . 1 1 23 GLU OE2 O -0.675 -9.085 3.292 . . . 1.0 . . . . . . . . . . . . A . 23 GLU OE2 . . . . . . . . . c30497_6e5i 1 . 4 . 1730 . 1 1 24 VAL C C 4.538 -5.480 2.038 . . . 1.0 . . . . . . . . . . . . A . 24 VAL C . . . . . . . . . c30497_6e5i 1 . 4 . 1731 . 1 1 24 VAL CA C 3.490 -4.389 2.199 . . . 1.0 . . . . . . . . . . . . A . 24 VAL CA . . . . . . . . . c30497_6e5i 1 . 4 . 1732 . 1 1 24 VAL CB C 3.884 -3.460 3.365 . . . 1.0 . . . . . . . . . . . . A . 24 VAL CB . . . . . . . . . c30497_6e5i 1 . 4 . 1733 . 1 1 24 VAL CG1 C 5.252 -2.842 3.122 . . . 1.0 . . . . . . . . . . . . A . 24 VAL CG1 . . . . . . . . . c30497_6e5i 1 . 4 . 1734 . 1 1 24 VAL CG2 C 2.837 -2.372 3.563 . . . 1.0 . . . . . . . . . . . . A . 24 VAL CG2 . . . . . . . . . c30497_6e5i 1 . 4 . 1735 . 1 1 24 VAL H H 1.827 -5.045 3.322 . . . 1.0 . . . . . . . . . . . . A . 24 VAL H . . . . . . . . . c30497_6e5i 1 . 4 . 1736 . 1 1 24 VAL HA H 3.453 -3.804 1.294 . . . 1.0 . . . . . . . . . . . . A . 24 VAL HA . . . . . . . . . c30497_6e5i 1 . 4 . 1737 . 1 1 24 VAL HB H 3.935 -4.050 4.268 . . . 1.0 . . . . . . . . . . . . A . 24 VAL HB . . . . . . . . . c30497_6e5i 1 . 4 . 1738 . 1 1 24 VAL HG11 H 5.985 -3.627 3.001 . . . 1.0 . . . . . . . . . . . . A . 24 VAL HG11 . . . . . . . . . c30497_6e5i 1 . 4 . 1739 . 1 1 24 VAL HG12 H 5.522 -2.224 3.965 . . . 1.0 . . . . . . . . . . . . A . 24 VAL HG12 . . . . . . . . . c30497_6e5i 1 . 4 . 1740 . 1 1 24 VAL HG13 H 5.220 -2.239 2.227 . . . 1.0 . . . . . . . . . . . . A . 24 VAL HG13 . . . . . . . . . c30497_6e5i 1 . 4 . 1741 . 1 1 24 VAL HG21 H 2.770 -1.772 2.667 . . . 1.0 . . . . . . . . . . . . A . 24 VAL HG21 . . . . . . . . . c30497_6e5i 1 . 4 . 1742 . 1 1 24 VAL HG22 H 3.122 -1.745 4.394 . . . 1.0 . . . . . . . . . . . . A . 24 VAL HG22 . . . . . . . . . c30497_6e5i 1 . 4 . 1743 . 1 1 24 VAL HG23 H 1.878 -2.824 3.764 . . . 1.0 . . . . . . . . . . . . A . 24 VAL HG23 . . . . . . . . . c30497_6e5i 1 . 4 . 1744 . 1 1 24 VAL N N 2.178 -4.973 2.410 . . . 1.0 . . . . . . . . . . . . A . 24 VAL N . . . . . . . . . c30497_6e5i 1 . 4 . 1745 . 1 1 24 VAL O O 4.917 -6.144 3.002 . . . 1.0 . . . . . . . . . . . . A . 24 VAL O . . . . . . . . . c30497_6e5i 1 . 4 . 1746 . 1 1 25 HIS C C 7.310 -6.038 0.131 . . . 1.0 . . . . . . . . . . . . A . 25 HIS C . . . . . . . . . c30497_6e5i 1 . 4 . 1747 . 1 1 25 HIS CA C 5.988 -6.687 0.518 . . . 1.0 . . . . . . . . . . . . A . 25 HIS CA . . . . . . . . . c30497_6e5i 1 . 4 . 1748 . 1 1 25 HIS CB C 5.509 -7.615 -0.598 . . . 1.0 . . . . . . . . . . . . A . 25 HIS CB . . . . . . . . . c30497_6e5i 1 . 4 . 1749 . 1 1 25 HIS CD2 C 3.235 -8.544 0.244 . . . 1.0 . . . . . . . . . . . . A . 25 HIS CD2 . . . . . . . . . c30497_6e5i 1 . 4 . 1750 . 1 1 25 HIS CE1 C 3.778 -10.661 0.345 . . . 1.0 . . . . . . . . . . . . A . 25 HIS CE1 . . . . . . . . . c30497_6e5i 1 . 4 . 1751 . 1 1 25 HIS CG C 4.527 -8.652 -0.147 . . . 1.0 . . . . . . . . . . . . A . 25 HIS CG . . . . . . . . . c30497_6e5i 1 . 4 . 1752 . 1 1 25 HIS H H 4.619 -5.139 0.072 . . . 1.0 . . . . . . . . . . . . A . 25 HIS H . . . . . . . . . c30497_6e5i 1 . 4 . 1753 . 1 1 25 HIS HA H 6.140 -7.269 1.414 . . . 1.0 . . . . . . . . . . . . A . 25 HIS HA . . . . . . . . . c30497_6e5i 1 . 4 . 1754 . 1 1 25 HIS HB2 H 5.034 -7.024 -1.364 . . . 1.0 . . . . . . . . . . . . A . 25 HIS HB2 . . . . . . . . . c30497_6e5i 1 . 4 . 1755 . 1 1 25 HIS HB3 H 6.359 -8.124 -1.022 . . . 1.0 . . . . . . . . . . . . A . 25 HIS HB3 . . . . . . . . . c30497_6e5i 1 . 4 . 1756 . 1 1 25 HIS HD1 H 5.703 -10.394 -0.294 . . . 1.0 . . . . . . . . . . . . A . 25 HIS HD1 . . . . . . . . . c30497_6e5i 1 . 4 . 1757 . 1 1 25 HIS HD2 H 2.658 -7.633 0.305 . . . 1.0 . . . . . . . . . . . . A . 25 HIS HD2 . . . . . . . . . c30497_6e5i 1 . 4 . 1758 . 1 1 25 HIS HE1 H 3.729 -11.728 0.497 . . . 1.0 . . . . . . . . . . . . A . 25 HIS HE1 . . . . . . . . . c30497_6e5i 1 . 4 . 1759 . 1 1 25 HIS HE2 H 1.947 -10.024 0.997 . . . 1.0 . . . . . . . . . . . . A . 25 HIS HE2 . . . . . . . . . c30497_6e5i 1 . 4 . 1760 . 1 1 25 HIS N N 4.982 -5.681 0.810 . . . 1.0 . . . . . . . . . . . . A . 25 HIS N . . . . . . . . . c30497_6e5i 1 . 4 . 1761 . 1 1 25 HIS ND1 N 4.833 -9.992 -0.072 . . . 1.0 . . . . . . . . . . . . A . 25 HIS ND1 . . . . . . . . . c30497_6e5i 1 . 4 . 1762 . 1 1 25 HIS NE2 N 2.794 -9.809 0.545 . . . 1.0 . . . . . . . . . . . . A . 25 HIS NE2 . . . . . . . . . c30497_6e5i 1 . 4 . 1763 . 1 1 25 HIS O O 7.532 -5.694 -1.028 . . . 1.0 . . . . . . . . . . . . A . 25 HIS O . . . . . . . . . c30497_6e5i 1 . 4 . 1764 . 1 1 26 CYS C C 10.457 -6.346 0.395 . . . 1.0 . . . . . . . . . . . . A . 26 CYS C . . . . . . . . . c30497_6e5i 1 . 4 . 1765 . 1 1 26 CYS CA C 9.487 -5.277 0.885 . . . 1.0 . . . . . . . . . . . . A . 26 CYS CA . . . . . . . . . c30497_6e5i 1 . 4 . 1766 . 1 1 26 CYS CB C 10.017 -4.642 2.171 . . . 1.0 . . . . . . . . . . . . A . 26 CYS CB . . . . . . . . . c30497_6e5i 1 . 4 . 1767 . 1 1 26 CYS H H 7.921 -6.120 2.022 . . . 1.0 . . . . . . . . . . . . A . 26 CYS H . . . . . . . . . c30497_6e5i 1 . 4 . 1768 . 1 1 26 CYS HA H 9.389 -4.514 0.128 . . . 1.0 . . . . . . . . . . . . A . 26 CYS HA . . . . . . . . . c30497_6e5i 1 . 4 . 1769 . 1 1 26 CYS HB2 H 10.123 -5.408 2.923 . . . 1.0 . . . . . . . . . . . . A . 26 CYS HB2 . . . . . . . . . c30497_6e5i 1 . 4 . 1770 . 1 1 26 CYS HB3 H 10.985 -4.202 1.975 . . . 1.0 . . . . . . . . . . . . A . 26 CYS HB3 . . . . . . . . . c30497_6e5i 1 . 4 . 1771 . 1 1 26 CYS N N 8.172 -5.854 1.114 . . . 1.0 . . . . . . . . . . . . A . 26 CYS N . . . . . . . . . c30497_6e5i 1 . 4 . 1772 . 1 1 26 CYS O O 11.142 -6.993 1.189 . . . 1.0 . . . . . . . . . . . . A . 26 CYS O . . . . . . . . . c30497_6e5i 1 . 4 . 1773 . 1 1 26 CYS SG S 8.942 -3.340 2.857 . . . 1.0 . . . . . . . . . . . . A . 26 CYS SG . . . . . . . . . c30497_6e5i 1 . 4 . 1774 . 1 1 27 NH2 HN1 H 9.933 -5.993 -1.488 . . . 1.0 . . . . . . . . . . . . A . 27 NH2 HN1 . . . . . . . . . c30497_6e5i 1 . 4 . 1775 . 1 1 27 NH2 HN2 H 11.121 -7.230 -1.249 . . . 1.0 . . . . . . . . . . . . A . 27 NH2 HN2 . . . . . . . . . c30497_6e5i 1 . 4 . 1776 . 1 1 27 NH2 N N 10.509 -6.544 -0.911 . . . 1.0 . . . . . . . . . . . . A . 27 NH2 N . . . . . . . . . c30497_6e5i 1 . 5 . 1777 . 1 1 1 ASN C C -6.417 5.865 -2.450 . . . 1.0 . . . . . . . . . . . . A . 1 ASN C . . . . . . . . . c30497_6e5i 1 . 5 . 1778 . 1 1 1 ASN CA C -7.681 5.042 -2.695 . . . 1.0 . . . . . . . . . . . . A . 1 ASN CA . . . . . . . . . c30497_6e5i 1 . 5 . 1779 . 1 1 1 ASN CB C -7.524 4.224 -3.983 . . . 1.0 . . . . . . . . . . . . A . 1 ASN CB . . . . . . . . . c30497_6e5i 1 . 5 . 1780 . 1 1 1 ASN CG C -8.678 3.266 -4.219 . . . 1.0 . . . . . . . . . . . . A . 1 ASN CG . . . . . . . . . c30497_6e5i 1 . 5 . 1781 . 1 1 1 ASN H1 H -9.719 5.342 -2.990 . . . 1.0 . . . . . . . . . . . . A . 1 ASN H1 . . . . . . . . . c30497_6e5i 1 . 5 . 1782 . 1 1 1 ASN H2 H -8.755 6.630 -3.508 . . . 1.0 . . . . . . . . . . . . A . 1 ASN H2 . . . . . . . . . c30497_6e5i 1 . 5 . 1783 . 1 1 1 ASN H3 H -9.028 6.389 -1.859 . . . 1.0 . . . . . . . . . . . . A . 1 ASN H3 . . . . . . . . . c30497_6e5i 1 . 5 . 1784 . 1 1 1 ASN HA H -7.817 4.365 -1.866 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HA . . . . . . . . . c30497_6e5i 1 . 5 . 1785 . 1 1 1 ASN HB2 H -7.469 4.900 -4.822 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HB2 . . . . . . . . . c30497_6e5i 1 . 5 . 1786 . 1 1 1 ASN HB3 H -6.609 3.654 -3.927 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HB3 . . . . . . . . . c30497_6e5i 1 . 5 . 1787 . 1 1 1 ASN HD21 H -7.449 1.941 -5.051 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HD21 . . . . . . . . . c30497_6e5i 1 . 5 . 1788 . 1 1 1 ASN HD22 H -9.115 1.476 -4.962 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HD22 . . . . . . . . . c30497_6e5i 1 . 5 . 1789 . 1 1 1 ASN N N -8.876 5.912 -2.770 . . . 1.0 . . . . . . . . . . . . A . 1 ASN N . . . . . . . . . c30497_6e5i 1 . 5 . 1790 . 1 1 1 ASN ND2 N -8.385 2.115 -4.804 . . . 1.0 . . . . . . . . . . . . A . 1 ASN ND2 . . . . . . . . . c30497_6e5i 1 . 5 . 1791 . 1 1 1 ASN O O -5.322 5.483 -2.871 . . . 1.0 . . . . . . . . . . . . A . 1 ASN O . . . . . . . . . c30497_6e5i 1 . 5 . 1792 . 1 1 1 ASN OD1 O -9.824 3.553 -3.868 . . . 1.0 . . . . . . . . . . . . A . 1 ASN OD1 . . . . . . . . . c30497_6e5i 1 . 5 . 1793 . 1 1 2 ASP C C -4.493 7.275 -0.454 . . . 1.0 . . . . . . . . . . . . A . 2 ASP C . . . . . . . . . c30497_6e5i 1 . 5 . 1794 . 1 1 2 ASP CA C -5.441 7.882 -1.483 . . . 1.0 . . . . . . . . . . . . A . 2 ASP CA . . . . . . . . . c30497_6e5i 1 . 5 . 1795 . 1 1 2 ASP CB C -5.931 9.254 -0.998 . . . 1.0 . . . . . . . . . . . . A . 2 ASP CB . . . . . . . . . c30497_6e5i 1 . 5 . 1796 . 1 1 2 ASP CG C -6.690 9.192 0.316 . . . 1.0 . . . . . . . . . . . . A . 2 ASP CG . . . . . . . . . c30497_6e5i 1 . 5 . 1797 . 1 1 2 ASP H H -7.455 7.228 -1.415 . . . 1.0 . . . . . . . . . . . . A . 2 ASP H . . . . . . . . . c30497_6e5i 1 . 5 . 1798 . 1 1 2 ASP HA H -4.899 8.014 -2.408 . . . 1.0 . . . . . . . . . . . . A . 2 ASP HA . . . . . . . . . c30497_6e5i 1 . 5 . 1799 . 1 1 2 ASP HB2 H -5.079 9.900 -0.863 . . . 1.0 . . . . . . . . . . . . A . 2 ASP HB2 . . . . . . . . . c30497_6e5i 1 . 5 . 1800 . 1 1 2 ASP HB3 H -6.582 9.679 -1.747 . . . 1.0 . . . . . . . . . . . . A . 2 ASP HB3 . . . . . . . . . c30497_6e5i 1 . 5 . 1801 . 1 1 2 ASP N N -6.566 6.991 -1.757 . . . 1.0 . . . . . . . . . . . . A . 2 ASP N . . . . . . . . . c30497_6e5i 1 . 5 . 1802 . 1 1 2 ASP O O -3.288 7.531 -0.482 . . . 1.0 . . . . . . . . . . . . A . 2 ASP O . . . . . . . . . c30497_6e5i 1 . 5 . 1803 . 1 1 2 ASP OD1 O -6.061 9.342 1.383 . . . 1.0 . . . . . . . . . . . . A . 2 ASP OD1 . . . . . . . . . c30497_6e5i 1 . 5 . 1804 . 1 1 2 ASP OD2 O -7.923 8.994 0.292 . . . 1.0 . . . . . . . . . . . . A . 2 ASP OD2 . . . . . . . . . c30497_6e5i 1 . 5 . 1805 . 1 1 3 LYS C C -3.224 4.856 0.822 . . . 1.0 . . . . . . . . . . . . A . 3 LYS C . . . . . . . . . c30497_6e5i 1 . 5 . 1806 . 1 1 3 LYS CA C -4.213 5.818 1.463 . . . 1.0 . . . . . . . . . . . . A . 3 LYS CA . . . . . . . . . c30497_6e5i 1 . 5 . 1807 . 1 1 3 LYS CB C -5.089 5.089 2.485 . . . 1.0 . . . . . . . . . . . . A . 3 LYS CB . . . . . . . . . c30497_6e5i 1 . 5 . 1808 . 1 1 3 LYS CD C -5.182 3.748 4.616 . . . 1.0 . . . . . . . . . . . . A . 3 LYS CD . . . . . . . . . c30497_6e5i 1 . 5 . 1809 . 1 1 3 LYS CE C -5.672 4.852 5.541 . . . 1.0 . . . . . . . . . . . . A . 3 LYS CE . . . . . . . . . c30497_6e5i 1 . 5 . 1810 . 1 1 3 LYS CG C -4.295 4.294 3.511 . . . 1.0 . . . . . . . . . . . . A . 3 LYS CG . . . . . . . . . c30497_6e5i 1 . 5 . 1811 . 1 1 3 LYS H H -5.993 6.274 0.414 . . . 1.0 . . . . . . . . . . . . A . 3 LYS H . . . . . . . . . c30497_6e5i 1 . 5 . 1812 . 1 1 3 LYS HA H -3.658 6.594 1.966 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HA . . . . . . . . . c30497_6e5i 1 . 5 . 1813 . 1 1 3 LYS HB2 H -5.688 5.815 3.010 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HB2 . . . . . . . . . c30497_6e5i 1 . 5 . 1814 . 1 1 3 LYS HB3 H -5.742 4.407 1.963 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HB3 . . . . . . . . . c30497_6e5i 1 . 5 . 1815 . 1 1 3 LYS HD2 H -6.037 3.264 4.169 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HD2 . . . . . . . . . c30497_6e5i 1 . 5 . 1816 . 1 1 3 LYS HD3 H -4.621 3.029 5.193 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HD3 . . . . . . . . . c30497_6e5i 1 . 5 . 1817 . 1 1 3 LYS HE2 H -6.247 5.562 4.966 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HE2 . . . . . . . . . c30497_6e5i 1 . 5 . 1818 . 1 1 3 LYS HE3 H -6.301 4.412 6.300 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HE3 . . . . . . . . . c30497_6e5i 1 . 5 . 1819 . 1 1 3 LYS HG2 H -3.811 3.469 3.011 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HG2 . . . . . . . . . c30497_6e5i 1 . 5 . 1820 . 1 1 3 LYS HG3 H -3.546 4.938 3.948 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HG3 . . . . . . . . . c30497_6e5i 1 . 5 . 1821 . 1 1 3 LYS HZ1 H -3.928 6.000 5.486 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HZ1 . . . . . . . . . c30497_6e5i 1 . 5 . 1822 . 1 1 3 LYS HZ2 H -3.981 4.896 6.763 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HZ2 . . . . . . . . . c30497_6e5i 1 . 5 . 1823 . 1 1 3 LYS HZ3 H -4.907 6.306 6.829 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HZ3 . . . . . . . . . c30497_6e5i 1 . 5 . 1824 . 1 1 3 LYS N N -5.031 6.455 0.443 . . . 1.0 . . . . . . . . . . . . A . 3 LYS N . . . . . . . . . c30497_6e5i 1 . 5 . 1825 . 1 1 3 LYS NZ N -4.545 5.563 6.200 . . . 1.0 . . . . . . . . . . . . A . 3 LYS NZ . . . . . . . . . c30497_6e5i 1 . 5 . 1826 . 1 1 3 LYS O O -2.091 4.726 1.273 . . . 1.0 . . . . . . . . . . . . A . 3 LYS O . . . . . . . . . c30497_6e5i 1 . 5 . 1827 . 1 1 4 CYS C C -1.609 4.090 -1.563 . . . 1.0 . . . . . . . . . . . . A . 4 CYS C . . . . . . . . . c30497_6e5i 1 . 5 . 1828 . 1 1 4 CYS CA C -2.793 3.313 -1.005 . . . 1.0 . . . . . . . . . . . . A . 4 CYS CA . . . . . . . . . c30497_6e5i 1 . 5 . 1829 . 1 1 4 CYS CB C -3.579 2.653 -2.140 . . . 1.0 . . . . . . . . . . . . A . 4 CYS CB . . . . . . . . . c30497_6e5i 1 . 5 . 1830 . 1 1 4 CYS H H -4.588 4.327 -0.535 . . . 1.0 . . . . . . . . . . . . A . 4 CYS H . . . . . . . . . c30497_6e5i 1 . 5 . 1831 . 1 1 4 CYS HA H -2.429 2.553 -0.335 . . . 1.0 . . . . . . . . . . . . A . 4 CYS HA . . . . . . . . . c30497_6e5i 1 . 5 . 1832 . 1 1 4 CYS HB2 H -4.408 2.104 -1.721 . . . 1.0 . . . . . . . . . . . . A . 4 CYS HB2 . . . . . . . . . c30497_6e5i 1 . 5 . 1833 . 1 1 4 CYS HB3 H -3.960 3.422 -2.797 . . . 1.0 . . . . . . . . . . . . A . 4 CYS HB3 . . . . . . . . . c30497_6e5i 1 . 5 . 1834 . 1 1 4 CYS N N -3.657 4.206 -0.249 . . . 1.0 . . . . . . . . . . . . A . 4 CYS N . . . . . . . . . c30497_6e5i 1 . 5 . 1835 . 1 1 4 CYS O O -0.471 3.619 -1.546 . . . 1.0 . . . . . . . . . . . . A . 4 CYS O . . . . . . . . . c30497_6e5i 1 . 5 . 1836 . 1 1 4 CYS SG S -2.603 1.493 -3.153 . . . 1.0 . . . . . . . . . . . . A . 4 CYS SG . . . . . . . . . c30497_6e5i 1 . 5 . 1837 . 1 1 5 LYS C C 0.100 6.622 -1.456 . . . 1.0 . . . . . . . . . . . . A . 5 LYS C . . . . . . . . . c30497_6e5i 1 . 5 . 1838 . 1 1 5 LYS CA C -0.863 6.182 -2.554 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CA . . . . . . . . . c30497_6e5i 1 . 5 . 1839 . 1 1 5 LYS CB C -1.513 7.404 -3.206 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CB . . . . . . . . . c30497_6e5i 1 . 5 . 1840 . 1 1 5 LYS CD C -1.216 9.645 -4.285 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CD . . . . . . . . . c30497_6e5i 1 . 5 . 1841 . 1 1 5 LYS CE C -0.221 10.654 -4.829 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CE . . . . . . . . . c30497_6e5i 1 . 5 . 1842 . 1 1 5 LYS CG C -0.517 8.398 -3.778 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CG . . . . . . . . . c30497_6e5i 1 . 5 . 1843 . 1 1 5 LYS H H -2.811 5.623 -1.979 . . . 1.0 . . . . . . . . . . . . A . 5 LYS H . . . . . . . . . c30497_6e5i 1 . 5 . 1844 . 1 1 5 LYS HA H -0.314 5.633 -3.302 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HA . . . . . . . . . c30497_6e5i 1 . 5 . 1845 . 1 1 5 LYS HB2 H -2.155 7.071 -4.008 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HB2 . . . . . . . . . c30497_6e5i 1 . 5 . 1846 . 1 1 5 LYS HB3 H -2.113 7.914 -2.466 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HB3 . . . . . . . . . c30497_6e5i 1 . 5 . 1847 . 1 1 5 LYS HD2 H -1.903 9.367 -5.071 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HD2 . . . . . . . . . c30497_6e5i 1 . 5 . 1848 . 1 1 5 LYS HD3 H -1.764 10.095 -3.469 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HD3 . . . . . . . . . c30497_6e5i 1 . 5 . 1849 . 1 1 5 LYS HE2 H 0.518 10.854 -4.071 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HE2 . . . . . . . . . c30497_6e5i 1 . 5 . 1850 . 1 1 5 LYS HE3 H 0.261 10.232 -5.700 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HE3 . . . . . . . . . c30497_6e5i 1 . 5 . 1851 . 1 1 5 LYS HG2 H 0.183 8.676 -3.006 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HG2 . . . . . . . . . c30497_6e5i 1 . 5 . 1852 . 1 1 5 LYS HG3 H 0.011 7.935 -4.598 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HG3 . . . . . . . . . c30497_6e5i 1 . 5 . 1853 . 1 1 5 LYS HZ1 H -0.177 12.588 -5.608 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HZ1 . . . . . . . . . c30497_6e5i 1 . 5 . 1854 . 1 1 5 LYS HZ2 H -1.315 12.371 -4.378 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HZ2 . . . . . . . . . c30497_6e5i 1 . 5 . 1855 . 1 1 5 LYS HZ3 H -1.615 11.755 -5.923 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HZ3 . . . . . . . . . c30497_6e5i 1 . 5 . 1856 . 1 1 5 LYS N N -1.887 5.305 -2.016 . . . 1.0 . . . . . . . . . . . . A . 5 LYS N . . . . . . . . . c30497_6e5i 1 . 5 . 1857 . 1 1 5 LYS NZ N -0.877 11.930 -5.211 . . . 1.0 . . . . . . . . . . . . A . 5 LYS NZ . . . . . . . . . c30497_6e5i 1 . 5 . 1858 . 1 1 5 LYS O O 1.310 6.675 -1.666 . . . 1.0 . . . . . . . . . . . . A . 5 LYS O . . . . . . . . . c30497_6e5i 1 . 5 . 1859 . 1 1 6 GLU C C 1.230 6.214 1.375 . . . 1.0 . . . . . . . . . . . . A . 6 GLU C . . . . . . . . . c30497_6e5i 1 . 5 . 1860 . 1 1 6 GLU CA C 0.383 7.362 0.841 . . . 1.0 . . . . . . . . . . . . A . 6 GLU CA . . . . . . . . . c30497_6e5i 1 . 5 . 1861 . 1 1 6 GLU CB C -0.474 7.947 1.964 . . . 1.0 . . . . . . . . . . . . A . 6 GLU CB . . . . . . . . . c30497_6e5i 1 . 5 . 1862 . 1 1 6 GLU CD C -1.794 9.946 2.746 . . . 1.0 . . . . . . . . . . . . A . 6 GLU CD . . . . . . . . . c30497_6e5i 1 . 5 . 1863 . 1 1 6 GLU CG C -1.249 9.187 1.556 . . . 1.0 . . . . . . . . . . . . A . 6 GLU CG . . . . . . . . . c30497_6e5i 1 . 5 . 1864 . 1 1 6 GLU H H -1.417 6.853 -0.165 . . . 1.0 . . . . . . . . . . . . A . 6 GLU H . . . . . . . . . c30497_6e5i 1 . 5 . 1865 . 1 1 6 GLU HA H 1.047 8.130 0.474 . . . 1.0 . . . . . . . . . . . . A . 6 GLU HA . . . . . . . . . c30497_6e5i 1 . 5 . 1866 . 1 1 6 GLU HB2 H -1.182 7.199 2.288 . . . 1.0 . . . . . . . . . . . . A . 6 GLU HB2 . . . . . . . . . c30497_6e5i 1 . 5 . 1867 . 1 1 6 GLU HB3 H 0.167 8.205 2.794 . . . 1.0 . . . . . . . . . . . . A . 6 GLU HB3 . . . . . . . . . c30497_6e5i 1 . 5 . 1868 . 1 1 6 GLU HG2 H -0.595 9.841 1.000 . . . 1.0 . . . . . . . . . . . . A . 6 GLU HG2 . . . . . . . . . c30497_6e5i 1 . 5 . 1869 . 1 1 6 GLU HG3 H -2.076 8.890 0.928 . . . 1.0 . . . . . . . . . . . . A . 6 GLU HG3 . . . . . . . . . c30497_6e5i 1 . 5 . 1870 . 1 1 6 GLU N N -0.442 6.924 -0.280 . . . 1.0 . . . . . . . . . . . . A . 6 GLU N . . . . . . . . . c30497_6e5i 1 . 5 . 1871 . 1 1 6 GLU O O 2.361 6.419 1.813 . . . 1.0 . . . . . . . . . . . . A . 6 GLU O . . . . . . . . . c30497_6e5i 1 . 5 . 1872 . 1 1 6 GLU OE1 O -1.277 11.041 3.052 . . . 1.0 . . . . . . . . . . . . A . 6 GLU OE1 . . . . . . . . . c30497_6e5i 1 . 5 . 1873 . 1 1 6 GLU OE2 O -2.735 9.442 3.393 . . . 1.0 . . . . . . . . . . . . A . 6 GLU OE2 . . . . . . . . . c30497_6e5i 1 . 5 . 1874 . 1 1 7 LEU C C 2.531 3.533 0.758 . . . 1.0 . . . . . . . . . . . . A . 7 LEU C . . . . . . . . . c30497_6e5i 1 . 5 . 1875 . 1 1 7 LEU CA C 1.417 3.825 1.751 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CA . . . . . . . . . c30497_6e5i 1 . 5 . 1876 . 1 1 7 LEU CB C 0.478 2.622 1.855 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CB . . . . . . . . . c30497_6e5i 1 . 5 . 1877 . 1 1 7 LEU CD1 C -1.602 1.606 2.827 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CD1 . . . . . . . . . c30497_6e5i 1 . 5 . 1878 . 1 1 7 LEU CD2 C 0.142 2.543 4.339 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CD2 . . . . . . . . . c30497_6e5i 1 . 5 . 1879 . 1 1 7 LEU CG C -0.547 2.688 2.991 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CG . . . . . . . . . c30497_6e5i 1 . 5 . 1880 . 1 1 7 LEU H H -0.254 4.919 1.048 . . . 1.0 . . . . . . . . . . . . A . 7 LEU H . . . . . . . . . c30497_6e5i 1 . 5 . 1881 . 1 1 7 LEU HA H 1.854 4.020 2.717 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HA . . . . . . . . . c30497_6e5i 1 . 5 . 1882 . 1 1 7 LEU HB2 H -0.056 2.531 0.920 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HB2 . . . . . . . . . c30497_6e5i 1 . 5 . 1883 . 1 1 7 LEU HB3 H 1.080 1.738 1.993 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HB3 . . . . . . . . . c30497_6e5i 1 . 5 . 1884 . 1 1 7 LEU HD11 H -1.131 0.636 2.845 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD11 . . . . . . . . . c30497_6e5i 1 . 5 . 1885 . 1 1 7 LEU HD12 H -2.115 1.741 1.886 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD12 . . . . . . . . . c30497_6e5i 1 . 5 . 1886 . 1 1 7 LEU HD13 H -2.317 1.674 3.635 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD13 . . . . . . . . . c30497_6e5i 1 . 5 . 1887 . 1 1 7 LEU HD21 H 0.866 3.332 4.461 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD21 . . . . . . . . . c30497_6e5i 1 . 5 . 1888 . 1 1 7 LEU HD22 H 0.640 1.584 4.383 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD22 . . . . . . . . . c30497_6e5i 1 . 5 . 1889 . 1 1 7 LEU HD23 H -0.593 2.602 5.126 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD23 . . . . . . . . . c30497_6e5i 1 . 5 . 1890 . 1 1 7 LEU HG H -1.043 3.650 2.969 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HG . . . . . . . . . c30497_6e5i 1 . 5 . 1891 . 1 1 7 LEU N N 0.679 5.012 1.345 . . . 1.0 . . . . . . . . . . . . A . 7 LEU N . . . . . . . . . c30497_6e5i 1 . 5 . 1892 . 1 1 7 LEU O O 3.658 3.221 1.143 . . . 1.0 . . . . . . . . . . . . A . 7 LEU O . . . . . . . . . c30497_6e5i 1 . 5 . 1893 . 1 1 8 LYS C C 4.291 4.481 -1.486 . . . 1.0 . . . . . . . . . . . . A . 8 LYS C . . . . . . . . . c30497_6e5i 1 . 5 . 1894 . 1 1 8 LYS CA C 3.174 3.445 -1.586 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CA . . . . . . . . . c30497_6e5i 1 . 5 . 1895 . 1 1 8 LYS CB C 2.458 3.522 -2.946 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CB . . . . . . . . . c30497_6e5i 1 . 5 . 1896 . 1 1 8 LYS CD C 4.245 4.221 -4.588 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CD . . . . . . . . . c30497_6e5i 1 . 5 . 1897 . 1 1 8 LYS CE C 5.032 3.827 -5.825 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CE . . . . . . . . . c30497_6e5i 1 . 5 . 1898 . 1 1 8 LYS CG C 3.305 3.112 -4.145 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CG . . . . . . . . . c30497_6e5i 1 . 5 . 1899 . 1 1 8 LYS H H 1.279 3.877 -0.759 . . . 1.0 . . . . . . . . . . . . A . 8 LYS H . . . . . . . . . c30497_6e5i 1 . 5 . 1900 . 1 1 8 LYS HA H 3.599 2.462 -1.464 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HA . . . . . . . . . c30497_6e5i 1 . 5 . 1901 . 1 1 8 LYS HB2 H 1.593 2.878 -2.914 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HB2 . . . . . . . . . c30497_6e5i 1 . 5 . 1902 . 1 1 8 LYS HB3 H 2.127 4.539 -3.100 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HB3 . . . . . . . . . c30497_6e5i 1 . 5 . 1903 . 1 1 8 LYS HD2 H 3.666 5.104 -4.809 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HD2 . . . . . . . . . c30497_6e5i 1 . 5 . 1904 . 1 1 8 LYS HD3 H 4.935 4.433 -3.785 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HD3 . . . . . . . . . c30497_6e5i 1 . 5 . 1905 . 1 1 8 LYS HE2 H 5.693 4.638 -6.090 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HE2 . . . . . . . . . c30497_6e5i 1 . 5 . 1906 . 1 1 8 LYS HE3 H 5.615 2.947 -5.601 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HE3 . . . . . . . . . c30497_6e5i 1 . 5 . 1907 . 1 1 8 LYS HG2 H 3.891 2.247 -3.877 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HG2 . . . . . . . . . c30497_6e5i 1 . 5 . 1908 . 1 1 8 LYS HG3 H 2.648 2.860 -4.965 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HG3 . . . . . . . . . c30497_6e5i 1 . 5 . 1909 . 1 1 8 LYS HZ1 H 4.707 3.325 -7.823 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ1 . . . . . . . . . c30497_6e5i 1 . 5 . 1910 . 1 1 8 LYS HZ2 H 3.534 4.358 -7.176 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ2 . . . . . . . . . c30497_6e5i 1 . 5 . 1911 . 1 1 8 LYS HZ3 H 3.536 2.721 -6.766 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ3 . . . . . . . . . c30497_6e5i 1 . 5 . 1912 . 1 1 8 LYS N N 2.206 3.650 -0.522 . . . 1.0 . . . . . . . . . . . . A . 8 LYS N . . . . . . . . . c30497_6e5i 1 . 5 . 1913 . 1 1 8 LYS NZ N 4.141 3.537 -6.978 . . . 1.0 . . . . . . . . . . . . A . 8 LYS NZ . . . . . . . . . c30497_6e5i 1 . 5 . 1914 . 1 1 8 LYS O O 5.466 4.166 -1.671 . . . 1.0 . . . . . . . . . . . . A . 8 LYS O . . . . . . . . . c30497_6e5i 1 . 5 . 1915 . 1 1 9 LYS C C 5.771 6.519 0.212 . . . 1.0 . . . . . . . . . . . . A . 9 LYS C . . . . . . . . . c30497_6e5i 1 . 5 . 1916 . 1 1 9 LYS CA C 4.892 6.785 -1.008 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CA . . . . . . . . . c30497_6e5i 1 . 5 . 1917 . 1 1 9 LYS CB C 4.175 8.129 -0.853 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CB . . . . . . . . . c30497_6e5i 1 . 5 . 1918 . 1 1 9 LYS CD C 4.358 10.605 -0.452 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CD . . . . . . . . . c30497_6e5i 1 . 5 . 1919 . 1 1 9 LYS CE C 5.300 11.768 -0.176 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CE . . . . . . . . . c30497_6e5i 1 . 5 . 1920 . 1 1 9 LYS CG C 5.117 9.307 -0.662 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CG . . . . . . . . . c30497_6e5i 1 . 5 . 1921 . 1 1 9 LYS H H 2.965 5.920 -1.089 . . . 1.0 . . . . . . . . . . . . A . 9 LYS H . . . . . . . . . c30497_6e5i 1 . 5 . 1922 . 1 1 9 LYS HA H 5.515 6.814 -1.887 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HA . . . . . . . . . c30497_6e5i 1 . 5 . 1923 . 1 1 9 LYS HB2 H 3.582 8.310 -1.737 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HB2 . . . . . . . . . c30497_6e5i 1 . 5 . 1924 . 1 1 9 LYS HB3 H 3.520 8.078 0.002 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HB3 . . . . . . . . . c30497_6e5i 1 . 5 . 1925 . 1 1 9 LYS HD2 H 3.786 10.824 -1.341 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HD2 . . . . . . . . . c30497_6e5i 1 . 5 . 1926 . 1 1 9 LYS HD3 H 3.688 10.486 0.387 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HD3 . . . . . . . . . c30497_6e5i 1 . 5 . 1927 . 1 1 9 LYS HE2 H 4.712 12.659 -0.019 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HE2 . . . . . . . . . c30497_6e5i 1 . 5 . 1928 . 1 1 9 LYS HE3 H 5.864 11.551 0.719 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HE3 . . . . . . . . . c30497_6e5i 1 . 5 . 1929 . 1 1 9 LYS HG2 H 5.740 9.122 0.201 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HG2 . . . . . . . . . c30497_6e5i 1 . 5 . 1930 . 1 1 9 LYS HG3 H 5.737 9.402 -1.541 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HG3 . . . . . . . . . c30497_6e5i 1 . 5 . 1931 . 1 1 9 LYS HZ1 H 6.863 12.817 -1.079 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HZ1 . . . . . . . . . c30497_6e5i 1 . 5 . 1932 . 1 1 9 LYS HZ2 H 5.726 12.212 -2.171 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HZ2 . . . . . . . . . c30497_6e5i 1 . 5 . 1933 . 1 1 9 LYS HZ3 H 6.841 11.169 -1.451 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HZ3 . . . . . . . . . c30497_6e5i 1 . 5 . 1934 . 1 1 9 LYS N N 3.921 5.716 -1.183 . . . 1.0 . . . . . . . . . . . . A . 9 LYS N . . . . . . . . . c30497_6e5i 1 . 5 . 1935 . 1 1 9 LYS NZ N 6.247 12.007 -1.297 . . . 1.0 . . . . . . . . . . . . A . 9 LYS NZ . . . . . . . . . c30497_6e5i 1 . 5 . 1936 . 1 1 9 LYS O O 6.994 6.660 0.154 . . . 1.0 . . . . . . . . . . . . A . 9 LYS O . . . . . . . . . c30497_6e5i 1 . 5 . 1937 . 1 1 10 ARG C C 6.795 4.701 2.462 . . . 1.0 . . . . . . . . . . . . A . 10 ARG C . . . . . . . . . c30497_6e5i 1 . 5 . 1938 . 1 1 10 ARG CA C 5.827 5.875 2.565 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CA . . . . . . . . . c30497_6e5i 1 . 5 . 1939 . 1 1 10 ARG CB C 4.806 5.609 3.673 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CB . . . . . . . . . c30497_6e5i 1 . 5 . 1940 . 1 1 10 ARG CD C 4.368 4.964 6.057 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CD . . . . . . . . . c30497_6e5i 1 . 5 . 1941 . 1 1 10 ARG CG C 5.430 5.204 4.998 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CG . . . . . . . . . c30497_6e5i 1 . 5 . 1942 . 1 1 10 ARG CZ C 4.180 3.978 8.305 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CZ . . . . . . . . . c30497_6e5i 1 . 5 . 1943 . 1 1 10 ARG H H 4.161 5.989 1.268 . . . 1.0 . . . . . . . . . . . . A . 10 ARG H . . . . . . . . . c30497_6e5i 1 . 5 . 1944 . 1 1 10 ARG HA H 6.384 6.764 2.814 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HA . . . . . . . . . c30497_6e5i 1 . 5 . 1945 . 1 1 10 ARG HB2 H 4.223 6.502 3.830 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HB2 . . . . . . . . . c30497_6e5i 1 . 5 . 1946 . 1 1 10 ARG HB3 H 4.148 4.813 3.352 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HB3 . . . . . . . . . c30497_6e5i 1 . 5 . 1947 . 1 1 10 ARG HD2 H 3.981 5.919 6.381 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HD2 . . . . . . . . . c30497_6e5i 1 . 5 . 1948 . 1 1 10 ARG HD3 H 3.569 4.384 5.624 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HD3 . . . . . . . . . c30497_6e5i 1 . 5 . 1949 . 1 1 10 ARG HE H 5.834 3.942 7.177 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HE . . . . . . . . . c30497_6e5i 1 . 5 . 1950 . 1 1 10 ARG HG2 H 5.997 4.294 4.856 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HG2 . . . . . . . . . c30497_6e5i 1 . 5 . 1951 . 1 1 10 ARG HG3 H 6.087 5.994 5.329 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HG3 . . . . . . . . . c30497_6e5i 1 . 5 . 1952 . 1 1 10 ARG HH11 H 2.386 4.203 9.217 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HH11 . . . . . . . . . c30497_6e5i 1 . 5 . 1953 . 1 1 10 ARG HH12 H 2.523 4.943 7.657 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HH12 . . . . . . . . . c30497_6e5i 1 . 5 . 1954 . 1 1 10 ARG HH21 H 5.665 2.962 9.234 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HH21 . . . . . . . . . c30497_6e5i 1 . 5 . 1955 . 1 1 10 ARG HH22 H 4.178 3.073 10.119 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HH22 . . . . . . . . . c30497_6e5i 1 . 5 . 1956 . 1 1 10 ARG N N 5.135 6.119 1.305 . . . 1.0 . . . . . . . . . . . . A . 10 ARG N . . . . . . . . . c30497_6e5i 1 . 5 . 1957 . 1 1 10 ARG NE N 4.897 4.250 7.219 . . . 1.0 . . . . . . . . . . . . A . 10 ARG NE . . . . . . . . . c30497_6e5i 1 . 5 . 1958 . 1 1 10 ARG NH1 N 2.930 4.407 8.400 . . . 1.0 . . . . . . . . . . . . A . 10 ARG NH1 . . . . . . . . . c30497_6e5i 1 . 5 . 1959 . 1 1 10 ARG NH2 N 4.717 3.284 9.298 . . . 1.0 . . . . . . . . . . . . A . 10 ARG NH2 . . . . . . . . . c30497_6e5i 1 . 5 . 1960 . 1 1 10 ARG O O 7.970 4.819 2.808 . . . 1.0 . . . . . . . . . . . . A . 10 ARG O . . . . . . . . . c30497_6e5i 1 . 5 . 1961 . 1 1 11 TYR C C 7.945 2.229 0.709 . . . 1.0 . . . . . . . . . . . . A . 11 TYR C . . . . . . . . . c30497_6e5i 1 . 5 . 1962 . 1 1 11 TYR CA C 7.087 2.348 1.960 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CA . . . . . . . . . c30497_6e5i 1 . 5 . 1963 . 1 1 11 TYR CB C 6.174 1.134 2.084 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CB . . . . . . . . . c30497_6e5i 1 . 5 . 1964 . 1 1 11 TYR CD1 C 6.192 0.410 4.494 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CD1 . . . . . . . . . c30497_6e5i 1 . 5 . 1965 . 1 1 11 TYR CD2 C 4.235 1.482 3.663 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CD2 . . . . . . . . . c30497_6e5i 1 . 5 . 1966 . 1 1 11 TYR CE1 C 5.603 0.284 5.735 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CE1 . . . . . . . . . c30497_6e5i 1 . 5 . 1967 . 1 1 11 TYR CE2 C 3.640 1.362 4.902 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CE2 . . . . . . . . . c30497_6e5i 1 . 5 . 1968 . 1 1 11 TYR CG C 5.520 1.008 3.438 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CG . . . . . . . . . c30497_6e5i 1 . 5 . 1969 . 1 1 11 TYR CZ C 4.327 0.763 5.936 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CZ . . . . . . . . . c30497_6e5i 1 . 5 . 1970 . 1 1 11 TYR H H 5.385 3.563 1.617 . . . 1.0 . . . . . . . . . . . . A . 11 TYR H . . . . . . . . . c30497_6e5i 1 . 5 . 1971 . 1 1 11 TYR HA H 7.739 2.372 2.818 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HA . . . . . . . . . c30497_6e5i 1 . 5 . 1972 . 1 1 11 TYR HB2 H 5.394 1.204 1.342 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HB2 . . . . . . . . . c30497_6e5i 1 . 5 . 1973 . 1 1 11 TYR HB3 H 6.752 0.241 1.910 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HB3 . . . . . . . . . c30497_6e5i 1 . 5 . 1974 . 1 1 11 TYR HD1 H 7.193 0.037 4.334 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HD1 . . . . . . . . . c30497_6e5i 1 . 5 . 1975 . 1 1 11 TYR HD2 H 3.699 1.953 2.851 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HD2 . . . . . . . . . c30497_6e5i 1 . 5 . 1976 . 1 1 11 TYR HE1 H 6.143 -0.184 6.543 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HE1 . . . . . . . . . c30497_6e5i 1 . 5 . 1977 . 1 1 11 TYR HE2 H 2.641 1.737 5.058 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HE2 . . . . . . . . . c30497_6e5i 1 . 5 . 1978 . 1 1 11 TYR HH H 4.371 0.890 7.859 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HH . . . . . . . . . c30497_6e5i 1 . 5 . 1979 . 1 1 11 TYR N N 6.302 3.573 1.976 . . . 1.0 . . . . . . . . . . . . A . 11 TYR N . . . . . . . . . c30497_6e5i 1 . 5 . 1980 . 1 1 11 TYR O O 8.752 1.304 0.590 . . . 1.0 . . . . . . . . . . . . A . 11 TYR O . . . . . . . . . c30497_6e5i 1 . 5 . 1981 . 1 1 11 TYR OH O 3.735 0.639 7.172 . . . 1.0 . . . . . . . . . . . . A . 11 TYR OH . . . . . . . . . c30497_6e5i 1 . 5 . 1982 . 1 1 12 ORN C C 9.478 -0.445 -2.747 . . . 1.0 . . . . . . . . . . . . A . 12 ORN C . . . . . . . . . c30497_6e5i 1 . 5 . 1983 . 1 1 12 ORN CA C 10.060 0.935 -3.044 . . . 1.0 . . . . . . . . . . . . A . 12 ORN CA . . . . . . . . . c30497_6e5i 1 . 5 . 1984 . 1 1 12 ORN CB C 8.961 1.864 -3.576 . . . 1.0 . . . . . . . . . . . . A . 12 ORN CB . . . . . . . . . c30497_6e5i 1 . 5 . 1985 . 1 1 12 ORN CD C 8.532 3.160 -1.471 . . . 1.0 . . . . . . . . . . . . A . 12 ORN CD . . . . . . . . . c30497_6e5i 1 . 5 . 1986 . 1 1 12 ORN CG C 7.930 2.249 -2.527 . . . 1.0 . . . . . . . . . . . . A . 12 ORN CG . . . . . . . . . c30497_6e5i 1 . 5 . 1987 . 1 1 12 ORN H H 10.782 0.404 -4.922 . . . 1.0 . . . . . . . . . . . . A . 12 ORN H . . . . . . . . . c30497_6e5i 1 . 5 . 1988 . 1 1 12 ORN HA H 10.470 1.346 -2.135 . . . 1.0 . . . . . . . . . . . . A . 12 ORN HA . . . . . . . . . c30497_6e5i 1 . 5 . 1989 . 1 1 12 ORN HB2 H 8.449 1.370 -4.388 . . . 1.0 . . . . . . . . . . . . A . 12 ORN HB2 . . . . . . . . . c30497_6e5i 1 . 5 . 1990 . 1 1 12 ORN HB3 H 9.419 2.768 -3.947 . . . 1.0 . . . . . . . . . . . . A . 12 ORN HB3 . . . . . . . . . c30497_6e5i 1 . 5 . 1991 . 1 1 12 ORN HD2 H 8.552 4.167 -1.854 . . . 1.0 . . . . . . . . . . . . A . 12 ORN HD2 . . . . . . . . . c30497_6e5i 1 . 5 . 1992 . 1 1 12 ORN HD3 H 9.539 2.837 -1.264 . . . 1.0 . . . . . . . . . . . . A . 12 ORN HD3 . . . . . . . . . c30497_6e5i 1 . 5 . 1993 . 1 1 12 ORN HE1 H 7.095 3.842 -0.094 . . . 1.0 . . . . . . . . . . . . A . 12 ORN HE1 . . . . . . . . . c30497_6e5i 1 . 5 . 1994 . 1 1 12 ORN HG2 H 7.563 1.354 -2.050 . . . 1.0 . . . . . . . . . . . . A . 12 ORN HG2 . . . . . . . . . c30497_6e5i 1 . 5 . 1995 . 1 1 12 ORN HG3 H 7.112 2.762 -3.008 . . . 1.0 . . . . . . . . . . . . A . 12 ORN HG3 . . . . . . . . . c30497_6e5i 1 . 5 . 1996 . 1 1 12 ORN N N 11.149 0.816 -4.040 . . . 1.0 . . . . . . . . . . . . A . 12 ORN N . . . . . . . . . c30497_6e5i 1 . 5 . 1997 . 1 1 12 ORN NE N 7.771 3.145 -0.228 . . . 1.0 . . . . . . . . . . . . A . 12 ORN NE . . . . . . . . . c30497_6e5i 1 . 5 . 1998 . 1 1 12 ORN O O 9.571 -1.352 -3.574 . . . 1.0 . . . . . . . . . . . . A . 12 ORN O . . . . . . . . . c30497_6e5i 1 . 5 . 1999 . 1 1 13 CYS C C 6.967 -2.021 -2.020 . . . 1.0 . . . . . . . . . . . . A . 13 CYS C . . . . . . . . . c30497_6e5i 1 . 5 . 2000 . 1 1 13 CYS CA C 8.240 -1.856 -1.206 . . . 1.0 . . . . . . . . . . . . A . 13 CYS CA . . . . . . . . . c30497_6e5i 1 . 5 . 2001 . 1 1 13 CYS CB C 7.902 -1.890 0.282 . . . 1.0 . . . . . . . . . . . . A . 13 CYS CB . . . . . . . . . c30497_6e5i 1 . 5 . 2002 . 1 1 13 CYS H H 8.910 0.127 -0.908 . . . 1.0 . . . . . . . . . . . . A . 13 CYS H . . . . . . . . . c30497_6e5i 1 . 5 . 2003 . 1 1 13 CYS HA H 8.911 -2.669 -1.436 . . . 1.0 . . . . . . . . . . . . A . 13 CYS HA . . . . . . . . . c30497_6e5i 1 . 5 . 2004 . 1 1 13 CYS HB2 H 7.249 -1.065 0.511 . . . 1.0 . . . . . . . . . . . . A . 13 CYS HB2 . . . . . . . . . c30497_6e5i 1 . 5 . 2005 . 1 1 13 CYS HB3 H 7.391 -2.816 0.505 . . . 1.0 . . . . . . . . . . . . A . 13 CYS HB3 . . . . . . . . . c30497_6e5i 1 . 5 . 2006 . 1 1 13 CYS N N 8.899 -0.609 -1.560 . . . 1.0 . . . . . . . . . . . . A . 13 CYS N . . . . . . . . . c30497_6e5i 1 . 5 . 2007 . 1 1 13 CYS O O 6.331 -1.036 -2.399 . . . 1.0 . . . . . . . . . . . . A . 13 CYS O . . . . . . . . . c30497_6e5i 1 . 5 . 2008 . 1 1 13 CYS SG S 9.347 -1.775 1.383 . . . 1.0 . . . . . . . . . . . . A . 13 CYS SG . . . . . . . . . c30497_6e5i 1 . 5 . 2009 . 1 1 14 GLU C C 4.188 -3.495 -2.189 . . . 1.0 . . . . . . . . . . . . A . 14 GLU C . . . . . . . . . c30497_6e5i 1 . 5 . 2010 . 1 1 14 GLU CA C 5.421 -3.560 -3.068 . . . 1.0 . . . . . . . . . . . . A . 14 GLU CA . . . . . . . . . c30497_6e5i 1 . 5 . 2011 . 1 1 14 GLU CB C 5.518 -4.954 -3.684 . . . 1.0 . . . . . . . . . . . . A . 14 GLU CB . . . . . . . . . c30497_6e5i 1 . 5 . 2012 . 1 1 14 GLU CD C 6.823 -6.602 -5.046 . . . 1.0 . . . . . . . . . . . . A . 14 GLU CD . . . . . . . . . c30497_6e5i 1 . 5 . 2013 . 1 1 14 GLU CG C 6.761 -5.187 -4.521 . . . 1.0 . . . . . . . . . . . . A . 14 GLU CG . . . . . . . . . c30497_6e5i 1 . 5 . 2014 . 1 1 14 GLU H H 7.129 -4.006 -1.914 . . . 1.0 . . . . . . . . . . . . A . 14 GLU H . . . . . . . . . c30497_6e5i 1 . 5 . 2015 . 1 1 14 GLU HA H 5.338 -2.823 -3.851 . . . 1.0 . . . . . . . . . . . . A . 14 GLU HA . . . . . . . . . c30497_6e5i 1 . 5 . 2016 . 1 1 14 GLU HB2 H 5.513 -5.680 -2.889 . . . 1.0 . . . . . . . . . . . . A . 14 GLU HB2 . . . . . . . . . c30497_6e5i 1 . 5 . 2017 . 1 1 14 GLU HB3 H 4.653 -5.116 -4.312 . . . 1.0 . . . . . . . . . . . . A . 14 GLU HB3 . . . . . . . . . c30497_6e5i 1 . 5 . 2018 . 1 1 14 GLU HG2 H 6.750 -4.508 -5.361 . . . 1.0 . . . . . . . . . . . . A . 14 GLU HG2 . . . . . . . . . c30497_6e5i 1 . 5 . 2019 . 1 1 14 GLU HG3 H 7.635 -5.003 -3.916 . . . 1.0 . . . . . . . . . . . . A . 14 GLU HG3 . . . . . . . . . c30497_6e5i 1 . 5 . 2020 . 1 1 14 GLU N N 6.600 -3.263 -2.280 . . . 1.0 . . . . . . . . . . . . A . 14 GLU N . . . . . . . . . c30497_6e5i 1 . 5 . 2021 . 1 1 14 GLU O O 3.858 -4.461 -1.503 . . . 1.0 . . . . . . . . . . . . A . 14 GLU O . . . . . . . . . c30497_6e5i 1 . 5 . 2022 . 1 1 14 GLU OE1 O 7.281 -7.491 -4.302 . . . 1.0 . . . . . . . . . . . . A . 14 GLU OE1 . . . . . . . . . c30497_6e5i 1 . 5 . 2023 . 1 1 14 GLU OE2 O 6.441 -6.830 -6.216 . . . 1.0 . . . . . . . . . . . . A . 14 GLU OE2 . . . . . . . . . c30497_6e5i 1 . 5 . 2024 . 1 1 15 VAL C C 1.126 -2.668 -2.270 . . . 1.0 . . . . . . . . . . . . A . 15 VAL C . . . . . . . . . c30497_6e5i 1 . 5 . 2025 . 1 1 15 VAL CA C 2.304 -2.198 -1.435 . . . 1.0 . . . . . . . . . . . . A . 15 VAL CA . . . . . . . . . c30497_6e5i 1 . 5 . 2026 . 1 1 15 VAL CB C 2.076 -0.740 -0.986 . . . 1.0 . . . . . . . . . . . . A . 15 VAL CB . . . . . . . . . c30497_6e5i 1 . 5 . 2027 . 1 1 15 VAL CG1 C 0.794 -0.622 -0.174 . . . 1.0 . . . . . . . . . . . . A . 15 VAL CG1 . . . . . . . . . c30497_6e5i 1 . 5 . 2028 . 1 1 15 VAL CG2 C 3.264 -0.234 -0.182 . . . 1.0 . . . . . . . . . . . . A . 15 VAL CG2 . . . . . . . . . c30497_6e5i 1 . 5 . 2029 . 1 1 15 VAL H H 3.861 -1.607 -2.730 . . . 1.0 . . . . . . . . . . . . A . 15 VAL H . . . . . . . . . c30497_6e5i 1 . 5 . 2030 . 1 1 15 VAL HA H 2.378 -2.820 -0.554 . . . 1.0 . . . . . . . . . . . . A . 15 VAL HA . . . . . . . . . c30497_6e5i 1 . 5 . 2031 . 1 1 15 VAL HB H 1.976 -0.125 -1.867 . . . 1.0 . . . . . . . . . . . . A . 15 VAL HB . . . . . . . . . c30497_6e5i 1 . 5 . 2032 . 1 1 15 VAL HG11 H 0.868 -1.245 0.705 . . . 1.0 . . . . . . . . . . . . A . 15 VAL HG11 . . . . . . . . . c30497_6e5i 1 . 5 . 2033 . 1 1 15 VAL HG12 H -0.043 -0.946 -0.776 . . . 1.0 . . . . . . . . . . . . A . 15 VAL HG12 . . . . . . . . . c30497_6e5i 1 . 5 . 2034 . 1 1 15 VAL HG13 H 0.649 0.405 0.123 . . . 1.0 . . . . . . . . . . . . A . 15 VAL HG13 . . . . . . . . . c30497_6e5i 1 . 5 . 2035 . 1 1 15 VAL HG21 H 3.450 -0.903 0.642 . . . 1.0 . . . . . . . . . . . . A . 15 VAL HG21 . . . . . . . . . c30497_6e5i 1 . 5 . 2036 . 1 1 15 VAL HG22 H 3.044 0.753 0.199 . . . 1.0 . . . . . . . . . . . . A . 15 VAL HG22 . . . . . . . . . c30497_6e5i 1 . 5 . 2037 . 1 1 15 VAL HG23 H 4.137 -0.190 -0.817 . . . 1.0 . . . . . . . . . . . . A . 15 VAL HG23 . . . . . . . . . c30497_6e5i 1 . 5 . 2038 . 1 1 15 VAL N N 3.527 -2.355 -2.194 . . . 1.0 . . . . . . . . . . . . A . 15 VAL N . . . . . . . . . c30497_6e5i 1 . 5 . 2039 . 1 1 15 VAL O O 0.633 -1.948 -3.137 . . . 1.0 . . . . . . . . . . . . A . 15 VAL O . . . . . . . . . c30497_6e5i 1 . 5 . 2040 . 1 1 16 ARG C C -1.710 -4.087 -2.098 . . . 1.0 . . . . . . . . . . . . A . 16 ARG C . . . . . . . . . c30497_6e5i 1 . 5 . 2041 . 1 1 16 ARG CA C -0.401 -4.476 -2.756 . . . 1.0 . . . . . . . . . . . . A . 16 ARG CA . . . . . . . . . c30497_6e5i 1 . 5 . 2042 . 1 1 16 ARG CB C -0.267 -5.996 -2.825 . . . 1.0 . . . . . . . . . . . . A . 16 ARG CB . . . . . . . . . c30497_6e5i 1 . 5 . 2043 . 1 1 16 ARG CD C 1.256 -5.978 -4.842 . . . 1.0 . . . . . . . . . . . . A . 16 ARG CD . . . . . . . . . c30497_6e5i 1 . 5 . 2044 . 1 1 16 ARG CG C 1.053 -6.475 -3.416 . . . 1.0 . . . . . . . . . . . . A . 16 ARG CG . . . . . . . . . c30497_6e5i 1 . 5 . 2045 . 1 1 16 ARG CZ C 0.436 -6.968 -6.952 . . . 1.0 . . . . . . . . . . . . A . 16 ARG CZ . . . . . . . . . c30497_6e5i 1 . 5 . 2046 . 1 1 16 ARG H H 1.132 -4.411 -1.303 . . . 1.0 . . . . . . . . . . . . A . 16 ARG H . . . . . . . . . c30497_6e5i 1 . 5 . 2047 . 1 1 16 ARG HA H -0.383 -4.073 -3.756 . . . 1.0 . . . . . . . . . . . . A . 16 ARG HA . . . . . . . . . c30497_6e5i 1 . 5 . 2048 . 1 1 16 ARG HB2 H -0.357 -6.397 -1.828 . . . 1.0 . . . . . . . . . . . . A . 16 ARG HB2 . . . . . . . . . c30497_6e5i 1 . 5 . 2049 . 1 1 16 ARG HB3 H -1.071 -6.388 -3.431 . . . 1.0 . . . . . . . . . . . . A . 16 ARG HB3 . . . . . . . . . c30497_6e5i 1 . 5 . 2050 . 1 1 16 ARG HD2 H 1.265 -4.899 -4.836 . . . 1.0 . . . . . . . . . . . . A . 16 ARG HD2 . . . . . . . . . c30497_6e5i 1 . 5 . 2051 . 1 1 16 ARG HD3 H 2.208 -6.341 -5.199 . . . 1.0 . . . . . . . . . . . . A . 16 ARG HD3 . . . . . . . . . c30497_6e5i 1 . 5 . 2052 . 1 1 16 ARG HE H -0.731 -6.336 -5.454 . . . 1.0 . . . . . . . . . . . . A . 16 ARG HE . . . . . . . . . c30497_6e5i 1 . 5 . 2053 . 1 1 16 ARG HG2 H 1.861 -6.107 -2.803 . . . 1.0 . . . . . . . . . . . . A . 16 ARG HG2 . . . . . . . . . c30497_6e5i 1 . 5 . 2054 . 1 1 16 ARG HG3 H 1.064 -7.554 -3.414 . . . 1.0 . . . . . . . . . . . . A . 16 ARG HG3 . . . . . . . . . c30497_6e5i 1 . 5 . 2055 . 1 1 16 ARG HH11 H 2.459 -6.867 -6.813 . . . 1.0 . . . . . . . . . . . . A . 16 ARG HH11 . . . . . . . . . c30497_6e5i 1 . 5 . 2056 . 1 1 16 ARG HH12 H 1.847 -7.545 -8.288 . . . 1.0 . . . . . . . . . . . . A . 16 ARG HH12 . . . . . . . . . c30497_6e5i 1 . 5 . 2057 . 1 1 16 ARG HH21 H -0.414 -7.735 -8.623 . . . 1.0 . . . . . . . . . . . . A . 16 ARG HH21 . . . . . . . . . c30497_6e5i 1 . 5 . 2058 . 1 1 16 ARG HH22 H -1.525 -7.207 -7.398 . . . 1.0 . . . . . . . . . . . . A . 16 ARG HH22 . . . . . . . . . c30497_6e5i 1 . 5 . 2059 . 1 1 16 ARG N N 0.701 -3.892 -2.020 . . . 1.0 . . . . . . . . . . . . A . 16 ARG N . . . . . . . . . c30497_6e5i 1 . 5 . 2060 . 1 1 16 ARG NE N 0.204 -6.440 -5.750 . . . 1.0 . . . . . . . . . . . . A . 16 ARG NE . . . . . . . . . c30497_6e5i 1 . 5 . 2061 . 1 1 16 ARG NH1 N 1.680 -7.140 -7.385 . . . 1.0 . . . . . . . . . . . . A . 16 ARG NH1 . . . . . . . . . c30497_6e5i 1 . 5 . 2062 . 1 1 16 ARG NH2 N -0.582 -7.334 -7.719 . . . 1.0 . . . . . . . . . . . . A . 16 ARG NH2 . . . . . . . . . c30497_6e5i 1 . 5 . 2063 . 1 1 16 ARG O O -2.027 -4.551 -1.000 . . . 1.0 . . . . . . . . . . . . A . 16 ARG O . . . . . . . . . c30497_6e5i 1 . 5 . 2064 . 1 1 17 CYS C C -4.873 -3.484 -2.749 . . . 1.0 . . . . . . . . . . . . A . 17 CYS C . . . . . . . . . c30497_6e5i 1 . 5 . 2065 . 1 1 17 CYS CA C -3.686 -2.697 -2.219 . . . 1.0 . . . . . . . . . . . . A . 17 CYS CA . . . . . . . . . c30497_6e5i 1 . 5 . 2066 . 1 1 17 CYS CB C -3.837 -1.221 -2.582 . . . 1.0 . . . . . . . . . . . . A . 17 CYS CB . . . . . . . . . c30497_6e5i 1 . 5 . 2067 . 1 1 17 CYS H H -2.147 -2.912 -3.640 . . . 1.0 . . . . . . . . . . . . A . 17 CYS H . . . . . . . . . c30497_6e5i 1 . 5 . 2068 . 1 1 17 CYS HA H -3.650 -2.796 -1.144 . . . 1.0 . . . . . . . . . . . . A . 17 CYS HA . . . . . . . . . c30497_6e5i 1 . 5 . 2069 . 1 1 17 CYS HB2 H -3.881 -1.130 -3.656 . . . 1.0 . . . . . . . . . . . . A . 17 CYS HB2 . . . . . . . . . c30497_6e5i 1 . 5 . 2070 . 1 1 17 CYS HB3 H -4.753 -0.843 -2.155 . . . 1.0 . . . . . . . . . . . . A . 17 CYS HB3 . . . . . . . . . c30497_6e5i 1 . 5 . 2071 . 1 1 17 CYS N N -2.446 -3.216 -2.758 . . . 1.0 . . . . . . . . . . . . A . 17 CYS N . . . . . . . . . c30497_6e5i 1 . 5 . 2072 . 1 1 17 CYS O O -5.221 -3.389 -3.928 . . . 1.0 . . . . . . . . . . . . A . 17 CYS O . . . . . . . . . c30497_6e5i 1 . 5 . 2073 . 1 1 17 CYS SG S -2.468 -0.170 -1.995 . . . 1.0 . . . . . . . . . . . . A . 17 CYS SG . . . . . . . . . c30497_6e5i 1 . 5 . 2074 . 1 1 18 ASP C C -7.825 -4.606 -1.331 . . . 1.0 . . . . . . . . . . . . A . 18 ASP C . . . . . . . . . c30497_6e5i 1 . 5 . 2075 . 1 1 18 ASP CA C -6.675 -5.017 -2.238 . . . 1.0 . . . . . . . . . . . . A . 18 ASP CA . . . . . . . . . c30497_6e5i 1 . 5 . 2076 . 1 1 18 ASP CB C -6.427 -6.521 -2.129 . . . 1.0 . . . . . . . . . . . . A . 18 ASP CB . . . . . . . . . c30497_6e5i 1 . 5 . 2077 . 1 1 18 ASP CG C -7.569 -7.328 -2.711 . . . 1.0 . . . . . . . . . . . . A . 18 ASP CG . . . . . . . . . c30497_6e5i 1 . 5 . 2078 . 1 1 18 ASP H H -5.138 -4.326 -0.961 . . . 1.0 . . . . . . . . . . . . A . 18 ASP H . . . . . . . . . c30497_6e5i 1 . 5 . 2079 . 1 1 18 ASP HA H -6.930 -4.771 -3.260 . . . 1.0 . . . . . . . . . . . . A . 18 ASP HA . . . . . . . . . c30497_6e5i 1 . 5 . 2080 . 1 1 18 ASP HB2 H -5.523 -6.771 -2.660 . . . 1.0 . . . . . . . . . . . . A . 18 ASP HB2 . . . . . . . . . c30497_6e5i 1 . 5 . 2081 . 1 1 18 ASP HB3 H -6.315 -6.786 -1.089 . . . 1.0 . . . . . . . . . . . . A . 18 ASP HB3 . . . . . . . . . c30497_6e5i 1 . 5 . 2082 . 1 1 18 ASP N N -5.485 -4.265 -1.880 . . . 1.0 . . . . . . . . . . . . A . 18 ASP N . . . . . . . . . c30497_6e5i 1 . 5 . 2083 . 1 1 18 ASP O O -8.077 -5.238 -0.300 . . . 1.0 . . . . . . . . . . . . A . 18 ASP O . . . . . . . . . c30497_6e5i 1 . 5 . 2084 . 1 1 18 ASP OD1 O -8.416 -7.811 -1.929 . . . 1.0 . . . . . . . . . . . . A . 18 ASP OD1 . . . . . . . . . c30497_6e5i 1 . 5 . 2085 . 1 1 18 ASP OD2 O -7.633 -7.485 -3.948 . . . 1.0 . . . . . . . . . . . . A . 18 ASP OD2 . . . . . . . . . c30497_6e5i 1 . 5 . 2086 . 1 1 19 DPR C C -9.141 -2.558 0.500 . . . 1.0 . . . . . . . . . . . . A . 19 DPR C . . . . . . . . . c30497_6e5i 1 . 5 . 2087 . 1 1 19 DPR CA C -9.614 -2.980 -0.887 . . . 1.0 . . . . . . . . . . . . A . 19 DPR CA . . . . . . . . . c30497_6e5i 1 . 5 . 2088 . 1 1 19 DPR CB C -10.111 -1.775 -1.688 . . . 1.0 . . . . . . . . . . . . A . 19 DPR CB . . . . . . . . . c30497_6e5i 1 . 5 . 2089 . 1 1 19 DPR CD C -8.277 -2.714 -2.896 . . . 1.0 . . . . . . . . . . . . A . 19 DPR CD . . . . . . . . . c30497_6e5i 1 . 5 . 2090 . 1 1 19 DPR CG C -8.987 -1.427 -2.599 . . . 1.0 . . . . . . . . . . . . A . 19 DPR CG . . . . . . . . . c30497_6e5i 1 . 5 . 2091 . 1 1 19 DPR HA H -10.414 -3.694 -0.791 . . . 1.0 . . . . . . . . . . . . A . 19 DPR HA . . . . . . . . . c30497_6e5i 1 . 5 . 2092 . 1 1 19 DPR HB2 H -10.339 -0.964 -1.014 . . . 1.0 . . . . . . . . . . . . A . 19 DPR HB2 . . . . . . . . . c30497_6e5i 1 . 5 . 2093 . 1 1 19 DPR HB3 H -10.997 -2.052 -2.239 . . . 1.0 . . . . . . . . . . . . A . 19 DPR HB3 . . . . . . . . . c30497_6e5i 1 . 5 . 2094 . 1 1 19 DPR HD2 H -7.221 -2.537 -3.038 . . . 1.0 . . . . . . . . . . . . A . 19 DPR HD2 . . . . . . . . . c30497_6e5i 1 . 5 . 2095 . 1 1 19 DPR HD3 H -8.703 -3.191 -3.766 . . . 1.0 . . . . . . . . . . . . A . 19 DPR HD3 . . . . . . . . . c30497_6e5i 1 . 5 . 2096 . 1 1 19 DPR HG2 H -8.320 -0.734 -2.109 . . . 1.0 . . . . . . . . . . . . A . 19 DPR HG2 . . . . . . . . . c30497_6e5i 1 . 5 . 2097 . 1 1 19 DPR HG3 H -9.373 -0.994 -3.509 . . . 1.0 . . . . . . . . . . . . A . 19 DPR HG3 . . . . . . . . . c30497_6e5i 1 . 5 . 2098 . 1 1 19 DPR N N -8.515 -3.515 -1.687 . . . 1.0 . . . . . . . . . . . . A . 19 DPR N . . . . . . . . . c30497_6e5i 1 . 5 . 2099 . 1 1 19 DPR O O -8.277 -1.691 0.639 . . . 1.0 . . . . . . . . . . . . A . 19 DPR O . . . . . . . . . c30497_6e5i 1 . 5 . 2100 . 1 1 20 PRO C C -8.008 -3.594 3.323 . . . 1.0 . . . . . . . . . . . . A . 20 PRO C . . . . . . . . . c30497_6e5i 1 . 5 . 2101 . 1 1 20 PRO CA C -9.314 -2.908 2.924 . . . 1.0 . . . . . . . . . . . . A . 20 PRO CA . . . . . . . . . c30497_6e5i 1 . 5 . 2102 . 1 1 20 PRO CB C -10.481 -3.486 3.719 . . . 1.0 . . . . . . . . . . . . A . 20 PRO CB . . . . . . . . . c30497_6e5i 1 . 5 . 2103 . 1 1 20 PRO CD C -10.765 -4.197 1.455 . . . 1.0 . . . . . . . . . . . . A . 20 PRO CD . . . . . . . . . c30497_6e5i 1 . 5 . 2104 . 1 1 20 PRO CG C -10.975 -4.615 2.885 . . . 1.0 . . . . . . . . . . . . A . 20 PRO CG . . . . . . . . . c30497_6e5i 1 . 5 . 2105 . 1 1 20 PRO HA H -9.236 -1.850 3.112 . . . 1.0 . . . . . . . . . . . . A . 20 PRO HA . . . . . . . . . c30497_6e5i 1 . 5 . 2106 . 1 1 20 PRO HB2 H -10.130 -3.829 4.681 . . . 1.0 . . . . . . . . . . . . A . 20 PRO HB2 . . . . . . . . . c30497_6e5i 1 . 5 . 2107 . 1 1 20 PRO HB3 H -11.241 -2.732 3.851 . . . 1.0 . . . . . . . . . . . . A . 20 PRO HB3 . . . . . . . . . c30497_6e5i 1 . 5 . 2108 . 1 1 20 PRO HD2 H -10.448 -5.038 0.857 . . . 1.0 . . . . . . . . . . . . A . 20 PRO HD2 . . . . . . . . . c30497_6e5i 1 . 5 . 2109 . 1 1 20 PRO HD3 H -11.669 -3.766 1.053 . . . 1.0 . . . . . . . . . . . . A . 20 PRO HD3 . . . . . . . . . c30497_6e5i 1 . 5 . 2110 . 1 1 20 PRO HG2 H -10.409 -5.507 3.102 . . . 1.0 . . . . . . . . . . . . A . 20 PRO HG2 . . . . . . . . . c30497_6e5i 1 . 5 . 2111 . 1 1 20 PRO HG3 H -12.024 -4.780 3.076 . . . 1.0 . . . . . . . . . . . . A . 20 PRO HG3 . . . . . . . . . c30497_6e5i 1 . 5 . 2112 . 1 1 20 PRO N N -9.696 -3.183 1.542 . . . 1.0 . . . . . . . . . . . . A . 20 PRO N . . . . . . . . . c30497_6e5i 1 . 5 . 2113 . 1 1 20 PRO O O -7.517 -3.409 4.440 . . . 1.0 . . . . . . . . . . . . A . 20 PRO O . . . . . . . . . c30497_6e5i 1 . 5 . 2114 . 1 1 21 ARG C C -5.035 -4.471 2.027 . . . 1.0 . . . . . . . . . . . . A . 21 ARG C . . . . . . . . . c30497_6e5i 1 . 5 . 2115 . 1 1 21 ARG CA C -6.229 -5.121 2.706 . . . 1.0 . . . . . . . . . . . . A . 21 ARG CA . . . . . . . . . c30497_6e5i 1 . 5 . 2116 . 1 1 21 ARG CB C -6.353 -6.577 2.255 . . . 1.0 . . . . . . . . . . . . A . 21 ARG CB . . . . . . . . . c30497_6e5i 1 . 5 . 2117 . 1 1 21 ARG CD C -7.486 -8.804 2.544 . . . 1.0 . . . . . . . . . . . . A . 21 ARG CD . . . . . . . . . c30497_6e5i 1 . 5 . 2118 . 1 1 21 ARG CG C -7.436 -7.350 2.988 . . . 1.0 . . . . . . . . . . . . A . 21 ARG CG . . . . . . . . . c30497_6e5i 1 . 5 . 2119 . 1 1 21 ARG CZ C -8.071 -10.119 0.536 . . . 1.0 . . . . . . . . . . . . A . 21 ARG CZ . . . . . . . . . c30497_6e5i 1 . 5 . 2120 . 1 1 21 ARG H H -7.859 -4.467 1.525 . . . 1.0 . . . . . . . . . . . . A . 21 ARG H . . . . . . . . . c30497_6e5i 1 . 5 . 2121 . 1 1 21 ARG HA H -6.076 -5.097 3.775 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HA . . . . . . . . . c30497_6e5i 1 . 5 . 2122 . 1 1 21 ARG HB2 H -6.576 -6.595 1.200 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HB2 . . . . . . . . . c30497_6e5i 1 . 5 . 2123 . 1 1 21 ARG HB3 H -5.409 -7.073 2.423 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HB3 . . . . . . . . . c30497_6e5i 1 . 5 . 2124 . 1 1 21 ARG HD2 H -6.523 -9.255 2.729 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HD2 . . . . . . . . . c30497_6e5i 1 . 5 . 2125 . 1 1 21 ARG HD3 H -8.238 -9.316 3.129 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HD3 . . . . . . . . . c30497_6e5i 1 . 5 . 2126 . 1 1 21 ARG HE H -7.842 -8.129 0.576 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HE . . . . . . . . . c30497_6e5i 1 . 5 . 2127 . 1 1 21 ARG HG2 H -7.230 -7.315 4.048 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HG2 . . . . . . . . . c30497_6e5i 1 . 5 . 2128 . 1 1 21 ARG HG3 H -8.391 -6.886 2.792 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HG3 . . . . . . . . . c30497_6e5i 1 . 5 . 2129 . 1 1 21 ARG HH11 H -7.825 -11.221 2.222 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HH11 . . . . . . . . . c30497_6e5i 1 . 5 . 2130 . 1 1 21 ARG HH12 H -8.234 -12.123 0.801 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HH12 . . . . . . . . . c30497_6e5i 1 . 5 . 2131 . 1 1 21 ARG HH21 H -8.394 -9.308 -1.299 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HH21 . . . . . . . . . c30497_6e5i 1 . 5 . 2132 . 1 1 21 ARG HH22 H -8.567 -11.039 -1.198 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HH22 . . . . . . . . . c30497_6e5i 1 . 5 . 2133 . 1 1 21 ARG N N -7.450 -4.387 2.417 . . . 1.0 . . . . . . . . . . . . A . 21 ARG N . . . . . . . . . c30497_6e5i 1 . 5 . 2134 . 1 1 21 ARG NE N -7.813 -8.949 1.123 . . . 1.0 . . . . . . . . . . . . A . 21 ARG NE . . . . . . . . . c30497_6e5i 1 . 5 . 2135 . 1 1 21 ARG NH1 N -8.041 -11.243 1.244 . . . 1.0 . . . . . . . . . . . . A . 21 ARG NH1 . . . . . . . . . c30497_6e5i 1 . 5 . 2136 . 1 1 21 ARG NH2 N -8.366 -10.163 -0.755 . . . 1.0 . . . . . . . . . . . . A . 21 ARG NH2 . . . . . . . . . c30497_6e5i 1 . 5 . 2137 . 1 1 21 ARG O O -5.108 -4.079 0.865 . . . 1.0 . . . . . . . . . . . . A . 21 ARG O . . . . . . . . . c30497_6e5i 1 . 5 . 2138 . 1 1 22 TYR C C -1.533 -4.639 2.592 . . . 1.0 . . . . . . . . . . . . A . 22 TYR C . . . . . . . . . c30497_6e5i 1 . 5 . 2139 . 1 1 22 TYR CA C -2.724 -3.769 2.230 . . . 1.0 . . . . . . . . . . . . A . 22 TYR CA . . . . . . . . . c30497_6e5i 1 . 5 . 2140 . 1 1 22 TYR CB C -2.519 -2.355 2.777 . . . 1.0 . . . . . . . . . . . . A . 22 TYR CB . . . . . . . . . c30497_6e5i 1 . 5 . 2141 . 1 1 22 TYR CD1 C -3.762 -0.729 1.305 . . . 1.0 . . . . . . . . . . . . A . 22 TYR CD1 . . . . . . . . . c30497_6e5i 1 . 5 . 2142 . 1 1 22 TYR CD2 C -4.695 -1.264 3.429 . . . 1.0 . . . . . . . . . . . . A . 22 TYR CD2 . . . . . . . . . c30497_6e5i 1 . 5 . 2143 . 1 1 22 TYR CE1 C -4.827 0.109 1.044 . . . 1.0 . . . . . . . . . . . . A . 22 TYR CE1 . . . . . . . . . c30497_6e5i 1 . 5 . 2144 . 1 1 22 TYR CE2 C -5.761 -0.428 3.178 . . . 1.0 . . . . . . . . . . . . A . 22 TYR CE2 . . . . . . . . . c30497_6e5i 1 . 5 . 2145 . 1 1 22 TYR CG C -3.679 -1.430 2.499 . . . 1.0 . . . . . . . . . . . . A . 22 TYR CG . . . . . . . . . c30497_6e5i 1 . 5 . 2146 . 1 1 22 TYR CZ C -5.824 0.256 1.984 . . . 1.0 . . . . . . . . . . . . A . 22 TYR CZ . . . . . . . . . c30497_6e5i 1 . 5 . 2147 . 1 1 22 TYR H H -3.955 -4.674 3.685 . . . 1.0 . . . . . . . . . . . . A . 22 TYR H . . . . . . . . . c30497_6e5i 1 . 5 . 2148 . 1 1 22 TYR HA H -2.813 -3.723 1.155 . . . 1.0 . . . . . . . . . . . . A . 22 TYR HA . . . . . . . . . c30497_6e5i 1 . 5 . 2149 . 1 1 22 TYR HB2 H -2.384 -2.404 3.846 . . . 1.0 . . . . . . . . . . . . A . 22 TYR HB2 . . . . . . . . . c30497_6e5i 1 . 5 . 2150 . 1 1 22 TYR HB3 H -1.638 -1.928 2.325 . . . 1.0 . . . . . . . . . . . . A . 22 TYR HB3 . . . . . . . . . c30497_6e5i 1 . 5 . 2151 . 1 1 22 TYR HD1 H -2.978 -0.848 0.572 . . . 1.0 . . . . . . . . . . . . A . 22 TYR HD1 . . . . . . . . . c30497_6e5i 1 . 5 . 2152 . 1 1 22 TYR HD2 H -4.643 -1.803 4.364 . . . 1.0 . . . . . . . . . . . . A . 22 TYR HD2 . . . . . . . . . c30497_6e5i 1 . 5 . 2153 . 1 1 22 TYR HE1 H -4.874 0.644 0.109 . . . 1.0 . . . . . . . . . . . . A . 22 TYR HE1 . . . . . . . . . c30497_6e5i 1 . 5 . 2154 . 1 1 22 TYR HE2 H -6.539 -0.314 3.913 . . . 1.0 . . . . . . . . . . . . A . 22 TYR HE2 . . . . . . . . . c30497_6e5i 1 . 5 . 2155 . 1 1 22 TYR HH H -7.276 0.857 0.877 . . . 1.0 . . . . . . . . . . . . A . 22 TYR HH . . . . . . . . . c30497_6e5i 1 . 5 . 2156 . 1 1 22 TYR N N -3.944 -4.353 2.760 . . . 1.0 . . . . . . . . . . . . A . 22 TYR N . . . . . . . . . c30497_6e5i 1 . 5 . 2157 . 1 1 22 TYR O O -1.204 -4.803 3.769 . . . 1.0 . . . . . . . . . . . . A . 22 TYR O . . . . . . . . . c30497_6e5i 1 . 5 . 2158 . 1 1 22 TYR OH O -6.890 1.089 1.731 . . . 1.0 . . . . . . . . . . . . A . 22 TYR OH . . . . . . . . . c30497_6e5i 1 . 5 . 2159 . 1 1 23 GLU C C 1.531 -5.350 1.427 . . . 1.0 . . . . . . . . . . . . A . 23 GLU C . . . . . . . . . c30497_6e5i 1 . 5 . 2160 . 1 1 23 GLU CA C 0.248 -6.072 1.793 . . . 1.0 . . . . . . . . . . . . A . 23 GLU CA . . . . . . . . . c30497_6e5i 1 . 5 . 2161 . 1 1 23 GLU CB C 0.123 -7.349 0.964 . . . 1.0 . . . . . . . . . . . . A . 23 GLU CB . . . . . . . . . c30497_6e5i 1 . 5 . 2162 . 1 1 23 GLU CD C -0.951 -8.778 2.741 . . . 1.0 . . . . . . . . . . . . A . 23 GLU CD . . . . . . . . . c30497_6e5i 1 . 5 . 2163 . 1 1 23 GLU CG C -1.064 -8.217 1.341 . . . 1.0 . . . . . . . . . . . . A . 23 GLU CG . . . . . . . . . c30497_6e5i 1 . 5 . 2164 . 1 1 23 GLU H H -1.204 -5.024 0.663 . . . 1.0 . . . . . . . . . . . . A . 23 GLU H . . . . . . . . . c30497_6e5i 1 . 5 . 2165 . 1 1 23 GLU HA H 0.279 -6.333 2.840 . . . 1.0 . . . . . . . . . . . . A . 23 GLU HA . . . . . . . . . c30497_6e5i 1 . 5 . 2166 . 1 1 23 GLU HB2 H 0.029 -7.078 -0.075 . . . 1.0 . . . . . . . . . . . . A . 23 GLU HB2 . . . . . . . . . c30497_6e5i 1 . 5 . 2167 . 1 1 23 GLU HB3 H 1.023 -7.932 1.091 . . . 1.0 . . . . . . . . . . . . A . 23 GLU HB3 . . . . . . . . . c30497_6e5i 1 . 5 . 2168 . 1 1 23 GLU HG2 H -1.963 -7.624 1.279 . . . 1.0 . . . . . . . . . . . . A . 23 GLU HG2 . . . . . . . . . c30497_6e5i 1 . 5 . 2169 . 1 1 23 GLU HG3 H -1.127 -9.040 0.645 . . . 1.0 . . . . . . . . . . . . A . 23 GLU HG3 . . . . . . . . . c30497_6e5i 1 . 5 . 2170 . 1 1 23 GLU N N -0.899 -5.205 1.582 . . . 1.0 . . . . . . . . . . . . A . 23 GLU N . . . . . . . . . c30497_6e5i 1 . 5 . 2171 . 1 1 23 GLU O O 1.811 -5.125 0.251 . . . 1.0 . . . . . . . . . . . . A . 23 GLU O . . . . . . . . . c30497_6e5i 1 . 5 . 2172 . 1 1 23 GLU OE1 O -1.588 -8.221 3.662 . . . 1.0 . . . . . . . . . . . . A . 23 GLU OE1 . . . . . . . . . c30497_6e5i 1 . 5 . 2173 . 1 1 23 GLU OE2 O -0.213 -9.764 2.937 . . . 1.0 . . . . . . . . . . . . A . 23 GLU OE2 . . . . . . . . . c30497_6e5i 1 . 5 . 2174 . 1 1 24 VAL C C 4.679 -5.338 2.062 . . . 1.0 . . . . . . . . . . . . A . 24 VAL C . . . . . . . . . c30497_6e5i 1 . 5 . 2175 . 1 1 24 VAL CA C 3.566 -4.309 2.207 . . . 1.0 . . . . . . . . . . . . A . 24 VAL CA . . . . . . . . . c30497_6e5i 1 . 5 . 2176 . 1 1 24 VAL CB C 3.906 -3.328 3.348 . . . 1.0 . . . . . . . . . . . . A . 24 VAL CB . . . . . . . . . c30497_6e5i 1 . 5 . 2177 . 1 1 24 VAL CG1 C 5.254 -2.666 3.106 . . . 1.0 . . . . . . . . . . . . A . 24 VAL CG1 . . . . . . . . . c30497_6e5i 1 . 5 . 2178 . 1 1 24 VAL CG2 C 2.814 -2.279 3.492 . . . 1.0 . . . . . . . . . . . . A . 24 VAL CG2 . . . . . . . . . c30497_6e5i 1 . 5 . 2179 . 1 1 24 VAL H H 2.010 -5.167 3.350 . . . 1.0 . . . . . . . . . . . . A . 24 VAL H . . . . . . . . . c30497_6e5i 1 . 5 . 2180 . 1 1 24 VAL HA H 3.486 -3.749 1.286 . . . 1.0 . . . . . . . . . . . . A . 24 VAL HA . . . . . . . . . c30497_6e5i 1 . 5 . 2181 . 1 1 24 VAL HB H 3.965 -3.887 4.271 . . . 1.0 . . . . . . . . . . . . A . 24 VAL HB . . . . . . . . . c30497_6e5i 1 . 5 . 2182 . 1 1 24 VAL HG11 H 6.022 -3.423 3.044 . . . 1.0 . . . . . . . . . . . . A . 24 VAL HG11 . . . . . . . . . c30497_6e5i 1 . 5 . 2183 . 1 1 24 VAL HG12 H 5.477 -1.993 3.919 . . . 1.0 . . . . . . . . . . . . A . 24 VAL HG12 . . . . . . . . . c30497_6e5i 1 . 5 . 2184 . 1 1 24 VAL HG13 H 5.221 -2.111 2.179 . . . 1.0 . . . . . . . . . . . . A . 24 VAL HG13 . . . . . . . . . c30497_6e5i 1 . 5 . 2185 . 1 1 24 VAL HG21 H 1.875 -2.763 3.715 . . . 1.0 . . . . . . . . . . . . A . 24 VAL HG21 . . . . . . . . . c30497_6e5i 1 . 5 . 2186 . 1 1 24 VAL HG22 H 2.723 -1.727 2.568 . . . 1.0 . . . . . . . . . . . . A . 24 VAL HG22 . . . . . . . . . c30497_6e5i 1 . 5 . 2187 . 1 1 24 VAL HG23 H 3.068 -1.599 4.293 . . . 1.0 . . . . . . . . . . . . A . 24 VAL HG23 . . . . . . . . . c30497_6e5i 1 . 5 . 2188 . 1 1 24 VAL N N 2.299 -4.977 2.432 . . . 1.0 . . . . . . . . . . . . A . 24 VAL N . . . . . . . . . c30497_6e5i 1 . 5 . 2189 . 1 1 24 VAL O O 5.259 -5.797 3.049 . . . 1.0 . . . . . . . . . . . . A . 24 VAL O . . . . . . . . . c30497_6e5i 1 . 5 . 2190 . 1 1 25 HIS C C 7.262 -6.047 0.078 . . . 1.0 . . . . . . . . . . . . A . 25 HIS C . . . . . . . . . c30497_6e5i 1 . 5 . 2191 . 1 1 25 HIS CA C 5.971 -6.710 0.539 . . . 1.0 . . . . . . . . . . . . A . 25 HIS CA . . . . . . . . . c30497_6e5i 1 . 5 . 2192 . 1 1 25 HIS CB C 5.464 -7.687 -0.531 . . . 1.0 . . . . . . . . . . . . A . 25 HIS CB . . . . . . . . . c30497_6e5i 1 . 5 . 2193 . 1 1 25 HIS CD2 C 6.699 -9.932 -0.103 . . . 1.0 . . . . . . . . . . . . A . 25 HIS CD2 . . . . . . . . . c30497_6e5i 1 . 5 . 2194 . 1 1 25 HIS CE1 C 7.891 -9.999 -1.938 . . . 1.0 . . . . . . . . . . . . A . 25 HIS CE1 . . . . . . . . . c30497_6e5i 1 . 5 . 2195 . 1 1 25 HIS CG C 6.407 -8.819 -0.818 . . . 1.0 . . . . . . . . . . . . A . 25 HIS CG . . . . . . . . . c30497_6e5i 1 . 5 . 2196 . 1 1 25 HIS H H 4.466 -5.293 0.080 . . . 1.0 . . . . . . . . . . . . A . 25 HIS H . . . . . . . . . c30497_6e5i 1 . 5 . 2197 . 1 1 25 HIS HA H 6.165 -7.254 1.449 . . . 1.0 . . . . . . . . . . . . A . 25 HIS HA . . . . . . . . . c30497_6e5i 1 . 5 . 2198 . 1 1 25 HIS HB2 H 4.527 -8.109 -0.207 . . . 1.0 . . . . . . . . . . . . A . 25 HIS HB2 . . . . . . . . . c30497_6e5i 1 . 5 . 2199 . 1 1 25 HIS HB3 H 5.307 -7.146 -1.449 . . . 1.0 . . . . . . . . . . . . A . 25 HIS HB3 . . . . . . . . . c30497_6e5i 1 . 5 . 2200 . 1 1 25 HIS HD1 H 7.172 -8.234 -2.704 . . . 1.0 . . . . . . . . . . . . A . 25 HIS HD1 . . . . . . . . . c30497_6e5i 1 . 5 . 2201 . 1 1 25 HIS HD2 H 6.280 -10.207 0.854 . . . 1.0 . . . . . . . . . . . . A . 25 HIS HD2 . . . . . . . . . c30497_6e5i 1 . 5 . 2202 . 1 1 25 HIS HE1 H 8.584 -10.319 -2.702 . . . 1.0 . . . . . . . . . . . . A . 25 HIS HE1 . . . . . . . . . c30497_6e5i 1 . 5 . 2203 . 1 1 25 HIS HE2 H 7.857 -11.589 -0.655 . . . 1.0 . . . . . . . . . . . . A . 25 HIS HE2 . . . . . . . . . c30497_6e5i 1 . 5 . 2204 . 1 1 25 HIS N N 4.957 -5.708 0.826 . . . 1.0 . . . . . . . . . . . . A . 25 HIS N . . . . . . . . . c30497_6e5i 1 . 5 . 2205 . 1 1 25 HIS ND1 N 7.170 -8.893 -1.964 . . . 1.0 . . . . . . . . . . . . A . 25 HIS ND1 . . . . . . . . . c30497_6e5i 1 . 5 . 2206 . 1 1 25 HIS NE2 N 7.626 -10.648 -0.820 . . . 1.0 . . . . . . . . . . . . A . 25 HIS NE2 . . . . . . . . . c30497_6e5i 1 . 5 . 2207 . 1 1 25 HIS O O 7.407 -5.685 -1.089 . . . 1.0 . . . . . . . . . . . . A . 25 HIS O . . . . . . . . . c30497_6e5i 1 . 5 . 2208 . 1 1 26 CYS C C 10.407 -6.375 0.113 . . . 1.0 . . . . . . . . . . . . A . 26 CYS C . . . . . . . . . c30497_6e5i 1 . 5 . 2209 . 1 1 26 CYS CA C 9.485 -5.302 0.678 . . . 1.0 . . . . . . . . . . . . A . 26 CYS CA . . . . . . . . . c30497_6e5i 1 . 5 . 2210 . 1 1 26 CYS CB C 10.110 -4.662 1.919 . . . 1.0 . . . . . . . . . . . . A . 26 CYS CB . . . . . . . . . c30497_6e5i 1 . 5 . 2211 . 1 1 26 CYS H H 8.005 -6.150 1.923 . . . 1.0 . . . . . . . . . . . . A . 26 CYS H . . . . . . . . . c30497_6e5i 1 . 5 . 2212 . 1 1 26 CYS HA H 9.331 -4.540 -0.071 . . . 1.0 . . . . . . . . . . . . A . 26 CYS HA . . . . . . . . . c30497_6e5i 1 . 5 . 2213 . 1 1 26 CYS HB2 H 10.256 -5.422 2.672 . . . 1.0 . . . . . . . . . . . . A . 26 CYS HB2 . . . . . . . . . c30497_6e5i 1 . 5 . 2214 . 1 1 26 CYS HB3 H 11.066 -4.238 1.652 . . . 1.0 . . . . . . . . . . . . A . 26 CYS HB3 . . . . . . . . . c30497_6e5i 1 . 5 . 2215 . 1 1 26 CYS N N 8.191 -5.877 1.000 . . . 1.0 . . . . . . . . . . . . A . 26 CYS N . . . . . . . . . c30497_6e5i 1 . 5 . 2216 . 1 1 26 CYS O O 11.179 -7.001 0.838 . . . 1.0 . . . . . . . . . . . . A . 26 CYS O . . . . . . . . . c30497_6e5i 1 . 5 . 2217 . 1 1 26 CYS SG S 9.100 -3.335 2.657 . . . 1.0 . . . . . . . . . . . . A . 26 CYS SG . . . . . . . . . c30497_6e5i 1 . 5 . 2218 . 1 1 27 NH2 HN1 H 9.662 -6.072 -1.701 . . . 1.0 . . . . . . . . . . . . A . 27 NH2 HN1 . . . . . . . . . c30497_6e5i 1 . 5 . 2219 . 1 1 27 NH2 HN2 H 10.854 -7.318 -1.574 . . . 1.0 . . . . . . . . . . . . A . 27 NH2 HN2 . . . . . . . . . c30497_6e5i 1 . 5 . 2220 . 1 1 27 NH2 N N 10.299 -6.611 -1.183 . . . 1.0 . . . . . . . . . . . . A . 27 NH2 N . . . . . . . . . c30497_6e5i 1 . 6 . 2221 . 1 1 1 ASN C C -6.751 6.459 -3.314 . . . 1.0 . . . . . . . . . . . . A . 1 ASN C . . . . . . . . . c30497_6e5i 1 . 6 . 2222 . 1 1 1 ASN CA C -8.267 6.456 -3.216 . . . 1.0 . . . . . . . . . . . . A . 1 ASN CA . . . . . . . . . c30497_6e5i 1 . 6 . 2223 . 1 1 1 ASN CB C -8.694 6.012 -1.813 . . . 1.0 . . . . . . . . . . . . A . 1 ASN CB . . . . . . . . . c30497_6e5i 1 . 6 . 2224 . 1 1 1 ASN CG C -10.139 6.357 -1.492 . . . 1.0 . . . . . . . . . . . . A . 1 ASN CG . . . . . . . . . c30497_6e5i 1 . 6 . 2225 . 1 1 1 ASN H1 H -8.505 4.593 -4.107 . . . 1.0 . . . . . . . . . . . . A . 1 ASN H1 . . . . . . . . . c30497_6e5i 1 . 6 . 2226 . 1 1 1 ASN H2 H -8.572 5.884 -5.192 . . . 1.0 . . . . . . . . . . . . A . 1 ASN H2 . . . . . . . . . c30497_6e5i 1 . 6 . 2227 . 1 1 1 ASN H3 H -9.886 5.565 -4.180 . . . 1.0 . . . . . . . . . . . . A . 1 ASN H3 . . . . . . . . . c30497_6e5i 1 . 6 . 2228 . 1 1 1 ASN HA H -8.629 7.457 -3.397 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HA . . . . . . . . . c30497_6e5i 1 . 6 . 2229 . 1 1 1 ASN HB2 H -8.578 4.942 -1.734 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HB2 . . . . . . . . . c30497_6e5i 1 . 6 . 2230 . 1 1 1 ASN HB3 H -8.057 6.489 -1.082 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HB3 . . . . . . . . . c30497_6e5i 1 . 6 . 2231 . 1 1 1 ASN HD21 H -10.006 8.080 -2.483 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HD21 . . . . . . . . . c30497_6e5i 1 . 6 . 2232 . 1 1 1 ASN HD22 H -11.538 7.744 -1.755 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HD22 . . . . . . . . . c30497_6e5i 1 . 6 . 2233 . 1 1 1 ASN N N -8.848 5.564 -4.244 . . . 1.0 . . . . . . . . . . . . A . 1 ASN N . . . . . . . . . c30497_6e5i 1 . 6 . 2234 . 1 1 1 ASN ND2 N -10.606 7.507 -1.958 . . . 1.0 . . . . . . . . . . . . A . 1 ASN ND2 . . . . . . . . . c30497_6e5i 1 . 6 . 2235 . 1 1 1 ASN O O -6.147 5.486 -3.763 . . . 1.0 . . . . . . . . . . . . A . 1 ASN O . . . . . . . . . c30497_6e5i 1 . 6 . 2236 . 1 1 1 ASN OD1 O -10.825 5.604 -0.804 . . . 1.0 . . . . . . . . . . . . A . 1 ASN OD1 . . . . . . . . . c30497_6e5i 1 . 6 . 2237 . 1 1 2 ASP C C -3.983 7.123 -1.753 . . . 1.0 . . . . . . . . . . . . A . 2 ASP C . . . . . . . . . c30497_6e5i 1 . 6 . 2238 . 1 1 2 ASP CA C -4.688 7.707 -2.979 . . . 1.0 . . . . . . . . . . . . A . 2 ASP CA . . . . . . . . . c30497_6e5i 1 . 6 . 2239 . 1 1 2 ASP CB C -4.320 9.186 -3.156 . . . 1.0 . . . . . . . . . . . . A . 2 ASP CB . . . . . . . . . c30497_6e5i 1 . 6 . 2240 . 1 1 2 ASP CG C -4.643 10.036 -1.942 . . . 1.0 . . . . . . . . . . . . A . 2 ASP CG . . . . . . . . . c30497_6e5i 1 . 6 . 2241 . 1 1 2 ASP H H -6.668 8.283 -2.498 . . . 1.0 . . . . . . . . . . . . A . 2 ASP H . . . . . . . . . c30497_6e5i 1 . 6 . 2242 . 1 1 2 ASP HA H -4.362 7.163 -3.853 . . . 1.0 . . . . . . . . . . . . A . 2 ASP HA . . . . . . . . . c30497_6e5i 1 . 6 . 2243 . 1 1 2 ASP HB2 H -3.264 9.264 -3.351 . . . 1.0 . . . . . . . . . . . . A . 2 ASP HB2 . . . . . . . . . c30497_6e5i 1 . 6 . 2244 . 1 1 2 ASP HB3 H -4.863 9.583 -4.002 . . . 1.0 . . . . . . . . . . . . A . 2 ASP HB3 . . . . . . . . . c30497_6e5i 1 . 6 . 2245 . 1 1 2 ASP N N -6.135 7.552 -2.883 . . . 1.0 . . . . . . . . . . . . A . 2 ASP N . . . . . . . . . c30497_6e5i 1 . 6 . 2246 . 1 1 2 ASP O O -2.797 7.370 -1.528 . . . 1.0 . . . . . . . . . . . . A . 2 ASP O . . . . . . . . . c30497_6e5i 1 . 6 . 2247 . 1 1 2 ASP OD1 O -3.713 10.376 -1.179 . . . 1.0 . . . . . . . . . . . . A . 2 ASP OD1 . . . . . . . . . c30497_6e5i 1 . 6 . 2248 . 1 1 2 ASP OD2 O -5.830 10.361 -1.735 . . . 1.0 . . . . . . . . . . . . A . 2 ASP OD2 . . . . . . . . . c30497_6e5i 1 . 6 . 2249 . 1 1 3 LYS C C -3.010 4.746 -0.195 . . . 1.0 . . . . . . . . . . . . A . 3 LYS C . . . . . . . . . c30497_6e5i 1 . 6 . 2250 . 1 1 3 LYS CA C -4.160 5.662 0.199 . . . 1.0 . . . . . . . . . . . . A . 3 LYS CA . . . . . . . . . c30497_6e5i 1 . 6 . 2251 . 1 1 3 LYS CB C -5.235 4.848 0.931 . . . 1.0 . . . . . . . . . . . . A . 3 LYS CB . . . . . . . . . c30497_6e5i 1 . 6 . 2252 . 1 1 3 LYS CD C -7.313 4.822 2.345 . . . 1.0 . . . . . . . . . . . . A . 3 LYS CD . . . . . . . . . c30497_6e5i 1 . 6 . 2253 . 1 1 3 LYS CE C -8.299 5.662 3.139 . . . 1.0 . . . . . . . . . . . . A . 3 LYS CE . . . . . . . . . c30497_6e5i 1 . 6 . 2254 . 1 1 3 LYS CG C -6.280 5.691 1.647 . . . 1.0 . . . . . . . . . . . . A . 3 LYS CG . . . . . . . . . c30497_6e5i 1 . 6 . 2255 . 1 1 3 LYS H H -5.649 6.166 -1.216 . . . 1.0 . . . . . . . . . . . . A . 3 LYS H . . . . . . . . . c30497_6e5i 1 . 6 . 2256 . 1 1 3 LYS HA H -3.782 6.426 0.861 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HA . . . . . . . . . c30497_6e5i 1 . 6 . 2257 . 1 1 3 LYS HB2 H -5.744 4.224 0.213 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HB2 . . . . . . . . . c30497_6e5i 1 . 6 . 2258 . 1 1 3 LYS HB3 H -4.753 4.217 1.662 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HB3 . . . . . . . . . c30497_6e5i 1 . 6 . 2259 . 1 1 3 LYS HD2 H -7.854 4.253 1.604 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HD2 . . . . . . . . . c30497_6e5i 1 . 6 . 2260 . 1 1 3 LYS HD3 H -6.804 4.147 3.020 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HD3 . . . . . . . . . c30497_6e5i 1 . 6 . 2261 . 1 1 3 LYS HE2 H -7.755 6.229 3.878 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HE2 . . . . . . . . . c30497_6e5i 1 . 6 . 2262 . 1 1 3 LYS HE3 H -8.796 6.341 2.462 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HE3 . . . . . . . . . c30497_6e5i 1 . 6 . 2263 . 1 1 3 LYS HG2 H -5.790 6.308 2.384 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HG2 . . . . . . . . . c30497_6e5i 1 . 6 . 2264 . 1 1 3 LYS HG3 H -6.781 6.318 0.925 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HG3 . . . . . . . . . c30497_6e5i 1 . 6 . 2265 . 1 1 3 LYS HZ1 H -9.949 5.432 4.396 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HZ1 . . . . . . . . . c30497_6e5i 1 . 6 . 2266 . 1 1 3 LYS HZ2 H -8.862 4.138 4.454 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HZ2 . . . . . . . . . c30497_6e5i 1 . 6 . 2267 . 1 1 3 LYS HZ3 H -9.897 4.315 3.129 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HZ3 . . . . . . . . . c30497_6e5i 1 . 6 . 2268 . 1 1 3 LYS N N -4.715 6.321 -0.981 . . . 1.0 . . . . . . . . . . . . A . 3 LYS N . . . . . . . . . c30497_6e5i 1 . 6 . 2269 . 1 1 3 LYS NZ N -9.321 4.829 3.826 . . . 1.0 . . . . . . . . . . . . A . 3 LYS NZ . . . . . . . . . c30497_6e5i 1 . 6 . 2270 . 1 1 3 LYS O O -1.990 4.679 0.489 . . . 1.0 . . . . . . . . . . . . A . 3 LYS O . . . . . . . . . c30497_6e5i 1 . 6 . 2271 . 1 1 4 CYS C C -0.894 3.915 -2.175 . . . 1.0 . . . . . . . . . . . . A . 4 CYS C . . . . . . . . . c30497_6e5i 1 . 6 . 2272 . 1 1 4 CYS CA C -2.163 3.153 -1.827 . . . 1.0 . . . . . . . . . . . . A . 4 CYS CA . . . . . . . . . c30497_6e5i 1 . 6 . 2273 . 1 1 4 CYS CB C -2.682 2.419 -3.062 . . . 1.0 . . . . . . . . . . . . A . 4 CYS CB . . . . . . . . . c30497_6e5i 1 . 6 . 2274 . 1 1 4 CYS H H -4.019 4.158 -1.812 . . . 1.0 . . . . . . . . . . . . A . 4 CYS H . . . . . . . . . c30497_6e5i 1 . 6 . 2275 . 1 1 4 CYS HA H -1.940 2.434 -1.055 . . . 1.0 . . . . . . . . . . . . A . 4 CYS HA . . . . . . . . . c30497_6e5i 1 . 6 . 2276 . 1 1 4 CYS HB2 H -2.891 3.139 -3.836 . . . 1.0 . . . . . . . . . . . . A . 4 CYS HB2 . . . . . . . . . c30497_6e5i 1 . 6 . 2277 . 1 1 4 CYS HB3 H -1.924 1.732 -3.408 . . . 1.0 . . . . . . . . . . . . A . 4 CYS HB3 . . . . . . . . . c30497_6e5i 1 . 6 . 2278 . 1 1 4 CYS N N -3.182 4.058 -1.316 . . . 1.0 . . . . . . . . . . . . A . 4 CYS N . . . . . . . . . c30497_6e5i 1 . 6 . 2279 . 1 1 4 CYS O O 0.209 3.419 -1.975 . . . 1.0 . . . . . . . . . . . . A . 4 CYS O . . . . . . . . . c30497_6e5i 1 . 6 . 2280 . 1 1 4 CYS SG S -4.202 1.463 -2.767 . . . 1.0 . . . . . . . . . . . . A . 4 CYS SG . . . . . . . . . c30497_6e5i 1 . 6 . 2281 . 1 1 5 LYS C C 0.767 6.527 -1.829 . . . 1.0 . . . . . . . . . . . . A . 5 LYS C . . . . . . . . . c30497_6e5i 1 . 6 . 2282 . 1 1 5 LYS CA C 0.069 5.966 -3.060 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CA . . . . . . . . . c30497_6e5i 1 . 6 . 2283 . 1 1 5 LYS CB C -0.386 7.102 -3.978 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CB . . . . . . . . . c30497_6e5i 1 . 6 . 2284 . 1 1 5 LYS CD C -1.319 7.790 -6.209 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CD . . . . . . . . . c30497_6e5i 1 . 6 . 2285 . 1 1 5 LYS CE C -1.683 7.333 -7.612 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CE . . . . . . . . . c30497_6e5i 1 . 6 . 2286 . 1 1 5 LYS CG C -0.798 6.638 -5.365 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CG . . . . . . . . . c30497_6e5i 1 . 6 . 2287 . 1 1 5 LYS H H -1.967 5.484 -2.777 . . . 1.0 . . . . . . . . . . . . A . 5 LYS H . . . . . . . . . c30497_6e5i 1 . 6 . 2288 . 1 1 5 LYS HA H 0.769 5.341 -3.595 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HA . . . . . . . . . c30497_6e5i 1 . 6 . 2289 . 1 1 5 LYS HB2 H -1.230 7.598 -3.523 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HB2 . . . . . . . . . c30497_6e5i 1 . 6 . 2290 . 1 1 5 LYS HB3 H 0.423 7.809 -4.084 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HB3 . . . . . . . . . c30497_6e5i 1 . 6 . 2291 . 1 1 5 LYS HD2 H -2.200 8.200 -5.736 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HD2 . . . . . . . . . c30497_6e5i 1 . 6 . 2292 . 1 1 5 LYS HD3 H -0.555 8.551 -6.274 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HD3 . . . . . . . . . c30497_6e5i 1 . 6 . 2293 . 1 1 5 LYS HE2 H -2.051 8.180 -8.169 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HE2 . . . . . . . . . c30497_6e5i 1 . 6 . 2294 . 1 1 5 LYS HE3 H -0.796 6.945 -8.092 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HE3 . . . . . . . . . c30497_6e5i 1 . 6 . 2295 . 1 1 5 LYS HG2 H 0.060 6.207 -5.859 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HG2 . . . . . . . . . c30497_6e5i 1 . 6 . 2296 . 1 1 5 LYS HG3 H -1.573 5.892 -5.272 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HG3 . . . . . . . . . c30497_6e5i 1 . 6 . 2297 . 1 1 5 LYS HZ1 H -2.966 5.995 -8.572 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HZ1 . . . . . . . . . c30497_6e5i 1 . 6 . 2298 . 1 1 5 LYS HZ2 H -3.585 6.622 -7.131 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HZ2 . . . . . . . . . c30497_6e5i 1 . 6 . 2299 . 1 1 5 LYS HZ3 H -2.383 5.437 -7.086 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HZ3 . . . . . . . . . c30497_6e5i 1 . 6 . 2300 . 1 1 5 LYS N N -1.061 5.133 -2.676 . . . 1.0 . . . . . . . . . . . . A . 5 LYS N . . . . . . . . . c30497_6e5i 1 . 6 . 2301 . 1 1 5 LYS NZ N -2.727 6.275 -7.599 . . . 1.0 . . . . . . . . . . . . A . 5 LYS NZ . . . . . . . . . c30497_6e5i 1 . 6 . 2302 . 1 1 5 LYS O O 1.993 6.628 -1.798 . . . 1.0 . . . . . . . . . . . . A . 5 LYS O . . . . . . . . . c30497_6e5i 1 . 6 . 2303 . 1 1 6 GLU C C 1.343 6.258 1.127 . . . 1.0 . . . . . . . . . . . . A . 6 GLU C . . . . . . . . . c30497_6e5i 1 . 6 . 2304 . 1 1 6 GLU CA C 0.549 7.362 0.442 . . . 1.0 . . . . . . . . . . . . A . 6 GLU CA . . . . . . . . . c30497_6e5i 1 . 6 . 2305 . 1 1 6 GLU CB C -0.555 7.873 1.369 . . . 1.0 . . . . . . . . . . . . A . 6 GLU CB . . . . . . . . . c30497_6e5i 1 . 6 . 2306 . 1 1 6 GLU CD C -0.238 10.299 0.760 . . . 1.0 . . . . . . . . . . . . A . 6 GLU CD . . . . . . . . . c30497_6e5i 1 . 6 . 2307 . 1 1 6 GLU CG C -1.217 9.149 0.876 . . . 1.0 . . . . . . . . . . . . A . 6 GLU CG . . . . . . . . . c30497_6e5i 1 . 6 . 2308 . 1 1 6 GLU H H -0.989 6.810 -0.910 . . . 1.0 . . . . . . . . . . . . A . 6 GLU H . . . . . . . . . c30497_6e5i 1 . 6 . 2309 . 1 1 6 GLU HA H 1.218 8.176 0.210 . . . 1.0 . . . . . . . . . . . . A . 6 GLU HA . . . . . . . . . c30497_6e5i 1 . 6 . 2310 . 1 1 6 GLU HB2 H -1.316 7.111 1.461 . . . 1.0 . . . . . . . . . . . . A . 6 GLU HB2 . . . . . . . . . c30497_6e5i 1 . 6 . 2311 . 1 1 6 GLU HB3 H -0.133 8.066 2.345 . . . 1.0 . . . . . . . . . . . . A . 6 GLU HB3 . . . . . . . . . c30497_6e5i 1 . 6 . 2312 . 1 1 6 GLU HG2 H -1.648 8.965 -0.095 . . . 1.0 . . . . . . . . . . . . A . 6 GLU HG2 . . . . . . . . . c30497_6e5i 1 . 6 . 2313 . 1 1 6 GLU HG3 H -1.997 9.426 1.569 . . . 1.0 . . . . . . . . . . . . A . 6 GLU HG3 . . . . . . . . . c30497_6e5i 1 . 6 . 2314 . 1 1 6 GLU N N -0.014 6.877 -0.813 . . . 1.0 . . . . . . . . . . . . A . 6 GLU N . . . . . . . . . c30497_6e5i 1 . 6 . 2315 . 1 1 6 GLU O O 2.458 6.478 1.601 . . . 1.0 . . . . . . . . . . . . A . 6 GLU O . . . . . . . . . c30497_6e5i 1 . 6 . 2316 . 1 1 6 GLU OE1 O -0.150 11.110 1.704 . . . 1.0 . . . . . . . . . . . . A . 6 GLU OE1 . . . . . . . . . c30497_6e5i 1 . 6 . 2317 . 1 1 6 GLU OE2 O 0.453 10.397 -0.276 . . . 1.0 . . . . . . . . . . . . A . 6 GLU OE2 . . . . . . . . . c30497_6e5i 1 . 6 . 2318 . 1 1 7 LEU C C 2.653 3.524 0.896 . . . 1.0 . . . . . . . . . . . . A . 7 LEU C . . . . . . . . . c30497_6e5i 1 . 6 . 2319 . 1 1 7 LEU CA C 1.435 3.905 1.728 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CA . . . . . . . . . c30497_6e5i 1 . 6 . 2320 . 1 1 7 LEU CB C 0.462 2.726 1.815 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CB . . . . . . . . . c30497_6e5i 1 . 6 . 2321 . 1 1 7 LEU CD1 C -1.761 1.856 2.593 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CD1 . . . . . . . . . c30497_6e5i 1 . 6 . 2322 . 1 1 7 LEU CD2 C -0.159 2.805 4.245 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CD2 . . . . . . . . . c30497_6e5i 1 . 6 . 2323 . 1 1 7 LEU CG C -0.683 2.902 2.820 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CG . . . . . . . . . c30497_6e5i 1 . 6 . 2324 . 1 1 7 LEU H H -0.140 4.960 0.788 . . . 1.0 . . . . . . . . . . . . A . 7 LEU H . . . . . . . . . c30497_6e5i 1 . 6 . 2325 . 1 1 7 LEU HA H 1.761 4.167 2.720 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HA . . . . . . . . . c30497_6e5i 1 . 6 . 2326 . 1 1 7 LEU HB2 H 0.036 2.568 0.836 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HB2 . . . . . . . . . c30497_6e5i 1 . 6 . 2327 . 1 1 7 LEU HB3 H 1.022 1.847 2.091 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HB3 . . . . . . . . . c30497_6e5i 1 . 6 . 2328 . 1 1 7 LEU HD11 H -2.566 2.007 3.298 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD11 . . . . . . . . . c30497_6e5i 1 . 6 . 2329 . 1 1 7 LEU HD12 H -1.344 0.870 2.732 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD12 . . . . . . . . . c30497_6e5i 1 . 6 . 2330 . 1 1 7 LEU HD13 H -2.145 1.945 1.587 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD13 . . . . . . . . . c30497_6e5i 1 . 6 . 2331 . 1 1 7 LEU HD21 H -0.969 2.966 4.939 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD21 . . . . . . . . . c30497_6e5i 1 . 6 . 2332 . 1 1 7 LEU HD22 H 0.603 3.552 4.401 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD22 . . . . . . . . . c30497_6e5i 1 . 6 . 2333 . 1 1 7 LEU HD23 H 0.262 1.823 4.406 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD23 . . . . . . . . . c30497_6e5i 1 . 6 . 2334 . 1 1 7 LEU HG H -1.127 3.879 2.689 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HG . . . . . . . . . c30497_6e5i 1 . 6 . 2335 . 1 1 7 LEU N N 0.766 5.063 1.157 . . . 1.0 . . . . . . . . . . . . A . 7 LEU N . . . . . . . . . c30497_6e5i 1 . 6 . 2336 . 1 1 7 LEU O O 3.698 3.173 1.441 . . . 1.0 . . . . . . . . . . . . A . 7 LEU O . . . . . . . . . c30497_6e5i 1 . 6 . 2337 . 1 1 8 LYS C C 4.782 4.245 -1.074 . . . 1.0 . . . . . . . . . . . . A . 8 LYS C . . . . . . . . . c30497_6e5i 1 . 6 . 2338 . 1 1 8 LYS CA C 3.610 3.312 -1.335 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CA . . . . . . . . . c30497_6e5i 1 . 6 . 2339 . 1 1 8 LYS CB C 3.144 3.454 -2.785 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CB . . . . . . . . . c30497_6e5i 1 . 6 . 2340 . 1 1 8 LYS CD C 3.667 3.241 -5.225 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CD . . . . . . . . . c30497_6e5i 1 . 6 . 2341 . 1 1 8 LYS CE C 4.628 2.679 -6.259 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CE . . . . . . . . . c30497_6e5i 1 . 6 . 2342 . 1 1 8 LYS CG C 4.178 3.026 -3.811 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CG . . . . . . . . . c30497_6e5i 1 . 6 . 2343 . 1 1 8 LYS H H 1.643 3.864 -0.796 . . . 1.0 . . . . . . . . . . . . A . 8 LYS H . . . . . . . . . c30497_6e5i 1 . 6 . 2344 . 1 1 8 LYS HA H 3.926 2.298 -1.160 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HA . . . . . . . . . c30497_6e5i 1 . 6 . 2345 . 1 1 8 LYS HB2 H 2.261 2.849 -2.925 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HB2 . . . . . . . . . c30497_6e5i 1 . 6 . 2346 . 1 1 8 LYS HB3 H 2.893 4.488 -2.969 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HB3 . . . . . . . . . c30497_6e5i 1 . 6 . 2347 . 1 1 8 LYS HD2 H 2.712 2.749 -5.330 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HD2 . . . . . . . . . c30497_6e5i 1 . 6 . 2348 . 1 1 8 LYS HD3 H 3.547 4.301 -5.395 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HD3 . . . . . . . . . c30497_6e5i 1 . 6 . 2349 . 1 1 8 LYS HE2 H 4.726 1.615 -6.098 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HE2 . . . . . . . . . c30497_6e5i 1 . 6 . 2350 . 1 1 8 LYS HE3 H 4.219 2.856 -7.243 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HE3 . . . . . . . . . c30497_6e5i 1 . 6 . 2351 . 1 1 8 LYS HG2 H 5.075 3.610 -3.670 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HG2 . . . . . . . . . c30497_6e5i 1 . 6 . 2352 . 1 1 8 LYS HG3 H 4.400 1.980 -3.672 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HG3 . . . . . . . . . c30497_6e5i 1 . 6 . 2353 . 1 1 8 LYS HZ1 H 6.597 2.910 -6.903 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ1 . . . . . . . . . c30497_6e5i 1 . 6 . 2354 . 1 1 8 LYS HZ2 H 6.394 3.125 -5.240 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ2 . . . . . . . . . c30497_6e5i 1 . 6 . 2355 . 1 1 8 LYS HZ3 H 5.900 4.331 -6.313 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ3 . . . . . . . . . c30497_6e5i 1 . 6 . 2356 . 1 1 8 LYS N N 2.515 3.608 -0.422 . . . 1.0 . . . . . . . . . . . . A . 8 LYS N . . . . . . . . . c30497_6e5i 1 . 6 . 2357 . 1 1 8 LYS NZ N 5.973 3.304 -6.172 . . . 1.0 . . . . . . . . . . . . A . 8 LYS NZ . . . . . . . . . c30497_6e5i 1 . 6 . 2358 . 1 1 8 LYS O O 5.922 3.809 -0.976 . . . 1.0 . . . . . . . . . . . . A . 8 LYS O . . . . . . . . . c30497_6e5i 1 . 6 . 2359 . 1 1 9 LYS C C 6.123 6.273 0.713 . . . 1.0 . . . . . . . . . . . . A . 9 LYS C . . . . . . . . . c30497_6e5i 1 . 6 . 2360 . 1 1 9 LYS CA C 5.509 6.524 -0.660 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CA . . . . . . . . . c30497_6e5i 1 . 6 . 2361 . 1 1 9 LYS CB C 4.908 7.930 -0.723 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CB . . . . . . . . . c30497_6e5i 1 . 6 . 2362 . 1 1 9 LYS CD C 7.053 9.083 -1.356 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CD . . . . . . . . . c30497_6e5i 1 . 6 . 2363 . 1 1 9 LYS CE C 8.098 10.101 -0.929 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CE . . . . . . . . . c30497_6e5i 1 . 6 . 2364 . 1 1 9 LYS CG C 5.893 9.034 -0.375 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CG . . . . . . . . . c30497_6e5i 1 . 6 . 2365 . 1 1 9 LYS H H 3.555 5.821 -1.061 . . . 1.0 . . . . . . . . . . . . A . 9 LYS H . . . . . . . . . c30497_6e5i 1 . 6 . 2366 . 1 1 9 LYS HA H 6.278 6.435 -1.410 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HA . . . . . . . . . c30497_6e5i 1 . 6 . 2367 . 1 1 9 LYS HB2 H 4.541 8.108 -1.722 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HB2 . . . . . . . . . c30497_6e5i 1 . 6 . 2368 . 1 1 9 LYS HB3 H 4.080 7.986 -0.031 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HB3 . . . . . . . . . c30497_6e5i 1 . 6 . 2369 . 1 1 9 LYS HD2 H 7.515 8.108 -1.404 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HD2 . . . . . . . . . c30497_6e5i 1 . 6 . 2370 . 1 1 9 LYS HD3 H 6.676 9.354 -2.330 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HD3 . . . . . . . . . c30497_6e5i 1 . 6 . 2371 . 1 1 9 LYS HE2 H 8.861 10.157 -1.691 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HE2 . . . . . . . . . c30497_6e5i 1 . 6 . 2372 . 1 1 9 LYS HE3 H 7.623 11.065 -0.827 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HE3 . . . . . . . . . c30497_6e5i 1 . 6 . 2373 . 1 1 9 LYS HG2 H 5.378 9.980 -0.395 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HG2 . . . . . . . . . c30497_6e5i 1 . 6 . 2374 . 1 1 9 LYS HG3 H 6.279 8.853 0.617 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HG3 . . . . . . . . . c30497_6e5i 1 . 6 . 2375 . 1 1 9 LYS HZ1 H 9.450 10.443 0.625 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HZ1 . . . . . . . . . c30497_6e5i 1 . 6 . 2376 . 1 1 9 LYS HZ2 H 9.189 8.808 0.289 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HZ2 . . . . . . . . . c30497_6e5i 1 . 6 . 2377 . 1 1 9 LYS HZ3 H 8.016 9.697 1.117 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HZ3 . . . . . . . . . c30497_6e5i 1 . 6 . 2378 . 1 1 9 LYS N N 4.487 5.531 -0.950 . . . 1.0 . . . . . . . . . . . . A . 9 LYS N . . . . . . . . . c30497_6e5i 1 . 6 . 2379 . 1 1 9 LYS NZ N 8.731 9.737 0.364 . . . 1.0 . . . . . . . . . . . . A . 9 LYS NZ . . . . . . . . . c30497_6e5i 1 . 6 . 2380 . 1 1 9 LYS O O 7.339 6.344 0.885 . . . 1.0 . . . . . . . . . . . . A . 9 LYS O . . . . . . . . . c30497_6e5i 1 . 6 . 2381 . 1 1 10 ARG C C 6.644 4.519 3.115 . . . 1.0 . . . . . . . . . . . . A . 10 ARG C . . . . . . . . . c30497_6e5i 1 . 6 . 2382 . 1 1 10 ARG CA C 5.697 5.712 3.046 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CA . . . . . . . . . c30497_6e5i 1 . 6 . 2383 . 1 1 10 ARG CB C 4.473 5.464 3.928 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CB . . . . . . . . . c30497_6e5i 1 . 6 . 2384 . 1 1 10 ARG CD C 3.536 4.902 6.177 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CD . . . . . . . . . c30497_6e5i 1 . 6 . 2385 . 1 1 10 ARG CG C 4.804 5.135 5.372 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CG . . . . . . . . . c30497_6e5i 1 . 6 . 2386 . 1 1 10 ARG CZ C 2.842 4.190 8.430 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CZ . . . . . . . . . c30497_6e5i 1 . 6 . 2387 . 1 1 10 ARG H H 4.311 5.907 1.465 . . . 1.0 . . . . . . . . . . . . A . 10 ARG H . . . . . . . . . c30497_6e5i 1 . 6 . 2388 . 1 1 10 ARG HA H 6.212 6.590 3.401 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HA . . . . . . . . . c30497_6e5i 1 . 6 . 2389 . 1 1 10 ARG HB2 H 3.855 6.349 3.915 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HB2 . . . . . . . . . c30497_6e5i 1 . 6 . 2390 . 1 1 10 ARG HB3 H 3.911 4.640 3.515 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HB3 . . . . . . . . . c30497_6e5i 1 . 6 . 2391 . 1 1 10 ARG HD2 H 2.991 5.831 6.236 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HD2 . . . . . . . . . c30497_6e5i 1 . 6 . 2392 . 1 1 10 ARG HD3 H 2.932 4.168 5.664 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HD3 . . . . . . . . . c30497_6e5i 1 . 6 . 2393 . 1 1 10 ARG HE H 4.738 4.268 7.788 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HE . . . . . . . . . c30497_6e5i 1 . 6 . 2394 . 1 1 10 ARG HG2 H 5.411 4.239 5.397 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HG2 . . . . . . . . . c30497_6e5i 1 . 6 . 2395 . 1 1 10 ARG HG3 H 5.351 5.961 5.803 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HG3 . . . . . . . . . c30497_6e5i 1 . 6 . 2396 . 1 1 10 ARG HH11 H 0.847 4.242 8.791 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HH11 . . . . . . . . . c30497_6e5i 1 . 6 . 2397 . 1 1 10 ARG HH12 H 1.330 4.782 7.214 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HH12 . . . . . . . . . c30497_6e5i 1 . 6 . 2398 . 1 1 10 ARG HH21 H 4.113 3.562 9.880 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HH21 . . . . . . . . . c30497_6e5i 1 . 6 . 2399 . 1 1 10 ARG HH22 H 2.434 3.553 10.309 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HH22 . . . . . . . . . c30497_6e5i 1 . 6 . 2400 . 1 1 10 ARG N N 5.268 5.964 1.679 . . . 1.0 . . . . . . . . . . . . A . 10 ARG N . . . . . . . . . c30497_6e5i 1 . 6 . 2401 . 1 1 10 ARG NE N 3.799 4.426 7.536 . . . 1.0 . . . . . . . . . . . . A . 10 ARG NE . . . . . . . . . c30497_6e5i 1 . 6 . 2402 . 1 1 10 ARG NH1 N 1.571 4.420 8.120 . . . 1.0 . . . . . . . . . . . . A . 10 ARG NH1 . . . . . . . . . c30497_6e5i 1 . 6 . 2403 . 1 1 10 ARG NH2 N 3.155 3.733 9.636 . . . 1.0 . . . . . . . . . . . . A . 10 ARG NH2 . . . . . . . . . c30497_6e5i 1 . 6 . 2404 . 1 1 10 ARG O O 7.684 4.578 3.767 . . . 1.0 . . . . . . . . . . . . A . 10 ARG O . . . . . . . . . c30497_6e5i 1 . 6 . 2405 . 1 1 11 TYR C C 8.179 2.250 1.385 . . . 1.0 . . . . . . . . . . . . A . 11 TYR C . . . . . . . . . c30497_6e5i 1 . 6 . 2406 . 1 1 11 TYR CA C 7.092 2.231 2.453 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CA . . . . . . . . . c30497_6e5i 1 . 6 . 2407 . 1 1 11 TYR CB C 6.202 1.004 2.280 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CB . . . . . . . . . c30497_6e5i 1 . 6 . 2408 . 1 1 11 TYR CD1 C 5.880 -0.262 4.432 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CD1 . . . . . . . . . c30497_6e5i 1 . 6 . 2409 . 1 1 11 TYR CD2 C 4.171 1.259 3.761 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CD2 . . . . . . . . . c30497_6e5i 1 . 6 . 2410 . 1 1 11 TYR CE1 C 5.159 -0.581 5.564 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CE1 . . . . . . . . . c30497_6e5i 1 . 6 . 2411 . 1 1 11 TYR CE2 C 3.444 0.944 4.891 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CE2 . . . . . . . . . c30497_6e5i 1 . 6 . 2412 . 1 1 11 TYR CG C 5.401 0.661 3.512 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CG . . . . . . . . . c30497_6e5i 1 . 6 . 2413 . 1 1 11 TYR CZ C 3.942 0.023 5.788 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CZ . . . . . . . . . c30497_6e5i 1 . 6 . 2414 . 1 1 11 TYR H H 5.466 3.468 1.887 . . . 1.0 . . . . . . . . . . . . A . 11 TYR H . . . . . . . . . c30497_6e5i 1 . 6 . 2415 . 1 1 11 TYR HA H 7.565 2.178 3.420 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HA . . . . . . . . . c30497_6e5i 1 . 6 . 2416 . 1 1 11 TYR HB2 H 5.512 1.180 1.470 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HB2 . . . . . . . . . c30497_6e5i 1 . 6 . 2417 . 1 1 11 TYR HB3 H 6.821 0.155 2.040 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HB3 . . . . . . . . . c30497_6e5i 1 . 6 . 2418 . 1 1 11 TYR HD1 H 6.835 -0.735 4.251 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HD1 . . . . . . . . . c30497_6e5i 1 . 6 . 2419 . 1 1 11 TYR HD2 H 3.782 1.979 3.055 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HD2 . . . . . . . . . c30497_6e5i 1 . 6 . 2420 . 1 1 11 TYR HE1 H 5.550 -1.300 6.267 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HE1 . . . . . . . . . c30497_6e5i 1 . 6 . 2421 . 1 1 11 TYR HE2 H 2.491 1.419 5.067 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HE2 . . . . . . . . . c30497_6e5i 1 . 6 . 2422 . 1 1 11 TYR HH H 2.281 -0.362 6.687 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HH . . . . . . . . . c30497_6e5i 1 . 6 . 2423 . 1 1 11 TYR N N 6.291 3.445 2.427 . . . 1.0 . . . . . . . . . . . . A . 11 TYR N . . . . . . . . . c30497_6e5i 1 . 6 . 2424 . 1 1 11 TYR O O 8.959 1.302 1.259 . . . 1.0 . . . . . . . . . . . . A . 11 TYR O . . . . . . . . . c30497_6e5i 1 . 6 . 2425 . 1 1 11 TYR OH O 3.219 -0.297 6.914 . . . 1.0 . . . . . . . . . . . . A . 11 TYR OH . . . . . . . . . c30497_6e5i 1 . 6 . 2426 . 1 1 12 ORN C C 9.787 0.140 -2.297 . . . 1.0 . . . . . . . . . . . . A . 12 ORN C . . . . . . . . . c30497_6e5i 1 . 6 . 2427 . 1 1 12 ORN CA C 10.663 1.384 -2.202 . . . 1.0 . . . . . . . . . . . . A . 12 ORN CA . . . . . . . . . c30497_6e5i 1 . 6 . 2428 . 1 1 12 ORN CB C 9.881 2.608 -2.688 . . . 1.0 . . . . . . . . . . . . A . 12 ORN CB . . . . . . . . . c30497_6e5i 1 . 6 . 2429 . 1 1 12 ORN CD C 9.215 3.504 -0.443 . . . 1.0 . . . . . . . . . . . . A . 12 ORN CD . . . . . . . . . c30497_6e5i 1 . 6 . 2430 . 1 1 12 ORN CG C 8.722 2.979 -1.780 . . . 1.0 . . . . . . . . . . . . A . 12 ORN CG . . . . . . . . . c30497_6e5i 1 . 6 . 2431 . 1 1 12 ORN H H 12.424 0.382 -2.665 . . . 1.0 . . . . . . . . . . . . A . 12 ORN H . . . . . . . . . c30497_6e5i 1 . 6 . 2432 . 1 1 12 ORN HA H 10.954 1.527 -1.174 . . . 1.0 . . . . . . . . . . . . A . 12 ORN HA . . . . . . . . . c30497_6e5i 1 . 6 . 2433 . 1 1 12 ORN HB2 H 9.488 2.405 -3.674 . . . 1.0 . . . . . . . . . . . . A . 12 ORN HB2 . . . . . . . . . c30497_6e5i 1 . 6 . 2434 . 1 1 12 ORN HB3 H 10.552 3.451 -2.744 . . . 1.0 . . . . . . . . . . . . A . 12 ORN HB3 . . . . . . . . . c30497_6e5i 1 . 6 . 2435 . 1 1 12 ORN HD2 H 9.432 4.554 -0.543 . . . 1.0 . . . . . . . . . . . . A . 12 ORN HD2 . . . . . . . . . c30497_6e5i 1 . 6 . 2436 . 1 1 12 ORN HD3 H 10.114 2.978 -0.173 . . . 1.0 . . . . . . . . . . . . A . 12 ORN HD3 . . . . . . . . . c30497_6e5i 1 . 6 . 2437 . 1 1 12 ORN HE1 H 7.571 4.035 0.752 . . . 1.0 . . . . . . . . . . . . A . 12 ORN HE1 . . . . . . . . . c30497_6e5i 1 . 6 . 2438 . 1 1 12 ORN HG2 H 8.115 2.104 -1.610 . . . 1.0 . . . . . . . . . . . . A . 12 ORN HG2 . . . . . . . . . c30497_6e5i 1 . 6 . 2439 . 1 1 12 ORN HG3 H 8.129 3.742 -2.258 . . . 1.0 . . . . . . . . . . . . A . 12 ORN HG3 . . . . . . . . . c30497_6e5i 1 . 6 . 2440 . 1 1 12 ORN N N 11.886 1.199 -3.014 . . . 1.0 . . . . . . . . . . . . A . 12 ORN N . . . . . . . . . c30497_6e5i 1 . 6 . 2441 . 1 1 12 ORN NE N 8.232 3.325 0.615 . . . 1.0 . . . . . . . . . . . . A . 12 ORN NE . . . . . . . . . c30497_6e5i 1 . 6 . 2442 . 1 1 12 ORN O O 9.761 -0.524 -3.331 . . . 1.0 . . . . . . . . . . . . A . 12 ORN O . . . . . . . . . c30497_6e5i 1 . 6 . 2443 . 1 1 13 CYS C C 6.887 -1.034 -1.867 . . . 1.0 . . . . . . . . . . . . A . 13 CYS C . . . . . . . . . c30497_6e5i 1 . 6 . 2444 . 1 1 13 CYS CA C 8.216 -1.345 -1.200 . . . 1.0 . . . . . . . . . . . . A . 13 CYS CA . . . . . . . . . c30497_6e5i 1 . 6 . 2445 . 1 1 13 CYS CB C 7.977 -1.809 0.233 . . . 1.0 . . . . . . . . . . . . A . 13 CYS CB . . . . . . . . . c30497_6e5i 1 . 6 . 2446 . 1 1 13 CYS H H 9.125 0.398 -0.423 . . . 1.0 . . . . . . . . . . . . A . 13 CYS H . . . . . . . . . c30497_6e5i 1 . 6 . 2447 . 1 1 13 CYS HA H 8.707 -2.133 -1.749 . . . 1.0 . . . . . . . . . . . . A . 13 CYS HA . . . . . . . . . c30497_6e5i 1 . 6 . 2448 . 1 1 13 CYS HB2 H 7.385 -1.070 0.745 . . . 1.0 . . . . . . . . . . . . A . 13 CYS HB2 . . . . . . . . . c30497_6e5i 1 . 6 . 2449 . 1 1 13 CYS HB3 H 7.435 -2.744 0.215 . . . 1.0 . . . . . . . . . . . . A . 13 CYS HB3 . . . . . . . . . c30497_6e5i 1 . 6 . 2450 . 1 1 13 CYS N N 9.078 -0.176 -1.220 . . . 1.0 . . . . . . . . . . . . A . 13 CYS N . . . . . . . . . c30497_6e5i 1 . 6 . 2451 . 1 1 13 CYS O O 6.327 0.048 -1.684 . . . 1.0 . . . . . . . . . . . . A . 13 CYS O . . . . . . . . . c30497_6e5i 1 . 6 . 2452 . 1 1 13 CYS SG S 9.502 -2.068 1.197 . . . 1.0 . . . . . . . . . . . . A . 13 CYS SG . . . . . . . . . c30497_6e5i 1 . 6 . 2453 . 1 1 14 GLU C C 3.982 -2.290 -2.469 . . . 1.0 . . . . . . . . . . . . A . 14 GLU C . . . . . . . . . c30497_6e5i 1 . 6 . 2454 . 1 1 14 GLU CA C 5.137 -1.829 -3.342 . . . 1.0 . . . . . . . . . . . . A . 14 GLU CA . . . . . . . . . c30497_6e5i 1 . 6 . 2455 . 1 1 14 GLU CB C 5.164 -2.631 -4.639 . . . 1.0 . . . . . . . . . . . . A . 14 GLU CB . . . . . . . . . c30497_6e5i 1 . 6 . 2456 . 1 1 14 GLU CD C 6.014 -0.738 -6.082 . . . 1.0 . . . . . . . . . . . . A . 14 GLU CD . . . . . . . . . c30497_6e5i 1 . 6 . 2457 . 1 1 14 GLU CG C 6.225 -2.166 -5.626 . . . 1.0 . . . . . . . . . . . . A . 14 GLU CG . . . . . . . . . c30497_6e5i 1 . 6 . 2458 . 1 1 14 GLU H H 6.869 -2.843 -2.695 . . . 1.0 . . . . . . . . . . . . A . 14 GLU H . . . . . . . . . c30497_6e5i 1 . 6 . 2459 . 1 1 14 GLU HA H 5.011 -0.781 -3.570 . . . 1.0 . . . . . . . . . . . . A . 14 GLU HA . . . . . . . . . c30497_6e5i 1 . 6 . 2460 . 1 1 14 GLU HB2 H 5.355 -3.667 -4.399 . . . 1.0 . . . . . . . . . . . . A . 14 GLU HB2 . . . . . . . . . c30497_6e5i 1 . 6 . 2461 . 1 1 14 GLU HB3 H 4.199 -2.553 -5.116 . . . 1.0 . . . . . . . . . . . . A . 14 GLU HB3 . . . . . . . . . c30497_6e5i 1 . 6 . 2462 . 1 1 14 GLU HG2 H 7.193 -2.236 -5.154 . . . 1.0 . . . . . . . . . . . . A . 14 GLU HG2 . . . . . . . . . c30497_6e5i 1 . 6 . 2463 . 1 1 14 GLU HG3 H 6.200 -2.813 -6.489 . . . 1.0 . . . . . . . . . . . . A . 14 GLU HG3 . . . . . . . . . c30497_6e5i 1 . 6 . 2464 . 1 1 14 GLU N N 6.389 -1.989 -2.628 . . . 1.0 . . . . . . . . . . . . A . 14 GLU N . . . . . . . . . c30497_6e5i 1 . 6 . 2465 . 1 1 14 GLU O O 4.018 -3.385 -1.909 . . . 1.0 . . . . . . . . . . . . A . 14 GLU O . . . . . . . . . c30497_6e5i 1 . 6 . 2466 . 1 1 14 GLU OE1 O 6.681 0.170 -5.550 . . . 1.0 . . . . . . . . . . . . A . 14 GLU OE1 . . . . . . . . . c30497_6e5i 1 . 6 . 2467 . 1 1 14 GLU OE2 O 5.180 -0.518 -6.987 . . . 1.0 . . . . . . . . . . . . A . 14 GLU OE2 . . . . . . . . . c30497_6e5i 1 . 6 . 2468 . 1 1 15 VAL C C 0.675 -2.296 -2.336 . . . 1.0 . . . . . . . . . . . . A . 15 VAL C . . . . . . . . . c30497_6e5i 1 . 6 . 2469 . 1 1 15 VAL CA C 1.834 -1.780 -1.498 . . . 1.0 . . . . . . . . . . . . A . 15 VAL CA . . . . . . . . . c30497_6e5i 1 . 6 . 2470 . 1 1 15 VAL CB C 1.384 -0.559 -0.673 . . . 1.0 . . . . . . . . . . . . A . 15 VAL CB . . . . . . . . . c30497_6e5i 1 . 6 . 2471 . 1 1 15 VAL CG1 C 0.222 -0.917 0.242 . . . 1.0 . . . . . . . . . . . . A . 15 VAL CG1 . . . . . . . . . c30497_6e5i 1 . 6 . 2472 . 1 1 15 VAL CG2 C 2.552 -0.008 0.130 . . . 1.0 . . . . . . . . . . . . A . 15 VAL CG2 . . . . . . . . . c30497_6e5i 1 . 6 . 2473 . 1 1 15 VAL H H 2.971 -0.615 -2.842 . . . 1.0 . . . . . . . . . . . . A . 15 VAL H . . . . . . . . . c30497_6e5i 1 . 6 . 2474 . 1 1 15 VAL HA H 2.140 -2.557 -0.813 . . . 1.0 . . . . . . . . . . . . A . 15 VAL HA . . . . . . . . . c30497_6e5i 1 . 6 . 2475 . 1 1 15 VAL HB H 1.053 0.208 -1.356 . . . 1.0 . . . . . . . . . . . . A . 15 VAL HB . . . . . . . . . c30497_6e5i 1 . 6 . 2476 . 1 1 15 VAL HG11 H -0.057 -0.049 0.821 . . . 1.0 . . . . . . . . . . . . A . 15 VAL HG11 . . . . . . . . . c30497_6e5i 1 . 6 . 2477 . 1 1 15 VAL HG12 H 0.520 -1.714 0.907 . . . 1.0 . . . . . . . . . . . . A . 15 VAL HG12 . . . . . . . . . c30497_6e5i 1 . 6 . 2478 . 1 1 15 VAL HG13 H -0.620 -1.239 -0.353 . . . 1.0 . . . . . . . . . . . . A . 15 VAL HG13 . . . . . . . . . c30497_6e5i 1 . 6 . 2479 . 1 1 15 VAL HG21 H 3.318 0.343 -0.542 . . . 1.0 . . . . . . . . . . . . A . 15 VAL HG21 . . . . . . . . . c30497_6e5i 1 . 6 . 2480 . 1 1 15 VAL HG22 H 2.956 -0.789 0.755 . . . 1.0 . . . . . . . . . . . . A . 15 VAL HG22 . . . . . . . . . c30497_6e5i 1 . 6 . 2481 . 1 1 15 VAL HG23 H 2.211 0.808 0.749 . . . 1.0 . . . . . . . . . . . . A . 15 VAL HG23 . . . . . . . . . c30497_6e5i 1 . 6 . 2482 . 1 1 15 VAL N N 2.967 -1.459 -2.344 . . . 1.0 . . . . . . . . . . . . A . 15 VAL N . . . . . . . . . c30497_6e5i 1 . 6 . 2483 . 1 1 15 VAL O O 0.148 -1.588 -3.196 . . . 1.0 . . . . . . . . . . . . A . 15 VAL O . . . . . . . . . c30497_6e5i 1 . 6 . 2484 . 1 1 16 ARG C C -2.091 -3.995 -2.085 . . . 1.0 . . . . . . . . . . . . A . 16 ARG C . . . . . . . . . c30497_6e5i 1 . 6 . 2485 . 1 1 16 ARG CA C -0.777 -4.175 -2.827 . . . 1.0 . . . . . . . . . . . . A . 16 ARG CA . . . . . . . . . c30497_6e5i 1 . 6 . 2486 . 1 1 16 ARG CB C -0.484 -5.663 -3.022 . . . 1.0 . . . . . . . . . . . . A . 16 ARG CB . . . . . . . . . c30497_6e5i 1 . 6 . 2487 . 1 1 16 ARG CD C 1.056 -7.432 -3.927 . . . 1.0 . . . . . . . . . . . . A . 16 ARG CD . . . . . . . . . c30497_6e5i 1 . 6 . 2488 . 1 1 16 ARG CG C 0.799 -5.940 -3.791 . . . 1.0 . . . . . . . . . . . . A . 16 ARG CG . . . . . . . . . c30497_6e5i 1 . 6 . 2489 . 1 1 16 ARG CZ C -0.264 -9.412 -4.592 . . . 1.0 . . . . . . . . . . . . A . 16 ARG CZ . . . . . . . . . c30497_6e5i 1 . 6 . 2490 . 1 1 16 ARG H H 0.756 -4.041 -1.382 . . . 1.0 . . . . . . . . . . . . A . 16 ARG H . . . . . . . . . c30497_6e5i 1 . 6 . 2491 . 1 1 16 ARG HA H -0.852 -3.698 -3.791 . . . 1.0 . . . . . . . . . . . . A . 16 ARG HA . . . . . . . . . c30497_6e5i 1 . 6 . 2492 . 1 1 16 ARG HB2 H -0.404 -6.132 -2.054 . . . 1.0 . . . . . . . . . . . . A . 16 ARG HB2 . . . . . . . . . c30497_6e5i 1 . 6 . 2493 . 1 1 16 ARG HB3 H -1.304 -6.110 -3.562 . . . 1.0 . . . . . . . . . . . . A . 16 ARG HB3 . . . . . . . . . c30497_6e5i 1 . 6 . 2494 . 1 1 16 ARG HD2 H 1.997 -7.578 -4.439 . . . 1.0 . . . . . . . . . . . . A . 16 ARG HD2 . . . . . . . . . c30497_6e5i 1 . 6 . 2495 . 1 1 16 ARG HD3 H 1.116 -7.865 -2.939 . . . 1.0 . . . . . . . . . . . . A . 16 ARG HD3 . . . . . . . . . c30497_6e5i 1 . 6 . 2496 . 1 1 16 ARG HE H -0.551 -7.554 -5.278 . . . 1.0 . . . . . . . . . . . . A . 16 ARG HE . . . . . . . . . c30497_6e5i 1 . 6 . 2497 . 1 1 16 ARG HG2 H 0.717 -5.509 -4.778 . . . 1.0 . . . . . . . . . . . . A . 16 ARG HG2 . . . . . . . . . c30497_6e5i 1 . 6 . 2498 . 1 1 16 ARG HG3 H 1.628 -5.487 -3.268 . . . 1.0 . . . . . . . . . . . . A . 16 ARG HG3 . . . . . . . . . c30497_6e5i 1 . 6 . 2499 . 1 1 16 ARG HH11 H 1.204 -9.797 -3.247 . . . 1.0 . . . . . . . . . . . . A . 16 ARG HH11 . . . . . . . . . c30497_6e5i 1 . 6 . 2500 . 1 1 16 ARG HH12 H 0.255 -11.168 -3.723 . . . 1.0 . . . . . . . . . . . . A . 16 ARG HH12 . . . . . . . . . c30497_6e5i 1 . 6 . 2501 . 1 1 16 ARG HH21 H -1.454 -10.920 -5.239 . . . 1.0 . . . . . . . . . . . . A . 16 ARG HH21 . . . . . . . . . c30497_6e5i 1 . 6 . 2502 . 1 1 16 ARG HH22 H -1.812 -9.357 -5.899 . . . 1.0 . . . . . . . . . . . . A . 16 ARG HH22 . . . . . . . . . c30497_6e5i 1 . 6 . 2503 . 1 1 16 ARG N N 0.299 -3.537 -2.092 . . . 1.0 . . . . . . . . . . . . A . 16 ARG N . . . . . . . . . c30497_6e5i 1 . 6 . 2504 . 1 1 16 ARG NE N -0.003 -8.107 -4.678 . . . 1.0 . . . . . . . . . . . . A . 16 ARG NE . . . . . . . . . c30497_6e5i 1 . 6 . 2505 . 1 1 16 ARG NH1 N 0.458 -10.188 -3.791 . . . 1.0 . . . . . . . . . . . . A . 16 ARG NH1 . . . . . . . . . c30497_6e5i 1 . 6 . 2506 . 1 1 16 ARG NH2 N -1.254 -9.938 -5.301 . . . 1.0 . . . . . . . . . . . . A . 16 ARG NH2 . . . . . . . . . c30497_6e5i 1 . 6 . 2507 . 1 1 16 ARG O O -2.288 -4.552 -1.005 . . . 1.0 . . . . . . . . . . . . A . 16 ARG O . . . . . . . . . c30497_6e5i 1 . 6 . 2508 . 1 1 17 CYS C C -5.310 -3.921 -2.503 . . . 1.0 . . . . . . . . . . . . A . 17 CYS C . . . . . . . . . c30497_6e5i 1 . 6 . 2509 . 1 1 17 CYS CA C -4.257 -2.924 -2.045 . . . 1.0 . . . . . . . . . . . . A . 17 CYS CA . . . . . . . . . c30497_6e5i 1 . 6 . 2510 . 1 1 17 CYS CB C -4.701 -1.505 -2.389 . . . 1.0 . . . . . . . . . . . . A . 17 CYS CB . . . . . . . . . c30497_6e5i 1 . 6 . 2511 . 1 1 17 CYS H H -2.763 -2.801 -3.528 . . . 1.0 . . . . . . . . . . . . A . 17 CYS H . . . . . . . . . c30497_6e5i 1 . 6 . 2512 . 1 1 17 CYS HA H -4.135 -3.006 -0.975 . . . 1.0 . . . . . . . . . . . . A . 17 CYS HA . . . . . . . . . c30497_6e5i 1 . 6 . 2513 . 1 1 17 CYS HB2 H -4.825 -1.426 -3.457 . . . 1.0 . . . . . . . . . . . . A . 17 CYS HB2 . . . . . . . . . c30497_6e5i 1 . 6 . 2514 . 1 1 17 CYS HB3 H -5.644 -1.301 -1.903 . . . 1.0 . . . . . . . . . . . . A . 17 CYS HB3 . . . . . . . . . c30497_6e5i 1 . 6 . 2515 . 1 1 17 CYS N N -2.976 -3.207 -2.662 . . . 1.0 . . . . . . . . . . . . A . 17 CYS N . . . . . . . . . c30497_6e5i 1 . 6 . 2516 . 1 1 17 CYS O O -5.621 -4.017 -3.693 . . . 1.0 . . . . . . . . . . . . A . 17 CYS O . . . . . . . . . c30497_6e5i 1 . 6 . 2517 . 1 1 17 CYS SG S -3.518 -0.222 -1.872 . . . 1.0 . . . . . . . . . . . . A . 17 CYS SG . . . . . . . . . c30497_6e5i 1 . 6 . 2518 . 1 1 18 ASP C C -8.085 -5.282 -0.890 . . . 1.0 . . . . . . . . . . . . A . 18 ASP C . . . . . . . . . c30497_6e5i 1 . 6 . 2519 . 1 1 18 ASP CA C -6.927 -5.596 -1.820 . . . 1.0 . . . . . . . . . . . . A . 18 ASP CA . . . . . . . . . c30497_6e5i 1 . 6 . 2520 . 1 1 18 ASP CB C -6.464 -7.041 -1.624 . . . 1.0 . . . . . . . . . . . . A . 18 ASP CB . . . . . . . . . c30497_6e5i 1 . 6 . 2521 . 1 1 18 ASP CG C -7.497 -8.048 -2.089 . . . 1.0 . . . . . . . . . . . . A . 18 ASP CG . . . . . . . . . c30497_6e5i 1 . 6 . 2522 . 1 1 18 ASP H H -5.515 -4.570 -0.631 . . . 1.0 . . . . . . . . . . . . A . 18 ASP H . . . . . . . . . c30497_6e5i 1 . 6 . 2523 . 1 1 18 ASP HA H -7.246 -5.457 -2.844 . . . 1.0 . . . . . . . . . . . . A . 18 ASP HA . . . . . . . . . c30497_6e5i 1 . 6 . 2524 . 1 1 18 ASP HB2 H -5.555 -7.201 -2.180 . . . 1.0 . . . . . . . . . . . . A . 18 ASP HB2 . . . . . . . . . c30497_6e5i 1 . 6 . 2525 . 1 1 18 ASP HB3 H -6.272 -7.210 -0.575 . . . 1.0 . . . . . . . . . . . . A . 18 ASP HB3 . . . . . . . . . c30497_6e5i 1 . 6 . 2526 . 1 1 18 ASP N N -5.847 -4.663 -1.553 . . . 1.0 . . . . . . . . . . . . A . 18 ASP N . . . . . . . . . c30497_6e5i 1 . 6 . 2527 . 1 1 18 ASP O O -8.157 -5.799 0.226 . . . 1.0 . . . . . . . . . . . . A . 18 ASP O . . . . . . . . . c30497_6e5i 1 . 6 . 2528 . 1 1 18 ASP OD1 O -8.168 -8.659 -1.228 . . . 1.0 . . . . . . . . . . . . A . 18 ASP OD1 . . . . . . . . . c30497_6e5i 1 . 6 . 2529 . 1 1 18 ASP OD2 O -7.661 -8.222 -3.316 . . . 1.0 . . . . . . . . . . . . A . 18 ASP OD2 . . . . . . . . . c30497_6e5i 1 . 6 . 2530 . 1 1 19 DPR C C -9.563 -3.178 0.743 . . . 1.0 . . . . . . . . . . . . A . 19 DPR C . . . . . . . . . c30497_6e5i 1 . 6 . 2531 . 1 1 19 DPR CA C -10.087 -3.932 -0.477 . . . 1.0 . . . . . . . . . . . . A . 19 DPR CA . . . . . . . . . c30497_6e5i 1 . 6 . 2532 . 1 1 19 DPR CB C -10.900 -3.011 -1.388 . . . 1.0 . . . . . . . . . . . . A . 19 DPR CB . . . . . . . . . c30497_6e5i 1 . 6 . 2533 . 1 1 19 DPR CD C -8.995 -3.752 -2.645 . . . 1.0 . . . . . . . . . . . . A . 19 DPR CD . . . . . . . . . c30497_6e5i 1 . 6 . 2534 . 1 1 19 DPR CG C -9.966 -2.614 -2.478 . . . 1.0 . . . . . . . . . . . . A . 19 DPR CG . . . . . . . . . c30497_6e5i 1 . 6 . 2535 . 1 1 19 DPR HA H -10.706 -4.752 -0.157 . . . 1.0 . . . . . . . . . . . . A . 19 DPR HA . . . . . . . . . c30497_6e5i 1 . 6 . 2536 . 1 1 19 DPR HB2 H -11.235 -2.152 -0.826 . . . 1.0 . . . . . . . . . . . . A . 19 DPR HB2 . . . . . . . . . c30497_6e5i 1 . 6 . 2537 . 1 1 19 DPR HB3 H -11.754 -3.549 -1.773 . . . 1.0 . . . . . . . . . . . . A . 19 DPR HB3 . . . . . . . . . c30497_6e5i 1 . 6 . 2538 . 1 1 19 DPR HD2 H -8.014 -3.375 -2.898 . . . 1.0 . . . . . . . . . . . . A . 19 DPR HD2 . . . . . . . . . c30497_6e5i 1 . 6 . 2539 . 1 1 19 DPR HD3 H -9.344 -4.440 -3.402 . . . 1.0 . . . . . . . . . . . . A . 19 DPR HD3 . . . . . . . . . c30497_6e5i 1 . 6 . 2540 . 1 1 19 DPR HG2 H -9.440 -1.714 -2.199 . . . 1.0 . . . . . . . . . . . . A . 19 DPR HG2 . . . . . . . . . c30497_6e5i 1 . 6 . 2541 . 1 1 19 DPR HG3 H -10.517 -2.456 -3.393 . . . 1.0 . . . . . . . . . . . . A . 19 DPR HG3 . . . . . . . . . c30497_6e5i 1 . 6 . 2542 . 1 1 19 DPR N N -8.986 -4.390 -1.318 . . . 1.0 . . . . . . . . . . . . A . 19 DPR N . . . . . . . . . c30497_6e5i 1 . 6 . 2543 . 1 1 19 DPR O O -8.836 -2.192 0.609 . . . 1.0 . . . . . . . . . . . . A . 19 DPR O . . . . . . . . . c30497_6e5i 1 . 6 . 2544 . 1 1 20 PRO C C -8.037 -3.587 3.570 . . . 1.0 . . . . . . . . . . . . A . 20 PRO C . . . . . . . . . c30497_6e5i 1 . 6 . 2545 . 1 1 20 PRO CA C -9.423 -3.064 3.192 . . . 1.0 . . . . . . . . . . . . A . 20 PRO CA . . . . . . . . . c30497_6e5i 1 . 6 . 2546 . 1 1 20 PRO CB C -10.464 -3.523 4.208 . . . 1.0 . . . . . . . . . . . . A . 20 PRO CB . . . . . . . . . c30497_6e5i 1 . 6 . 2547 . 1 1 20 PRO CD C -10.852 -4.758 2.187 . . . 1.0 . . . . . . . . . . . . A . 20 PRO CD . . . . . . . . . c30497_6e5i 1 . 6 . 2548 . 1 1 20 PRO CG C -10.938 -4.835 3.690 . . . 1.0 . . . . . . . . . . . . A . 20 PRO CG . . . . . . . . . c30497_6e5i 1 . 6 . 2549 . 1 1 20 PRO HA H -9.404 -1.987 3.149 . . . 1.0 . . . . . . . . . . . . A . 20 PRO HA . . . . . . . . . c30497_6e5i 1 . 6 . 2550 . 1 1 20 PRO HB2 H -10.002 -3.622 5.179 . . . 1.0 . . . . . . . . . . . . A . 20 PRO HB2 . . . . . . . . . c30497_6e5i 1 . 6 . 2551 . 1 1 20 PRO HB3 H -11.268 -2.803 4.256 . . . 1.0 . . . . . . . . . . . . A . 20 PRO HB3 . . . . . . . . . c30497_6e5i 1 . 6 . 2552 . 1 1 20 PRO HD2 H -10.464 -5.681 1.782 . . . 1.0 . . . . . . . . . . . . A . 20 PRO HD2 . . . . . . . . . c30497_6e5i 1 . 6 . 2553 . 1 1 20 PRO HD3 H -11.822 -4.541 1.768 . . . 1.0 . . . . . . . . . . . . A . 20 PRO HD3 . . . . . . . . . c30497_6e5i 1 . 6 . 2554 . 1 1 20 PRO HG2 H -10.302 -5.624 4.059 . . . 1.0 . . . . . . . . . . . . A . 20 PRO HG2 . . . . . . . . . c30497_6e5i 1 . 6 . 2555 . 1 1 20 PRO HG3 H -11.959 -5.004 3.997 . . . 1.0 . . . . . . . . . . . . A . 20 PRO HG3 . . . . . . . . . c30497_6e5i 1 . 6 . 2556 . 1 1 20 PRO N N -9.917 -3.643 1.944 . . . 1.0 . . . . . . . . . . . . A . 20 PRO N . . . . . . . . . c30497_6e5i 1 . 6 . 2557 . 1 1 20 PRO O O -7.461 -3.176 4.577 . . . 1.0 . . . . . . . . . . . . A . 20 PRO O . . . . . . . . . c30497_6e5i 1 . 6 . 2558 . 1 1 21 ARG C C -5.108 -4.380 2.278 . . . 1.0 . . . . . . . . . . . . A . 21 ARG C . . . . . . . . . c30497_6e5i 1 . 6 . 2559 . 1 1 21 ARG CA C -6.209 -5.091 3.048 . . . 1.0 . . . . . . . . . . . . A . 21 ARG CA . . . . . . . . . c30497_6e5i 1 . 6 . 2560 . 1 1 21 ARG CB C -6.200 -6.573 2.679 . . . 1.0 . . . . . . . . . . . . A . 21 ARG CB . . . . . . . . . c30497_6e5i 1 . 6 . 2561 . 1 1 21 ARG CD C -7.199 -8.859 2.962 . . . 1.0 . . . . . . . . . . . . A . 21 ARG CD . . . . . . . . . c30497_6e5i 1 . 6 . 2562 . 1 1 21 ARG CG C -7.289 -7.390 3.354 . . . 1.0 . . . . . . . . . . . . A . 21 ARG CG . . . . . . . . . c30497_6e5i 1 . 6 . 2563 . 1 1 21 ARG CZ C -4.930 -9.830 2.726 . . . 1.0 . . . . . . . . . . . . A . 21 ARG CZ . . . . . . . . . c30497_6e5i 1 . 6 . 2564 . 1 1 21 ARG H H -7.984 -4.757 1.943 . . . 1.0 . . . . . . . . . . . . A . 21 ARG H . . . . . . . . . c30497_6e5i 1 . 6 . 2565 . 1 1 21 ARG HA H -6.020 -4.987 4.105 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HA . . . . . . . . . c30497_6e5i 1 . 6 . 2566 . 1 1 21 ARG HB2 H -6.327 -6.664 1.611 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HB2 . . . . . . . . . c30497_6e5i 1 . 6 . 2567 . 1 1 21 ARG HB3 H -5.244 -6.992 2.953 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HB3 . . . . . . . . . c30497_6e5i 1 . 6 . 2568 . 1 1 21 ARG HD2 H -8.061 -9.375 3.356 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HD2 . . . . . . . . . c30497_6e5i 1 . 6 . 2569 . 1 1 21 ARG HD3 H -7.201 -8.929 1.885 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HD3 . . . . . . . . . c30497_6e5i 1 . 6 . 2570 . 1 1 21 ARG HE H -5.959 -9.704 4.443 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HE . . . . . . . . . c30497_6e5i 1 . 6 . 2571 . 1 1 21 ARG HG2 H -7.181 -7.303 4.423 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HG2 . . . . . . . . . c30497_6e5i 1 . 6 . 2572 . 1 1 21 ARG HG3 H -8.253 -7.005 3.054 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HG3 . . . . . . . . . c30497_6e5i 1 . 6 . 2573 . 1 1 21 ARG HH11 H -5.702 -9.107 0.997 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HH11 . . . . . . . . . c30497_6e5i 1 . 6 . 2574 . 1 1 21 ARG HH12 H -4.110 -9.797 0.862 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HH12 . . . . . . . . . c30497_6e5i 1 . 6 . 2575 . 1 1 21 ARG HH21 H -3.888 -10.641 4.264 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HH21 . . . . . . . . . c30497_6e5i 1 . 6 . 2576 . 1 1 21 ARG HH22 H -3.096 -10.693 2.721 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HH22 . . . . . . . . . c30497_6e5i 1 . 6 . 2577 . 1 1 21 ARG N N -7.502 -4.493 2.761 . . . 1.0 . . . . . . . . . . . . A . 21 ARG N . . . . . . . . . c30497_6e5i 1 . 6 . 2578 . 1 1 21 ARG NE N -5.983 -9.497 3.478 . . . 1.0 . . . . . . . . . . . . A . 21 ARG NE . . . . . . . . . c30497_6e5i 1 . 6 . 2579 . 1 1 21 ARG NH1 N -4.918 -9.559 1.425 . . . 1.0 . . . . . . . . . . . . A . 21 ARG NH1 . . . . . . . . . c30497_6e5i 1 . 6 . 2580 . 1 1 21 ARG NH2 N -3.886 -10.433 3.282 . . . 1.0 . . . . . . . . . . . . A . 21 ARG NH2 . . . . . . . . . c30497_6e5i 1 . 6 . 2581 . 1 1 21 ARG O O -5.294 -3.990 1.126 . . . 1.0 . . . . . . . . . . . . A . 21 ARG O . . . . . . . . . c30497_6e5i 1 . 6 . 2582 . 1 1 22 TYR C C -1.577 -4.454 2.538 . . . 1.0 . . . . . . . . . . . . A . 22 TYR C . . . . . . . . . c30497_6e5i 1 . 6 . 2583 . 1 1 22 TYR CA C -2.809 -3.605 2.283 . . . 1.0 . . . . . . . . . . . . A . 22 TYR CA . . . . . . . . . c30497_6e5i 1 . 6 . 2584 . 1 1 22 TYR CB C -2.577 -2.188 2.806 . . . 1.0 . . . . . . . . . . . . A . 22 TYR CB . . . . . . . . . c30497_6e5i 1 . 6 . 2585 . 1 1 22 TYR CD1 C -3.965 -0.594 1.440 . . . 1.0 . . . . . . . . . . . . A . 22 TYR CD1 . . . . . . . . . c30497_6e5i 1 . 6 . 2586 . 1 1 22 TYR CD2 C -4.683 -1.098 3.654 . . . 1.0 . . . . . . . . . . . . A . 22 TYR CD2 . . . . . . . . . c30497_6e5i 1 . 6 . 2587 . 1 1 22 TYR CE1 C -5.047 0.243 1.273 . . . 1.0 . . . . . . . . . . . . A . 22 TYR CE1 . . . . . . . . . c30497_6e5i 1 . 6 . 2588 . 1 1 22 TYR CE2 C -5.769 -0.264 3.495 . . . 1.0 . . . . . . . . . . . . A . 22 TYR CE2 . . . . . . . . . c30497_6e5i 1 . 6 . 2589 . 1 1 22 TYR CG C -3.764 -1.276 2.630 . . . 1.0 . . . . . . . . . . . . A . 22 TYR CG . . . . . . . . . c30497_6e5i 1 . 6 . 2590 . 1 1 22 TYR CZ C -5.948 0.405 2.304 . . . 1.0 . . . . . . . . . . . . A . 22 TYR CZ . . . . . . . . . c30497_6e5i 1 . 6 . 2591 . 1 1 22 TYR H H -3.899 -4.501 3.855 . . . 1.0 . . . . . . . . . . . . A . 22 TYR H . . . . . . . . . c30497_6e5i 1 . 6 . 2592 . 1 1 22 TYR HA H -2.995 -3.566 1.221 . . . 1.0 . . . . . . . . . . . . A . 22 TYR HA . . . . . . . . . c30497_6e5i 1 . 6 . 2593 . 1 1 22 TYR HB2 H -2.344 -2.230 3.858 . . . 1.0 . . . . . . . . . . . . A . 22 TYR HB2 . . . . . . . . . c30497_6e5i 1 . 6 . 2594 . 1 1 22 TYR HB3 H -1.744 -1.753 2.276 . . . 1.0 . . . . . . . . . . . . A . 22 TYR HB3 . . . . . . . . . c30497_6e5i 1 . 6 . 2595 . 1 1 22 TYR HD1 H -3.257 -0.724 0.634 . . . 1.0 . . . . . . . . . . . . A . 22 TYR HD1 . . . . . . . . . c30497_6e5i 1 . 6 . 2596 . 1 1 22 TYR HD2 H -4.540 -1.624 4.585 . . . 1.0 . . . . . . . . . . . . A . 22 TYR HD2 . . . . . . . . . c30497_6e5i 1 . 6 . 2597 . 1 1 22 TYR HE1 H -5.184 0.763 0.338 . . . 1.0 . . . . . . . . . . . . A . 22 TYR HE1 . . . . . . . . . c30497_6e5i 1 . 6 . 2598 . 1 1 22 TYR HE2 H -6.473 -0.139 4.303 . . . 1.0 . . . . . . . . . . . . A . 22 TYR HE2 . . . . . . . . . c30497_6e5i 1 . 6 . 2599 . 1 1 22 TYR HH H -7.449 1.058 1.293 . . . 1.0 . . . . . . . . . . . . A . 22 TYR HH . . . . . . . . . c30497_6e5i 1 . 6 . 2600 . 1 1 22 TYR N N -3.966 -4.211 2.921 . . . 1.0 . . . . . . . . . . . . A . 22 TYR N . . . . . . . . . c30497_6e5i 1 . 6 . 2601 . 1 1 22 TYR O O -1.055 -4.493 3.653 . . . 1.0 . . . . . . . . . . . . A . 22 TYR O . . . . . . . . . c30497_6e5i 1 . 6 . 2602 . 1 1 22 TYR OH O -7.029 1.240 2.144 . . . 1.0 . . . . . . . . . . . . A . 22 TYR OH . . . . . . . . . c30497_6e5i 1 . 6 . 2603 . 1 1 23 GLU C C 1.282 -5.345 1.123 . . . 1.0 . . . . . . . . . . . . A . 23 GLU C . . . . . . . . . c30497_6e5i 1 . 6 . 2604 . 1 1 23 GLU CA C 0.023 -6.022 1.627 . . . 1.0 . . . . . . . . . . . . A . 23 GLU CA . . . . . . . . . c30497_6e5i 1 . 6 . 2605 . 1 1 23 GLU CB C -0.213 -7.314 0.853 . . . 1.0 . . . . . . . . . . . . A . 23 GLU CB . . . . . . . . . c30497_6e5i 1 . 6 . 2606 . 1 1 23 GLU CD C -1.498 -9.467 0.670 . . . 1.0 . . . . . . . . . . . . A . 23 GLU CD . . . . . . . . . c30497_6e5i 1 . 6 . 2607 . 1 1 23 GLU CG C -1.342 -8.161 1.412 . . . 1.0 . . . . . . . . . . . . A . 23 GLU CG . . . . . . . . . c30497_6e5i 1 . 6 . 2608 . 1 1 23 GLU H H -1.551 -5.025 0.629 . . . 1.0 . . . . . . . . . . . . A . 23 GLU H . . . . . . . . . c30497_6e5i 1 . 6 . 2609 . 1 1 23 GLU HA H 0.150 -6.257 2.671 . . . 1.0 . . . . . . . . . . . . A . 23 GLU HA . . . . . . . . . c30497_6e5i 1 . 6 . 2610 . 1 1 23 GLU HB2 H -0.447 -7.066 -0.170 . . . 1.0 . . . . . . . . . . . . A . 23 GLU HB2 . . . . . . . . . c30497_6e5i 1 . 6 . 2611 . 1 1 23 GLU HB3 H 0.692 -7.899 0.874 . . . 1.0 . . . . . . . . . . . . A . 23 GLU HB3 . . . . . . . . . c30497_6e5i 1 . 6 . 2612 . 1 1 23 GLU HG2 H -1.134 -8.379 2.449 . . . 1.0 . . . . . . . . . . . . A . 23 GLU HG2 . . . . . . . . . c30497_6e5i 1 . 6 . 2613 . 1 1 23 GLU HG3 H -2.267 -7.608 1.338 . . . 1.0 . . . . . . . . . . . . A . 23 GLU HG3 . . . . . . . . . c30497_6e5i 1 . 6 . 2614 . 1 1 23 GLU N N -1.118 -5.135 1.506 . . . 1.0 . . . . . . . . . . . . A . 23 GLU N . . . . . . . . . c30497_6e5i 1 . 6 . 2615 . 1 1 23 GLU O O 1.415 -5.066 -0.065 . . . 1.0 . . . . . . . . . . . . A . 23 GLU O . . . . . . . . . c30497_6e5i 1 . 6 . 2616 . 1 1 23 GLU OE1 O -2.585 -9.713 0.110 . . . 1.0 . . . . . . . . . . . . A . 23 GLU OE1 . . . . . . . . . c30497_6e5i 1 . 6 . 2617 . 1 1 23 GLU OE2 O -0.527 -10.256 0.638 . . . 1.0 . . . . . . . . . . . . A . 23 GLU OE2 . . . . . . . . . c30497_6e5i 1 . 6 . 2618 . 1 1 24 VAL C C 4.448 -5.467 1.143 . . . 1.0 . . . . . . . . . . . . A . 24 VAL C . . . . . . . . . c30497_6e5i 1 . 6 . 2619 . 1 1 24 VAL CA C 3.446 -4.435 1.657 . . . 1.0 . . . . . . . . . . . . A . 24 VAL CA . . . . . . . . . c30497_6e5i 1 . 6 . 2620 . 1 1 24 VAL CB C 4.044 -3.615 2.826 . . . 1.0 . . . . . . . . . . . . A . 24 VAL CB . . . . . . . . . c30497_6e5i 1 . 6 . 2621 . 1 1 24 VAL CG1 C 3.078 -2.519 3.245 . . . 1.0 . . . . . . . . . . . . A . 24 VAL CG1 . . . . . . . . . c30497_6e5i 1 . 6 . 2622 . 1 1 24 VAL CG2 C 4.379 -4.500 4.017 . . . 1.0 . . . . . . . . . . . . A . 24 VAL CG2 . . . . . . . . . c30497_6e5i 1 . 6 . 2623 . 1 1 24 VAL H H 2.048 -5.336 2.961 . . . 1.0 . . . . . . . . . . . . A . 24 VAL H . . . . . . . . . c30497_6e5i 1 . 6 . 2624 . 1 1 24 VAL HA H 3.224 -3.751 0.849 . . . 1.0 . . . . . . . . . . . . A . 24 VAL HA . . . . . . . . . c30497_6e5i 1 . 6 . 2625 . 1 1 24 VAL HB H 4.957 -3.147 2.484 . . . 1.0 . . . . . . . . . . . . A . 24 VAL HB . . . . . . . . . c30497_6e5i 1 . 6 . 2626 . 1 1 24 VAL HG11 H 3.520 -1.930 4.036 . . . 1.0 . . . . . . . . . . . . A . 24 VAL HG11 . . . . . . . . . c30497_6e5i 1 . 6 . 2627 . 1 1 24 VAL HG12 H 2.160 -2.964 3.600 . . . 1.0 . . . . . . . . . . . . A . 24 VAL HG12 . . . . . . . . . c30497_6e5i 1 . 6 . 2628 . 1 1 24 VAL HG13 H 2.865 -1.885 2.400 . . . 1.0 . . . . . . . . . . . . A . 24 VAL HG13 . . . . . . . . . c30497_6e5i 1 . 6 . 2629 . 1 1 24 VAL HG21 H 5.069 -5.271 3.707 . . . 1.0 . . . . . . . . . . . . A . 24 VAL HG21 . . . . . . . . . c30497_6e5i 1 . 6 . 2630 . 1 1 24 VAL HG22 H 3.476 -4.955 4.394 . . . 1.0 . . . . . . . . . . . . A . 24 VAL HG22 . . . . . . . . . c30497_6e5i 1 . 6 . 2631 . 1 1 24 VAL HG23 H 4.833 -3.902 4.793 . . . 1.0 . . . . . . . . . . . . A . 24 VAL HG23 . . . . . . . . . c30497_6e5i 1 . 6 . 2632 . 1 1 24 VAL N N 2.203 -5.081 2.027 . . . 1.0 . . . . . . . . . . . . A . 24 VAL N . . . . . . . . . c30497_6e5i 1 . 6 . 2633 . 1 1 24 VAL O O 4.757 -6.455 1.816 . . . 1.0 . . . . . . . . . . . . A . 24 VAL O . . . . . . . . . c30497_6e5i 1 . 6 . 2634 . 1 1 25 HIS C C 7.107 -5.457 -1.133 . . . 1.0 . . . . . . . . . . . . A . 25 HIS C . . . . . . . . . c30497_6e5i 1 . 6 . 2635 . 1 1 25 HIS CA C 5.844 -6.184 -0.695 . . . 1.0 . . . . . . . . . . . . A . 25 HIS CA . . . . . . . . . c30497_6e5i 1 . 6 . 2636 . 1 1 25 HIS CB C 5.188 -6.871 -1.896 . . . 1.0 . . . . . . . . . . . . A . 25 HIS CB . . . . . . . . . c30497_6e5i 1 . 6 . 2637 . 1 1 25 HIS CD2 C 6.299 -9.197 -2.216 . . . 1.0 . . . . . . . . . . . . A . 25 HIS CD2 . . . . . . . . . c30497_6e5i 1 . 6 . 2638 . 1 1 25 HIS CE1 C 7.471 -8.750 -4.010 . . . 1.0 . . . . . . . . . . . . A . 25 HIS CE1 . . . . . . . . . c30497_6e5i 1 . 6 . 2639 . 1 1 25 HIS CG C 6.057 -7.906 -2.547 . . . 1.0 . . . . . . . . . . . . A . 25 HIS CG . . . . . . . . . c30497_6e5i 1 . 6 . 2640 . 1 1 25 HIS H H 4.625 -4.463 -0.570 . . . 1.0 . . . . . . . . . . . . A . 25 HIS H . . . . . . . . . c30497_6e5i 1 . 6 . 2641 . 1 1 25 HIS HA H 6.106 -6.929 0.036 . . . 1.0 . . . . . . . . . . . . A . 25 HIS HA . . . . . . . . . c30497_6e5i 1 . 6 . 2642 . 1 1 25 HIS HB2 H 4.279 -7.355 -1.573 . . . 1.0 . . . . . . . . . . . . A . 25 HIS HB2 . . . . . . . . . c30497_6e5i 1 . 6 . 2643 . 1 1 25 HIS HB3 H 4.947 -6.126 -2.638 . . . 1.0 . . . . . . . . . . . . A . 25 HIS HB3 . . . . . . . . . c30497_6e5i 1 . 6 . 2644 . 1 1 25 HIS HD1 H 6.839 -6.810 -4.171 . . . 1.0 . . . . . . . . . . . . A . 25 HIS HD1 . . . . . . . . . c30497_6e5i 1 . 6 . 2645 . 1 1 25 HIS HD2 H 5.875 -9.734 -1.381 . . . 1.0 . . . . . . . . . . . . A . 25 HIS HD2 . . . . . . . . . c30497_6e5i 1 . 6 . 2646 . 1 1 25 HIS HE1 H 8.139 -8.849 -4.850 . . . 1.0 . . . . . . . . . . . . A . 25 HIS HE1 . . . . . . . . . c30497_6e5i 1 . 6 . 2647 . 1 1 25 HIS HE2 H 7.436 -10.641 -3.231 . . . 1.0 . . . . . . . . . . . . A . 25 HIS HE2 . . . . . . . . . c30497_6e5i 1 . 6 . 2648 . 1 1 25 HIS N N 4.916 -5.260 -0.071 . . . 1.0 . . . . . . . . . . . . A . 25 HIS N . . . . . . . . . c30497_6e5i 1 . 6 . 2649 . 1 1 25 HIS ND1 N 6.805 -7.660 -3.677 . . . 1.0 . . . . . . . . . . . . A . 25 HIS ND1 . . . . . . . . . c30497_6e5i 1 . 6 . 2650 . 1 1 25 HIS NE2 N 7.180 -9.695 -3.140 . . . 1.0 . . . . . . . . . . . . A . 25 HIS NE2 . . . . . . . . . c30497_6e5i 1 . 6 . 2651 . 1 1 25 HIS O O 7.087 -4.655 -2.065 . . . 1.0 . . . . . . . . . . . . A . 25 HIS O . . . . . . . . . c30497_6e5i 1 . 6 . 2652 . 1 1 26 CYS C C 10.247 -5.995 -1.756 . . . 1.0 . . . . . . . . . . . . A . 26 CYS C . . . . . . . . . c30497_6e5i 1 . 6 . 2653 . 1 1 26 CYS CA C 9.475 -5.126 -0.772 . . . 1.0 . . . . . . . . . . . . A . 26 CYS CA . . . . . . . . . c30497_6e5i 1 . 6 . 2654 . 1 1 26 CYS CB C 10.282 -4.917 0.508 . . . 1.0 . . . . . . . . . . . . A . 26 CYS CB . . . . . . . . . c30497_6e5i 1 . 6 . 2655 . 1 1 26 CYS H H 8.157 -6.399 0.272 . . . 1.0 . . . . . . . . . . . . A . 26 CYS H . . . . . . . . . c30497_6e5i 1 . 6 . 2656 . 1 1 26 CYS HA H 9.276 -4.168 -1.228 . . . 1.0 . . . . . . . . . . . . A . 26 CYS HA . . . . . . . . . c30497_6e5i 1 . 6 . 2657 . 1 1 26 CYS HB2 H 10.555 -5.879 0.915 . . . 1.0 . . . . . . . . . . . . A . 26 CYS HB2 . . . . . . . . . c30497_6e5i 1 . 6 . 2658 . 1 1 26 CYS HB3 H 11.177 -4.360 0.276 . . . 1.0 . . . . . . . . . . . . A . 26 CYS HB3 . . . . . . . . . c30497_6e5i 1 . 6 . 2659 . 1 1 26 CYS N N 8.202 -5.745 -0.458 . . . 1.0 . . . . . . . . . . . . A . 26 CYS N . . . . . . . . . c30497_6e5i 1 . 6 . 2660 . 1 1 26 CYS O O 11.028 -6.863 -1.365 . . . 1.0 . . . . . . . . . . . . A . 26 CYS O . . . . . . . . . c30497_6e5i 1 . 6 . 2661 . 1 1 26 CYS SG S 9.379 -4.002 1.800 . . . 1.0 . . . . . . . . . . . . A . 26 CYS SG . . . . . . . . . c30497_6e5i 1 . 6 . 2662 . 1 1 27 NH2 HN1 H 9.369 -5.067 -3.273 . . . 1.0 . . . . . . . . . . . . A . 27 NH2 HN1 . . . . . . . . . c30497_6e5i 1 . 6 . 2663 . 1 1 27 NH2 HN2 H 10.477 -6.326 -3.699 . . . 1.0 . . . . . . . . . . . . A . 27 NH2 HN2 . . . . . . . . . c30497_6e5i 1 . 6 . 2664 . 1 1 27 NH2 N N 10.007 -5.777 -3.036 . . . 1.0 . . . . . . . . . . . . A . 27 NH2 N . . . . . . . . . c30497_6e5i 1 . 7 . 2665 . 1 1 1 ASN C C -6.326 5.523 -3.191 . . . 1.0 . . . . . . . . . . . . A . 1 ASN C . . . . . . . . . c30497_6e5i 1 . 7 . 2666 . 1 1 1 ASN CA C -7.665 4.858 -3.511 . . . 1.0 . . . . . . . . . . . . A . 1 ASN CA . . . . . . . . . c30497_6e5i 1 . 7 . 2667 . 1 1 1 ASN CB C -7.704 3.439 -2.939 . . . 1.0 . . . . . . . . . . . . A . 1 ASN CB . . . . . . . . . c30497_6e5i 1 . 7 . 2668 . 1 1 1 ASN CG C -7.400 3.401 -1.456 . . . 1.0 . . . . . . . . . . . . A . 1 ASN CG . . . . . . . . . c30497_6e5i 1 . 7 . 2669 . 1 1 1 ASN H1 H -7.888 5.786 -5.359 . . . 1.0 . . . . . . . . . . . . A . 1 ASN H1 . . . . . . . . . c30497_6e5i 1 . 7 . 2670 . 1 1 1 ASN H2 H -8.795 4.372 -5.191 . . . 1.0 . . . . . . . . . . . . A . 1 ASN H2 . . . . . . . . . c30497_6e5i 1 . 7 . 2671 . 1 1 1 ASN H3 H -7.127 4.280 -5.436 . . . 1.0 . . . . . . . . . . . . A . 1 ASN H3 . . . . . . . . . c30497_6e5i 1 . 7 . 2672 . 1 1 1 ASN HA H -8.455 5.440 -3.065 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HA . . . . . . . . . c30497_6e5i 1 . 7 . 2673 . 1 1 1 ASN HB2 H -8.687 3.021 -3.095 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HB2 . . . . . . . . . c30497_6e5i 1 . 7 . 2674 . 1 1 1 ASN HB3 H -6.974 2.831 -3.451 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HB3 . . . . . . . . . c30497_6e5i 1 . 7 . 2675 . 1 1 1 ASN HD21 H -9.334 3.568 -1.011 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HD21 . . . . . . . . . c30497_6e5i 1 . 7 . 2676 . 1 1 1 ASN HD22 H -8.253 3.452 0.338 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HD22 . . . . . . . . . c30497_6e5i 1 . 7 . 2677 . 1 1 1 ASN N N -7.886 4.821 -4.974 . . . 1.0 . . . . . . . . . . . . A . 1 ASN N . . . . . . . . . c30497_6e5i 1 . 7 . 2678 . 1 1 1 ASN ND2 N -8.430 3.485 -0.626 . . . 1.0 . . . . . . . . . . . . A . 1 ASN ND2 . . . . . . . . . c30497_6e5i 1 . 7 . 2679 . 1 1 1 ASN O O -5.269 5.050 -3.616 . . . 1.0 . . . . . . . . . . . . A . 1 ASN O . . . . . . . . . c30497_6e5i 1 . 7 . 2680 . 1 1 1 ASN OD1 O -6.245 3.297 -1.059 . . . 1.0 . . . . . . . . . . . . A . 1 ASN OD1 . . . . . . . . . c30497_6e5i 1 . 7 . 2681 . 1 1 2 ASP C C -4.313 6.729 -1.069 . . . 1.0 . . . . . . . . . . . . A . 2 ASP C . . . . . . . . . c30497_6e5i 1 . 7 . 2682 . 1 1 2 ASP CA C -5.168 7.398 -2.140 . . . 1.0 . . . . . . . . . . . . A . 2 ASP CA . . . . . . . . . c30497_6e5i 1 . 7 . 2683 . 1 1 2 ASP CB C -5.518 8.827 -1.707 . . . 1.0 . . . . . . . . . . . . A . 2 ASP CB . . . . . . . . . c30497_6e5i 1 . 7 . 2684 . 1 1 2 ASP CG C -6.262 8.891 -0.387 . . . 1.0 . . . . . . . . . . . . A . 2 ASP CG . . . . . . . . . c30497_6e5i 1 . 7 . 2685 . 1 1 2 ASP H H -7.239 6.929 -2.090 . . . 1.0 . . . . . . . . . . . . A . 2 ASP H . . . . . . . . . c30497_6e5i 1 . 7 . 2686 . 1 1 2 ASP HA H -4.587 7.450 -3.050 . . . 1.0 . . . . . . . . . . . . A . 2 ASP HA . . . . . . . . . c30497_6e5i 1 . 7 . 2687 . 1 1 2 ASP HB2 H -4.607 9.394 -1.606 . . . 1.0 . . . . . . . . . . . . A . 2 ASP HB2 . . . . . . . . . c30497_6e5i 1 . 7 . 2688 . 1 1 2 ASP HB3 H -6.133 9.283 -2.467 . . . 1.0 . . . . . . . . . . . . A . 2 ASP HB3 . . . . . . . . . c30497_6e5i 1 . 7 . 2689 . 1 1 2 ASP N N -6.373 6.624 -2.441 . . . 1.0 . . . . . . . . . . . . A . 2 ASP N . . . . . . . . . c30497_6e5i 1 . 7 . 2690 . 1 1 2 ASP O O -3.119 7.010 -0.966 . . . 1.0 . . . . . . . . . . . . A . 2 ASP O . . . . . . . . . c30497_6e5i 1 . 7 . 2691 . 1 1 2 ASP OD1 O -5.607 9.007 0.671 . . . 1.0 . . . . . . . . . . . . A . 2 ASP OD1 . . . . . . . . . c30497_6e5i 1 . 7 . 2692 . 1 1 2 ASP OD2 O -7.511 8.847 -0.403 . . . 1.0 . . . . . . . . . . . . A . 2 ASP OD2 . . . . . . . . . c30497_6e5i 1 . 7 . 2693 . 1 1 3 LYS C C -3.034 4.321 0.090 . . . 1.0 . . . . . . . . . . . . A . 3 LYS C . . . . . . . . . c30497_6e5i 1 . 7 . 2694 . 1 1 3 LYS CA C -4.159 5.110 0.738 . . . 1.0 . . . . . . . . . . . . A . 3 LYS CA . . . . . . . . . c30497_6e5i 1 . 7 . 2695 . 1 1 3 LYS CB C -5.055 4.157 1.536 . . . 1.0 . . . . . . . . . . . . A . 3 LYS CB . . . . . . . . . c30497_6e5i 1 . 7 . 2696 . 1 1 3 LYS CD C -6.797 5.808 2.321 . . . 1.0 . . . . . . . . . . . . A . 3 LYS CD . . . . . . . . . c30497_6e5i 1 . 7 . 2697 . 1 1 3 LYS CE C -7.492 6.397 3.541 . . . 1.0 . . . . . . . . . . . . A . 3 LYS CE . . . . . . . . . c30497_6e5i 1 . 7 . 2698 . 1 1 3 LYS CG C -5.748 4.790 2.730 . . . 1.0 . . . . . . . . . . . . A . 3 LYS CG . . . . . . . . . c30497_6e5i 1 . 7 . 2699 . 1 1 3 LYS H H -5.868 5.672 -0.383 . . . 1.0 . . . . . . . . . . . . A . 3 LYS H . . . . . . . . . c30497_6e5i 1 . 7 . 2700 . 1 1 3 LYS HA H -3.729 5.834 1.412 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HA . . . . . . . . . c30497_6e5i 1 . 7 . 2701 . 1 1 3 LYS HB2 H -5.814 3.766 0.877 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HB2 . . . . . . . . . c30497_6e5i 1 . 7 . 2702 . 1 1 3 LYS HB3 H -4.450 3.336 1.894 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HB3 . . . . . . . . . c30497_6e5i 1 . 7 . 2703 . 1 1 3 LYS HD2 H -6.320 6.603 1.768 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HD2 . . . . . . . . . c30497_6e5i 1 . 7 . 2704 . 1 1 3 LYS HD3 H -7.532 5.321 1.697 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HD3 . . . . . . . . . c30497_6e5i 1 . 7 . 2705 . 1 1 3 LYS HE2 H -8.219 7.123 3.210 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HE2 . . . . . . . . . c30497_6e5i 1 . 7 . 2706 . 1 1 3 LYS HE3 H -7.995 5.601 4.072 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HE3 . . . . . . . . . c30497_6e5i 1 . 7 . 2707 . 1 1 3 LYS HG2 H -6.226 4.013 3.305 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HG2 . . . . . . . . . c30497_6e5i 1 . 7 . 2708 . 1 1 3 LYS HG3 H -5.005 5.281 3.341 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HG3 . . . . . . . . . c30497_6e5i 1 . 7 . 2709 . 1 1 3 LYS HZ1 H -7.036 7.471 5.271 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HZ1 . . . . . . . . . c30497_6e5i 1 . 7 . 2710 . 1 1 3 LYS HZ2 H -6.021 7.818 3.964 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HZ2 . . . . . . . . . c30497_6e5i 1 . 7 . 2711 . 1 1 3 LYS HZ3 H -5.837 6.369 4.815 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HZ3 . . . . . . . . . c30497_6e5i 1 . 7 . 2712 . 1 1 3 LYS N N -4.912 5.841 -0.279 . . . 1.0 . . . . . . . . . . . . A . 3 LYS N . . . . . . . . . c30497_6e5i 1 . 7 . 2713 . 1 1 3 LYS NZ N -6.530 7.059 4.461 . . . 1.0 . . . . . . . . . . . . A . 3 LYS NZ . . . . . . . . . c30497_6e5i 1 . 7 . 2714 . 1 1 3 LYS O O -1.931 4.258 0.619 . . . 1.0 . . . . . . . . . . . . A . 3 LYS O . . . . . . . . . c30497_6e5i 1 . 7 . 2715 . 1 1 4 CYS C C -1.122 3.882 -2.136 . . . 1.0 . . . . . . . . . . . . A . 4 CYS C . . . . . . . . . c30497_6e5i 1 . 7 . 2716 . 1 1 4 CYS CA C -2.326 3.000 -1.826 . . . 1.0 . . . . . . . . . . . . A . 4 CYS CA . . . . . . . . . c30497_6e5i 1 . 7 . 2717 . 1 1 4 CYS CB C -2.937 2.484 -3.128 . . . 1.0 . . . . . . . . . . . . A . 4 CYS CB . . . . . . . . . c30497_6e5i 1 . 7 . 2718 . 1 1 4 CYS H H -4.237 3.803 -1.414 . . . 1.0 . . . . . . . . . . . . A . 4 CYS H . . . . . . . . . c30497_6e5i 1 . 7 . 2719 . 1 1 4 CYS HA H -2.004 2.163 -1.228 . . . 1.0 . . . . . . . . . . . . A . 4 CYS HA . . . . . . . . . c30497_6e5i 1 . 7 . 2720 . 1 1 4 CYS HB2 H -3.321 3.320 -3.692 . . . 1.0 . . . . . . . . . . . . A . 4 CYS HB2 . . . . . . . . . c30497_6e5i 1 . 7 . 2721 . 1 1 4 CYS HB3 H -2.169 1.988 -3.705 . . . 1.0 . . . . . . . . . . . . A . 4 CYS HB3 . . . . . . . . . c30497_6e5i 1 . 7 . 2722 . 1 1 4 CYS N N -3.322 3.740 -1.065 . . . 1.0 . . . . . . . . . . . . A . 4 CYS N . . . . . . . . . c30497_6e5i 1 . 7 . 2723 . 1 1 4 CYS O O 0.026 3.475 -1.962 . . . 1.0 . . . . . . . . . . . . A . 4 CYS O . . . . . . . . . c30497_6e5i 1 . 7 . 2724 . 1 1 4 CYS SG S -4.304 1.303 -2.895 . . . 1.0 . . . . . . . . . . . . A . 4 CYS SG . . . . . . . . . c30497_6e5i 1 . 7 . 2725 . 1 1 5 LYS C C 0.425 6.509 -1.736 . . . 1.0 . . . . . . . . . . . . A . 5 LYS C . . . . . . . . . c30497_6e5i 1 . 7 . 2726 . 1 1 5 LYS CA C -0.369 6.045 -2.951 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CA . . . . . . . . . c30497_6e5i 1 . 7 . 2727 . 1 1 5 LYS CB C -1.004 7.248 -3.657 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CB . . . . . . . . . c30497_6e5i 1 . 7 . 2728 . 1 1 5 LYS CD C -0.676 9.468 -4.780 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CD . . . . . . . . . c30497_6e5i 1 . 7 . 2729 . 1 1 5 LYS CE C 0.337 10.440 -5.364 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CE . . . . . . . . . c30497_6e5i 1 . 7 . 2730 . 1 1 5 LYS CG C 0.006 8.234 -4.214 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CG . . . . . . . . . c30497_6e5i 1 . 7 . 2731 . 1 1 5 LYS H H -2.341 5.387 -2.604 . . . 1.0 . . . . . . . . . . . . A . 5 LYS H . . . . . . . . . c30497_6e5i 1 . 7 . 2732 . 1 1 5 LYS HA H 0.298 5.544 -3.635 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HA . . . . . . . . . c30497_6e5i 1 . 7 . 2733 . 1 1 5 LYS HB2 H -1.613 6.890 -4.474 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HB2 . . . . . . . . . c30497_6e5i 1 . 7 . 2734 . 1 1 5 LYS HB3 H -1.635 7.770 -2.953 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HB3 . . . . . . . . . c30497_6e5i 1 . 7 . 2735 . 1 1 5 LYS HD2 H -1.361 9.164 -5.558 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HD2 . . . . . . . . . c30497_6e5i 1 . 7 . 2736 . 1 1 5 LYS HD3 H -1.222 9.960 -3.989 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HD3 . . . . . . . . . c30497_6e5i 1 . 7 . 2737 . 1 1 5 LYS HE2 H 1.036 10.718 -4.592 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HE2 . . . . . . . . . c30497_6e5i 1 . 7 . 2738 . 1 1 5 LYS HE3 H 0.866 9.948 -6.166 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HE3 . . . . . . . . . c30497_6e5i 1 . 7 . 2739 . 1 1 5 LYS HG2 H 0.674 8.533 -3.422 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HG2 . . . . . . . . . c30497_6e5i 1 . 7 . 2740 . 1 1 5 LYS HG3 H 0.569 7.751 -5.000 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HG3 . . . . . . . . . c30497_6e5i 1 . 7 . 2741 . 1 1 5 LYS HZ1 H 0.409 12.300 -6.303 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HZ1 . . . . . . . . . c30497_6e5i 1 . 7 . 2742 . 1 1 5 LYS HZ2 H -0.797 12.176 -5.128 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HZ2 . . . . . . . . . c30497_6e5i 1 . 7 . 2743 . 1 1 5 LYS HZ3 H -1.001 11.425 -6.628 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HZ3 . . . . . . . . . c30497_6e5i 1 . 7 . 2744 . 1 1 5 LYS N N -1.405 5.105 -2.561 . . . 1.0 . . . . . . . . . . . . A . 5 LYS N . . . . . . . . . c30497_6e5i 1 . 7 . 2745 . 1 1 5 LYS NZ N -0.309 11.669 -5.892 . . . 1.0 . . . . . . . . . . . . A . 5 LYS NZ . . . . . . . . . c30497_6e5i 1 . 7 . 2746 . 1 1 5 LYS O O 1.645 6.659 -1.797 . . . 1.0 . . . . . . . . . . . . A . 5 LYS O . . . . . . . . . c30497_6e5i 1 . 7 . 2747 . 1 1 6 GLU C C 1.189 6.119 1.262 . . . 1.0 . . . . . . . . . . . . A . 6 GLU C . . . . . . . . . c30497_6e5i 1 . 7 . 2748 . 1 1 6 GLU CA C 0.351 7.203 0.594 . . . 1.0 . . . . . . . . . . . . A . 6 GLU CA . . . . . . . . . c30497_6e5i 1 . 7 . 2749 . 1 1 6 GLU CB C -0.717 7.723 1.552 . . . 1.0 . . . . . . . . . . . . A . 6 GLU CB . . . . . . . . . c30497_6e5i 1 . 7 . 2750 . 1 1 6 GLU CD C -0.429 10.158 0.971 . . . 1.0 . . . . . . . . . . . . A . 6 GLU CD . . . . . . . . . c30497_6e5i 1 . 7 . 2751 . 1 1 6 GLU CG C -1.392 8.993 1.060 . . . 1.0 . . . . . . . . . . . . A . 6 GLU CG . . . . . . . . . c30497_6e5i 1 . 7 . 2752 . 1 1 6 GLU H H -1.241 6.535 -0.635 . . . 1.0 . . . . . . . . . . . . A . 6 GLU H . . . . . . . . . c30497_6e5i 1 . 7 . 2753 . 1 1 6 GLU HA H 1.000 8.021 0.323 . . . 1.0 . . . . . . . . . . . . A . 6 GLU HA . . . . . . . . . c30497_6e5i 1 . 7 . 2754 . 1 1 6 GLU HB2 H -1.473 6.963 1.680 . . . 1.0 . . . . . . . . . . . . A . 6 GLU HB2 . . . . . . . . . c30497_6e5i 1 . 7 . 2755 . 1 1 6 GLU HB3 H -0.259 7.930 2.508 . . . 1.0 . . . . . . . . . . . . A . 6 GLU HB3 . . . . . . . . . c30497_6e5i 1 . 7 . 2756 . 1 1 6 GLU HG2 H -1.804 8.811 0.080 . . . 1.0 . . . . . . . . . . . . A . 6 GLU HG2 . . . . . . . . . c30497_6e5i 1 . 7 . 2757 . 1 1 6 GLU HG3 H -2.187 9.251 1.741 . . . 1.0 . . . . . . . . . . . . A . 6 GLU HG3 . . . . . . . . . c30497_6e5i 1 . 7 . 2758 . 1 1 6 GLU N N -0.273 6.714 -0.629 . . . 1.0 . . . . . . . . . . . . A . 6 GLU N . . . . . . . . . c30497_6e5i 1 . 7 . 2759 . 1 1 6 GLU O O 2.242 6.396 1.835 . . . 1.0 . . . . . . . . . . . . A . 6 GLU O . . . . . . . . . c30497_6e5i 1 . 7 . 2760 . 1 1 6 GLU OE1 O -0.190 10.824 2.000 . . . 1.0 . . . . . . . . . . . . A . 6 GLU OE1 . . . . . . . . . c30497_6e5i 1 . 7 . 2761 . 1 1 6 GLU OE2 O 0.091 10.419 -0.137 . . . 1.0 . . . . . . . . . . . . A . 6 GLU OE2 . . . . . . . . . c30497_6e5i 1 . 7 . 2762 . 1 1 7 LEU C C 2.678 3.477 0.830 . . . 1.0 . . . . . . . . . . . . A . 7 LEU C . . . . . . . . . c30497_6e5i 1 . 7 . 2763 . 1 1 7 LEU CA C 1.467 3.751 1.709 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CA . . . . . . . . . c30497_6e5i 1 . 7 . 2764 . 1 1 7 LEU CB C 0.568 2.518 1.790 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CB . . . . . . . . . c30497_6e5i 1 . 7 . 2765 . 1 1 7 LEU CD1 C -1.562 1.473 2.607 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CD1 . . . . . . . . . c30497_6e5i 1 . 7 . 2766 . 1 1 7 LEU CD2 C -0.066 2.638 4.222 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CD2 . . . . . . . . . c30497_6e5i 1 . 7 . 2767 . 1 1 7 LEU CG C -0.587 2.623 2.792 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CG . . . . . . . . . c30497_6e5i 1 . 7 . 2768 . 1 1 7 LEU H H -0.152 4.728 0.760 . . . 1.0 . . . . . . . . . . . . A . 7 LEU H . . . . . . . . . c30497_6e5i 1 . 7 . 2769 . 1 1 7 LEU HA H 1.808 4.011 2.699 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HA . . . . . . . . . c30497_6e5i 1 . 7 . 2770 . 1 1 7 LEU HB2 H 0.152 2.341 0.809 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HB2 . . . . . . . . . c30497_6e5i 1 . 7 . 2771 . 1 1 7 LEU HB3 H 1.176 1.669 2.061 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HB3 . . . . . . . . . c30497_6e5i 1 . 7 . 2772 . 1 1 7 LEU HD11 H -2.379 1.576 3.307 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD11 . . . . . . . . . c30497_6e5i 1 . 7 . 2773 . 1 1 7 LEU HD12 H -1.052 0.538 2.786 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD12 . . . . . . . . . c30497_6e5i 1 . 7 . 2774 . 1 1 7 LEU HD13 H -1.950 1.485 1.599 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD13 . . . . . . . . . c30497_6e5i 1 . 7 . 2775 . 1 1 7 LEU HD21 H 0.619 3.461 4.351 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD21 . . . . . . . . . c30497_6e5i 1 . 7 . 2776 . 1 1 7 LEU HD22 H 0.443 1.708 4.427 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD22 . . . . . . . . . c30497_6e5i 1 . 7 . 2777 . 1 1 7 LEU HD23 H -0.894 2.750 4.906 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD23 . . . . . . . . . c30497_6e5i 1 . 7 . 2778 . 1 1 7 LEU HG H -1.122 3.548 2.620 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HG . . . . . . . . . c30497_6e5i 1 . 7 . 2779 . 1 1 7 LEU N N 0.722 4.883 1.182 . . . 1.0 . . . . . . . . . . . . A . 7 LEU N . . . . . . . . . c30497_6e5i 1 . 7 . 2780 . 1 1 7 LEU O O 3.760 3.160 1.322 . . . 1.0 . . . . . . . . . . . . A . 7 LEU O . . . . . . . . . c30497_6e5i 1 . 7 . 2781 . 1 1 8 LYS C C 4.597 4.627 -1.180 . . . 1.0 . . . . . . . . . . . . A . 8 LYS C . . . . . . . . . c30497_6e5i 1 . 7 . 2782 . 1 1 8 LYS CA C 3.582 3.511 -1.428 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CA . . . . . . . . . c30497_6e5i 1 . 7 . 2783 . 1 1 8 LYS CB C 3.031 3.596 -2.855 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CB . . . . . . . . . c30497_6e5i 1 . 7 . 2784 . 1 1 8 LYS CD C 3.444 3.454 -5.328 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CD . . . . . . . . . c30497_6e5i 1 . 7 . 2785 . 1 1 8 LYS CE C 3.143 4.918 -5.617 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CE . . . . . . . . . c30497_6e5i 1 . 7 . 2786 . 1 1 8 LYS CG C 4.043 3.269 -3.940 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CG . . . . . . . . . c30497_6e5i 1 . 7 . 2787 . 1 1 8 LYS H H 1.580 3.805 -0.810 . . . 1.0 . . . . . . . . . . . . A . 8 LYS H . . . . . . . . . c30497_6e5i 1 . 7 . 2788 . 1 1 8 LYS HA H 4.060 2.555 -1.282 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HA . . . . . . . . . c30497_6e5i 1 . 7 . 2789 . 1 1 8 LYS HB2 H 2.205 2.908 -2.948 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HB2 . . . . . . . . . c30497_6e5i 1 . 7 . 2790 . 1 1 8 LYS HB3 H 2.669 4.599 -3.023 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HB3 . . . . . . . . . c30497_6e5i 1 . 7 . 2791 . 1 1 8 LYS HD2 H 4.142 3.089 -6.065 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HD2 . . . . . . . . . c30497_6e5i 1 . 7 . 2792 . 1 1 8 LYS HD3 H 2.525 2.890 -5.389 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HD3 . . . . . . . . . c30497_6e5i 1 . 7 . 2793 . 1 1 8 LYS HE2 H 2.450 5.283 -4.874 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HE2 . . . . . . . . . c30497_6e5i 1 . 7 . 2794 . 1 1 8 LYS HE3 H 4.063 5.480 -5.555 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HE3 . . . . . . . . . c30497_6e5i 1 . 7 . 2795 . 1 1 8 LYS HG2 H 4.895 3.923 -3.835 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HG2 . . . . . . . . . c30497_6e5i 1 . 7 . 2796 . 1 1 8 LYS HG3 H 4.358 2.242 -3.828 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HG3 . . . . . . . . . c30497_6e5i 1 . 7 . 2797 . 1 1 8 LYS HZ1 H 3.190 4.756 -7.698 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ1 . . . . . . . . . c30497_6e5i 1 . 7 . 2798 . 1 1 8 LYS HZ2 H 2.377 6.126 -7.138 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ2 . . . . . . . . . c30497_6e5i 1 . 7 . 2799 . 1 1 8 LYS HZ3 H 1.641 4.608 -7.034 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ3 . . . . . . . . . c30497_6e5i 1 . 7 . 2800 . 1 1 8 LYS N N 2.488 3.624 -0.475 . . . 1.0 . . . . . . . . . . . . A . 8 LYS N . . . . . . . . . c30497_6e5i 1 . 7 . 2801 . 1 1 8 LYS NZ N 2.547 5.114 -6.964 . . . 1.0 . . . . . . . . . . . . A . 8 LYS NZ . . . . . . . . . c30497_6e5i 1 . 7 . 2802 . 1 1 8 LYS O O 5.798 4.452 -1.372 . . . 1.0 . . . . . . . . . . . . A . 8 LYS O . . . . . . . . . c30497_6e5i 1 . 7 . 2803 . 1 1 9 LYS C C 5.729 6.619 0.861 . . . 1.0 . . . . . . . . . . . . A . 9 LYS C . . . . . . . . . c30497_6e5i 1 . 7 . 2804 . 1 1 9 LYS CA C 4.925 6.913 -0.403 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CA . . . . . . . . . c30497_6e5i 1 . 7 . 2805 . 1 1 9 LYS CB C 4.039 8.143 -0.184 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CB . . . . . . . . . c30497_6e5i 1 . 7 . 2806 . 1 1 9 LYS CD C 5.524 9.817 -1.325 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CD . . . . . . . . . c30497_6e5i 1 . 7 . 2807 . 1 1 9 LYS CE C 6.098 11.222 -1.261 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CE . . . . . . . . . c30497_6e5i 1 . 7 . 2808 . 1 1 9 LYS CG C 4.799 9.451 -0.040 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CG . . . . . . . . . c30497_6e5i 1 . 7 . 2809 . 1 1 9 LYS H H 3.114 5.869 -0.694 . . . 1.0 . . . . . . . . . . . . A . 9 LYS H . . . . . . . . . c30497_6e5i 1 . 7 . 2810 . 1 1 9 LYS HA H 5.601 7.101 -1.220 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HA . . . . . . . . . c30497_6e5i 1 . 7 . 2811 . 1 1 9 LYS HB2 H 3.367 8.238 -1.022 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HB2 . . . . . . . . . c30497_6e5i 1 . 7 . 2812 . 1 1 9 LYS HB3 H 3.457 7.992 0.713 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HB3 . . . . . . . . . c30497_6e5i 1 . 7 . 2813 . 1 1 9 LYS HD2 H 6.330 9.117 -1.483 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HD2 . . . . . . . . . c30497_6e5i 1 . 7 . 2814 . 1 1 9 LYS HD3 H 4.827 9.758 -2.147 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HD3 . . . . . . . . . c30497_6e5i 1 . 7 . 2815 . 1 1 9 LYS HE2 H 6.759 11.289 -0.410 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HE2 . . . . . . . . . c30497_6e5i 1 . 7 . 2816 . 1 1 9 LYS HE3 H 6.658 11.409 -2.165 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HE3 . . . . . . . . . c30497_6e5i 1 . 7 . 2817 . 1 1 9 LYS HG2 H 4.099 10.233 0.203 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HG2 . . . . . . . . . c30497_6e5i 1 . 7 . 2818 . 1 1 9 LYS HG3 H 5.522 9.349 0.756 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HG3 . . . . . . . . . c30497_6e5i 1 . 7 . 2819 . 1 1 9 LYS HZ1 H 4.389 12.212 -1.940 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HZ1 . . . . . . . . . c30497_6e5i 1 . 7 . 2820 . 1 1 9 LYS HZ2 H 5.459 13.204 -1.089 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HZ2 . . . . . . . . . c30497_6e5i 1 . 7 . 2821 . 1 1 9 LYS HZ3 H 4.487 12.101 -0.256 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HZ3 . . . . . . . . . c30497_6e5i 1 . 7 . 2822 . 1 1 9 LYS N N 4.089 5.775 -0.753 . . . 1.0 . . . . . . . . . . . . A . 9 LYS N . . . . . . . . . c30497_6e5i 1 . 7 . 2823 . 1 1 9 LYS NZ N 5.035 12.256 -1.127 . . . 1.0 . . . . . . . . . . . . A . 9 LYS NZ . . . . . . . . . c30497_6e5i 1 . 7 . 2824 . 1 1 9 LYS O O 6.922 6.922 0.938 . . . 1.0 . . . . . . . . . . . . A . 9 LYS O . . . . . . . . . c30497_6e5i 1 . 7 . 2825 . 1 1 10 ARG C C 6.728 4.623 2.997 . . . 1.0 . . . . . . . . . . . . A . 10 ARG C . . . . . . . . . c30497_6e5i 1 . 7 . 2826 . 1 1 10 ARG CA C 5.679 5.720 3.129 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CA . . . . . . . . . c30497_6e5i 1 . 7 . 2827 . 1 1 10 ARG CB C 4.612 5.286 4.139 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CB . . . . . . . . . c30497_6e5i 1 . 7 . 2828 . 1 1 10 ARG CD C 4.110 4.402 6.451 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CD . . . . . . . . . c30497_6e5i 1 . 7 . 2829 . 1 1 10 ARG CG C 5.188 4.888 5.491 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CG . . . . . . . . . c30497_6e5i 1 . 7 . 2830 . 1 1 10 ARG CZ C 3.993 3.551 8.771 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CZ . . . . . . . . . c30497_6e5i 1 . 7 . 2831 . 1 1 10 ARG H H 4.116 5.803 1.709 . . . 1.0 . . . . . . . . . . . . A . 10 ARG H . . . . . . . . . c30497_6e5i 1 . 7 . 2832 . 1 1 10 ARG HA H 6.157 6.616 3.491 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HA . . . . . . . . . c30497_6e5i 1 . 7 . 2833 . 1 1 10 ARG HB2 H 3.923 6.101 4.287 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HB2 . . . . . . . . . c30497_6e5i 1 . 7 . 2834 . 1 1 10 ARG HB3 H 4.074 4.441 3.738 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HB3 . . . . . . . . . c30497_6e5i 1 . 7 . 2835 . 1 1 10 ARG HD2 H 3.490 5.239 6.730 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HD2 . . . . . . . . . c30497_6e5i 1 . 7 . 2836 . 1 1 10 ARG HD3 H 3.506 3.660 5.948 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HD3 . . . . . . . . . c30497_6e5i 1 . 7 . 2837 . 1 1 10 ARG HE H 5.642 3.581 7.639 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HE . . . . . . . . . c30497_6e5i 1 . 7 . 2838 . 1 1 10 ARG HG2 H 5.908 4.095 5.344 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HG2 . . . . . . . . . c30497_6e5i 1 . 7 . 2839 . 1 1 10 ARG HG3 H 5.681 5.748 5.924 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HG3 . . . . . . . . . c30497_6e5i 1 . 7 . 2840 . 1 1 10 ARG HH11 H 2.191 3.662 9.688 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HH11 . . . . . . . . . c30497_6e5i 1 . 7 . 2841 . 1 1 10 ARG HH12 H 2.241 4.292 8.072 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HH12 . . . . . . . . . c30497_6e5i 1 . 7 . 2842 . 1 1 10 ARG HH21 H 5.573 2.758 9.768 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HH21 . . . . . . . . . c30497_6e5i 1 . 7 . 2843 . 1 1 10 ARG HH22 H 4.074 2.789 10.649 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HH22 . . . . . . . . . c30497_6e5i 1 . 7 . 2844 . 1 1 10 ARG N N 5.062 6.029 1.845 . . . 1.0 . . . . . . . . . . . . A . 10 ARG N . . . . . . . . . c30497_6e5i 1 . 7 . 2845 . 1 1 10 ARG NE N 4.683 3.810 7.662 . . . 1.0 . . . . . . . . . . . . A . 10 ARG NE . . . . . . . . . c30497_6e5i 1 . 7 . 2846 . 1 1 10 ARG NH1 N 2.706 3.859 8.849 . . . 1.0 . . . . . . . . . . . . A . 10 ARG NH1 . . . . . . . . . c30497_6e5i 1 . 7 . 2847 . 1 1 10 ARG NH2 N 4.595 2.990 9.813 . . . 1.0 . . . . . . . . . . . . A . 10 ARG NH2 . . . . . . . . . c30497_6e5i 1 . 7 . 2848 . 1 1 10 ARG O O 7.873 4.790 3.415 . . . 1.0 . . . . . . . . . . . . A . 10 ARG O . . . . . . . . . c30497_6e5i 1 . 7 . 2849 . 1 1 11 TYR C C 8.186 2.381 1.208 . . . 1.0 . . . . . . . . . . . . A . 11 TYR C . . . . . . . . . c30497_6e5i 1 . 7 . 2850 . 1 1 11 TYR CA C 7.191 2.329 2.362 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CA . . . . . . . . . c30497_6e5i 1 . 7 . 2851 . 1 1 11 TYR CB C 6.343 1.063 2.282 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CB . . . . . . . . . c30497_6e5i 1 . 7 . 2852 . 1 1 11 TYR CD1 C 6.115 0.124 4.618 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CD1 . . . . . . . . . c30497_6e5i 1 . 7 . 2853 . 1 1 11 TYR CD2 C 4.229 1.208 3.648 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CD2 . . . . . . . . . c30497_6e5i 1 . 7 . 2854 . 1 1 11 TYR CE1 C 5.389 -0.122 5.766 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CE1 . . . . . . . . . c30497_6e5i 1 . 7 . 2855 . 1 1 11 TYR CE2 C 3.494 0.965 4.794 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CE2 . . . . . . . . . c30497_6e5i 1 . 7 . 2856 . 1 1 11 TYR CG C 5.549 0.793 3.541 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CG . . . . . . . . . c30497_6e5i 1 . 7 . 2857 . 1 1 11 TYR CZ C 4.099 0.296 5.863 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CZ . . . . . . . . . c30497_6e5i 1 . 7 . 2858 . 1 1 11 TYR H H 5.446 3.470 1.982 . . . 1.0 . . . . . . . . . . . . A . 11 TYR H . . . . . . . . . c30497_6e5i 1 . 7 . 2859 . 1 1 11 TYR HA H 7.748 2.306 3.285 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HA . . . . . . . . . c30497_6e5i 1 . 7 . 2860 . 1 1 11 TYR HB2 H 5.648 1.153 1.460 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HB2 . . . . . . . . . c30497_6e5i 1 . 7 . 2861 . 1 1 11 TYR HB3 H 6.989 0.217 2.110 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HB3 . . . . . . . . . c30497_6e5i 1 . 7 . 2862 . 1 1 11 TYR HD1 H 7.144 -0.205 4.551 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HD1 . . . . . . . . . c30497_6e5i 1 . 7 . 2863 . 1 1 11 TYR HD2 H 3.773 1.727 2.817 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HD2 . . . . . . . . . c30497_6e5i 1 . 7 . 2864 . 1 1 11 TYR HE1 H 5.846 -0.645 6.589 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HE1 . . . . . . . . . c30497_6e5i 1 . 7 . 2865 . 1 1 11 TYR HE2 H 2.469 1.296 4.858 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HE2 . . . . . . . . . c30497_6e5i 1 . 7 . 2866 . 1 1 11 TYR HH H 2.446 -0.164 6.769 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HH . . . . . . . . . c30497_6e5i 1 . 7 . 2867 . 1 1 11 TYR N N 6.336 3.506 2.405 . . . 1.0 . . . . . . . . . . . . A . 11 TYR N . . . . . . . . . c30497_6e5i 1 . 7 . 2868 . 1 1 11 TYR O O 8.996 1.470 1.039 . . . 1.0 . . . . . . . . . . . . A . 11 TYR O . . . . . . . . . c30497_6e5i 1 . 7 . 2869 . 1 1 11 TYR OH O 3.357 0.058 6.999 . . . 1.0 . . . . . . . . . . . . A . 11 TYR OH . . . . . . . . . c30497_6e5i 1 . 7 . 2870 . 1 1 12 ORN C C 9.995 0.093 -2.263 . . . 1.0 . . . . . . . . . . . . A . 12 ORN C . . . . . . . . . c30497_6e5i 1 . 7 . 2871 . 1 1 12 ORN CA C 10.695 1.444 -2.212 . . . 1.0 . . . . . . . . . . . . A . 12 ORN CA . . . . . . . . . c30497_6e5i 1 . 7 . 2872 . 1 1 12 ORN CB C 9.785 2.514 -2.828 . . . 1.0 . . . . . . . . . . . . A . 12 ORN CB . . . . . . . . . c30497_6e5i 1 . 7 . 2873 . 1 1 12 ORN CD C 9.023 3.635 -0.721 . . . 1.0 . . . . . . . . . . . . A . 12 ORN CD . . . . . . . . . c30497_6e5i 1 . 7 . 2874 . 1 1 12 ORN CG C 8.589 2.866 -1.955 . . . 1.0 . . . . . . . . . . . . A . 12 ORN CG . . . . . . . . . c30497_6e5i 1 . 7 . 2875 . 1 1 12 ORN H H 12.589 0.648 -2.527 . . . 1.0 . . . . . . . . . . . . A . 12 ORN H . . . . . . . . . c30497_6e5i 1 . 7 . 2876 . 1 1 12 ORN HA H 10.904 1.697 -1.185 . . . 1.0 . . . . . . . . . . . . A . 12 ORN HA . . . . . . . . . c30497_6e5i 1 . 7 . 2877 . 1 1 12 ORN HB2 H 9.416 2.156 -3.778 . . . 1.0 . . . . . . . . . . . . A . 12 ORN HB2 . . . . . . . . . c30497_6e5i 1 . 7 . 2878 . 1 1 12 ORN HB3 H 10.363 3.410 -2.992 . . . 1.0 . . . . . . . . . . . . A . 12 ORN HB3 . . . . . . . . . c30497_6e5i 1 . 7 . 2879 . 1 1 12 ORN HD2 H 9.051 4.684 -0.964 . . . 1.0 . . . . . . . . . . . . A . 12 ORN HD2 . . . . . . . . . c30497_6e5i 1 . 7 . 2880 . 1 1 12 ORN HD3 H 10.011 3.310 -0.440 . . . 1.0 . . . . . . . . . . . . A . 12 ORN HD3 . . . . . . . . . c30497_6e5i 1 . 7 . 2881 . 1 1 12 ORN HE1 H 7.444 4.119 0.580 . . . 1.0 . . . . . . . . . . . . A . 12 ORN HE1 . . . . . . . . . c30497_6e5i 1 . 7 . 2882 . 1 1 12 ORN HG2 H 8.100 1.955 -1.646 . . . 1.0 . . . . . . . . . . . . A . 12 ORN HG2 . . . . . . . . . c30497_6e5i 1 . 7 . 2883 . 1 1 12 ORN HG3 H 7.902 3.472 -2.525 . . . 1.0 . . . . . . . . . . . . A . 12 ORN HG3 . . . . . . . . . c30497_6e5i 1 . 7 . 2884 . 1 1 12 ORN N N 11.974 1.370 -2.952 . . . 1.0 . . . . . . . . . . . . A . 12 ORN N . . . . . . . . . c30497_6e5i 1 . 7 . 2885 . 1 1 12 ORN NE N 8.124 3.436 0.410 . . . 1.0 . . . . . . . . . . . . A . 12 ORN NE . . . . . . . . . c30497_6e5i 1 . 7 . 2886 . 1 1 12 ORN O O 10.191 -0.677 -3.205 . . . 1.0 . . . . . . . . . . . . A . 12 ORN O . . . . . . . . . c30497_6e5i 1 . 7 . 2887 . 1 1 13 CYS C C 7.203 -1.281 -2.140 . . . 1.0 . . . . . . . . . . . . A . 13 CYS C . . . . . . . . . c30497_6e5i 1 . 7 . 2888 . 1 1 13 CYS CA C 8.408 -1.419 -1.221 . . . 1.0 . . . . . . . . . . . . A . 13 CYS CA . . . . . . . . . c30497_6e5i 1 . 7 . 2889 . 1 1 13 CYS CB C 7.931 -1.714 0.200 . . . 1.0 . . . . . . . . . . . . A . 13 CYS CB . . . . . . . . . c30497_6e5i 1 . 7 . 2890 . 1 1 13 CYS H H 9.134 0.424 -0.488 . . . 1.0 . . . . . . . . . . . . A . 13 CYS H . . . . . . . . . c30497_6e5i 1 . 7 . 2891 . 1 1 13 CYS HA H 9.027 -2.232 -1.568 . . . 1.0 . . . . . . . . . . . . A . 13 CYS HA . . . . . . . . . c30497_6e5i 1 . 7 . 2892 . 1 1 13 CYS HB2 H 7.237 -0.947 0.502 . . . 1.0 . . . . . . . . . . . . A . 13 CYS HB2 . . . . . . . . . c30497_6e5i 1 . 7 . 2893 . 1 1 13 CYS HB3 H 7.426 -2.671 0.210 . . . 1.0 . . . . . . . . . . . . A . 13 CYS HB3 . . . . . . . . . c30497_6e5i 1 . 7 . 2894 . 1 1 13 CYS N N 9.197 -0.199 -1.247 . . . 1.0 . . . . . . . . . . . . A . 13 CYS N . . . . . . . . . c30497_6e5i 1 . 7 . 2895 . 1 1 13 CYS O O 6.799 -0.170 -2.494 . . . 1.0 . . . . . . . . . . . . A . 13 CYS O . . . . . . . . . c30497_6e5i 1 . 7 . 2896 . 1 1 13 CYS SG S 9.260 -1.775 1.440 . . . 1.0 . . . . . . . . . . . . A . 13 CYS SG . . . . . . . . . c30497_6e5i 1 . 7 . 2897 . 1 1 14 GLU C C 4.247 -2.834 -2.531 . . . 1.0 . . . . . . . . . . . . A . 14 GLU C . . . . . . . . . c30497_6e5i 1 . 7 . 2898 . 1 1 14 GLU CA C 5.447 -2.410 -3.351 . . . 1.0 . . . . . . . . . . . . A . 14 GLU CA . . . . . . . . . c30497_6e5i 1 . 7 . 2899 . 1 1 14 GLU CB C 5.618 -3.349 -4.544 . . . 1.0 . . . . . . . . . . . . A . 14 GLU CB . . . . . . . . . c30497_6e5i 1 . 7 . 2900 . 1 1 14 GLU CD C 6.717 -3.706 -6.783 . . . 1.0 . . . . . . . . . . . . A . 14 GLU CD . . . . . . . . . c30497_6e5i 1 . 7 . 2901 . 1 1 14 GLU CG C 6.748 -2.949 -5.476 . . . 1.0 . . . . . . . . . . . . A . 14 GLU CG . . . . . . . . . c30497_6e5i 1 . 7 . 2902 . 1 1 14 GLU H H 7.020 -3.266 -2.233 . . . 1.0 . . . . . . . . . . . . A . 14 GLU H . . . . . . . . . c30497_6e5i 1 . 7 . 2903 . 1 1 14 GLU HA H 5.289 -1.405 -3.708 . . . 1.0 . . . . . . . . . . . . A . 14 GLU HA . . . . . . . . . c30497_6e5i 1 . 7 . 2904 . 1 1 14 GLU HB2 H 5.821 -4.344 -4.174 . . . 1.0 . . . . . . . . . . . . A . 14 GLU HB2 . . . . . . . . . c30497_6e5i 1 . 7 . 2905 . 1 1 14 GLU HB3 H 4.699 -3.364 -5.110 . . . 1.0 . . . . . . . . . . . . A . 14 GLU HB3 . . . . . . . . . c30497_6e5i 1 . 7 . 2906 . 1 1 14 GLU HG2 H 6.664 -1.894 -5.689 . . . 1.0 . . . . . . . . . . . . A . 14 GLU HG2 . . . . . . . . . c30497_6e5i 1 . 7 . 2907 . 1 1 14 GLU HG3 H 7.688 -3.143 -4.985 . . . 1.0 . . . . . . . . . . . . A . 14 GLU HG3 . . . . . . . . . c30497_6e5i 1 . 7 . 2908 . 1 1 14 GLU N N 6.635 -2.408 -2.524 . . . 1.0 . . . . . . . . . . . . A . 14 GLU N . . . . . . . . . c30497_6e5i 1 . 7 . 2909 . 1 1 14 GLU O O 4.182 -3.962 -2.045 . . . 1.0 . . . . . . . . . . . . A . 14 GLU O . . . . . . . . . c30497_6e5i 1 . 7 . 2910 . 1 1 14 GLU OE1 O 7.195 -4.860 -6.811 . . . 1.0 . . . . . . . . . . . . A . 14 GLU OE1 . . . . . . . . . c30497_6e5i 1 . 7 . 2911 . 1 1 14 GLU OE2 O 6.216 -3.159 -7.786 . . . 1.0 . . . . . . . . . . . . A . 14 GLU OE2 . . . . . . . . . c30497_6e5i 1 . 7 . 2912 . 1 1 15 VAL C C 1.007 -2.700 -2.534 . . . 1.0 . . . . . . . . . . . . A . 15 VAL C . . . . . . . . . c30497_6e5i 1 . 7 . 2913 . 1 1 15 VAL CA C 2.115 -2.230 -1.599 . . . 1.0 . . . . . . . . . . . . A . 15 VAL CA . . . . . . . . . c30497_6e5i 1 . 7 . 2914 . 1 1 15 VAL CB C 1.631 -1.033 -0.739 . . . 1.0 . . . . . . . . . . . . A . 15 VAL CB . . . . . . . . . c30497_6e5i 1 . 7 . 2915 . 1 1 15 VAL CG1 C 2.764 -0.495 0.122 . . . 1.0 . . . . . . . . . . . . A . 15 VAL CG1 . . . . . . . . . c30497_6e5i 1 . 7 . 2916 . 1 1 15 VAL CG2 C 1.044 0.075 -1.597 . . . 1.0 . . . . . . . . . . . . A . 15 VAL CG2 . . . . . . . . . c30497_6e5i 1 . 7 . 2917 . 1 1 15 VAL H H 3.412 -1.042 -2.768 . . . 1.0 . . . . . . . . . . . . A . 15 VAL H . . . . . . . . . c30497_6e5i 1 . 7 . 2918 . 1 1 15 VAL HA H 2.359 -3.044 -0.931 . . . 1.0 . . . . . . . . . . . . A . 15 VAL HA . . . . . . . . . c30497_6e5i 1 . 7 . 2919 . 1 1 15 VAL HB H 0.855 -1.391 -0.078 . . . 1.0 . . . . . . . . . . . . A . 15 VAL HB . . . . . . . . . c30497_6e5i 1 . 7 . 2920 . 1 1 15 VAL HG11 H 2.383 0.279 0.775 . . . 1.0 . . . . . . . . . . . . A . 15 VAL HG11 . . . . . . . . . c30497_6e5i 1 . 7 . 2921 . 1 1 15 VAL HG12 H 3.534 -0.081 -0.513 . . . 1.0 . . . . . . . . . . . . A . 15 VAL HG12 . . . . . . . . . c30497_6e5i 1 . 7 . 2922 . 1 1 15 VAL HG13 H 3.177 -1.294 0.714 . . . 1.0 . . . . . . . . . . . . A . 15 VAL HG13 . . . . . . . . . c30497_6e5i 1 . 7 . 2923 . 1 1 15 VAL HG21 H 0.198 -0.312 -2.148 . . . 1.0 . . . . . . . . . . . . A . 15 VAL HG21 . . . . . . . . . c30497_6e5i 1 . 7 . 2924 . 1 1 15 VAL HG22 H 1.793 0.430 -2.288 . . . 1.0 . . . . . . . . . . . . A . 15 VAL HG22 . . . . . . . . . c30497_6e5i 1 . 7 . 2925 . 1 1 15 VAL HG23 H 0.722 0.886 -0.962 . . . 1.0 . . . . . . . . . . . . A . 15 VAL HG23 . . . . . . . . . c30497_6e5i 1 . 7 . 2926 . 1 1 15 VAL N N 3.308 -1.926 -2.360 . . . 1.0 . . . . . . . . . . . . A . 15 VAL N . . . . . . . . . c30497_6e5i 1 . 7 . 2927 . 1 1 15 VAL O O 0.794 -2.132 -3.610 . . . 1.0 . . . . . . . . . . . . A . 15 VAL O . . . . . . . . . c30497_6e5i 1 . 7 . 2928 . 1 1 16 ARG C C -2.062 -4.031 -2.203 . . . 1.0 . . . . . . . . . . . . A . 16 ARG C . . . . . . . . . c30497_6e5i 1 . 7 . 2929 . 1 1 16 ARG CA C -0.750 -4.315 -2.912 . . . 1.0 . . . . . . . . . . . . A . 16 ARG CA . . . . . . . . . c30497_6e5i 1 . 7 . 2930 . 1 1 16 ARG CB C -0.564 -5.818 -3.109 . . . 1.0 . . . . . . . . . . . . A . 16 ARG CB . . . . . . . . . c30497_6e5i 1 . 7 . 2931 . 1 1 16 ARG CD C -1.617 -8.011 -3.722 . . . 1.0 . . . . . . . . . . . . A . 16 ARG CD . . . . . . . . . c30497_6e5i 1 . 7 . 2932 . 1 1 16 ARG CG C -1.813 -6.513 -3.610 . . . 1.0 . . . . . . . . . . . . A . 16 ARG CG . . . . . . . . . c30497_6e5i 1 . 7 . 2933 . 1 1 16 ARG CZ C -3.182 -9.705 -4.599 . . . 1.0 . . . . . . . . . . . . A . 16 ARG CZ . . . . . . . . . c30497_6e5i 1 . 7 . 2934 . 1 1 16 ARG H H 0.613 -4.211 -1.307 . . . 1.0 . . . . . . . . . . . . A . 16 ARG H . . . . . . . . . c30497_6e5i 1 . 7 . 2935 . 1 1 16 ARG HA H -0.762 -3.828 -3.875 . . . 1.0 . . . . . . . . . . . . A . 16 ARG HA . . . . . . . . . c30497_6e5i 1 . 7 . 2936 . 1 1 16 ARG HB2 H 0.226 -5.980 -3.825 . . . 1.0 . . . . . . . . . . . . A . 16 ARG HB2 . . . . . . . . . c30497_6e5i 1 . 7 . 2937 . 1 1 16 ARG HB3 H -0.284 -6.261 -2.167 . . . 1.0 . . . . . . . . . . . . A . 16 ARG HB3 . . . . . . . . . c30497_6e5i 1 . 7 . 2938 . 1 1 16 ARG HD2 H -1.062 -8.222 -4.623 . . . 1.0 . . . . . . . . . . . . A . 16 ARG HD2 . . . . . . . . . c30497_6e5i 1 . 7 . 2939 . 1 1 16 ARG HD3 H -1.059 -8.356 -2.863 . . . 1.0 . . . . . . . . . . . . A . 16 ARG HD3 . . . . . . . . . c30497_6e5i 1 . 7 . 2940 . 1 1 16 ARG HE H -3.598 -8.405 -3.133 . . . 1.0 . . . . . . . . . . . . A . 16 ARG HE . . . . . . . . . c30497_6e5i 1 . 7 . 2941 . 1 1 16 ARG HG2 H -2.621 -6.316 -2.921 . . . 1.0 . . . . . . . . . . . . A . 16 ARG HG2 . . . . . . . . . c30497_6e5i 1 . 7 . 2942 . 1 1 16 ARG HG3 H -2.065 -6.119 -4.583 . . . 1.0 . . . . . . . . . . . . A . 16 ARG HG3 . . . . . . . . . c30497_6e5i 1 . 7 . 2943 . 1 1 16 ARG HH11 H -1.373 -9.710 -5.512 . . . 1.0 . . . . . . . . . . . . A . 16 ARG HH11 . . . . . . . . . c30497_6e5i 1 . 7 . 2944 . 1 1 16 ARG HH12 H -2.501 -10.892 -6.092 . . . 1.0 . . . . . . . . . . . . A . 16 ARG HH12 . . . . . . . . . c30497_6e5i 1 . 7 . 2945 . 1 1 16 ARG HH21 H -4.611 -11.024 -5.170 . . . 1.0 . . . . . . . . . . . . A . 16 ARG HH21 . . . . . . . . . c30497_6e5i 1 . 7 . 2946 . 1 1 16 ARG HH22 H -5.068 -9.934 -3.900 . . . 1.0 . . . . . . . . . . . . A . 16 ARG HH22 . . . . . . . . . c30497_6e5i 1 . 7 . 2947 . 1 1 16 ARG N N 0.350 -3.769 -2.145 . . . 1.0 . . . . . . . . . . . . A . 16 ARG N . . . . . . . . . c30497_6e5i 1 . 7 . 2948 . 1 1 16 ARG NE N -2.897 -8.707 -3.772 . . . 1.0 . . . . . . . . . . . . A . 16 ARG NE . . . . . . . . . c30497_6e5i 1 . 7 . 2949 . 1 1 16 ARG NH1 N -2.280 -10.136 -5.472 . . . 1.0 . . . . . . . . . . . . A . 16 ARG NH1 . . . . . . . . . c30497_6e5i 1 . 7 . 2950 . 1 1 16 ARG NH2 N -4.381 -10.267 -4.553 . . . 1.0 . . . . . . . . . . . . A . 16 ARG NH2 . . . . . . . . . c30497_6e5i 1 . 7 . 2951 . 1 1 16 ARG O O -2.203 -4.300 -1.014 . . . 1.0 . . . . . . . . . . . . A . 16 ARG O . . . . . . . . . c30497_6e5i 1 . 7 . 2952 . 1 1 17 CYS C C -5.365 -4.106 -2.629 . . . 1.0 . . . . . . . . . . . . A . 17 CYS C . . . . . . . . . c30497_6e5i 1 . 7 . 2953 . 1 1 17 CYS CA C -4.273 -3.085 -2.345 . . . 1.0 . . . . . . . . . . . . A . 17 CYS CA . . . . . . . . . c30497_6e5i 1 . 7 . 2954 . 1 1 17 CYS CB C -4.670 -1.718 -2.889 . . . 1.0 . . . . . . . . . . . . A . 17 CYS CB . . . . . . . . . c30497_6e5i 1 . 7 . 2955 . 1 1 17 CYS H H -2.864 -3.342 -3.891 . . . 1.0 . . . . . . . . . . . . A . 17 CYS H . . . . . . . . . c30497_6e5i 1 . 7 . 2956 . 1 1 17 CYS HA H -4.130 -3.011 -1.278 . . . 1.0 . . . . . . . . . . . . A . 17 CYS HA . . . . . . . . . c30497_6e5i 1 . 7 . 2957 . 1 1 17 CYS HB2 H -4.914 -1.814 -3.936 . . . 1.0 . . . . . . . . . . . . A . 17 CYS HB2 . . . . . . . . . c30497_6e5i 1 . 7 . 2958 . 1 1 17 CYS HB3 H -5.534 -1.356 -2.353 . . . 1.0 . . . . . . . . . . . . A . 17 CYS HB3 . . . . . . . . . c30497_6e5i 1 . 7 . 2959 . 1 1 17 CYS N N -3.012 -3.487 -2.933 . . . 1.0 . . . . . . . . . . . . A . 17 CYS N . . . . . . . . . c30497_6e5i 1 . 7 . 2960 . 1 1 17 CYS O O -5.707 -4.366 -3.784 . . . 1.0 . . . . . . . . . . . . A . 17 CYS O . . . . . . . . . c30497_6e5i 1 . 7 . 2961 . 1 1 17 CYS SG S -3.347 -0.476 -2.737 . . . 1.0 . . . . . . . . . . . . A . 17 CYS SG . . . . . . . . . c30497_6e5i 1 . 7 . 2962 . 1 1 18 ASP C C -8.142 -5.049 -0.766 . . . 1.0 . . . . . . . . . . . . A . 18 ASP C . . . . . . . . . c30497_6e5i 1 . 7 . 2963 . 1 1 18 ASP CA C -7.033 -5.582 -1.657 . . . 1.0 . . . . . . . . . . . . A . 18 ASP CA . . . . . . . . . c30497_6e5i 1 . 7 . 2964 . 1 1 18 ASP CB C -6.668 -7.011 -1.238 . . . 1.0 . . . . . . . . . . . . A . 18 ASP CB . . . . . . . . . c30497_6e5i 1 . 7 . 2965 . 1 1 18 ASP CG C -5.759 -7.708 -2.231 . . . 1.0 . . . . . . . . . . . . A . 18 ASP CG . . . . . . . . . c30497_6e5i 1 . 7 . 2966 . 1 1 18 ASP H H -5.497 -4.512 -0.683 . . . 1.0 . . . . . . . . . . . . A . 18 ASP H . . . . . . . . . c30497_6e5i 1 . 7 . 2967 . 1 1 18 ASP HA H -7.373 -5.585 -2.682 . . . 1.0 . . . . . . . . . . . . A . 18 ASP HA . . . . . . . . . c30497_6e5i 1 . 7 . 2968 . 1 1 18 ASP HB2 H -6.165 -6.978 -0.285 . . . 1.0 . . . . . . . . . . . . A . 18 ASP HB2 . . . . . . . . . c30497_6e5i 1 . 7 . 2969 . 1 1 18 ASP HB3 H -7.574 -7.588 -1.139 . . . 1.0 . . . . . . . . . . . . A . 18 ASP HB3 . . . . . . . . . c30497_6e5i 1 . 7 . 2970 . 1 1 18 ASP N N -5.889 -4.692 -1.568 . . . 1.0 . . . . . . . . . . . . A . 18 ASP N . . . . . . . . . c30497_6e5i 1 . 7 . 2971 . 1 1 18 ASP O O -8.274 -5.463 0.393 . . . 1.0 . . . . . . . . . . . . A . 18 ASP O . . . . . . . . . c30497_6e5i 1 . 7 . 2972 . 1 1 18 ASP OD1 O -6.241 -8.117 -3.311 . . . 1.0 . . . . . . . . . . . . A . 18 ASP OD1 . . . . . . . . . c30497_6e5i 1 . 7 . 2973 . 1 1 18 ASP OD2 O -4.562 -7.869 -1.930 . . . 1.0 . . . . . . . . . . . . A . 18 ASP OD2 . . . . . . . . . c30497_6e5i 1 . 7 . 2974 . 1 1 19 DPR C C -9.360 -2.698 0.699 . . . 1.0 . . . . . . . . . . . . A . 19 DPR C . . . . . . . . . c30497_6e5i 1 . 7 . 2975 . 1 1 19 DPR CA C -9.970 -3.428 -0.494 . . . 1.0 . . . . . . . . . . . . A . 19 DPR CA . . . . . . . . . c30497_6e5i 1 . 7 . 2976 . 1 1 19 DPR CB C -10.594 -2.434 -1.474 . . . 1.0 . . . . . . . . . . . . A . 19 DPR CB . . . . . . . . . c30497_6e5i 1 . 7 . 2977 . 1 1 19 DPR CD C -8.922 -3.637 -2.676 . . . 1.0 . . . . . . . . . . . . A . 19 DPR CD . . . . . . . . . c30497_6e5i 1 . 7 . 2978 . 1 1 19 DPR CG C -10.250 -2.957 -2.824 . . . 1.0 . . . . . . . . . . . . A . 19 DPR CG . . . . . . . . . c30497_6e5i 1 . 7 . 2979 . 1 1 19 DPR HA H -10.725 -4.114 -0.152 . . . 1.0 . . . . . . . . . . . . A . 19 DPR HA . . . . . . . . . c30497_6e5i 1 . 7 . 2980 . 1 1 19 DPR HB2 H -10.173 -1.454 -1.312 . . . 1.0 . . . . . . . . . . . . A . 19 DPR HB2 . . . . . . . . . c30497_6e5i 1 . 7 . 2981 . 1 1 19 DPR HB3 H -11.662 -2.402 -1.323 . . . 1.0 . . . . . . . . . . . . A . 19 DPR HB3 . . . . . . . . . c30497_6e5i 1 . 7 . 2982 . 1 1 19 DPR HD2 H -8.115 -2.937 -2.835 . . . 1.0 . . . . . . . . . . . . A . 19 DPR HD2 . . . . . . . . . c30497_6e5i 1 . 7 . 2983 . 1 1 19 DPR HD3 H -8.846 -4.467 -3.362 . . . 1.0 . . . . . . . . . . . . A . 19 DPR HD3 . . . . . . . . . c30497_6e5i 1 . 7 . 2984 . 1 1 19 DPR HG2 H -10.178 -2.142 -3.527 . . . 1.0 . . . . . . . . . . . . A . 19 DPR HG2 . . . . . . . . . c30497_6e5i 1 . 7 . 2985 . 1 1 19 DPR HG3 H -11.001 -3.664 -3.146 . . . 1.0 . . . . . . . . . . . . A . 19 DPR HG3 . . . . . . . . . c30497_6e5i 1 . 7 . 2986 . 1 1 19 DPR N N -8.942 -4.108 -1.282 . . . 1.0 . . . . . . . . . . . . A . 19 DPR N . . . . . . . . . c30497_6e5i 1 . 7 . 2987 . 1 1 19 DPR O O -8.506 -1.824 0.535 . . . 1.0 . . . . . . . . . . . . A . 19 DPR O . . . . . . . . . c30497_6e5i 1 . 7 . 2988 . 1 1 20 PRO C C -7.918 -3.055 3.580 . . . 1.0 . . . . . . . . . . . . A . 20 PRO C . . . . . . . . . c30497_6e5i 1 . 7 . 2989 . 1 1 20 PRO CA C -9.259 -2.463 3.146 . . . 1.0 . . . . . . . . . . . . A . 20 PRO CA . . . . . . . . . c30497_6e5i 1 . 7 . 2990 . 1 1 20 PRO CB C -10.342 -2.801 4.165 . . . 1.0 . . . . . . . . . . . . A . 20 PRO CB . . . . . . . . . c30497_6e5i 1 . 7 . 2991 . 1 1 20 PRO CD C -10.811 -4.079 2.195 . . . 1.0 . . . . . . . . . . . . A . 20 PRO CD . . . . . . . . . c30497_6e5i 1 . 7 . 2992 . 1 1 20 PRO CG C -10.891 -4.104 3.700 . . . 1.0 . . . . . . . . . . . . A . 20 PRO CG . . . . . . . . . c30497_6e5i 1 . 7 . 2993 . 1 1 20 PRO HA H -9.168 -1.392 3.054 . . . 1.0 . . . . . . . . . . . . A . 20 PRO HA . . . . . . . . . c30497_6e5i 1 . 7 . 2994 . 1 1 20 PRO HB2 H -9.903 -2.882 5.148 . . . 1.0 . . . . . . . . . . . . A . 20 PRO HB2 . . . . . . . . . c30497_6e5i 1 . 7 . 2995 . 1 1 20 PRO HB3 H -11.098 -2.031 4.163 . . . 1.0 . . . . . . . . . . . . A . 20 PRO HB3 . . . . . . . . . c30497_6e5i 1 . 7 . 2996 . 1 1 20 PRO HD2 H -10.513 -5.046 1.816 . . . 1.0 . . . . . . . . . . . . A . 20 PRO HD2 . . . . . . . . . c30497_6e5i 1 . 7 . 2997 . 1 1 20 PRO HD3 H -11.759 -3.783 1.776 . . . 1.0 . . . . . . . . . . . . A . 20 PRO HD3 . . . . . . . . . c30497_6e5i 1 . 7 . 2998 . 1 1 20 PRO HG2 H -10.295 -4.913 4.094 . . . 1.0 . . . . . . . . . . . . A . 20 PRO HG2 . . . . . . . . . c30497_6e5i 1 . 7 . 2999 . 1 1 20 PRO HG3 H -11.918 -4.204 4.017 . . . 1.0 . . . . . . . . . . . . A . 20 PRO HG3 . . . . . . . . . c30497_6e5i 1 . 7 . 3000 . 1 1 20 PRO N N -9.777 -3.064 1.917 . . . 1.0 . . . . . . . . . . . . A . 20 PRO N . . . . . . . . . c30497_6e5i 1 . 7 . 3001 . 1 1 20 PRO O O -7.357 -2.655 4.601 . . . 1.0 . . . . . . . . . . . . A . 20 PRO O . . . . . . . . . c30497_6e5i 1 . 7 . 3002 . 1 1 21 ARG C C -5.046 -4.207 2.213 . . . 1.0 . . . . . . . . . . . . A . 21 ARG C . . . . . . . . . c30497_6e5i 1 . 7 . 3003 . 1 1 21 ARG CA C -6.152 -4.664 3.148 . . . 1.0 . . . . . . . . . . . . A . 21 ARG CA . . . . . . . . . c30497_6e5i 1 . 7 . 3004 . 1 1 21 ARG CB C -6.294 -6.182 3.077 . . . 1.0 . . . . . . . . . . . . A . 21 ARG CB . . . . . . . . . c30497_6e5i 1 . 7 . 3005 . 1 1 21 ARG CD C -7.358 -8.258 3.977 . . . 1.0 . . . . . . . . . . . . A . 21 ARG CD . . . . . . . . . c30497_6e5i 1 . 7 . 3006 . 1 1 21 ARG CG C -7.213 -6.757 4.138 . . . 1.0 . . . . . . . . . . . . A . 21 ARG CG . . . . . . . . . c30497_6e5i 1 . 7 . 3007 . 1 1 21 ARG CZ C -8.634 -10.104 4.989 . . . 1.0 . . . . . . . . . . . . A . 21 ARG CZ . . . . . . . . . c30497_6e5i 1 . 7 . 3008 . 1 1 21 ARG H H -7.887 -4.281 1.994 . . . 1.0 . . . . . . . . . . . . A . 21 ARG H . . . . . . . . . c30497_6e5i 1 . 7 . 3009 . 1 1 21 ARG HA H -5.892 -4.382 4.157 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HA . . . . . . . . . c30497_6e5i 1 . 7 . 3010 . 1 1 21 ARG HB2 H -6.687 -6.449 2.107 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HB2 . . . . . . . . . c30497_6e5i 1 . 7 . 3011 . 1 1 21 ARG HB3 H -5.318 -6.629 3.196 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HB3 . . . . . . . . . c30497_6e5i 1 . 7 . 3012 . 1 1 21 ARG HD2 H -7.816 -8.461 3.022 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HD2 . . . . . . . . . c30497_6e5i 1 . 7 . 3013 . 1 1 21 ARG HD3 H -6.375 -8.705 4.005 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HD3 . . . . . . . . . c30497_6e5i 1 . 7 . 3014 . 1 1 21 ARG HE H -8.386 -8.294 5.813 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HE . . . . . . . . . c30497_6e5i 1 . 7 . 3015 . 1 1 21 ARG HG2 H -6.799 -6.546 5.113 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HG2 . . . . . . . . . c30497_6e5i 1 . 7 . 3016 . 1 1 21 ARG HG3 H -8.186 -6.296 4.048 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HG3 . . . . . . . . . c30497_6e5i 1 . 7 . 3017 . 1 1 21 ARG HH11 H -7.864 -10.501 3.155 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HH11 . . . . . . . . . c30497_6e5i 1 . 7 . 3018 . 1 1 21 ARG HH12 H -8.731 -11.809 3.895 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HH12 . . . . . . . . . c30497_6e5i 1 . 7 . 3019 . 1 1 21 ARG HH21 H -9.541 -10.019 6.801 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HH21 . . . . . . . . . c30497_6e5i 1 . 7 . 3020 . 1 1 21 ARG HH22 H -9.671 -11.538 5.974 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HH22 . . . . . . . . . c30497_6e5i 1 . 7 . 3021 . 1 1 21 ARG N N -7.411 -4.013 2.813 . . . 1.0 . . . . . . . . . . . . A . 21 ARG N . . . . . . . . . c30497_6e5i 1 . 7 . 3022 . 1 1 21 ARG NE N -8.179 -8.854 5.029 . . . 1.0 . . . . . . . . . . . . A . 21 ARG NE . . . . . . . . . c30497_6e5i 1 . 7 . 3023 . 1 1 21 ARG NH1 N -8.390 -10.865 3.928 . . . 1.0 . . . . . . . . . . . . A . 21 ARG NH1 . . . . . . . . . c30497_6e5i 1 . 7 . 3024 . 1 1 21 ARG NH2 N -9.342 -10.590 6.001 . . . 1.0 . . . . . . . . . . . . A . 21 ARG NH2 . . . . . . . . . c30497_6e5i 1 . 7 . 3025 . 1 1 21 ARG O O -5.288 -3.943 1.038 . . . 1.0 . . . . . . . . . . . . A . 21 ARG O . . . . . . . . . c30497_6e5i 1 . 7 . 3026 . 1 1 22 TYR C C -1.474 -4.510 2.289 . . . 1.0 . . . . . . . . . . . . A . 22 TYR C . . . . . . . . . c30497_6e5i 1 . 7 . 3027 . 1 1 22 TYR CA C -2.693 -3.657 1.969 . . . 1.0 . . . . . . . . . . . . A . 22 TYR CA . . . . . . . . . c30497_6e5i 1 . 7 . 3028 . 1 1 22 TYR CB C -2.392 -2.185 2.260 . . . 1.0 . . . . . . . . . . . . A . 22 TYR CB . . . . . . . . . c30497_6e5i 1 . 7 . 3029 . 1 1 22 TYR CD1 C -3.739 -0.683 0.745 . . . 1.0 . . . . . . . . . . . . A . 22 TYR CD1 . . . . . . . . . c30497_6e5i 1 . 7 . 3030 . 1 1 22 TYR CD2 C -4.475 -0.972 2.991 . . . 1.0 . . . . . . . . . . . . A . 22 TYR CD2 . . . . . . . . . c30497_6e5i 1 . 7 . 3031 . 1 1 22 TYR CE1 C -4.796 0.167 0.501 . . . 1.0 . . . . . . . . . . . . A . 22 TYR CE1 . . . . . . . . . c30497_6e5i 1 . 7 . 3032 . 1 1 22 TYR CE2 C -5.539 -0.125 2.755 . . . 1.0 . . . . . . . . . . . . A . 22 TYR CE2 . . . . . . . . . c30497_6e5i 1 . 7 . 3033 . 1 1 22 TYR CG C -3.559 -1.265 1.994 . . . 1.0 . . . . . . . . . . . . A . 22 TYR CG . . . . . . . . . c30497_6e5i 1 . 7 . 3034 . 1 1 22 TYR CZ C -5.718 0.412 1.501 . . . 1.0 . . . . . . . . . . . . A . 22 TYR CZ . . . . . . . . . c30497_6e5i 1 . 7 . 3035 . 1 1 22 TYR H H -3.713 -4.341 3.687 . . . 1.0 . . . . . . . . . . . . A . 22 TYR H . . . . . . . . . c30497_6e5i 1 . 7 . 3036 . 1 1 22 TYR HA H -2.934 -3.768 0.921 . . . 1.0 . . . . . . . . . . . . A . 22 TYR HA . . . . . . . . . c30497_6e5i 1 . 7 . 3037 . 1 1 22 TYR HB2 H -2.117 -2.078 3.297 . . . 1.0 . . . . . . . . . . . . A . 22 TYR HB2 . . . . . . . . . c30497_6e5i 1 . 7 . 3038 . 1 1 22 TYR HB3 H -1.569 -1.865 1.637 . . . 1.0 . . . . . . . . . . . . A . 22 TYR HB3 . . . . . . . . . c30497_6e5i 1 . 7 . 3039 . 1 1 22 TYR HD1 H -3.032 -0.901 -0.041 . . . 1.0 . . . . . . . . . . . . A . 22 TYR HD1 . . . . . . . . . c30497_6e5i 1 . 7 . 3040 . 1 1 22 TYR HD2 H -4.350 -1.421 3.967 . . . 1.0 . . . . . . . . . . . . A . 22 TYR HD2 . . . . . . . . . c30497_6e5i 1 . 7 . 3041 . 1 1 22 TYR HE1 H -4.917 0.608 -0.477 . . . 1.0 . . . . . . . . . . . . A . 22 TYR HE1 . . . . . . . . . c30497_6e5i 1 . 7 . 3042 . 1 1 22 TYR HE2 H -6.240 0.089 3.547 . . . 1.0 . . . . . . . . . . . . A . 22 TYR HE2 . . . . . . . . . c30497_6e5i 1 . 7 . 3043 . 1 1 22 TYR HH H -6.816 1.929 1.993 . . . 1.0 . . . . . . . . . . . . A . 22 TYR HH . . . . . . . . . c30497_6e5i 1 . 7 . 3044 . 1 1 22 TYR N N -3.839 -4.105 2.744 . . . 1.0 . . . . . . . . . . . . A . 22 TYR N . . . . . . . . . c30497_6e5i 1 . 7 . 3045 . 1 1 22 TYR O O -0.936 -4.452 3.395 . . . 1.0 . . . . . . . . . . . . A . 22 TYR O . . . . . . . . . c30497_6e5i 1 . 7 . 3046 . 1 1 22 TYR OH O -6.751 1.296 1.269 . . . 1.0 . . . . . . . . . . . . A . 22 TYR OH . . . . . . . . . c30497_6e5i 1 . 7 . 3047 . 1 1 23 GLU C C 1.382 -5.486 1.096 . . . 1.0 . . . . . . . . . . . . A . 23 GLU C . . . . . . . . . c30497_6e5i 1 . 7 . 3048 . 1 1 23 GLU CA C 0.090 -6.186 1.495 . . . 1.0 . . . . . . . . . . . . A . 23 GLU CA . . . . . . . . . c30497_6e5i 1 . 7 . 3049 . 1 1 23 GLU CB C -0.094 -7.462 0.670 . . . 1.0 . . . . . . . . . . . . A . 23 GLU CB . . . . . . . . . c30497_6e5i 1 . 7 . 3050 . 1 1 23 GLU CD C -1.206 -8.768 2.526 . . . 1.0 . . . . . . . . . . . . A . 23 GLU CD . . . . . . . . . c30497_6e5i 1 . 7 . 3051 . 1 1 23 GLU CG C -1.293 -8.298 1.088 . . . 1.0 . . . . . . . . . . . . A . 23 GLU CG . . . . . . . . . c30497_6e5i 1 . 7 . 3052 . 1 1 23 GLU H H -1.492 -5.256 0.443 . . . 1.0 . . . . . . . . . . . . A . 23 GLU H . . . . . . . . . c30497_6e5i 1 . 7 . 3053 . 1 1 23 GLU HA H 0.144 -6.447 2.540 . . . 1.0 . . . . . . . . . . . . A . 23 GLU HA . . . . . . . . . c30497_6e5i 1 . 7 . 3054 . 1 1 23 GLU HB2 H -0.216 -7.191 -0.366 . . . 1.0 . . . . . . . . . . . . A . 23 GLU HB2 . . . . . . . . . c30497_6e5i 1 . 7 . 3055 . 1 1 23 GLU HB3 H 0.793 -8.070 0.770 . . . 1.0 . . . . . . . . . . . . A . 23 GLU HB3 . . . . . . . . . c30497_6e5i 1 . 7 . 3056 . 1 1 23 GLU HG2 H -2.189 -7.705 0.975 . . . 1.0 . . . . . . . . . . . . A . 23 GLU HG2 . . . . . . . . . c30497_6e5i 1 . 7 . 3057 . 1 1 23 GLU HG3 H -1.355 -9.164 0.446 . . . 1.0 . . . . . . . . . . . . A . 23 GLU HG3 . . . . . . . . . c30497_6e5i 1 . 7 . 3058 . 1 1 23 GLU N N -1.043 -5.294 1.317 . . . 1.0 . . . . . . . . . . . . A . 23 GLU N . . . . . . . . . c30497_6e5i 1 . 7 . 3059 . 1 1 23 GLU O O 1.603 -5.190 -0.077 . . . 1.0 . . . . . . . . . . . . A . 23 GLU O . . . . . . . . . c30497_6e5i 1 . 7 . 3060 . 1 1 23 GLU OE1 O -2.027 -8.324 3.357 . . . 1.0 . . . . . . . . . . . . A . 23 GLU OE1 . . . . . . . . . c30497_6e5i 1 . 7 . 3061 . 1 1 23 GLU OE2 O -0.315 -9.585 2.837 . . . 1.0 . . . . . . . . . . . . A . 23 GLU OE2 . . . . . . . . . c30497_6e5i 1 . 7 . 3062 . 1 1 24 VAL C C 4.590 -5.457 1.476 . . . 1.0 . . . . . . . . . . . . A . 24 VAL C . . . . . . . . . c30497_6e5i 1 . 7 . 3063 . 1 1 24 VAL CA C 3.465 -4.497 1.842 . . . 1.0 . . . . . . . . . . . . A . 24 VAL CA . . . . . . . . . c30497_6e5i 1 . 7 . 3064 . 1 1 24 VAL CB C 3.877 -3.672 3.079 . . . 1.0 . . . . . . . . . . . . A . 24 VAL CB . . . . . . . . . c30497_6e5i 1 . 7 . 3065 . 1 1 24 VAL CG1 C 5.162 -2.902 2.811 . . . 1.0 . . . . . . . . . . . . A . 24 VAL CG1 . . . . . . . . . c30497_6e5i 1 . 7 . 3066 . 1 1 24 VAL CG2 C 2.759 -2.723 3.488 . . . 1.0 . . . . . . . . . . . . A . 24 VAL CG2 . . . . . . . . . c30497_6e5i 1 . 7 . 3067 . 1 1 24 VAL H H 2.020 -5.534 2.980 . . . 1.0 . . . . . . . . . . . . A . 24 VAL H . . . . . . . . . c30497_6e5i 1 . 7 . 3068 . 1 1 24 VAL HA H 3.302 -3.819 1.018 . . . 1.0 . . . . . . . . . . . . A . 24 VAL HA . . . . . . . . . c30497_6e5i 1 . 7 . 3069 . 1 1 24 VAL HB H 4.058 -4.354 3.896 . . . 1.0 . . . . . . . . . . . . A . 24 VAL HB . . . . . . . . . c30497_6e5i 1 . 7 . 3070 . 1 1 24 VAL HG11 H 5.018 -2.240 1.971 . . . 1.0 . . . . . . . . . . . . A . 24 VAL HG11 . . . . . . . . . c30497_6e5i 1 . 7 . 3071 . 1 1 24 VAL HG12 H 5.959 -3.597 2.588 . . . 1.0 . . . . . . . . . . . . A . 24 VAL HG12 . . . . . . . . . c30497_6e5i 1 . 7 . 3072 . 1 1 24 VAL HG13 H 5.424 -2.323 3.684 . . . 1.0 . . . . . . . . . . . . A . 24 VAL HG13 . . . . . . . . . c30497_6e5i 1 . 7 . 3073 . 1 1 24 VAL HG21 H 2.532 -2.062 2.666 . . . 1.0 . . . . . . . . . . . . A . 24 VAL HG21 . . . . . . . . . c30497_6e5i 1 . 7 . 3074 . 1 1 24 VAL HG22 H 3.075 -2.141 4.341 . . . 1.0 . . . . . . . . . . . . A . 24 VAL HG22 . . . . . . . . . c30497_6e5i 1 . 7 . 3075 . 1 1 24 VAL HG23 H 1.878 -3.293 3.746 . . . 1.0 . . . . . . . . . . . . A . 24 VAL HG23 . . . . . . . . . c30497_6e5i 1 . 7 . 3076 . 1 1 24 VAL N N 2.227 -5.220 2.075 . . . 1.0 . . . . . . . . . . . . A . 24 VAL N . . . . . . . . . c30497_6e5i 1 . 7 . 3077 . 1 1 24 VAL O O 5.125 -6.168 2.329 . . . 1.0 . . . . . . . . . . . . A . 24 VAL O . . . . . . . . . c30497_6e5i 1 . 7 . 3078 . 1 1 25 HIS C C 7.303 -5.602 -0.428 . . . 1.0 . . . . . . . . . . . . A . 25 HIS C . . . . . . . . . c30497_6e5i 1 . 7 . 3079 . 1 1 25 HIS CA C 5.985 -6.353 -0.299 . . . 1.0 . . . . . . . . . . . . A . 25 HIS CA . . . . . . . . . c30497_6e5i 1 . 7 . 3080 . 1 1 25 HIS CB C 5.582 -6.958 -1.646 . . . 1.0 . . . . . . . . . . . . A . 25 HIS CB . . . . . . . . . c30497_6e5i 1 . 7 . 3081 . 1 1 25 HIS CD2 C 3.412 -8.253 -1.045 . . . 1.0 . . . . . . . . . . . . A . 25 HIS CD2 . . . . . . . . . c30497_6e5i 1 . 7 . 3082 . 1 1 25 HIS CE1 C 4.034 -10.245 -1.709 . . . 1.0 . . . . . . . . . . . . A . 25 HIS CE1 . . . . . . . . . c30497_6e5i 1 . 7 . 3083 . 1 1 25 HIS CG C 4.672 -8.144 -1.526 . . . 1.0 . . . . . . . . . . . . A . 25 HIS CG . . . . . . . . . c30497_6e5i 1 . 7 . 3084 . 1 1 25 HIS H H 4.485 -4.870 -0.430 . . . 1.0 . . . . . . . . . . . . A . 25 HIS H . . . . . . . . . c30497_6e5i 1 . 7 . 3085 . 1 1 25 HIS HA H 6.114 -7.151 0.416 . . . 1.0 . . . . . . . . . . . . A . 25 HIS HA . . . . . . . . . c30497_6e5i 1 . 7 . 3086 . 1 1 25 HIS HB2 H 5.070 -6.207 -2.228 . . . 1.0 . . . . . . . . . . . . A . 25 HIS HB2 . . . . . . . . . c30497_6e5i 1 . 7 . 3087 . 1 1 25 HIS HB3 H 6.469 -7.267 -2.172 . . . 1.0 . . . . . . . . . . . . A . 25 HIS HB3 . . . . . . . . . c30497_6e5i 1 . 7 . 3088 . 1 1 25 HIS HD1 H 5.901 -9.667 -2.321 . . . 1.0 . . . . . . . . . . . . A . 25 HIS HD1 . . . . . . . . . c30497_6e5i 1 . 7 . 3089 . 1 1 25 HIS HD2 H 2.809 -7.453 -0.642 . . . 1.0 . . . . . . . . . . . . A . 25 HIS HD2 . . . . . . . . . c30497_6e5i 1 . 7 . 3090 . 1 1 25 HIS HE1 H 4.033 -11.302 -1.931 . . . 1.0 . . . . . . . . . . . . A . 25 HIS HE1 . . . . . . . . . c30497_6e5i 1 . 7 . 3091 . 1 1 25 HIS HE2 H 2.258 -9.979 -0.737 . . . 1.0 . . . . . . . . . . . . A . 25 HIS HE2 . . . . . . . . . c30497_6e5i 1 . 7 . 3092 . 1 1 25 HIS N N 4.939 -5.476 0.200 . . . 1.0 . . . . . . . . . . . . A . 25 HIS N . . . . . . . . . c30497_6e5i 1 . 7 . 3093 . 1 1 25 HIS ND1 N 5.032 -9.412 -1.933 . . . 1.0 . . . . . . . . . . . . A . 25 HIS ND1 . . . . . . . . . c30497_6e5i 1 . 7 . 3094 . 1 1 25 HIS NE2 N 3.039 -9.570 -1.169 . . . 1.0 . . . . . . . . . . . . A . 25 HIS NE2 . . . . . . . . . c30497_6e5i 1 . 7 . 3095 . 1 1 25 HIS O O 7.512 -4.843 -1.374 . . . 1.0 . . . . . . . . . . . . A . 25 HIS O . . . . . . . . . c30497_6e5i 1 . 7 . 3096 . 1 1 26 CYS C C 10.535 -6.159 0.031 . . . 1.0 . . . . . . . . . . . . A . 26 CYS C . . . . . . . . . c30497_6e5i 1 . 7 . 3097 . 1 1 26 CYS CA C 9.488 -5.177 0.536 . . . 1.0 . . . . . . . . . . . . A . 26 CYS CA . . . . . . . . . c30497_6e5i 1 . 7 . 3098 . 1 1 26 CYS CB C 9.854 -4.697 1.941 . . . 1.0 . . . . . . . . . . . . A . 26 CYS CB . . . . . . . . . c30497_6e5i 1 . 7 . 3099 . 1 1 26 CYS H H 7.943 -6.407 1.278 . . . 1.0 . . . . . . . . . . . . A . 26 CYS H . . . . . . . . . c30497_6e5i 1 . 7 . 3100 . 1 1 26 CYS HA H 9.448 -4.327 -0.130 . . . 1.0 . . . . . . . . . . . . A . 26 CYS HA . . . . . . . . . c30497_6e5i 1 . 7 . 3101 . 1 1 26 CYS HB2 H 9.795 -5.531 2.623 . . . 1.0 . . . . . . . . . . . . A . 26 CYS HB2 . . . . . . . . . c30497_6e5i 1 . 7 . 3102 . 1 1 26 CYS HB3 H 10.865 -4.318 1.931 . . . 1.0 . . . . . . . . . . . . A . 26 CYS HB3 . . . . . . . . . c30497_6e5i 1 . 7 . 3103 . 1 1 26 CYS N N 8.178 -5.804 0.540 . . . 1.0 . . . . . . . . . . . . A . 26 CYS N . . . . . . . . . c30497_6e5i 1 . 7 . 3104 . 1 1 26 CYS O O 11.265 -6.771 0.812 . . . 1.0 . . . . . . . . . . . . A . 26 CYS O . . . . . . . . . c30497_6e5i 1 . 7 . 3105 . 1 1 26 CYS SG S 8.776 -3.379 2.585 . . . 1.0 . . . . . . . . . . . . A . 26 CYS SG . . . . . . . . . c30497_6e5i 1 . 7 . 3106 . 1 1 27 NH2 HN1 H 9.987 -5.803 -1.844 . . . 1.0 . . . . . . . . . . . . A . 27 NH2 HN1 . . . . . . . . . c30497_6e5i 1 . 7 . 3107 . 1 1 27 NH2 HN2 H 11.255 -6.960 -1.633 . . . 1.0 . . . . . . . . . . . . A . 27 NH2 HN2 . . . . . . . . . c30497_6e5i 1 . 7 . 3108 . 1 1 27 NH2 N N 10.599 -6.323 -1.279 . . . 1.0 . . . . . . . . . . . . A . 27 NH2 N . . . . . . . . . c30497_6e5i 1 . 8 . 3109 . 1 1 1 ASN C C -6.697 6.395 -3.310 . . . 1.0 . . . . . . . . . . . . A . 1 ASN C . . . . . . . . . c30497_6e5i 1 . 8 . 3110 . 1 1 1 ASN CA C -8.216 6.327 -3.423 . . . 1.0 . . . . . . . . . . . . A . 1 ASN CA . . . . . . . . . c30497_6e5i 1 . 8 . 3111 . 1 1 1 ASN CB C -8.836 5.796 -2.124 . . . 1.0 . . . . . . . . . . . . A . 1 ASN CB . . . . . . . . . c30497_6e5i 1 . 8 . 3112 . 1 1 1 ASN CG C -8.678 6.754 -0.960 . . . 1.0 . . . . . . . . . . . . A . 1 ASN CG . . . . . . . . . c30497_6e5i 1 . 8 . 3113 . 1 1 1 ASN H1 H -8.239 4.488 -4.394 . . . 1.0 . . . . . . . . . . . . A . 1 ASN H1 . . . . . . . . . c30497_6e5i 1 . 8 . 3114 . 1 1 1 ASN H2 H -8.178 5.813 -5.436 . . . 1.0 . . . . . . . . . . . . A . 1 ASN H2 . . . . . . . . . c30497_6e5i 1 . 8 . 3115 . 1 1 1 ASN H3 H -9.623 5.423 -4.657 . . . 1.0 . . . . . . . . . . . . A . 1 ASN H3 . . . . . . . . . c30497_6e5i 1 . 8 . 3116 . 1 1 1 ASN HA H -8.595 7.318 -3.621 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HA . . . . . . . . . c30497_6e5i 1 . 8 . 3117 . 1 1 1 ASN HB2 H -9.891 5.623 -2.282 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HB2 . . . . . . . . . c30497_6e5i 1 . 8 . 3118 . 1 1 1 ASN HB3 H -8.361 4.863 -1.866 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HB3 . . . . . . . . . c30497_6e5i 1 . 8 . 3119 . 1 1 1 ASN HD21 H -10.407 7.631 -1.403 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HD21 . . . . . . . . . c30497_6e5i 1 . 8 . 3120 . 1 1 1 ASN HD22 H -9.560 8.280 -0.040 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HD22 . . . . . . . . . c30497_6e5i 1 . 8 . 3121 . 1 1 1 ASN N N -8.591 5.452 -4.554 . . . 1.0 . . . . . . . . . . . . A . 1 ASN N . . . . . . . . . c30497_6e5i 1 . 8 . 3122 . 1 1 1 ASN ND2 N -9.645 7.641 -0.782 . . . 1.0 . . . . . . . . . . . . A . 1 ASN ND2 . . . . . . . . . c30497_6e5i 1 . 8 . 3123 . 1 1 1 ASN O O -5.995 5.500 -3.782 . . . 1.0 . . . . . . . . . . . . A . 1 ASN O . . . . . . . . . c30497_6e5i 1 . 8 . 3124 . 1 1 1 ASN OD1 O -7.696 6.694 -0.222 . . . 1.0 . . . . . . . . . . . . A . 1 ASN OD1 . . . . . . . . . c30497_6e5i 1 . 8 . 3125 . 1 1 2 ASP C C -4.095 7.066 -1.428 . . . 1.0 . . . . . . . . . . . . A . 2 ASP C . . . . . . . . . c30497_6e5i 1 . 8 . 3126 . 1 1 2 ASP CA C -4.753 7.705 -2.645 . . . 1.0 . . . . . . . . . . . . A . 2 ASP CA . . . . . . . . . c30497_6e5i 1 . 8 . 3127 . 1 1 2 ASP CB C -4.461 9.207 -2.653 . . . 1.0 . . . . . . . . . . . . A . 2 ASP CB . . . . . . . . . c30497_6e5i 1 . 8 . 3128 . 1 1 2 ASP CG C -4.770 9.852 -3.988 . . . 1.0 . . . . . . . . . . . . A . 2 ASP CG . . . . . . . . . c30497_6e5i 1 . 8 . 3129 . 1 1 2 ASP H H -6.803 8.097 -2.266 . . . 1.0 . . . . . . . . . . . . A . 2 ASP H . . . . . . . . . c30497_6e5i 1 . 8 . 3130 . 1 1 2 ASP HA H -4.322 7.271 -3.532 . . . 1.0 . . . . . . . . . . . . A . 2 ASP HA . . . . . . . . . c30497_6e5i 1 . 8 . 3131 . 1 1 2 ASP HB2 H -5.060 9.687 -1.896 . . . 1.0 . . . . . . . . . . . . A . 2 ASP HB2 . . . . . . . . . c30497_6e5i 1 . 8 . 3132 . 1 1 2 ASP HB3 H -3.418 9.365 -2.432 . . . 1.0 . . . . . . . . . . . . A . 2 ASP HB3 . . . . . . . . . c30497_6e5i 1 . 8 . 3133 . 1 1 2 ASP N N -6.192 7.457 -2.695 . . . 1.0 . . . . . . . . . . . . A . 2 ASP N . . . . . . . . . c30497_6e5i 1 . 8 . 3134 . 1 1 2 ASP O O -2.916 7.301 -1.162 . . . 1.0 . . . . . . . . . . . . A . 2 ASP O . . . . . . . . . c30497_6e5i 1 . 8 . 3135 . 1 1 2 ASP OD1 O -4.058 9.566 -4.971 . . . 1.0 . . . . . . . . . . . . A . 2 ASP OD1 . . . . . . . . . c30497_6e5i 1 . 8 . 3136 . 1 1 2 ASP OD2 O -5.722 10.663 -4.059 . . . 1.0 . . . . . . . . . . . . A . 2 ASP OD2 . . . . . . . . . c30497_6e5i 1 . 8 . 3137 . 1 1 3 LYS C C -3.163 4.639 0.024 . . . 1.0 . . . . . . . . . . . . A . 3 LYS C . . . . . . . . . c30497_6e5i 1 . 8 . 3138 . 1 1 3 LYS CA C -4.308 5.548 0.458 . . . 1.0 . . . . . . . . . . . . A . 3 LYS CA . . . . . . . . . c30497_6e5i 1 . 8 . 3139 . 1 1 3 LYS CB C -5.406 4.730 1.142 . . . 1.0 . . . . . . . . . . . . A . 3 LYS CB . . . . . . . . . c30497_6e5i 1 . 8 . 3140 . 1 1 3 LYS CD C -4.489 4.882 3.479 . . . 1.0 . . . . . . . . . . . . A . 3 LYS CD . . . . . . . . . c30497_6e5i 1 . 8 . 3141 . 1 1 3 LYS CE C -3.993 4.099 4.681 . . . 1.0 . . . . . . . . . . . . A . 3 LYS CE . . . . . . . . . c30497_6e5i 1 . 8 . 3142 . 1 1 3 LYS CG C -4.931 3.956 2.360 . . . 1.0 . . . . . . . . . . . . A . 3 LYS CG . . . . . . . . . c30497_6e5i 1 . 8 . 3143 . 1 1 3 LYS H H -5.789 6.126 -0.933 . . . 1.0 . . . . . . . . . . . . A . 3 LYS H . . . . . . . . . c30497_6e5i 1 . 8 . 3144 . 1 1 3 LYS HA H -3.928 6.283 1.150 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HA . . . . . . . . . c30497_6e5i 1 . 8 . 3145 . 1 1 3 LYS HB2 H -6.194 5.399 1.453 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HB2 . . . . . . . . . c30497_6e5i 1 . 8 . 3146 . 1 1 3 LYS HB3 H -5.808 4.025 0.430 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HB3 . . . . . . . . . c30497_6e5i 1 . 8 . 3147 . 1 1 3 LYS HD2 H -3.690 5.512 3.118 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HD2 . . . . . . . . . c30497_6e5i 1 . 8 . 3148 . 1 1 3 LYS HD3 H -5.327 5.493 3.779 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HD3 . . . . . . . . . c30497_6e5i 1 . 8 . 3149 . 1 1 3 LYS HE2 H -4.777 3.432 5.009 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HE2 . . . . . . . . . c30497_6e5i 1 . 8 . 3150 . 1 1 3 LYS HE3 H -3.130 3.519 4.387 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HE3 . . . . . . . . . c30497_6e5i 1 . 8 . 3151 . 1 1 3 LYS HG2 H -5.740 3.340 2.719 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HG2 . . . . . . . . . c30497_6e5i 1 . 8 . 3152 . 1 1 3 LYS HG3 H -4.099 3.330 2.071 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HG3 . . . . . . . . . c30497_6e5i 1 . 8 . 3153 . 1 1 3 LYS HZ1 H -2.903 5.680 5.498 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HZ1 . . . . . . . . . c30497_6e5i 1 . 8 . 3154 . 1 1 3 LYS HZ2 H -3.219 4.428 6.589 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HZ2 . . . . . . . . . c30497_6e5i 1 . 8 . 3155 . 1 1 3 LYS HZ3 H -4.452 5.501 6.155 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HZ3 . . . . . . . . . c30497_6e5i 1 . 8 . 3156 . 1 1 3 LYS N N -4.848 6.253 -0.696 . . . 1.0 . . . . . . . . . . . . A . 3 LYS N . . . . . . . . . c30497_6e5i 1 . 8 . 3157 . 1 1 3 LYS NZ N -3.616 4.988 5.808 . . . 1.0 . . . . . . . . . . . . A . 3 LYS NZ . . . . . . . . . c30497_6e5i 1 . 8 . 3158 . 1 1 3 LYS O O -2.110 4.592 0.667 . . . 1.0 . . . . . . . . . . . . A . 3 LYS O . . . . . . . . . c30497_6e5i 1 . 8 . 3159 . 1 1 4 CYS C C -1.100 3.864 -2.001 . . . 1.0 . . . . . . . . . . . . A . 4 CYS C . . . . . . . . . c30497_6e5i 1 . 8 . 3160 . 1 1 4 CYS CA C -2.352 3.070 -1.652 . . . 1.0 . . . . . . . . . . . . A . 4 CYS CA . . . . . . . . . c30497_6e5i 1 . 8 . 3161 . 1 1 4 CYS CB C -2.880 2.378 -2.908 . . . 1.0 . . . . . . . . . . . . A . 4 CYS CB . . . . . . . . . c30497_6e5i 1 . 8 . 3162 . 1 1 4 CYS H H -4.246 4.001 -1.528 . . . 1.0 . . . . . . . . . . . . A . 4 CYS H . . . . . . . . . c30497_6e5i 1 . 8 . 3163 . 1 1 4 CYS HA H -2.101 2.325 -0.916 . . . 1.0 . . . . . . . . . . . . A . 4 CYS HA . . . . . . . . . c30497_6e5i 1 . 8 . 3164 . 1 1 4 CYS HB2 H -3.239 3.127 -3.593 . . . 1.0 . . . . . . . . . . . . A . 4 CYS HB2 . . . . . . . . . c30497_6e5i 1 . 8 . 3165 . 1 1 4 CYS HB3 H -2.073 1.830 -3.371 . . . 1.0 . . . . . . . . . . . . A . 4 CYS HB3 . . . . . . . . . c30497_6e5i 1 . 8 . 3166 . 1 1 4 CYS N N -3.373 3.937 -1.083 . . . 1.0 . . . . . . . . . . . . A . 4 CYS N . . . . . . . . . c30497_6e5i 1 . 8 . 3167 . 1 1 4 CYS O O 0.020 3.413 -1.770 . . . 1.0 . . . . . . . . . . . . A . 4 CYS O . . . . . . . . . c30497_6e5i 1 . 8 . 3168 . 1 1 4 CYS SG S -4.241 1.209 -2.613 . . . 1.0 . . . . . . . . . . . . A . 4 CYS SG . . . . . . . . . c30497_6e5i 1 . 8 . 3169 . 1 1 5 LYS C C 0.590 6.382 -1.748 . . . 1.0 . . . . . . . . . . . . A . 5 LYS C . . . . . . . . . c30497_6e5i 1 . 8 . 3170 . 1 1 5 LYS CA C -0.216 5.918 -2.955 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CA . . . . . . . . . c30497_6e5i 1 . 8 . 3171 . 1 1 5 LYS CB C -0.766 7.124 -3.718 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CB . . . . . . . . . c30497_6e5i 1 . 8 . 3172 . 1 1 5 LYS CD C -0.315 9.315 -4.852 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CD . . . . . . . . . c30497_6e5i 1 . 8 . 3173 . 1 1 5 LYS CE C 0.747 10.313 -5.284 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CE . . . . . . . . . c30497_6e5i 1 . 8 . 3174 . 1 1 5 LYS CG C 0.300 8.109 -4.164 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CG . . . . . . . . . c30497_6e5i 1 . 8 . 3175 . 1 1 5 LYS H H -2.228 5.361 -2.676 . . . 1.0 . . . . . . . . . . . . A . 5 LYS H . . . . . . . . . c30497_6e5i 1 . 8 . 3176 . 1 1 5 LYS HA H 0.430 5.351 -3.608 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HA . . . . . . . . . c30497_6e5i 1 . 8 . 3177 . 1 1 5 LYS HB2 H -1.288 6.772 -4.595 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HB2 . . . . . . . . . c30497_6e5i 1 . 8 . 3178 . 1 1 5 LYS HB3 H -1.465 7.647 -3.082 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HB3 . . . . . . . . . c30497_6e5i 1 . 8 . 3179 . 1 1 5 LYS HD2 H -0.857 8.981 -5.723 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HD2 . . . . . . . . . c30497_6e5i 1 . 8 . 3180 . 1 1 5 LYS HD3 H -0.995 9.799 -4.166 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HD3 . . . . . . . . . c30497_6e5i 1 . 8 . 3181 . 1 1 5 LYS HE2 H 0.262 11.162 -5.742 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HE2 . . . . . . . . . c30497_6e5i 1 . 8 . 3182 . 1 1 5 LYS HE3 H 1.291 10.640 -4.411 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HE3 . . . . . . . . . c30497_6e5i 1 . 8 . 3183 . 1 1 5 LYS HG2 H 0.854 8.442 -3.300 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HG2 . . . . . . . . . c30497_6e5i 1 . 8 . 3184 . 1 1 5 LYS HG3 H 0.967 7.614 -4.854 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HG3 . . . . . . . . . c30497_6e5i 1 . 8 . 3185 . 1 1 5 LYS HZ1 H 2.358 10.453 -6.605 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HZ1 . . . . . . . . . c30497_6e5i 1 . 8 . 3186 . 1 1 5 LYS HZ2 H 1.188 9.323 -7.068 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HZ2 . . . . . . . . . c30497_6e5i 1 . 8 . 3187 . 1 1 5 LYS HZ3 H 2.254 8.965 -5.807 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HZ3 . . . . . . . . . c30497_6e5i 1 . 8 . 3188 . 1 1 5 LYS N N -1.308 5.054 -2.546 . . . 1.0 . . . . . . . . . . . . A . 5 LYS N . . . . . . . . . c30497_6e5i 1 . 8 . 3189 . 1 1 5 LYS NZ N 1.704 9.724 -6.258 . . . 1.0 . . . . . . . . . . . . A . 5 LYS NZ . . . . . . . . . c30497_6e5i 1 . 8 . 3190 . 1 1 5 LYS O O 1.817 6.340 -1.762 . . . 1.0 . . . . . . . . . . . . A . 5 LYS O . . . . . . . . . c30497_6e5i 1 . 8 . 3191 . 1 1 6 GLU C C 1.342 6.179 1.183 . . . 1.0 . . . . . . . . . . . . A . 6 GLU C . . . . . . . . . c30497_6e5i 1 . 8 . 3192 . 1 1 6 GLU CA C 0.552 7.294 0.505 . . . 1.0 . . . . . . . . . . . . A . 6 GLU CA . . . . . . . . . c30497_6e5i 1 . 8 . 3193 . 1 1 6 GLU CB C -0.472 7.886 1.471 . . . 1.0 . . . . . . . . . . . . A . 6 GLU CB . . . . . . . . . c30497_6e5i 1 . 8 . 3194 . 1 1 6 GLU CD C -0.049 10.300 0.866 . . . 1.0 . . . . . . . . . . . . A . 6 GLU CD . . . . . . . . . c30497_6e5i 1 . 8 . 3195 . 1 1 6 GLU CG C -1.078 9.192 0.982 . . . 1.0 . . . . . . . . . . . . A . 6 GLU CG . . . . . . . . . c30497_6e5i 1 . 8 . 3196 . 1 1 6 GLU H H -1.087 6.787 -0.739 . . . 1.0 . . . . . . . . . . . . A . 6 GLU H . . . . . . . . . c30497_6e5i 1 . 8 . 3197 . 1 1 6 GLU HA H 1.241 8.070 0.208 . . . 1.0 . . . . . . . . . . . . A . 6 GLU HA . . . . . . . . . c30497_6e5i 1 . 8 . 3198 . 1 1 6 GLU HB2 H -1.271 7.174 1.613 . . . 1.0 . . . . . . . . . . . . A . 6 GLU HB2 . . . . . . . . . c30497_6e5i 1 . 8 . 3199 . 1 1 6 GLU HB3 H 0.008 8.070 2.421 . . . 1.0 . . . . . . . . . . . . A . 6 GLU HB3 . . . . . . . . . c30497_6e5i 1 . 8 . 3200 . 1 1 6 GLU HG2 H -1.519 9.030 0.010 . . . 1.0 . . . . . . . . . . . . A . 6 GLU HG2 . . . . . . . . . c30497_6e5i 1 . 8 . 3201 . 1 1 6 GLU HG3 H -1.843 9.501 1.675 . . . 1.0 . . . . . . . . . . . . A . 6 GLU HG3 . . . . . . . . . c30497_6e5i 1 . 8 . 3202 . 1 1 6 GLU N N -0.105 6.805 -0.701 . . . 1.0 . . . . . . . . . . . . A . 6 GLU N . . . . . . . . . c30497_6e5i 1 . 8 . 3203 . 1 1 6 GLU O O 2.455 6.399 1.673 . . . 1.0 . . . . . . . . . . . . A . 6 GLU O . . . . . . . . . c30497_6e5i 1 . 8 . 3204 . 1 1 6 GLU OE1 O 0.188 11.010 1.868 . . . 1.0 . . . . . . . . . . . . A . 6 GLU OE1 . . . . . . . . . c30497_6e5i 1 . 8 . 3205 . 1 1 6 GLU OE2 O 0.533 10.473 -0.223 . . . 1.0 . . . . . . . . . . . . A . 6 GLU OE2 . . . . . . . . . c30497_6e5i 1 . 8 . 3206 . 1 1 7 LEU C C 2.677 3.483 0.896 . . . 1.0 . . . . . . . . . . . . A . 7 LEU C . . . . . . . . . c30497_6e5i 1 . 8 . 3207 . 1 1 7 LEU CA C 1.452 3.815 1.740 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CA . . . . . . . . . c30497_6e5i 1 . 8 . 3208 . 1 1 7 LEU CB C 0.505 2.616 1.785 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CB . . . . . . . . . c30497_6e5i 1 . 8 . 3209 . 1 1 7 LEU CD1 C -1.670 1.639 2.559 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CD1 . . . . . . . . . c30497_6e5i 1 . 8 . 3210 . 1 1 7 LEU CD2 C -0.060 2.539 4.228 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CD2 . . . . . . . . . c30497_6e5i 1 . 8 . 3211 . 1 1 7 LEU CG C -0.618 2.703 2.823 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CG . . . . . . . . . c30497_6e5i 1 . 8 . 3212 . 1 1 7 LEU H H -0.149 4.884 0.852 . . . 1.0 . . . . . . . . . . . . A . 7 LEU H . . . . . . . . . c30497_6e5i 1 . 8 . 3213 . 1 1 7 LEU HA H 1.774 4.050 2.742 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HA . . . . . . . . . c30497_6e5i 1 . 8 . 3214 . 1 1 7 LEU HB2 H 0.056 2.507 0.809 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HB2 . . . . . . . . . c30497_6e5i 1 . 8 . 3215 . 1 1 7 LEU HB3 H 1.089 1.733 1.993 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HB3 . . . . . . . . . c30497_6e5i 1 . 8 . 3216 . 1 1 7 LEU HD11 H -2.444 1.702 3.309 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD11 . . . . . . . . . c30497_6e5i 1 . 8 . 3217 . 1 1 7 LEU HD12 H -1.211 0.662 2.598 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD12 . . . . . . . . . c30497_6e5i 1 . 8 . 3218 . 1 1 7 LEU HD13 H -2.104 1.794 1.582 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD13 . . . . . . . . . c30497_6e5i 1 . 8 . 3219 . 1 1 7 LEU HD21 H 0.683 3.300 4.414 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD21 . . . . . . . . . c30497_6e5i 1 . 8 . 3220 . 1 1 7 LEU HD22 H 0.392 1.564 4.322 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD22 . . . . . . . . . c30497_6e5i 1 . 8 . 3221 . 1 1 7 LEU HD23 H -0.862 2.634 4.947 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD23 . . . . . . . . . c30497_6e5i 1 . 8 . 3222 . 1 1 7 LEU HG H -1.092 3.672 2.756 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HG . . . . . . . . . c30497_6e5i 1 . 8 . 3223 . 1 1 7 LEU N N 0.766 4.983 1.203 . . . 1.0 . . . . . . . . . . . . A . 7 LEU N . . . . . . . . . c30497_6e5i 1 . 8 . 3224 . 1 1 7 LEU O O 3.749 3.185 1.424 . . . 1.0 . . . . . . . . . . . . A . 7 LEU O . . . . . . . . . c30497_6e5i 1 . 8 . 3225 . 1 1 8 LYS C C 4.728 4.307 -1.137 . . . 1.0 . . . . . . . . . . . . A . 8 LYS C . . . . . . . . . c30497_6e5i 1 . 8 . 3226 . 1 1 8 LYS CA C 3.596 3.307 -1.353 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CA . . . . . . . . . c30497_6e5i 1 . 8 . 3227 . 1 1 8 LYS CB C 3.063 3.397 -2.784 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CB . . . . . . . . . c30497_6e5i 1 . 8 . 3228 . 1 1 8 LYS CD C 3.524 3.430 -5.243 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CD . . . . . . . . . c30497_6e5i 1 . 8 . 3229 . 1 1 8 LYS CE C 4.592 3.478 -6.320 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CE . . . . . . . . . c30497_6e5i 1 . 8 . 3230 . 1 1 8 LYS CG C 4.132 3.309 -3.856 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CG . . . . . . . . . c30497_6e5i 1 . 8 . 3231 . 1 1 8 LYS H H 1.619 3.774 -0.771 . . . 1.0 . . . . . . . . . . . . A . 8 LYS H . . . . . . . . . c30497_6e5i 1 . 8 . 3232 . 1 1 8 LYS HA H 3.970 2.312 -1.176 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HA . . . . . . . . . c30497_6e5i 1 . 8 . 3233 . 1 1 8 LYS HB2 H 2.364 2.591 -2.943 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HB2 . . . . . . . . . c30497_6e5i 1 . 8 . 3234 . 1 1 8 LYS HB3 H 2.545 4.337 -2.901 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HB3 . . . . . . . . . c30497_6e5i 1 . 8 . 3235 . 1 1 8 LYS HD2 H 2.888 2.576 -5.422 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HD2 . . . . . . . . . c30497_6e5i 1 . 8 . 3236 . 1 1 8 LYS HD3 H 2.936 4.334 -5.290 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HD3 . . . . . . . . . c30497_6e5i 1 . 8 . 3237 . 1 1 8 LYS HE2 H 5.204 2.591 -6.244 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HE2 . . . . . . . . . c30497_6e5i 1 . 8 . 3238 . 1 1 8 LYS HE3 H 4.110 3.500 -7.286 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HE3 . . . . . . . . . c30497_6e5i 1 . 8 . 3239 . 1 1 8 LYS HG2 H 4.841 4.110 -3.712 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HG2 . . . . . . . . . c30497_6e5i 1 . 8 . 3240 . 1 1 8 LYS HG3 H 4.634 2.358 -3.773 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HG3 . . . . . . . . . c30497_6e5i 1 . 8 . 3241 . 1 1 8 LYS HZ1 H 4.900 5.542 -6.311 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ1 . . . . . . . . . c30497_6e5i 1 . 8 . 3242 . 1 1 8 LYS HZ2 H 6.213 4.658 -6.902 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ2 . . . . . . . . . c30497_6e5i 1 . 8 . 3243 . 1 1 8 LYS HZ3 H 5.903 4.697 -5.243 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ3 . . . . . . . . . c30497_6e5i 1 . 8 . 3244 . 1 1 8 LYS N N 2.509 3.552 -0.416 . . . 1.0 . . . . . . . . . . . . A . 8 LYS N . . . . . . . . . c30497_6e5i 1 . 8 . 3245 . 1 1 8 LYS NZ N 5.461 4.676 -6.185 . . . 1.0 . . . . . . . . . . . . A . 8 LYS NZ . . . . . . . . . c30497_6e5i 1 . 8 . 3246 . 1 1 8 LYS O O 5.902 3.956 -1.204 . . . 1.0 . . . . . . . . . . . . A . 8 LYS O . . . . . . . . . c30497_6e5i 1 . 8 . 3247 . 1 1 9 LYS C C 6.036 6.395 0.717 . . . 1.0 . . . . . . . . . . . . A . 9 LYS C . . . . . . . . . c30497_6e5i 1 . 8 . 3248 . 1 1 9 LYS CA C 5.331 6.603 -0.617 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CA . . . . . . . . . c30497_6e5i 1 . 8 . 3249 . 1 1 9 LYS CB C 4.642 7.965 -0.643 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CB . . . . . . . . . c30497_6e5i 1 . 8 . 3250 . 1 1 9 LYS CD C 3.143 9.504 -1.953 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CD . . . . . . . . . c30497_6e5i 1 . 8 . 3251 . 1 1 9 LYS CE C 3.732 10.738 -1.292 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CE . . . . . . . . . c30497_6e5i 1 . 8 . 3252 . 1 1 9 LYS CG C 4.143 8.364 -2.023 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CG . . . . . . . . . c30497_6e5i 1 . 8 . 3253 . 1 1 9 LYS H H 3.400 5.769 -0.848 . . . 1.0 . . . . . . . . . . . . A . 9 LYS H . . . . . . . . . c30497_6e5i 1 . 8 . 3254 . 1 1 9 LYS HA H 6.066 6.565 -1.405 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HA . . . . . . . . . c30497_6e5i 1 . 8 . 3255 . 1 1 9 LYS HB2 H 3.798 7.941 0.031 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HB2 . . . . . . . . . c30497_6e5i 1 . 8 . 3256 . 1 1 9 LYS HB3 H 5.341 8.716 -0.303 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HB3 . . . . . . . . . c30497_6e5i 1 . 8 . 3257 . 1 1 9 LYS HD2 H 2.835 9.758 -2.955 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HD2 . . . . . . . . . c30497_6e5i 1 . 8 . 3258 . 1 1 9 LYS HD3 H 2.284 9.178 -1.384 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HD3 . . . . . . . . . c30497_6e5i 1 . 8 . 3259 . 1 1 9 LYS HE2 H 4.107 10.468 -0.317 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HE2 . . . . . . . . . c30497_6e5i 1 . 8 . 3260 . 1 1 9 LYS HE3 H 4.543 11.108 -1.902 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HE3 . . . . . . . . . c30497_6e5i 1 . 8 . 3261 . 1 1 9 LYS HG2 H 4.983 8.676 -2.624 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HG2 . . . . . . . . . c30497_6e5i 1 . 8 . 3262 . 1 1 9 LYS HG3 H 3.667 7.509 -2.484 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HG3 . . . . . . . . . c30497_6e5i 1 . 8 . 3263 . 1 1 9 LYS HZ1 H 3.102 12.595 -0.583 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HZ1 . . . . . . . . . c30497_6e5i 1 . 8 . 3264 . 1 1 9 LYS HZ2 H 1.869 11.431 -0.653 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HZ2 . . . . . . . . . c30497_6e5i 1 . 8 . 3265 . 1 1 9 LYS HZ3 H 2.430 12.163 -2.075 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HZ3 . . . . . . . . . c30497_6e5i 1 . 8 . 3266 . 1 1 9 LYS N N 4.359 5.549 -0.867 . . . 1.0 . . . . . . . . . . . . A . 9 LYS N . . . . . . . . . c30497_6e5i 1 . 8 . 3267 . 1 1 9 LYS NZ N 2.714 11.806 -1.140 . . . 1.0 . . . . . . . . . . . . A . 9 LYS NZ . . . . . . . . . c30497_6e5i 1 . 8 . 3268 . 1 1 9 LYS O O 7.235 6.651 0.838 . . . 1.0 . . . . . . . . . . . . A . 9 LYS O . . . . . . . . . c30497_6e5i 1 . 8 . 3269 . 1 1 10 ARG C C 6.889 4.547 2.956 . . . 1.0 . . . . . . . . . . . . A . 10 ARG C . . . . . . . . . c30497_6e5i 1 . 8 . 3270 . 1 1 10 ARG CA C 5.851 5.660 3.029 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CA . . . . . . . . . c30497_6e5i 1 . 8 . 3271 . 1 1 10 ARG CB C 4.749 5.255 4.013 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CB . . . . . . . . . c30497_6e5i 1 . 8 . 3272 . 1 1 10 ARG CD C 4.192 4.298 6.279 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CD . . . . . . . . . c30497_6e5i 1 . 8 . 3273 . 1 1 10 ARG CG C 5.286 4.845 5.377 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CG . . . . . . . . . c30497_6e5i 1 . 8 . 3274 . 1 1 10 ARG CZ C 4.023 2.945 8.343 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CZ . . . . . . . . . c30497_6e5i 1 . 8 . 3275 . 1 1 10 ARG H H 4.331 5.777 1.559 . . . 1.0 . . . . . . . . . . . . A . 10 ARG H . . . . . . . . . c30497_6e5i 1 . 8 . 3276 . 1 1 10 ARG HA H 6.326 6.560 3.382 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HA . . . . . . . . . c30497_6e5i 1 . 8 . 3277 . 1 1 10 ARG HB2 H 4.074 6.086 4.143 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HB2 . . . . . . . . . c30497_6e5i 1 . 8 . 3278 . 1 1 10 ARG HB3 H 4.202 4.420 3.601 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HB3 . . . . . . . . . c30497_6e5i 1 . 8 . 3279 . 1 1 10 ARG HD2 H 3.539 5.108 6.565 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HD2 . . . . . . . . . c30497_6e5i 1 . 8 . 3280 . 1 1 10 ARG HD3 H 3.626 3.559 5.731 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HD3 . . . . . . . . . c30497_6e5i 1 . 8 . 3281 . 1 1 10 ARG HE H 5.698 3.806 7.668 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HE . . . . . . . . . c30497_6e5i 1 . 8 . 3282 . 1 1 10 ARG HG2 H 6.038 4.081 5.240 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HG2 . . . . . . . . . c30497_6e5i 1 . 8 . 3283 . 1 1 10 ARG HG3 H 5.729 5.711 5.848 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HG3 . . . . . . . . . c30497_6e5i 1 . 8 . 3284 . 1 1 10 ARG HH11 H 2.190 2.206 8.795 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HH11 . . . . . . . . . c30497_6e5i 1 . 8 . 3285 . 1 1 10 ARG HH12 H 2.264 3.176 7.357 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HH12 . . . . . . . . . c30497_6e5i 1 . 8 . 3286 . 1 1 10 ARG HH21 H 5.590 2.533 9.563 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HH21 . . . . . . . . . c30497_6e5i 1 . 8 . 3287 . 1 1 10 ARG HH22 H 4.071 1.842 10.040 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HH22 . . . . . . . . . c30497_6e5i 1 . 8 . 3288 . 1 1 10 ARG N N 5.289 5.932 1.712 . . . 1.0 . . . . . . . . . . . . A . 10 ARG N . . . . . . . . . c30497_6e5i 1 . 8 . 3289 . 1 1 10 ARG NE N 4.737 3.677 7.489 . . . 1.0 . . . . . . . . . . . . A . 10 ARG NE . . . . . . . . . c30497_6e5i 1 . 8 . 3290 . 1 1 10 ARG NH1 N 2.722 2.761 8.147 . . . 1.0 . . . . . . . . . . . . A . 10 ARG NH1 . . . . . . . . . c30497_6e5i 1 . 8 . 3291 . 1 1 10 ARG NH2 N 4.608 2.398 9.401 . . . 1.0 . . . . . . . . . . . . A . 10 ARG NH2 . . . . . . . . . c30497_6e5i 1 . 8 . 3292 . 1 1 10 ARG O O 8.020 4.695 3.427 . . . 1.0 . . . . . . . . . . . . A . 10 ARG O . . . . . . . . . c30497_6e5i 1 . 8 . 3293 . 1 1 11 TYR C C 8.403 2.366 1.215 . . . 1.0 . . . . . . . . . . . . A . 11 TYR C . . . . . . . . . c30497_6e5i 1 . 8 . 3294 . 1 1 11 TYR CA C 7.352 2.262 2.309 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CA . . . . . . . . . c30497_6e5i 1 . 8 . 3295 . 1 1 11 TYR CB C 6.504 1.005 2.136 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CB . . . . . . . . . c30497_6e5i 1 . 8 . 3296 . 1 1 11 TYR CD1 C 6.218 -0.132 4.361 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CD1 . . . . . . . . . c30497_6e5i 1 . 8 . 3297 . 1 1 11 TYR CD2 C 4.404 1.173 3.537 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CD2 . . . . . . . . . c30497_6e5i 1 . 8 . 3298 . 1 1 11 TYR CE1 C 5.494 -0.431 5.495 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CE1 . . . . . . . . . c30497_6e5i 1 . 8 . 3299 . 1 1 11 TYR CE2 C 3.671 0.876 4.668 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CE2 . . . . . . . . . c30497_6e5i 1 . 8 . 3300 . 1 1 11 TYR CG C 5.688 0.673 3.364 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CG . . . . . . . . . c30497_6e5i 1 . 8 . 3301 . 1 1 11 TYR CZ C 4.221 0.076 5.644 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CZ . . . . . . . . . c30497_6e5i 1 . 8 . 3302 . 1 1 11 TYR H H 5.622 3.411 1.909 . . . 1.0 . . . . . . . . . . . . A . 11 TYR H . . . . . . . . . c30497_6e5i 1 . 8 . 3303 . 1 1 11 TYR HA H 7.860 2.203 3.260 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HA . . . . . . . . . c30497_6e5i 1 . 8 . 3304 . 1 1 11 TYR HB2 H 5.826 1.142 1.310 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HB2 . . . . . . . . . c30497_6e5i 1 . 8 . 3305 . 1 1 11 TYR HB3 H 7.152 0.170 1.934 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HB3 . . . . . . . . . c30497_6e5i 1 . 8 . 3306 . 1 1 11 TYR HD1 H 7.216 -0.526 4.240 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HD1 . . . . . . . . . c30497_6e5i 1 . 8 . 3307 . 1 1 11 TYR HD2 H 3.974 1.800 2.767 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HD2 . . . . . . . . . c30497_6e5i 1 . 8 . 3308 . 1 1 11 TYR HE1 H 5.925 -1.059 6.259 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HE1 . . . . . . . . . c30497_6e5i 1 . 8 . 3309 . 1 1 11 TYR HE2 H 2.676 1.275 4.786 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HE2 . . . . . . . . . c30497_6e5i 1 . 8 . 3310 . 1 1 11 TYR HH H 2.568 -0.327 6.551 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HH . . . . . . . . . c30497_6e5i 1 . 8 . 3311 . 1 1 11 TYR N N 6.504 3.438 2.348 . . . 1.0 . . . . . . . . . . . . A . 11 TYR N . . . . . . . . . c30497_6e5i 1 . 8 . 3312 . 1 1 11 TYR O O 9.260 1.491 1.078 . . . 1.0 . . . . . . . . . . . . A . 11 TYR O . . . . . . . . . c30497_6e5i 1 . 8 . 3313 . 1 1 11 TYR OH O 3.500 -0.213 6.781 . . . 1.0 . . . . . . . . . . . . A . 11 TYR OH . . . . . . . . . c30497_6e5i 1 . 8 . 3314 . 1 1 12 ORN C C 9.964 0.409 -2.501 . . . 1.0 . . . . . . . . . . . . A . 12 ORN C . . . . . . . . . c30497_6e5i 1 . 8 . 3315 . 1 1 12 ORN CA C 10.807 1.674 -2.425 . . . 1.0 . . . . . . . . . . . . A . 12 ORN CA . . . . . . . . . c30497_6e5i 1 . 8 . 3316 . 1 1 12 ORN CB C 9.970 2.867 -2.889 . . . 1.0 . . . . . . . . . . . . A . 12 ORN CB . . . . . . . . . c30497_6e5i 1 . 8 . 3317 . 1 1 12 ORN CD C 9.286 3.699 -0.635 . . . 1.0 . . . . . . . . . . . . A . 12 ORN CD . . . . . . . . . c30497_6e5i 1 . 8 . 3318 . 1 1 12 ORN CG C 8.803 3.169 -1.970 . . . 1.0 . . . . . . . . . . . . A . 12 ORN CG . . . . . . . . . c30497_6e5i 1 . 8 . 3319 . 1 1 12 ORN H H 11.738 1.370 -4.258 . . . 1.0 . . . . . . . . . . . . A . 12 ORN H . . . . . . . . . c30497_6e5i 1 . 8 . 3320 . 1 1 12 ORN HA H 11.119 1.831 -1.404 . . . 1.0 . . . . . . . . . . . . A . 12 ORN HA . . . . . . . . . c30497_6e5i 1 . 8 . 3321 . 1 1 12 ORN HB2 H 9.581 2.660 -3.875 . . . 1.0 . . . . . . . . . . . . A . 12 ORN HB2 . . . . . . . . . c30497_6e5i 1 . 8 . 3322 . 1 1 12 ORN HB3 H 10.600 3.741 -2.935 . . . 1.0 . . . . . . . . . . . . A . 12 ORN HB3 . . . . . . . . . c30497_6e5i 1 . 8 . 3323 . 1 1 12 ORN HD2 H 9.429 4.763 -0.720 . . . 1.0 . . . . . . . . . . . . A . 12 ORN HD2 . . . . . . . . . c30497_6e5i 1 . 8 . 3324 . 1 1 12 ORN HD3 H 10.227 3.231 -0.392 . . . 1.0 . . . . . . . . . . . . A . 12 ORN HD3 . . . . . . . . . c30497_6e5i 1 . 8 . 3325 . 1 1 12 ORN HE1 H 7.629 4.089 0.590 . . . 1.0 . . . . . . . . . . . . A . 12 ORN HE1 . . . . . . . . . c30497_6e5i 1 . 8 . 3326 . 1 1 12 ORN HG2 H 8.240 2.262 -1.805 . . . 1.0 . . . . . . . . . . . . A . 12 ORN HG2 . . . . . . . . . c30497_6e5i 1 . 8 . 3327 . 1 1 12 ORN HG3 H 8.168 3.909 -2.434 . . . 1.0 . . . . . . . . . . . . A . 12 ORN HG3 . . . . . . . . . c30497_6e5i 1 . 8 . 3328 . 1 1 12 ORN N N 12.012 1.530 -3.269 . . . 1.0 . . . . . . . . . . . . A . 12 ORN N . . . . . . . . . c30497_6e5i 1 . 8 . 3329 . 1 1 12 ORN NE N 8.344 3.437 0.442 . . . 1.0 . . . . . . . . . . . . A . 12 ORN NE . . . . . . . . . c30497_6e5i 1 . 8 . 3330 . 1 1 12 ORN O O 9.831 -0.187 -3.568 . . . 1.0 . . . . . . . . . . . . A . 12 ORN O . . . . . . . . . c30497_6e5i 1 . 8 . 3331 . 1 1 13 CYS C C 7.192 -0.836 -1.938 . . . 1.0 . . . . . . . . . . . . A . 13 CYS C . . . . . . . . . c30497_6e5i 1 . 8 . 3332 . 1 1 13 CYS CA C 8.548 -1.172 -1.331 . . . 1.0 . . . . . . . . . . . . A . 13 CYS CA . . . . . . . . . c30497_6e5i 1 . 8 . 3333 . 1 1 13 CYS CB C 8.374 -1.655 0.107 . . . 1.0 . . . . . . . . . . . . A . 13 CYS CB . . . . . . . . . c30497_6e5i 1 . 8 . 3334 . 1 1 13 CYS H H 9.549 0.511 -0.542 . . . 1.0 . . . . . . . . . . . . A . 13 CYS H . . . . . . . . . c30497_6e5i 1 . 8 . 3335 . 1 1 13 CYS HA H 9.014 -1.948 -1.918 . . . 1.0 . . . . . . . . . . . . A . 13 CYS HA . . . . . . . . . c30497_6e5i 1 . 8 . 3336 . 1 1 13 CYS HB2 H 7.688 -0.999 0.613 . . . 1.0 . . . . . . . . . . . . A . 13 CYS HB2 . . . . . . . . . c30497_6e5i 1 . 8 . 3337 . 1 1 13 CYS HB3 H 7.960 -2.653 0.095 . . . 1.0 . . . . . . . . . . . . A . 13 CYS HB3 . . . . . . . . . c30497_6e5i 1 . 8 . 3338 . 1 1 13 CYS N N 9.399 0.002 -1.371 . . . 1.0 . . . . . . . . . . . . A . 13 CYS N . . . . . . . . . c30497_6e5i 1 . 8 . 3339 . 1 1 13 CYS O O 6.741 0.311 -1.874 . . . 1.0 . . . . . . . . . . . . A . 13 CYS O . . . . . . . . . c30497_6e5i 1 . 8 . 3340 . 1 1 13 CYS SG S 9.924 -1.700 1.077 . . . 1.0 . . . . . . . . . . . . A . 13 CYS SG . . . . . . . . . c30497_6e5i 1 . 8 . 3341 . 1 1 14 GLU C C 4.154 -2.275 -2.445 . . . 1.0 . . . . . . . . . . . . A . 14 GLU C . . . . . . . . . c30497_6e5i 1 . 8 . 3342 . 1 1 14 GLU CA C 5.284 -1.606 -3.205 . . . 1.0 . . . . . . . . . . . . A . 14 GLU CA . . . . . . . . . c30497_6e5i 1 . 8 . 3343 . 1 1 14 GLU CB C 5.364 -2.157 -4.627 . . . 1.0 . . . . . . . . . . . . A . 14 GLU CB . . . . . . . . . c30497_6e5i 1 . 8 . 3344 . 1 1 14 GLU CD C 4.278 -2.378 -6.884 . . . 1.0 . . . . . . . . . . . . A . 14 GLU CD . . . . . . . . . c30497_6e5i 1 . 8 . 3345 . 1 1 14 GLU CG C 4.098 -1.962 -5.442 . . . 1.0 . . . . . . . . . . . . A . 14 GLU CG . . . . . . . . . c30497_6e5i 1 . 8 . 3346 . 1 1 14 GLU H H 6.921 -2.732 -2.496 . . . 1.0 . . . . . . . . . . . . A . 14 GLU H . . . . . . . . . c30497_6e5i 1 . 8 . 3347 . 1 1 14 GLU HA H 5.102 -0.543 -3.243 . . . 1.0 . . . . . . . . . . . . A . 14 GLU HA . . . . . . . . . c30497_6e5i 1 . 8 . 3348 . 1 1 14 GLU HB2 H 6.176 -1.669 -5.141 . . . 1.0 . . . . . . . . . . . . A . 14 GLU HB2 . . . . . . . . . c30497_6e5i 1 . 8 . 3349 . 1 1 14 GLU HB3 H 5.569 -3.216 -4.573 . . . 1.0 . . . . . . . . . . . . A . 14 GLU HB3 . . . . . . . . . c30497_6e5i 1 . 8 . 3350 . 1 1 14 GLU HG2 H 3.309 -2.555 -5.007 . . . 1.0 . . . . . . . . . . . . A . 14 GLU HG2 . . . . . . . . . c30497_6e5i 1 . 8 . 3351 . 1 1 14 GLU HG3 H 3.820 -0.918 -5.417 . . . 1.0 . . . . . . . . . . . . A . 14 GLU HG3 . . . . . . . . . c30497_6e5i 1 . 8 . 3352 . 1 1 14 GLU N N 6.547 -1.823 -2.526 . . . 1.0 . . . . . . . . . . . . A . 14 GLU N . . . . . . . . . c30497_6e5i 1 . 8 . 3353 . 1 1 14 GLU O O 4.195 -3.472 -2.186 . . . 1.0 . . . . . . . . . . . . A . 14 GLU O . . . . . . . . . c30497_6e5i 1 . 8 . 3354 . 1 1 14 GLU OE1 O 4.281 -3.593 -7.165 . . . 1.0 . . . . . . . . . . . . A . 14 GLU OE1 . . . . . . . . . c30497_6e5i 1 . 8 . 3355 . 1 1 14 GLU OE2 O 4.421 -1.486 -7.747 . . . 1.0 . . . . . . . . . . . . A . 14 GLU OE2 . . . . . . . . . c30497_6e5i 1 . 8 . 3356 . 1 1 15 VAL C C 0.952 -2.544 -2.320 . . . 1.0 . . . . . . . . . . . . A . 15 VAL C . . . . . . . . . c30497_6e5i 1 . 8 . 3357 . 1 1 15 VAL CA C 2.027 -2.065 -1.351 . . . 1.0 . . . . . . . . . . . . A . 15 VAL CA . . . . . . . . . c30497_6e5i 1 . 8 . 3358 . 1 1 15 VAL CB C 1.424 -1.065 -0.339 . . . 1.0 . . . . . . . . . . . . A . 15 VAL CB . . . . . . . . . c30497_6e5i 1 . 8 . 3359 . 1 1 15 VAL CG1 C 2.497 -0.538 0.602 . . . 1.0 . . . . . . . . . . . . A . 15 VAL CG1 . . . . . . . . . c30497_6e5i 1 . 8 . 3360 . 1 1 15 VAL CG2 C 0.717 0.077 -1.045 . . . 1.0 . . . . . . . . . . . . A . 15 VAL CG2 . . . . . . . . . c30497_6e5i 1 . 8 . 3361 . 1 1 15 VAL H H 3.162 -0.556 -2.298 . . . 1.0 . . . . . . . . . . . . A . 15 VAL H . . . . . . . . . c30497_6e5i 1 . 8 . 3362 . 1 1 15 VAL HA H 2.390 -2.920 -0.798 . . . 1.0 . . . . . . . . . . . . A . 15 VAL HA . . . . . . . . . c30497_6e5i 1 . 8 . 3363 . 1 1 15 VAL HB H 0.693 -1.594 0.257 . . . 1.0 . . . . . . . . . . . . A . 15 VAL HB . . . . . . . . . c30497_6e5i 1 . 8 . 3364 . 1 1 15 VAL HG11 H 2.040 0.094 1.349 . . . 1.0 . . . . . . . . . . . . A . 15 VAL HG11 . . . . . . . . . c30497_6e5i 1 . 8 . 3365 . 1 1 15 VAL HG12 H 3.221 0.037 0.040 . . . 1.0 . . . . . . . . . . . . A . 15 VAL HG12 . . . . . . . . . c30497_6e5i 1 . 8 . 3366 . 1 1 15 VAL HG13 H 2.993 -1.365 1.084 . . . 1.0 . . . . . . . . . . . . A . 15 VAL HG13 . . . . . . . . . c30497_6e5i 1 . 8 . 3367 . 1 1 15 VAL HG21 H -0.083 -0.319 -1.652 . . . 1.0 . . . . . . . . . . . . A . 15 VAL HG21 . . . . . . . . . c30497_6e5i 1 . 8 . 3368 . 1 1 15 VAL HG22 H 1.420 0.603 -1.674 . . . 1.0 . . . . . . . . . . . . A . 15 VAL HG22 . . . . . . . . . c30497_6e5i 1 . 8 . 3369 . 1 1 15 VAL HG23 H 0.312 0.756 -0.311 . . . 1.0 . . . . . . . . . . . . A . 15 VAL HG23 . . . . . . . . . c30497_6e5i 1 . 8 . 3370 . 1 1 15 VAL N N 3.151 -1.507 -2.074 . . . 1.0 . . . . . . . . . . . . A . 15 VAL N . . . . . . . . . c30497_6e5i 1 . 8 . 3371 . 1 1 15 VAL O O 0.733 -1.951 -3.380 . . . 1.0 . . . . . . . . . . . . A . 15 VAL O . . . . . . . . . c30497_6e5i 1 . 8 . 3372 . 1 1 16 ARG C C -2.070 -3.894 -2.070 . . . 1.0 . . . . . . . . . . . . A . 16 ARG C . . . . . . . . . c30497_6e5i 1 . 8 . 3373 . 1 1 16 ARG CA C -0.757 -4.197 -2.757 . . . 1.0 . . . . . . . . . . . . A . 16 ARG CA . . . . . . . . . c30497_6e5i 1 . 8 . 3374 . 1 1 16 ARG CB C -0.580 -5.705 -2.936 . . . 1.0 . . . . . . . . . . . . A . 16 ARG CB . . . . . . . . . c30497_6e5i 1 . 8 . 3375 . 1 1 16 ARG CD C 0.639 -5.654 -5.152 . . . 1.0 . . . . . . . . . . . . A . 16 ARG CD . . . . . . . . . c30497_6e5i 1 . 8 . 3376 . 1 1 16 ARG CG C 0.680 -6.098 -3.695 . . . 1.0 . . . . . . . . . . . . A . 16 ARG CG . . . . . . . . . c30497_6e5i 1 . 8 . 3377 . 1 1 16 ARG CZ C 0.615 -3.564 -6.469 . . . 1.0 . . . . . . . . . . . . A . 16 ARG CZ . . . . . . . . . c30497_6e5i 1 . 8 . 3378 . 1 1 16 ARG H H 0.594 -4.101 -1.145 . . . 1.0 . . . . . . . . . . . . A . 16 ARG H . . . . . . . . . c30497_6e5i 1 . 8 . 3379 . 1 1 16 ARG HA H -0.749 -3.719 -3.724 . . . 1.0 . . . . . . . . . . . . A . 16 ARG HA . . . . . . . . . c30497_6e5i 1 . 8 . 3380 . 1 1 16 ARG HB2 H -0.544 -6.166 -1.962 . . . 1.0 . . . . . . . . . . . . A . 16 ARG HB2 . . . . . . . . . c30497_6e5i 1 . 8 . 3381 . 1 1 16 ARG HB3 H -1.433 -6.090 -3.473 . . . 1.0 . . . . . . . . . . . . A . 16 ARG HB3 . . . . . . . . . c30497_6e5i 1 . 8 . 3382 . 1 1 16 ARG HD2 H 1.452 -6.128 -5.681 . . . 1.0 . . . . . . . . . . . . A . 16 ARG HD2 . . . . . . . . . c30497_6e5i 1 . 8 . 3383 . 1 1 16 ARG HD3 H -0.298 -5.976 -5.584 . . . 1.0 . . . . . . . . . . . . A . 16 ARG HD3 . . . . . . . . . c30497_6e5i 1 . 8 . 3384 . 1 1 16 ARG HE H 0.957 -3.676 -4.501 . . . 1.0 . . . . . . . . . . . . A . 16 ARG HE . . . . . . . . . c30497_6e5i 1 . 8 . 3385 . 1 1 16 ARG HG2 H 1.532 -5.639 -3.216 . . . 1.0 . . . . . . . . . . . . A . 16 ARG HG2 . . . . . . . . . c30497_6e5i 1 . 8 . 3386 . 1 1 16 ARG HG3 H 0.785 -7.172 -3.658 . . . 1.0 . . . . . . . . . . . . A . 16 ARG HG3 . . . . . . . . . c30497_6e5i 1 . 8 . 3387 . 1 1 16 ARG HH11 H 0.247 -5.241 -7.543 . . . 1.0 . . . . . . . . . . . . A . 16 ARG HH11 . . . . . . . . . c30497_6e5i 1 . 8 . 3388 . 1 1 16 ARG HH12 H 0.229 -3.763 -8.447 . . . 1.0 . . . . . . . . . . . . A . 16 ARG HH12 . . . . . . . . . c30497_6e5i 1 . 8 . 3389 . 1 1 16 ARG HH21 H 0.632 -1.760 -7.394 . . . 1.0 . . . . . . . . . . . . A . 16 ARG HH21 . . . . . . . . . c30497_6e5i 1 . 8 . 3390 . 1 1 16 ARG HH22 H 0.930 -1.722 -5.685 . . . 1.0 . . . . . . . . . . . . A . 16 ARG HH22 . . . . . . . . . c30497_6e5i 1 . 8 . 3391 . 1 1 16 ARG N N 0.325 -3.645 -1.971 . . . 1.0 . . . . . . . . . . . . A . 16 ARG N . . . . . . . . . c30497_6e5i 1 . 8 . 3392 . 1 1 16 ARG NE N 0.757 -4.202 -5.309 . . . 1.0 . . . . . . . . . . . . A . 16 ARG NE . . . . . . . . . c30497_6e5i 1 . 8 . 3393 . 1 1 16 ARG NH1 N 0.344 -4.244 -7.575 . . . 1.0 . . . . . . . . . . . . A . 16 ARG NH1 . . . . . . . . . c30497_6e5i 1 . 8 . 3394 . 1 1 16 ARG NH2 N 0.737 -2.244 -6.520 . . . 1.0 . . . . . . . . . . . . A . 16 ARG NH2 . . . . . . . . . c30497_6e5i 1 . 8 . 3395 . 1 1 16 ARG O O -2.157 -3.934 -0.843 . . . 1.0 . . . . . . . . . . . . A . 16 ARG O . . . . . . . . . c30497_6e5i 1 . 8 . 3396 . 1 1 17 CYS C C -5.435 -4.156 -2.579 . . . 1.0 . . . . . . . . . . . . A . 17 CYS C . . . . . . . . . c30497_6e5i 1 . 8 . 3397 . 1 1 17 CYS CA C -4.342 -3.143 -2.303 . . . 1.0 . . . . . . . . . . . . A . 17 CYS CA . . . . . . . . . c30497_6e5i 1 . 8 . 3398 . 1 1 17 CYS CB C -4.702 -1.790 -2.905 . . . 1.0 . . . . . . . . . . . . A . 17 CYS CB . . . . . . . . . c30497_6e5i 1 . 8 . 3399 . 1 1 17 CYS H H -2.988 -3.687 -3.824 . . . 1.0 . . . . . . . . . . . . A . 17 CYS H . . . . . . . . . c30497_6e5i 1 . 8 . 3400 . 1 1 17 CYS HA H -4.222 -3.033 -1.236 . . . 1.0 . . . . . . . . . . . . A . 17 CYS HA . . . . . . . . . c30497_6e5i 1 . 8 . 3401 . 1 1 17 CYS HB2 H -4.965 -1.926 -3.942 . . . 1.0 . . . . . . . . . . . . A . 17 CYS HB2 . . . . . . . . . c30497_6e5i 1 . 8 . 3402 . 1 1 17 CYS HB3 H -5.544 -1.374 -2.374 . . . 1.0 . . . . . . . . . . . . A . 17 CYS HB3 . . . . . . . . . c30497_6e5i 1 . 8 . 3403 . 1 1 17 CYS N N -3.082 -3.592 -2.851 . . . 1.0 . . . . . . . . . . . . A . 17 CYS N . . . . . . . . . c30497_6e5i 1 . 8 . 3404 . 1 1 17 CYS O O -5.835 -4.360 -3.725 . . . 1.0 . . . . . . . . . . . . A . 17 CYS O . . . . . . . . . c30497_6e5i 1 . 8 . 3405 . 1 1 17 CYS SG S -3.335 -0.589 -2.827 . . . 1.0 . . . . . . . . . . . . A . 17 CYS SG . . . . . . . . . c30497_6e5i 1 . 8 . 3406 . 1 1 18 ASP C C -8.155 -5.304 -0.810 . . . 1.0 . . . . . . . . . . . . A . 18 ASP C . . . . . . . . . c30497_6e5i 1 . 8 . 3407 . 1 1 18 ASP CA C -6.971 -5.768 -1.643 . . . 1.0 . . . . . . . . . . . . A . 18 ASP CA . . . . . . . . . c30497_6e5i 1 . 8 . 3408 . 1 1 18 ASP CB C -6.496 -7.146 -1.179 . . . 1.0 . . . . . . . . . . . . A . 18 ASP CB . . . . . . . . . c30497_6e5i 1 . 8 . 3409 . 1 1 18 ASP CG C -7.414 -8.253 -1.646 . . . 1.0 . . . . . . . . . . . . A . 18 ASP CG . . . . . . . . . c30497_6e5i 1 . 8 . 3410 . 1 1 18 ASP H H -5.537 -4.590 -0.637 . . . 1.0 . . . . . . . . . . . . A . 18 ASP H . . . . . . . . . c30497_6e5i 1 . 8 . 3411 . 1 1 18 ASP HA H -7.266 -5.821 -2.679 . . . 1.0 . . . . . . . . . . . . A . 18 ASP HA . . . . . . . . . c30497_6e5i 1 . 8 . 3412 . 1 1 18 ASP HB2 H -5.506 -7.331 -1.567 . . . 1.0 . . . . . . . . . . . . A . 18 ASP HB2 . . . . . . . . . c30497_6e5i 1 . 8 . 3413 . 1 1 18 ASP HB3 H -6.463 -7.162 -0.100 . . . 1.0 . . . . . . . . . . . . A . 18 ASP HB3 . . . . . . . . . c30497_6e5i 1 . 8 . 3414 . 1 1 18 ASP N N -5.905 -4.795 -1.527 . . . 1.0 . . . . . . . . . . . . A . 18 ASP N . . . . . . . . . c30497_6e5i 1 . 8 . 3415 . 1 1 18 ASP O O -8.304 -5.693 0.353 . . . 1.0 . . . . . . . . . . . . A . 18 ASP O . . . . . . . . . c30497_6e5i 1 . 8 . 3416 . 1 1 18 ASP OD1 O -8.133 -8.836 -0.810 . . . 1.0 . . . . . . . . . . . . A . 18 ASP OD1 . . . . . . . . . c30497_6e5i 1 . 8 . 3417 . 1 1 18 ASP OD2 O -7.421 -8.546 -2.860 . . . 1.0 . . . . . . . . . . . . A . 18 ASP OD2 . . . . . . . . . c30497_6e5i 1 . 8 . 3418 . 1 1 19 DPR C C -9.583 -3.005 0.530 . . . 1.0 . . . . . . . . . . . . A . 19 DPR C . . . . . . . . . c30497_6e5i 1 . 8 . 3419 . 1 1 19 DPR CA C -10.102 -3.810 -0.660 . . . 1.0 . . . . . . . . . . . . A . 19 DPR CA . . . . . . . . . c30497_6e5i 1 . 8 . 3420 . 1 1 19 DPR CB C -10.754 -2.887 -1.690 . . . 1.0 . . . . . . . . . . . . A . 19 DPR CB . . . . . . . . . c30497_6e5i 1 . 8 . 3421 . 1 1 19 DPR CD C -8.966 -4.018 -2.798 . . . 1.0 . . . . . . . . . . . . A . 19 DPR CD . . . . . . . . . c30497_6e5i 1 . 8 . 3422 . 1 1 19 DPR CG C -10.322 -3.412 -3.013 . . . 1.0 . . . . . . . . . . . . A . 19 DPR CG . . . . . . . . . c30497_6e5i 1 . 8 . 3423 . 1 1 19 DPR HA H -10.824 -4.533 -0.321 . . . 1.0 . . . . . . . . . . . . A . 19 DPR HA . . . . . . . . . c30497_6e5i 1 . 8 . 3424 . 1 1 19 DPR HB2 H -10.409 -1.875 -1.538 . . . 1.0 . . . . . . . . . . . . A . 19 DPR HB2 . . . . . . . . . c30497_6e5i 1 . 8 . 3425 . 1 1 19 DPR HB3 H -11.827 -2.926 -1.580 . . . 1.0 . . . . . . . . . . . . A . 19 DPR HB3 . . . . . . . . . c30497_6e5i 1 . 8 . 3426 . 1 1 19 DPR HD2 H -8.192 -3.282 -2.958 . . . 1.0 . . . . . . . . . . . . A . 19 DPR HD2 . . . . . . . . . c30497_6e5i 1 . 8 . 3427 . 1 1 19 DPR HD3 H -8.827 -4.865 -3.452 . . . 1.0 . . . . . . . . . . . . A . 19 DPR HD3 . . . . . . . . . c30497_6e5i 1 . 8 . 3428 . 1 1 19 DPR HG2 H -10.263 -2.606 -3.728 . . . 1.0 . . . . . . . . . . . . A . 19 DPR HG2 . . . . . . . . . c30497_6e5i 1 . 8 . 3429 . 1 1 19 DPR HG3 H -11.018 -4.165 -3.352 . . . 1.0 . . . . . . . . . . . . A . 19 DPR HG3 . . . . . . . . . c30497_6e5i 1 . 8 . 3430 . 1 1 19 DPR N N -9.005 -4.442 -1.388 . . . 1.0 . . . . . . . . . . . . A . 19 DPR N . . . . . . . . . c30497_6e5i 1 . 8 . 3431 . 1 1 19 DPR O O -8.797 -2.072 0.365 . . . 1.0 . . . . . . . . . . . . A . 19 DPR O . . . . . . . . . c30497_6e5i 1 . 8 . 3432 . 1 1 20 PRO C C -8.199 -3.181 3.445 . . . 1.0 . . . . . . . . . . . . A . 20 PRO C . . . . . . . . . c30497_6e5i 1 . 8 . 3433 . 1 1 20 PRO CA C -9.566 -2.698 2.965 . . . 1.0 . . . . . . . . . . . . A . 20 PRO CA . . . . . . . . . c30497_6e5i 1 . 8 . 3434 . 1 1 20 PRO CB C -10.643 -3.087 3.971 . . . 1.0 . . . . . . . . . . . . A . 20 PRO CB . . . . . . . . . c30497_6e5i 1 . 8 . 3435 . 1 1 20 PRO CD C -10.991 -4.431 2.021 . . . 1.0 . . . . . . . . . . . . A . 20 PRO CD . . . . . . . . . c30497_6e5i 1 . 8 . 3436 . 1 1 20 PRO CG C -11.110 -4.426 3.521 . . . 1.0 . . . . . . . . . . . . A . 20 PRO CG . . . . . . . . . c30497_6e5i 1 . 8 . 3437 . 1 1 20 PRO HA H -9.549 -1.627 2.850 . . . 1.0 . . . . . . . . . . . . A . 20 PRO HA . . . . . . . . . c30497_6e5i 1 . 8 . 3438 . 1 1 20 PRO HB2 H -10.214 -3.128 4.961 . . . 1.0 . . . . . . . . . . . . A . 20 PRO HB2 . . . . . . . . . c30497_6e5i 1 . 8 . 3439 . 1 1 20 PRO HB3 H -11.441 -2.361 3.948 . . . 1.0 . . . . . . . . . . . . A . 20 PRO HB3 . . . . . . . . . c30497_6e5i 1 . 8 . 3440 . 1 1 20 PRO HD2 H -10.629 -5.386 1.673 . . . 1.0 . . . . . . . . . . . . A . 20 PRO HD2 . . . . . . . . . c30497_6e5i 1 . 8 . 3441 . 1 1 20 PRO HD3 H -11.943 -4.200 1.569 . . . 1.0 . . . . . . . . . . . . A . 20 PRO HD3 . . . . . . . . . c30497_6e5i 1 . 8 . 3442 . 1 1 20 PRO HG2 H -10.485 -5.195 3.949 . . . 1.0 . . . . . . . . . . . . A . 20 PRO HG2 . . . . . . . . . c30497_6e5i 1 . 8 . 3443 . 1 1 20 PRO HG3 H -12.139 -4.573 3.814 . . . 1.0 . . . . . . . . . . . . A . 20 PRO HG3 . . . . . . . . . c30497_6e5i 1 . 8 . 3444 . 1 1 20 PRO N N -10.010 -3.365 1.744 . . . 1.0 . . . . . . . . . . . . A . 20 PRO N . . . . . . . . . c30497_6e5i 1 . 8 . 3445 . 1 1 20 PRO O O -7.668 -2.674 4.432 . . . 1.0 . . . . . . . . . . . . A . 20 PRO O . . . . . . . . . c30497_6e5i 1 . 8 . 3446 . 1 1 21 ARG C C -5.227 -4.233 2.287 . . . 1.0 . . . . . . . . . . . . A . 21 ARG C . . . . . . . . . c30497_6e5i 1 . 8 . 3447 . 1 1 21 ARG CA C -6.361 -4.734 3.166 . . . 1.0 . . . . . . . . . . . . A . 21 ARG CA . . . . . . . . . c30497_6e5i 1 . 8 . 3448 . 1 1 21 ARG CB C -6.413 -6.260 3.114 . . . 1.0 . . . . . . . . . . . . A . 21 ARG CB . . . . . . . . . c30497_6e5i 1 . 8 . 3449 . 1 1 21 ARG CD C -7.479 -8.385 3.912 . . . 1.0 . . . . . . . . . . . . A . 21 ARG CD . . . . . . . . . c30497_6e5i 1 . 8 . 3450 . 1 1 21 ARG CG C -7.489 -6.867 3.994 . . . 1.0 . . . . . . . . . . . . A . 21 ARG CG . . . . . . . . . c30497_6e5i 1 . 8 . 3451 . 1 1 21 ARG CZ C -8.693 -10.279 4.924 . . . 1.0 . . . . . . . . . . . . A . 21 ARG CZ . . . . . . . . . c30497_6e5i 1 . 8 . 3452 . 1 1 21 ARG H H -8.068 -4.492 1.935 . . . 1.0 . . . . . . . . . . . . A . 21 ARG H . . . . . . . . . c30497_6e5i 1 . 8 . 3453 . 1 1 21 ARG HA H -6.175 -4.422 4.181 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HA . . . . . . . . . c30497_6e5i 1 . 8 . 3454 . 1 1 21 ARG HB2 H -6.596 -6.566 2.096 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HB2 . . . . . . . . . c30497_6e5i 1 . 8 . 3455 . 1 1 21 ARG HB3 H -5.458 -6.650 3.431 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HB3 . . . . . . . . . c30497_6e5i 1 . 8 . 3456 . 1 1 21 ARG HD2 H -7.554 -8.677 2.874 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HD2 . . . . . . . . . c30497_6e5i 1 . 8 . 3457 . 1 1 21 ARG HD3 H -6.549 -8.748 4.322 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HD3 . . . . . . . . . c30497_6e5i 1 . 8 . 3458 . 1 1 21 ARG HE H -9.301 -8.373 4.962 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HE . . . . . . . . . c30497_6e5i 1 . 8 . 3459 . 1 1 21 ARG HG2 H -7.313 -6.571 5.018 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HG2 . . . . . . . . . c30497_6e5i 1 . 8 . 3460 . 1 1 21 ARG HG3 H -8.453 -6.504 3.672 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HG3 . . . . . . . . . c30497_6e5i 1 . 8 . 3461 . 1 1 21 ARG HH11 H -6.945 -10.790 4.034 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HH11 . . . . . . . . . c30497_6e5i 1 . 8 . 3462 . 1 1 21 ARG HH12 H -7.830 -12.103 4.736 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HH12 . . . . . . . . . c30497_6e5i 1 . 8 . 3463 . 1 1 21 ARG HH21 H -10.470 -10.108 5.884 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HH21 . . . . . . . . . c30497_6e5i 1 . 8 . 3464 . 1 1 21 ARG HH22 H -9.829 -11.718 5.787 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HH22 . . . . . . . . . c30497_6e5i 1 . 8 . 3465 . 1 1 21 ARG N N -7.631 -4.160 2.752 . . . 1.0 . . . . . . . . . . . . A . 21 ARG N . . . . . . . . . c30497_6e5i 1 . 8 . 3466 . 1 1 21 ARG NE N -8.588 -8.980 4.654 . . . 1.0 . . . . . . . . . . . . A . 21 ARG NE . . . . . . . . . c30497_6e5i 1 . 8 . 3467 . 1 1 21 ARG NH1 N -7.747 -11.124 4.534 . . . 1.0 . . . . . . . . . . . . A . 21 ARG NH1 . . . . . . . . . c30497_6e5i 1 . 8 . 3468 . 1 1 21 ARG NH2 N -9.749 -10.737 5.585 . . . 1.0 . . . . . . . . . . . . A . 21 ARG NH2 . . . . . . . . . c30497_6e5i 1 . 8 . 3469 . 1 1 21 ARG O O -5.411 -3.995 1.094 . . . 1.0 . . . . . . . . . . . . A . 21 ARG O . . . . . . . . . c30497_6e5i 1 . 8 . 3470 . 1 1 22 TYR C C -1.694 -4.523 2.517 . . . 1.0 . . . . . . . . . . . . A . 22 TYR C . . . . . . . . . c30497_6e5i 1 . 8 . 3471 . 1 1 22 TYR CA C -2.877 -3.638 2.155 . . . 1.0 . . . . . . . . . . . . A . 22 TYR CA . . . . . . . . . c30497_6e5i 1 . 8 . 3472 . 1 1 22 TYR CB C -2.550 -2.173 2.449 . . . 1.0 . . . . . . . . . . . . A . 22 TYR CB . . . . . . . . . c30497_6e5i 1 . 8 . 3473 . 1 1 22 TYR CD1 C -3.778 -0.668 0.840 . . . 1.0 . . . . . . . . . . . . A . 22 TYR CD1 . . . . . . . . . c30497_6e5i 1 . 8 . 3474 . 1 1 22 TYR CD2 C -4.645 -0.902 3.046 . . . 1.0 . . . . . . . . . . . . A . 22 TYR CD2 . . . . . . . . . c30497_6e5i 1 . 8 . 3475 . 1 1 22 TYR CE1 C -4.810 0.191 0.522 . . . 1.0 . . . . . . . . . . . . A . 22 TYR CE1 . . . . . . . . . c30497_6e5i 1 . 8 . 3476 . 1 1 22 TYR CE2 C -5.680 -0.044 2.735 . . . 1.0 . . . . . . . . . . . . A . 22 TYR CE2 . . . . . . . . . c30497_6e5i 1 . 8 . 3477 . 1 1 22 TYR CG C -3.678 -1.227 2.106 . . . 1.0 . . . . . . . . . . . . A . 22 TYR CG . . . . . . . . . c30497_6e5i 1 . 8 . 3478 . 1 1 22 TYR CZ C -5.760 0.500 1.473 . . . 1.0 . . . . . . . . . . . . A . 22 TYR CZ . . . . . . . . . c30497_6e5i 1 . 8 . 3479 . 1 1 22 TYR H H -3.989 -4.236 3.847 . . . 1.0 . . . . . . . . . . . . A . 22 TYR H . . . . . . . . . c30497_6e5i 1 . 8 . 3480 . 1 1 22 TYR HA H -3.083 -3.748 1.100 . . . 1.0 . . . . . . . . . . . . A . 22 TYR HA . . . . . . . . . c30497_6e5i 1 . 8 . 3481 . 1 1 22 TYR HB2 H -2.327 -2.060 3.498 . . . 1.0 . . . . . . . . . . . . A . 22 TYR HB2 . . . . . . . . . c30497_6e5i 1 . 8 . 3482 . 1 1 22 TYR HB3 H -1.687 -1.885 1.868 . . . 1.0 . . . . . . . . . . . . A . 22 TYR HB3 . . . . . . . . . c30497_6e5i 1 . 8 . 3483 . 1 1 22 TYR HD1 H -3.032 -0.911 0.097 . . . 1.0 . . . . . . . . . . . . A . 22 TYR HD1 . . . . . . . . . c30497_6e5i 1 . 8 . 3484 . 1 1 22 TYR HD2 H -4.581 -1.330 4.035 . . . 1.0 . . . . . . . . . . . . A . 22 TYR HD2 . . . . . . . . . c30497_6e5i 1 . 8 . 3485 . 1 1 22 TYR HE1 H -4.868 0.617 -0.469 . . . 1.0 . . . . . . . . . . . . A . 22 TYR HE1 . . . . . . . . . c30497_6e5i 1 . 8 . 3486 . 1 1 22 TYR HE2 H -6.420 0.197 3.480 . . . 1.0 . . . . . . . . . . . . A . 22 TYR HE2 . . . . . . . . . c30497_6e5i 1 . 8 . 3487 . 1 1 22 TYR HH H -7.178 1.091 0.314 . . . 1.0 . . . . . . . . . . . . A . 22 TYR HH . . . . . . . . . c30497_6e5i 1 . 8 . 3488 . 1 1 22 TYR N N -4.060 -4.066 2.886 . . . 1.0 . . . . . . . . . . . . A . 22 TYR N . . . . . . . . . c30497_6e5i 1 . 8 . 3489 . 1 1 22 TYR O O -1.384 -4.710 3.694 . . . 1.0 . . . . . . . . . . . . A . 22 TYR O . . . . . . . . . c30497_6e5i 1 . 8 . 3490 . 1 1 22 TYR OH O -6.793 1.355 1.158 . . . 1.0 . . . . . . . . . . . . A . 22 TYR OH . . . . . . . . . c30497_6e5i 1 . 8 . 3491 . 1 1 23 GLU C C 1.358 -5.378 1.242 . . . 1.0 . . . . . . . . . . . . A . 23 GLU C . . . . . . . . . c30497_6e5i 1 . 8 . 3492 . 1 1 23 GLU CA C 0.052 -6.002 1.707 . . . 1.0 . . . . . . . . . . . . A . 23 GLU CA . . . . . . . . . c30497_6e5i 1 . 8 . 3493 . 1 1 23 GLU CB C -0.206 -7.300 0.939 . . . 1.0 . . . . . . . . . . . . A . 23 GLU CB . . . . . . . . . c30497_6e5i 1 . 8 . 3494 . 1 1 23 GLU CD C -1.823 -9.172 0.430 . . . 1.0 . . . . . . . . . . . . A . 23 GLU CD . . . . . . . . . c30497_6e5i 1 . 8 . 3495 . 1 1 23 GLU CG C -1.522 -7.970 1.299 . . . 1.0 . . . . . . . . . . . . A . 23 GLU CG . . . . . . . . . c30497_6e5i 1 . 8 . 3496 . 1 1 23 GLU H H -1.317 -4.836 0.588 . . . 1.0 . . . . . . . . . . . . A . 23 GLU H . . . . . . . . . c30497_6e5i 1 . 8 . 3497 . 1 1 23 GLU HA H 0.120 -6.219 2.761 . . . 1.0 . . . . . . . . . . . . A . 23 GLU HA . . . . . . . . . c30497_6e5i 1 . 8 . 3498 . 1 1 23 GLU HB2 H -0.213 -7.086 -0.118 . . . 1.0 . . . . . . . . . . . . A . 23 GLU HB2 . . . . . . . . . c30497_6e5i 1 . 8 . 3499 . 1 1 23 GLU HB3 H 0.593 -7.994 1.151 . . . 1.0 . . . . . . . . . . . . A . 23 GLU HB3 . . . . . . . . . c30497_6e5i 1 . 8 . 3500 . 1 1 23 GLU HG2 H -1.475 -8.294 2.328 . . . 1.0 . . . . . . . . . . . . A . 23 GLU HG2 . . . . . . . . . c30497_6e5i 1 . 8 . 3501 . 1 1 23 GLU HG3 H -2.320 -7.252 1.186 . . . 1.0 . . . . . . . . . . . . A . 23 GLU HG3 . . . . . . . . . c30497_6e5i 1 . 8 . 3502 . 1 1 23 GLU N N -1.051 -5.072 1.504 . . . 1.0 . . . . . . . . . . . . A . 23 GLU N . . . . . . . . . c30497_6e5i 1 . 8 . 3503 . 1 1 23 GLU O O 1.486 -4.985 0.091 . . . 1.0 . . . . . . . . . . . . A . 23 GLU O . . . . . . . . . c30497_6e5i 1 . 8 . 3504 . 1 1 23 GLU OE1 O -2.561 -9.022 -0.564 . . . 1.0 . . . . . . . . . . . . A . 23 GLU OE1 . . . . . . . . . c30497_6e5i 1 . 8 . 3505 . 1 1 23 GLU OE2 O -1.310 -10.272 0.726 . . . 1.0 . . . . . . . . . . . . A . 23 GLU OE2 . . . . . . . . . c30497_6e5i 1 . 8 . 3506 . 1 1 24 VAL C C 4.482 -5.644 1.040 . . . 1.0 . . . . . . . . . . . . A . 24 VAL C . . . . . . . . . c30497_6e5i 1 . 8 . 3507 . 1 1 24 VAL CA C 3.595 -4.665 1.799 . . . 1.0 . . . . . . . . . . . . A . 24 VAL CA . . . . . . . . . c30497_6e5i 1 . 8 . 3508 . 1 1 24 VAL CB C 4.331 -4.155 3.054 . . . 1.0 . . . . . . . . . . . . A . 24 VAL CB . . . . . . . . . c30497_6e5i 1 . 8 . 3509 . 1 1 24 VAL CG1 C 5.660 -3.512 2.682 . . . 1.0 . . . . . . . . . . . . A . 24 VAL CG1 . . . . . . . . . c30497_6e5i 1 . 8 . 3510 . 1 1 24 VAL CG2 C 3.456 -3.169 3.813 . . . 1.0 . . . . . . . . . . . . A . 24 VAL CG2 . . . . . . . . . c30497_6e5i 1 . 8 . 3511 . 1 1 24 VAL H H 2.191 -5.652 3.033 . . . 1.0 . . . . . . . . . . . . A . 24 VAL H . . . . . . . . . c30497_6e5i 1 . 8 . 3512 . 1 1 24 VAL HA H 3.390 -3.820 1.160 . . . 1.0 . . . . . . . . . . . . A . 24 VAL HA . . . . . . . . . c30497_6e5i 1 . 8 . 3513 . 1 1 24 VAL HB H 4.530 -4.998 3.698 . . . 1.0 . . . . . . . . . . . . A . 24 VAL HB . . . . . . . . . c30497_6e5i 1 . 8 . 3514 . 1 1 24 VAL HG11 H 6.179 -3.212 3.581 . . . 1.0 . . . . . . . . . . . . A . 24 VAL HG11 . . . . . . . . . c30497_6e5i 1 . 8 . 3515 . 1 1 24 VAL HG12 H 5.478 -2.644 2.064 . . . 1.0 . . . . . . . . . . . . A . 24 VAL HG12 . . . . . . . . . c30497_6e5i 1 . 8 . 3516 . 1 1 24 VAL HG13 H 6.264 -4.223 2.136 . . . 1.0 . . . . . . . . . . . . A . 24 VAL HG13 . . . . . . . . . c30497_6e5i 1 . 8 . 3517 . 1 1 24 VAL HG21 H 2.545 -3.658 4.124 . . . 1.0 . . . . . . . . . . . . A . 24 VAL HG21 . . . . . . . . . c30497_6e5i 1 . 8 . 3518 . 1 1 24 VAL HG22 H 3.215 -2.336 3.169 . . . 1.0 . . . . . . . . . . . . A . 24 VAL HG22 . . . . . . . . . c30497_6e5i 1 . 8 . 3519 . 1 1 24 VAL HG23 H 3.989 -2.809 4.681 . . . 1.0 . . . . . . . . . . . . A . 24 VAL HG23 . . . . . . . . . c30497_6e5i 1 . 8 . 3520 . 1 1 24 VAL N N 2.326 -5.284 2.134 . . . 1.0 . . . . . . . . . . . . A . 24 VAL N . . . . . . . . . c30497_6e5i 1 . 8 . 3521 . 1 1 24 VAL O O 4.920 -6.658 1.583 . . . 1.0 . . . . . . . . . . . . A . 24 VAL O . . . . . . . . . c30497_6e5i 1 . 8 . 3522 . 1 1 25 HIS C C 6.831 -5.454 -1.415 . . . 1.0 . . . . . . . . . . . . A . 25 HIS C . . . . . . . . . c30497_6e5i 1 . 8 . 3523 . 1 1 25 HIS CA C 5.535 -6.179 -1.083 . . . 1.0 . . . . . . . . . . . . A . 25 HIS CA . . . . . . . . . c30497_6e5i 1 . 8 . 3524 . 1 1 25 HIS CB C 4.763 -6.507 -2.366 . . . 1.0 . . . . . . . . . . . . A . 25 HIS CB . . . . . . . . . c30497_6e5i 1 . 8 . 3525 . 1 1 25 HIS CD2 C 6.592 -7.614 -3.842 . . . 1.0 . . . . . . . . . . . . A . 25 HIS CD2 . . . . . . . . . c30497_6e5i 1 . 8 . 3526 . 1 1 25 HIS CE1 C 5.541 -9.476 -4.301 . . . 1.0 . . . . . . . . . . . . A . 25 HIS CE1 . . . . . . . . . c30497_6e5i 1 . 8 . 3527 . 1 1 25 HIS CG C 5.393 -7.569 -3.218 . . . 1.0 . . . . . . . . . . . . A . 25 HIS CG . . . . . . . . . c30497_6e5i 1 . 8 . 3528 . 1 1 25 HIS H H 4.339 -4.514 -0.595 . . . 1.0 . . . . . . . . . . . . A . 25 HIS H . . . . . . . . . c30497_6e5i 1 . 8 . 3529 . 1 1 25 HIS HA H 5.761 -7.091 -0.555 . . . 1.0 . . . . . . . . . . . . A . 25 HIS HA . . . . . . . . . c30497_6e5i 1 . 8 . 3530 . 1 1 25 HIS HB2 H 3.774 -6.844 -2.103 . . . 1.0 . . . . . . . . . . . . A . 25 HIS HB2 . . . . . . . . . c30497_6e5i 1 . 8 . 3531 . 1 1 25 HIS HB3 H 4.681 -5.610 -2.962 . . . 1.0 . . . . . . . . . . . . A . 25 HIS HB3 . . . . . . . . . c30497_6e5i 1 . 8 . 3532 . 1 1 25 HIS HD1 H 3.862 -9.020 -3.222 . . . 1.0 . . . . . . . . . . . . A . 25 HIS HD1 . . . . . . . . . c30497_6e5i 1 . 8 . 3533 . 1 1 25 HIS HD2 H 7.357 -6.852 -3.819 . . . 1.0 . . . . . . . . . . . . A . 25 HIS HD2 . . . . . . . . . c30497_6e5i 1 . 8 . 3534 . 1 1 25 HIS HE1 H 5.304 -10.450 -4.701 . . . 1.0 . . . . . . . . . . . . A . 25 HIS HE1 . . . . . . . . . c30497_6e5i 1 . 8 . 3535 . 1 1 25 HIS HE2 H 7.360 -9.068 -5.146 . . . 1.0 . . . . . . . . . . . . A . 25 HIS HE2 . . . . . . . . . c30497_6e5i 1 . 8 . 3536 . 1 1 25 HIS N N 4.721 -5.340 -0.223 . . . 1.0 . . . . . . . . . . . . A . 25 HIS N . . . . . . . . . c30497_6e5i 1 . 8 . 3537 . 1 1 25 HIS ND1 N 4.760 -8.751 -3.527 . . . 1.0 . . . . . . . . . . . . A . 25 HIS ND1 . . . . . . . . . c30497_6e5i 1 . 8 . 3538 . 1 1 25 HIS NE2 N 6.658 -8.810 -4.508 . . . 1.0 . . . . . . . . . . . . A . 25 HIS NE2 . . . . . . . . . c30497_6e5i 1 . 8 . 3539 . 1 1 25 HIS O O 6.883 -4.634 -2.329 . . . 1.0 . . . . . . . . . . . . A . 25 HIS O . . . . . . . . . c30497_6e5i 1 . 8 . 3540 . 1 1 26 CYS C C 10.093 -6.036 -1.599 . . . 1.0 . . . . . . . . . . . . A . 26 CYS C . . . . . . . . . c30497_6e5i 1 . 8 . 3541 . 1 1 26 CYS CA C 9.145 -5.092 -0.871 . . . 1.0 . . . . . . . . . . . . A . 26 CYS CA . . . . . . . . . c30497_6e5i 1 . 8 . 3542 . 1 1 26 CYS CB C 9.738 -4.660 0.469 . . . 1.0 . . . . . . . . . . . . A . 26 CYS CB . . . . . . . . . c30497_6e5i 1 . 8 . 3543 . 1 1 26 CYS H H 7.783 -6.412 0.050 . . . 1.0 . . . . . . . . . . . . A . 26 CYS H . . . . . . . . . c30497_6e5i 1 . 8 . 3544 . 1 1 26 CYS HA H 8.979 -4.217 -1.482 . . . 1.0 . . . . . . . . . . . . A . 26 CYS HA . . . . . . . . . c30497_6e5i 1 . 8 . 3545 . 1 1 26 CYS HB2 H 8.942 -4.336 1.121 . . . 1.0 . . . . . . . . . . . . A . 26 CYS HB2 . . . . . . . . . c30497_6e5i 1 . 8 . 3546 . 1 1 26 CYS HB3 H 10.243 -5.504 0.917 . . . 1.0 . . . . . . . . . . . . A . 26 CYS HB3 . . . . . . . . . c30497_6e5i 1 . 8 . 3547 . 1 1 26 CYS N N 7.870 -5.740 -0.662 . . . 1.0 . . . . . . . . . . . . A . 26 CYS N . . . . . . . . . c30497_6e5i 1 . 8 . 3548 . 1 1 26 CYS O O 10.969 -6.651 -0.993 . . . 1.0 . . . . . . . . . . . . A . 26 CYS O . . . . . . . . . c30497_6e5i 1 . 8 . 3549 . 1 1 26 CYS SG S 10.939 -3.298 0.343 . . . 1.0 . . . . . . . . . . . . A . 26 CYS SG . . . . . . . . . c30497_6e5i 1 . 8 . 3550 . 1 1 27 NH2 HN1 H 9.183 -5.643 -3.325 . . . 1.0 . . . . . . . . . . . . A . 27 NH2 HN1 . . . . . . . . . c30497_6e5i 1 . 8 . 3551 . 1 1 27 NH2 HN2 H 10.491 -6.771 -3.396 . . . 1.0 . . . . . . . . . . . . A . 27 NH2 HN2 . . . . . . . . . c30497_6e5i 1 . 8 . 3552 . 1 1 27 NH2 N N 9.904 -6.164 -2.902 . . . 1.0 . . . . . . . . . . . . A . 27 NH2 N . . . . . . . . . c30497_6e5i 1 . 9 . 3553 . 1 1 1 ASN C C -5.418 6.460 -4.068 . . . 1.0 . . . . . . . . . . . . A . 1 ASN C . . . . . . . . . c30497_6e5i 1 . 9 . 3554 . 1 1 1 ASN CA C -6.683 5.880 -4.676 . . . 1.0 . . . . . . . . . . . . A . 1 ASN CA . . . . . . . . . c30497_6e5i 1 . 9 . 3555 . 1 1 1 ASN CB C -7.136 4.669 -3.859 . . . 1.0 . . . . . . . . . . . . A . 1 ASN CB . . . . . . . . . c30497_6e5i 1 . 9 . 3556 . 1 1 1 ASN CG C -8.505 4.168 -4.272 . . . 1.0 . . . . . . . . . . . . A . 1 ASN CG . . . . . . . . . c30497_6e5i 1 . 9 . 3557 . 1 1 1 ASN H1 H -6.203 6.343 -6.650 . . . 1.0 . . . . . . . . . . . . A . 1 ASN H1 . . . . . . . . . c30497_6e5i 1 . 9 . 3558 . 1 1 1 ASN H2 H -7.301 5.068 -6.493 . . . 1.0 . . . . . . . . . . . . A . 1 ASN H2 . . . . . . . . . c30497_6e5i 1 . 9 . 3559 . 1 1 1 ASN H3 H -5.666 4.822 -6.151 . . . 1.0 . . . . . . . . . . . . A . 1 ASN H3 . . . . . . . . . c30497_6e5i 1 . 9 . 3560 . 1 1 1 ASN HA H -7.458 6.631 -4.653 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HA . . . . . . . . . c30497_6e5i 1 . 9 . 3561 . 1 1 1 ASN HB2 H -6.426 3.868 -3.992 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HB2 . . . . . . . . . c30497_6e5i 1 . 9 . 3562 . 1 1 1 ASN HB3 H -7.171 4.941 -2.813 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HB3 . . . . . . . . . c30497_6e5i 1 . 9 . 3563 . 1 1 1 ASN HD21 H -9.376 5.348 -2.928 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HD21 . . . . . . . . . c30497_6e5i 1 . 9 . 3564 . 1 1 1 ASN HD22 H -10.440 4.370 -3.880 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HD22 . . . . . . . . . c30497_6e5i 1 . 9 . 3565 . 1 1 1 ASN N N -6.449 5.501 -6.089 . . . 1.0 . . . . . . . . . . . . A . 1 ASN N . . . . . . . . . c30497_6e5i 1 . 9 . 3566 . 1 1 1 ASN ND2 N -9.543 4.680 -3.629 . . . 1.0 . . . . . . . . . . . . A . 1 ASN ND2 . . . . . . . . . c30497_6e5i 1 . 9 . 3567 . 1 1 1 ASN O O -4.373 5.806 -4.042 . . . 1.0 . . . . . . . . . . . . A . 1 ASN O . . . . . . . . . c30497_6e5i 1 . 9 . 3568 . 1 1 1 ASN OD1 O -8.629 3.330 -5.164 . . . 1.0 . . . . . . . . . . . . A . 1 ASN OD1 . . . . . . . . . c30497_6e5i 1 . 9 . 3569 . 1 1 2 ASP C C -3.885 7.731 -1.728 . . . 1.0 . . . . . . . . . . . . A . 2 ASP C . . . . . . . . . c30497_6e5i 1 . 9 . 3570 . 1 1 2 ASP CA C -4.362 8.389 -3.016 . . . 1.0 . . . . . . . . . . . . A . 2 ASP CA . . . . . . . . . c30497_6e5i 1 . 9 . 3571 . 1 1 2 ASP CB C -4.687 9.864 -2.757 . . . 1.0 . . . . . . . . . . . . A . 2 ASP CB . . . . . . . . . c30497_6e5i 1 . 9 . 3572 . 1 1 2 ASP CG C -5.565 10.078 -1.539 . . . 1.0 . . . . . . . . . . . . A . 2 ASP CG . . . . . . . . . c30497_6e5i 1 . 9 . 3573 . 1 1 2 ASP H H -6.394 8.134 -3.567 . . . 1.0 . . . . . . . . . . . . A . 2 ASP H . . . . . . . . . c30497_6e5i 1 . 9 . 3574 . 1 1 2 ASP HA H -3.567 8.331 -3.745 . . . 1.0 . . . . . . . . . . . . A . 2 ASP HA . . . . . . . . . c30497_6e5i 1 . 9 . 3575 . 1 1 2 ASP HB2 H -3.765 10.404 -2.607 . . . 1.0 . . . . . . . . . . . . A . 2 ASP HB2 . . . . . . . . . c30497_6e5i 1 . 9 . 3576 . 1 1 2 ASP HB3 H -5.195 10.269 -3.618 . . . 1.0 . . . . . . . . . . . . A . 2 ASP HB3 . . . . . . . . . c30497_6e5i 1 . 9 . 3577 . 1 1 2 ASP N N -5.517 7.687 -3.567 . . . 1.0 . . . . . . . . . . . . A . 2 ASP N . . . . . . . . . c30497_6e5i 1 . 9 . 3578 . 1 1 2 ASP O O -2.742 7.912 -1.325 . . . 1.0 . . . . . . . . . . . . A . 2 ASP O . . . . . . . . . c30497_6e5i 1 . 9 . 3579 . 1 1 2 ASP OD1 O -5.044 10.535 -0.498 . . . 1.0 . . . . . . . . . . . . A . 2 ASP OD1 . . . . . . . . . c30497_6e5i 1 . 9 . 3580 . 1 1 2 ASP OD2 O -6.781 9.800 -1.617 . . . 1.0 . . . . . . . . . . . . A . 2 ASP OD2 . . . . . . . . . c30497_6e5i 1 . 9 . 3581 . 1 1 3 LYS C C -3.328 5.196 -0.178 . . . 1.0 . . . . . . . . . . . . A . 3 LYS C . . . . . . . . . c30497_6e5i 1 . 9 . 3582 . 1 1 3 LYS CA C -4.402 6.241 0.124 . . . 1.0 . . . . . . . . . . . . A . 3 LYS CA . . . . . . . . . c30497_6e5i 1 . 9 . 3583 . 1 1 3 LYS CB C -5.644 5.581 0.722 . . . 1.0 . . . . . . . . . . . . A . 3 LYS CB . . . . . . . . . c30497_6e5i 1 . 9 . 3584 . 1 1 3 LYS CD C -6.738 4.522 2.713 . . . 1.0 . . . . . . . . . . . . A . 3 LYS CD . . . . . . . . . c30497_6e5i 1 . 9 . 3585 . 1 1 3 LYS CE C -6.569 4.077 4.156 . . . 1.0 . . . . . . . . . . . . A . 3 LYS CE . . . . . . . . . c30497_6e5i 1 . 9 . 3586 . 1 1 3 LYS CG C -5.441 5.057 2.130 . . . 1.0 . . . . . . . . . . . . A . 3 LYS CG . . . . . . . . . c30497_6e5i 1 . 9 . 3587 . 1 1 3 LYS H H -5.674 6.891 -1.438 . . . 1.0 . . . . . . . . . . . . A . 3 LYS H . . . . . . . . . c30497_6e5i 1 . 9 . 3588 . 1 1 3 LYS HA H -4.006 6.954 0.827 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HA . . . . . . . . . c30497_6e5i 1 . 9 . 3589 . 1 1 3 LYS HB2 H -6.445 6.303 0.743 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HB2 . . . . . . . . . c30497_6e5i 1 . 9 . 3590 . 1 1 3 LYS HB3 H -5.936 4.752 0.094 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HB3 . . . . . . . . . c30497_6e5i 1 . 9 . 3591 . 1 1 3 LYS HD2 H -7.484 5.299 2.675 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HD2 . . . . . . . . . c30497_6e5i 1 . 9 . 3592 . 1 1 3 LYS HD3 H -7.065 3.679 2.122 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HD3 . . . . . . . . . c30497_6e5i 1 . 9 . 3593 . 1 1 3 LYS HE2 H -6.224 4.915 4.742 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HE2 . . . . . . . . . c30497_6e5i 1 . 9 . 3594 . 1 1 3 LYS HE3 H -7.525 3.745 4.531 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HE3 . . . . . . . . . c30497_6e5i 1 . 9 . 3595 . 1 1 3 LYS HG2 H -4.714 4.261 2.106 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HG2 . . . . . . . . . c30497_6e5i 1 . 9 . 3596 . 1 1 3 LYS HG3 H -5.081 5.861 2.753 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HG3 . . . . . . . . . c30497_6e5i 1 . 9 . 3597 . 1 1 3 LYS HZ1 H -4.635 3.308 4.055 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HZ1 . . . . . . . . . c30497_6e5i 1 . 9 . 3598 . 1 1 3 LYS HZ2 H -5.841 2.201 3.618 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HZ2 . . . . . . . . . c30497_6e5i 1 . 9 . 3599 . 1 1 3 LYS HZ3 H -5.599 2.591 5.248 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HZ3 . . . . . . . . . c30497_6e5i 1 . 9 . 3600 . 1 1 3 LYS N N -4.761 6.962 -1.091 . . . 1.0 . . . . . . . . . . . . A . 3 LYS N . . . . . . . . . c30497_6e5i 1 . 9 . 3601 . 1 1 3 LYS NZ N -5.593 2.969 4.279 . . . 1.0 . . . . . . . . . . . . A . 3 LYS NZ . . . . . . . . . c30497_6e5i 1 . 9 . 3602 . 1 1 3 LYS O O -2.359 5.038 0.573 . . . 1.0 . . . . . . . . . . . . A . 3 LYS O . . . . . . . . . c30497_6e5i 1 . 9 . 3603 . 1 1 4 CYS C C -1.214 4.215 -2.129 . . . 1.0 . . . . . . . . . . . . A . 4 CYS C . . . . . . . . . c30497_6e5i 1 . 9 . 3604 . 1 1 4 CYS CA C -2.517 3.524 -1.748 . . . 1.0 . . . . . . . . . . . . A . 4 CYS CA . . . . . . . . . c30497_6e5i 1 . 9 . 3605 . 1 1 4 CYS CB C -3.058 2.736 -2.942 . . . 1.0 . . . . . . . . . . . . A . 4 CYS CB . . . . . . . . . c30497_6e5i 1 . 9 . 3606 . 1 1 4 CYS H H -4.292 4.667 -1.845 . . . 1.0 . . . . . . . . . . . . A . 4 CYS H . . . . . . . . . c30497_6e5i 1 . 9 . 3607 . 1 1 4 CYS HA H -2.328 2.844 -0.931 . . . 1.0 . . . . . . . . . . . . A . 4 CYS HA . . . . . . . . . c30497_6e5i 1 . 9 . 3608 . 1 1 4 CYS HB2 H -3.399 3.432 -3.695 . . . 1.0 . . . . . . . . . . . . A . 4 CYS HB2 . . . . . . . . . c30497_6e5i 1 . 9 . 3609 . 1 1 4 CYS HB3 H -2.265 2.128 -3.351 . . . 1.0 . . . . . . . . . . . . A . 4 CYS HB3 . . . . . . . . . c30497_6e5i 1 . 9 . 3610 . 1 1 4 CYS N N -3.495 4.506 -1.300 . . . 1.0 . . . . . . . . . . . . A . 4 CYS N . . . . . . . . . c30497_6e5i 1 . 9 . 3611 . 1 1 4 CYS O O -0.129 3.663 -1.956 . . . 1.0 . . . . . . . . . . . . A . 4 CYS O . . . . . . . . . c30497_6e5i 1 . 9 . 3612 . 1 1 4 CYS SG S -4.451 1.634 -2.539 . . . 1.0 . . . . . . . . . . . . A . 4 CYS SG . . . . . . . . . c30497_6e5i 1 . 9 . 3613 . 1 1 5 LYS C C 0.574 6.673 -1.760 . . . 1.0 . . . . . . . . . . . . A . 5 LYS C . . . . . . . . . c30497_6e5i 1 . 9 . 3614 . 1 1 5 LYS CA C -0.184 6.235 -3.010 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CA . . . . . . . . . c30497_6e5i 1 . 9 . 3615 . 1 1 5 LYS CB C -0.646 7.452 -3.814 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CB . . . . . . . . . c30497_6e5i 1 . 9 . 3616 . 1 1 5 LYS CD C -0.043 9.569 -5.025 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CD . . . . . . . . . c30497_6e5i 1 . 9 . 3617 . 1 1 5 LYS CE C -0.828 9.205 -6.279 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CE . . . . . . . . . c30497_6e5i 1 . 9 . 3618 . 1 1 5 LYS CG C 0.485 8.335 -4.309 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CG . . . . . . . . . c30497_6e5i 1 . 9 . 3619 . 1 1 5 LYS H H -2.233 5.801 -2.772 . . . 1.0 . . . . . . . . . . . . A . 5 LYS H . . . . . . . . . c30497_6e5i 1 . 9 . 3620 . 1 1 5 LYS HA H 0.464 5.627 -3.622 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HA . . . . . . . . . c30497_6e5i 1 . 9 . 3621 . 1 1 5 LYS HB2 H -1.204 7.108 -4.671 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HB2 . . . . . . . . . c30497_6e5i 1 . 9 . 3622 . 1 1 5 LYS HB3 H -1.296 8.052 -3.192 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HB3 . . . . . . . . . c30497_6e5i 1 . 9 . 3623 . 1 1 5 LYS HD2 H -0.693 10.109 -4.354 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HD2 . . . . . . . . . c30497_6e5i 1 . 9 . 3624 . 1 1 5 LYS HD3 H 0.791 10.194 -5.303 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HD3 . . . . . . . . . c30497_6e5i 1 . 9 . 3625 . 1 1 5 LYS HE2 H -1.681 8.608 -5.994 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HE2 . . . . . . . . . c30497_6e5i 1 . 9 . 3626 . 1 1 5 LYS HE3 H -1.168 10.114 -6.750 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HE3 . . . . . . . . . c30497_6e5i 1 . 9 . 3627 . 1 1 5 LYS HG2 H 1.079 8.648 -3.465 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HG2 . . . . . . . . . c30497_6e5i 1 . 9 . 3628 . 1 1 5 LYS HG3 H 1.100 7.768 -4.994 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HG3 . . . . . . . . . c30497_6e5i 1 . 9 . 3629 . 1 1 5 LYS HZ1 H 0.358 7.569 -6.808 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HZ1 . . . . . . . . . c30497_6e5i 1 . 9 . 3630 . 1 1 5 LYS HZ2 H 0.802 9.009 -7.571 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HZ2 . . . . . . . . . c30497_6e5i 1 . 9 . 3631 . 1 1 5 LYS HZ3 H -0.575 8.175 -8.077 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HZ3 . . . . . . . . . c30497_6e5i 1 . 9 . 3632 . 1 1 5 LYS N N -1.337 5.432 -2.639 . . . 1.0 . . . . . . . . . . . . A . 5 LYS N . . . . . . . . . c30497_6e5i 1 . 9 . 3633 . 1 1 5 LYS NZ N -0.003 8.436 -7.250 . . . 1.0 . . . . . . . . . . . . A . 5 LYS NZ . . . . . . . . . c30497_6e5i 1 . 9 . 3634 . 1 1 5 LYS O O 1.808 6.669 -1.728 . . . 1.0 . . . . . . . . . . . . A . 5 LYS O . . . . . . . . . c30497_6e5i 1 . 9 . 3635 . 1 1 6 GLU C C 1.193 6.270 1.140 . . . 1.0 . . . . . . . . . . . . A . 6 GLU C . . . . . . . . . c30497_6e5i 1 . 9 . 3636 . 1 1 6 GLU CA C 0.388 7.415 0.554 . . . 1.0 . . . . . . . . . . . . A . 6 GLU CA . . . . . . . . . c30497_6e5i 1 . 9 . 3637 . 1 1 6 GLU CB C -0.722 7.818 1.526 . . . 1.0 . . . . . . . . . . . . A . 6 GLU CB . . . . . . . . . c30497_6e5i 1 . 9 . 3638 . 1 1 6 GLU CD C -0.357 10.305 1.612 . . . 1.0 . . . . . . . . . . . . A . 6 GLU CD . . . . . . . . . c30497_6e5i 1 . 9 . 3639 . 1 1 6 GLU CG C -1.309 9.190 1.248 . . . 1.0 . . . . . . . . . . . . A . 6 GLU CG . . . . . . . . . c30497_6e5i 1 . 9 . 3640 . 1 1 6 GLU H H -1.157 7.030 -0.832 . . . 1.0 . . . . . . . . . . . . A . 6 GLU H . . . . . . . . . c30497_6e5i 1 . 9 . 3641 . 1 1 6 GLU HA H 1.041 8.257 0.390 . . . 1.0 . . . . . . . . . . . . A . 6 GLU HA . . . . . . . . . c30497_6e5i 1 . 9 . 3642 . 1 1 6 GLU HB2 H -1.518 7.092 1.465 . . . 1.0 . . . . . . . . . . . . A . 6 GLU HB2 . . . . . . . . . c30497_6e5i 1 . 9 . 3643 . 1 1 6 GLU HB3 H -0.323 7.819 2.529 . . . 1.0 . . . . . . . . . . . . A . 6 GLU HB3 . . . . . . . . . c30497_6e5i 1 . 9 . 3644 . 1 1 6 GLU HG2 H -1.539 9.265 0.196 . . . 1.0 . . . . . . . . . . . . A . 6 GLU HG2 . . . . . . . . . c30497_6e5i 1 . 9 . 3645 . 1 1 6 GLU HG3 H -2.215 9.303 1.821 . . . 1.0 . . . . . . . . . . . . A . 6 GLU HG3 . . . . . . . . . c30497_6e5i 1 . 9 . 3646 . 1 1 6 GLU N N -0.181 7.029 -0.727 . . . 1.0 . . . . . . . . . . . . A . 6 GLU N . . . . . . . . . c30497_6e5i 1 . 9 . 3647 . 1 1 6 GLU O O 2.339 6.449 1.551 . . . 1.0 . . . . . . . . . . . . A . 6 GLU O . . . . . . . . . c30497_6e5i 1 . 9 . 3648 . 1 1 6 GLU OE1 O -0.251 10.638 2.809 . . . 1.0 . . . . . . . . . . . . A . 6 GLU OE1 . . . . . . . . . c30497_6e5i 1 . 9 . 3649 . 1 1 6 GLU OE2 O 0.285 10.866 0.699 . . . 1.0 . . . . . . . . . . . . A . 6 GLU OE2 . . . . . . . . . c30497_6e5i 1 . 9 . 3650 . 1 1 7 LEU C C 2.452 3.539 0.793 . . . 1.0 . . . . . . . . . . . . A . 7 LEU C . . . . . . . . . c30497_6e5i 1 . 9 . 3651 . 1 1 7 LEU CA C 1.258 3.902 1.668 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CA . . . . . . . . . c30497_6e5i 1 . 9 . 3652 . 1 1 7 LEU CB C 0.275 2.734 1.735 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CB . . . . . . . . . c30497_6e5i 1 . 9 . 3653 . 1 1 7 LEU CD1 C -1.912 1.829 2.566 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CD1 . . . . . . . . . c30497_6e5i 1 . 9 . 3654 . 1 1 7 LEU CD2 C -0.276 2.776 4.182 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CD2 . . . . . . . . . c30497_6e5i 1 . 9 . 3655 . 1 1 7 LEU CG C -0.840 2.884 2.775 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CG . . . . . . . . . c30497_6e5i 1 . 9 . 3656 . 1 1 7 LEU H H -0.341 5.021 0.838 . . . 1.0 . . . . . . . . . . . . A . 7 LEU H . . . . . . . . . c30497_6e5i 1 . 9 . 3657 . 1 1 7 LEU HA H 1.612 4.121 2.661 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HA . . . . . . . . . c30497_6e5i 1 . 9 . 3658 . 1 1 7 LEU HB2 H -0.179 2.620 0.762 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HB2 . . . . . . . . . c30497_6e5i 1 . 9 . 3659 . 1 1 7 LEU HB3 H 0.830 1.837 1.961 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HB3 . . . . . . . . . c30497_6e5i 1 . 9 . 3660 . 1 1 7 LEU HD11 H -2.339 1.939 1.581 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD11 . . . . . . . . . c30497_6e5i 1 . 9 . 3661 . 1 1 7 LEU HD12 H -2.688 1.952 3.309 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD12 . . . . . . . . . c30497_6e5i 1 . 9 . 3662 . 1 1 7 LEU HD13 H -1.475 0.846 2.663 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD13 . . . . . . . . . c30497_6e5i 1 . 9 . 3663 . 1 1 7 LEU HD21 H -1.070 2.919 4.898 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD21 . . . . . . . . . c30497_6e5i 1 . 9 . 3664 . 1 1 7 LEU HD22 H 0.481 3.530 4.329 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD22 . . . . . . . . . c30497_6e5i 1 . 9 . 3665 . 1 1 7 LEU HD23 H 0.158 1.796 4.320 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD23 . . . . . . . . . c30497_6e5i 1 . 9 . 3666 . 1 1 7 LEU HG H -1.299 3.858 2.668 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HG . . . . . . . . . c30497_6e5i 1 . 9 . 3667 . 1 1 7 LEU N N 0.588 5.091 1.163 . . . 1.0 . . . . . . . . . . . . A . 7 LEU N . . . . . . . . . c30497_6e5i 1 . 9 . 3668 . 1 1 7 LEU O O 3.500 3.132 1.295 . . . 1.0 . . . . . . . . . . . . A . 7 LEU O . . . . . . . . . c30497_6e5i 1 . 9 . 3669 . 1 1 8 LYS C C 4.583 4.278 -1.183 . . . 1.0 . . . . . . . . . . . . A . 8 LYS C . . . . . . . . . c30497_6e5i 1 . 9 . 3670 . 1 1 8 LYS CA C 3.357 3.413 -1.458 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CA . . . . . . . . . c30497_6e5i 1 . 9 . 3671 . 1 1 8 LYS CB C 2.873 3.647 -2.888 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CB . . . . . . . . . c30497_6e5i 1 . 9 . 3672 . 1 1 8 LYS CD C 3.415 3.563 -5.336 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CD . . . . . . . . . c30497_6e5i 1 . 9 . 3673 . 1 1 8 LYS CE C 4.325 2.968 -6.399 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CE . . . . . . . . . c30497_6e5i 1 . 9 . 3674 . 1 1 8 LYS CG C 3.824 3.117 -3.944 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CG . . . . . . . . . c30497_6e5i 1 . 9 . 3675 . 1 1 8 LYS H H 1.428 4.030 -0.850 . . . 1.0 . . . . . . . . . . . . A . 8 LYS H . . . . . . . . . c30497_6e5i 1 . 9 . 3676 . 1 1 8 LYS HA H 3.628 2.377 -1.341 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HA . . . . . . . . . c30497_6e5i 1 . 9 . 3677 . 1 1 8 LYS HB2 H 1.919 3.157 -3.015 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HB2 . . . . . . . . . c30497_6e5i 1 . 9 . 3678 . 1 1 8 LYS HB3 H 2.748 4.707 -3.044 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HB3 . . . . . . . . . c30497_6e5i 1 . 9 . 3679 . 1 1 8 LYS HD2 H 2.402 3.239 -5.523 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HD2 . . . . . . . . . c30497_6e5i 1 . 9 . 3680 . 1 1 8 LYS HD3 H 3.467 4.639 -5.390 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HD3 . . . . . . . . . c30497_6e5i 1 . 9 . 3681 . 1 1 8 LYS HE2 H 4.190 1.899 -6.410 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HE2 . . . . . . . . . c30497_6e5i 1 . 9 . 3682 . 1 1 8 LYS HE3 H 4.047 3.375 -7.359 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HE3 . . . . . . . . . c30497_6e5i 1 . 9 . 3683 . 1 1 8 LYS HG2 H 4.818 3.484 -3.737 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HG2 . . . . . . . . . c30497_6e5i 1 . 9 . 3684 . 1 1 8 LYS HG3 H 3.822 2.039 -3.906 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HG3 . . . . . . . . . c30497_6e5i 1 . 9 . 3685 . 1 1 8 LYS HZ1 H 6.054 2.861 -5.231 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ1 . . . . . . . . . c30497_6e5i 1 . 9 . 3686 . 1 1 8 LYS HZ2 H 5.917 4.295 -6.116 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ2 . . . . . . . . . c30497_6e5i 1 . 9 . 3687 . 1 1 8 LYS HZ3 H 6.349 2.859 -6.895 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ3 . . . . . . . . . c30497_6e5i 1 . 9 . 3688 . 1 1 8 LYS N N 2.293 3.709 -0.512 . . . 1.0 . . . . . . . . . . . . A . 8 LYS N . . . . . . . . . c30497_6e5i 1 . 9 . 3689 . 1 1 8 LYS NZ N 5.760 3.268 -6.143 . . . 1.0 . . . . . . . . . . . . A . 8 LYS NZ . . . . . . . . . c30497_6e5i 1 . 9 . 3690 . 1 1 8 LYS O O 5.709 3.787 -1.172 . . . 1.0 . . . . . . . . . . . . A . 8 LYS O . . . . . . . . . c30497_6e5i 1 . 9 . 3691 . 1 1 9 LYS C C 6.008 6.236 0.719 . . . 1.0 . . . . . . . . . . . . A . 9 LYS C . . . . . . . . . c30497_6e5i 1 . 9 . 3692 . 1 1 9 LYS CA C 5.444 6.488 -0.675 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CA . . . . . . . . . c30497_6e5i 1 . 9 . 3693 . 1 1 9 LYS CB C 4.960 7.935 -0.789 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CB . . . . . . . . . c30497_6e5i 1 . 9 . 3694 . 1 1 9 LYS CD C 7.036 8.844 -1.871 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CD . . . . . . . . . c30497_6e5i 1 . 9 . 3695 . 1 1 9 LYS CE C 8.204 9.810 -1.746 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CE . . . . . . . . . c30497_6e5i 1 . 9 . 3696 . 1 1 9 LYS CG C 6.078 8.961 -0.697 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CG . . . . . . . . . c30497_6e5i 1 . 9 . 3697 . 1 1 9 LYS H H 3.434 5.906 -1.002 . . . 1.0 . . . . . . . . . . . . A . 9 LYS H . . . . . . . . . c30497_6e5i 1 . 9 . 3698 . 1 1 9 LYS HA H 6.223 6.319 -1.402 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HA . . . . . . . . . c30497_6e5i 1 . 9 . 3699 . 1 1 9 LYS HB2 H 4.462 8.060 -1.738 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HB2 . . . . . . . . . c30497_6e5i 1 . 9 . 3700 . 1 1 9 LYS HB3 H 4.256 8.128 0.005 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HB3 . . . . . . . . . c30497_6e5i 1 . 9 . 3701 . 1 1 9 LYS HD2 H 7.420 7.837 -1.912 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HD2 . . . . . . . . . c30497_6e5i 1 . 9 . 3702 . 1 1 9 LYS HD3 H 6.498 9.063 -2.782 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HD3 . . . . . . . . . c30497_6e5i 1 . 9 . 3703 . 1 1 9 LYS HE2 H 8.780 9.775 -2.658 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HE2 . . . . . . . . . c30497_6e5i 1 . 9 . 3704 . 1 1 9 LYS HE3 H 7.814 10.806 -1.608 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HE3 . . . . . . . . . c30497_6e5i 1 . 9 . 3705 . 1 1 9 LYS HG2 H 5.647 9.950 -0.694 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HG2 . . . . . . . . . c30497_6e5i 1 . 9 . 3706 . 1 1 9 LYS HG3 H 6.624 8.801 0.221 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HG3 . . . . . . . . . c30497_6e5i 1 . 9 . 3707 . 1 1 9 LYS HZ1 H 9.941 10.080 -0.618 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HZ1 . . . . . . . . . c30497_6e5i 1 . 9 . 3708 . 1 1 9 LYS HZ2 H 9.393 8.483 -0.656 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HZ2 . . . . . . . . . c30497_6e5i 1 . 9 . 3709 . 1 1 9 LYS HZ3 H 8.595 9.623 0.299 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HZ3 . . . . . . . . . c30497_6e5i 1 . 9 . 3710 . 1 1 9 LYS N N 4.357 5.565 -0.961 . . . 1.0 . . . . . . . . . . . . A . 9 LYS N . . . . . . . . . c30497_6e5i 1 . 9 . 3711 . 1 1 9 LYS NZ N 9.093 9.476 -0.601 . . . 1.0 . . . . . . . . . . . . A . 9 LYS NZ . . . . . . . . . c30497_6e5i 1 . 9 . 3712 . 1 1 9 LYS O O 7.215 6.335 0.943 . . . 1.0 . . . . . . . . . . . . A . 9 LYS O . . . . . . . . . c30497_6e5i 1 . 9 . 3713 . 1 1 10 ARG C C 6.479 4.478 3.132 . . . 1.0 . . . . . . . . . . . . A . 10 ARG C . . . . . . . . . c30497_6e5i 1 . 9 . 3714 . 1 1 10 ARG CA C 5.494 5.639 3.029 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CA . . . . . . . . . c30497_6e5i 1 . 9 . 3715 . 1 1 10 ARG CB C 4.236 5.341 3.847 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CB . . . . . . . . . c30497_6e5i 1 . 9 . 3716 . 1 1 10 ARG CD C 3.202 4.830 6.077 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CD . . . . . . . . . c30497_6e5i 1 . 9 . 3717 . 1 1 10 ARG CG C 4.501 5.010 5.305 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CG . . . . . . . . . c30497_6e5i 1 . 9 . 3718 . 1 1 10 ARG CZ C 2.477 4.171 8.343 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CZ . . . . . . . . . c30497_6e5i 1 . 9 . 3719 . 1 1 10 ARG H H 4.176 5.817 1.388 . . . 1.0 . . . . . . . . . . . . A . 10 ARG H . . . . . . . . . c30497_6e5i 1 . 9 . 3720 . 1 1 10 ARG HA H 5.963 6.529 3.416 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HA . . . . . . . . . c30497_6e5i 1 . 9 . 3721 . 1 1 10 ARG HB2 H 3.588 6.203 3.807 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HB2 . . . . . . . . . c30497_6e5i 1 . 9 . 3722 . 1 1 10 ARG HB3 H 3.725 4.502 3.400 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HB3 . . . . . . . . . c30497_6e5i 1 . 9 . 3723 . 1 1 10 ARG HD2 H 2.730 5.794 6.187 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HD2 . . . . . . . . . c30497_6e5i 1 . 9 . 3724 . 1 1 10 ARG HD3 H 2.551 4.174 5.518 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HD3 . . . . . . . . . c30497_6e5i 1 . 9 . 3725 . 1 1 10 ARG HE H 4.320 3.910 7.605 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HE . . . . . . . . . c30497_6e5i 1 . 9 . 3726 . 1 1 10 ARG HG2 H 5.074 4.095 5.358 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HG2 . . . . . . . . . c30497_6e5i 1 . 9 . 3727 . 1 1 10 ARG HG3 H 5.066 5.818 5.749 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HG3 . . . . . . . . . c30497_6e5i 1 . 9 . 3728 . 1 1 10 ARG HH11 H 0.549 4.591 8.827 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HH11 . . . . . . . . . c30497_6e5i 1 . 9 . 3729 . 1 1 10 ARG HH12 H 1.047 5.109 7.246 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HH12 . . . . . . . . . c30497_6e5i 1 . 9 . 3730 . 1 1 10 ARG HH21 H 3.673 3.237 9.685 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HH21 . . . . . . . . . c30497_6e5i 1 . 9 . 3731 . 1 1 10 ARG HH22 H 2.047 3.528 10.217 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HH22 . . . . . . . . . c30497_6e5i 1 . 9 . 3732 . 1 1 10 ARG N N 5.121 5.895 1.644 . . . 1.0 . . . . . . . . . . . . A . 10 ARG N . . . . . . . . . c30497_6e5i 1 . 9 . 3733 . 1 1 10 ARG NE N 3.420 4.261 7.407 . . . 1.0 . . . . . . . . . . . . A . 10 ARG NE . . . . . . . . . c30497_6e5i 1 . 9 . 3734 . 1 1 10 ARG NH1 N 1.261 4.660 8.119 . . . 1.0 . . . . . . . . . . . . A . 10 ARG NH1 . . . . . . . . . c30497_6e5i 1 . 9 . 3735 . 1 1 10 ARG NH2 N 2.756 3.601 9.507 . . . 1.0 . . . . . . . . . . . . A . 10 ARG NH2 . . . . . . . . . c30497_6e5i 1 . 9 . 3736 . 1 1 10 ARG O O 7.458 4.537 3.880 . . . 1.0 . . . . . . . . . . . . A . 10 ARG O . . . . . . . . . c30497_6e5i 1 . 9 . 3737 . 1 1 11 TYR C C 8.079 2.219 1.286 . . . 1.0 . . . . . . . . . . . . A . 11 TYR C . . . . . . . . . c30497_6e5i 1 . 9 . 3738 . 1 1 11 TYR CA C 7.057 2.235 2.416 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CA . . . . . . . . . c30497_6e5i 1 . 9 . 3739 . 1 1 11 TYR CB C 6.185 0.983 2.361 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CB . . . . . . . . . c30497_6e5i 1 . 9 . 3740 . 1 1 11 TYR CD1 C 5.819 0.174 4.727 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CD1 . . . . . . . . . c30497_6e5i 1 . 9 . 3741 . 1 1 11 TYR CD2 C 4.014 1.253 3.608 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CD2 . . . . . . . . . c30497_6e5i 1 . 9 . 3742 . 1 1 11 TYR CE1 C 5.028 0.004 5.845 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CE1 . . . . . . . . . c30497_6e5i 1 . 9 . 3743 . 1 1 11 TYR CE2 C 3.218 1.088 4.723 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CE2 . . . . . . . . . c30497_6e5i 1 . 9 . 3744 . 1 1 11 TYR CG C 5.326 0.801 3.591 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CG . . . . . . . . . c30497_6e5i 1 . 9 . 3745 . 1 1 11 TYR CZ C 3.766 0.470 5.866 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CZ . . . . . . . . . c30497_6e5i 1 . 9 . 3746 . 1 1 11 TYR H H 5.444 3.447 1.769 . . . 1.0 . . . . . . . . . . . . A . 11 TYR H . . . . . . . . . c30497_6e5i 1 . 9 . 3747 . 1 1 11 TYR HA H 7.584 2.244 3.355 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HA . . . . . . . . . c30497_6e5i 1 . 9 . 3748 . 1 1 11 TYR HB2 H 5.533 1.043 1.503 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HB2 . . . . . . . . . c30497_6e5i 1 . 9 . 3749 . 1 1 11 TYR HB3 H 6.819 0.117 2.267 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HB3 . . . . . . . . . c30497_6e5i 1 . 9 . 3750 . 1 1 11 TYR HD1 H 6.840 -0.186 4.730 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HD1 . . . . . . . . . c30497_6e5i 1 . 9 . 3751 . 1 1 11 TYR HD2 H 3.618 1.740 2.731 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HD2 . . . . . . . . . c30497_6e5i 1 . 9 . 3752 . 1 1 11 TYR HE1 H 5.429 -0.486 6.716 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HE1 . . . . . . . . . c30497_6e5i 1 . 9 . 3753 . 1 1 11 TYR HE2 H 2.199 1.448 4.716 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HE2 . . . . . . . . . c30497_6e5i 1 . 9 . 3754 . 1 1 11 TYR HH H 3.440 0.537 7.741 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HH . . . . . . . . . c30497_6e5i 1 . 9 . 3755 . 1 1 11 TYR N N 6.222 3.426 2.372 . . . 1.0 . . . . . . . . . . . . A . 11 TYR N . . . . . . . . . c30497_6e5i 1 . 9 . 3756 . 1 1 11 TYR O O 8.862 1.276 1.155 . . . 1.0 . . . . . . . . . . . . A . 11 TYR O . . . . . . . . . c30497_6e5i 1 . 9 . 3757 . 1 1 11 TYR OH O 2.937 0.293 6.953 . . . 1.0 . . . . . . . . . . . . A . 11 TYR OH . . . . . . . . . c30497_6e5i 1 . 9 . 3758 . 1 1 12 ORN C C 9.900 -0.039 -2.321 . . . 1.0 . . . . . . . . . . . . A . 12 ORN C . . . . . . . . . c30497_6e5i 1 . 9 . 3759 . 1 1 12 ORN CA C 10.598 1.316 -2.369 . . . 1.0 . . . . . . . . . . . . A . 12 ORN CA . . . . . . . . . c30497_6e5i 1 . 9 . 3760 . 1 1 12 ORN CB C 9.625 2.392 -2.864 . . . 1.0 . . . . . . . . . . . . A . 12 ORN CB . . . . . . . . . c30497_6e5i 1 . 9 . 3761 . 1 1 12 ORN CD C 9.006 3.397 -0.647 . . . 1.0 . . . . . . . . . . . . A . 12 ORN CD . . . . . . . . . c30497_6e5i 1 . 9 . 3762 . 1 1 12 ORN CG C 8.497 2.687 -1.890 . . . 1.0 . . . . . . . . . . . . A . 12 ORN CG . . . . . . . . . c30497_6e5i 1 . 9 . 3763 . 1 1 12 ORN H H 11.476 0.935 -4.216 . . . 1.0 . . . . . . . . . . . . A . 12 ORN H . . . . . . . . . c30497_6e5i 1 . 9 . 3764 . 1 1 12 ORN HA H 10.941 1.570 -1.378 . . . 1.0 . . . . . . . . . . . . A . 12 ORN HA . . . . . . . . . c30497_6e5i 1 . 9 . 3765 . 1 1 12 ORN HB2 H 9.190 2.066 -3.798 . . . 1.0 . . . . . . . . . . . . A . 12 ORN HB2 . . . . . . . . . c30497_6e5i 1 . 9 . 3766 . 1 1 12 ORN HB3 H 10.174 3.305 -3.032 . . . 1.0 . . . . . . . . . . . . A . 12 ORN HB3 . . . . . . . . . c30497_6e5i 1 . 9 . 3767 . 1 1 12 ORN HD2 H 9.131 4.443 -0.875 . . . 1.0 . . . . . . . . . . . . A . 12 ORN HD2 . . . . . . . . . c30497_6e5i 1 . 9 . 3768 . 1 1 12 ORN HD3 H 9.957 2.975 -0.368 . . . 1.0 . . . . . . . . . . . . A . 12 ORN HD3 . . . . . . . . . c30497_6e5i 1 . 9 . 3769 . 1 1 12 ORN HE1 H 7.444 3.987 0.629 . . . 1.0 . . . . . . . . . . . . A . 12 ORN HE1 . . . . . . . . . c30497_6e5i 1 . 9 . 3770 . 1 1 12 ORN HG2 H 8.034 1.756 -1.596 . . . 1.0 . . . . . . . . . . . . A . 12 ORN HG2 . . . . . . . . . c30497_6e5i 1 . 9 . 3771 . 1 1 12 ORN HG3 H 7.769 3.313 -2.377 . . . 1.0 . . . . . . . . . . . . A . 12 ORN HG3 . . . . . . . . . c30497_6e5i 1 . 9 . 3772 . 1 1 12 ORN N N 11.771 1.246 -3.268 . . . 1.0 . . . . . . . . . . . . A . 12 ORN N . . . . . . . . . c30497_6e5i 1 . 9 . 3773 . 1 1 12 ORN NE N 8.086 3.263 0.474 . . . 1.0 . . . . . . . . . . . . A . 12 ORN NE . . . . . . . . . c30497_6e5i 1 . 9 . 3774 . 1 1 12 ORN O O 9.959 -0.804 -3.284 . . . 1.0 . . . . . . . . . . . . A . 12 ORN O . . . . . . . . . c30497_6e5i 1 . 9 . 3775 . 1 1 13 CYS C C 7.295 -1.608 -1.959 . . . 1.0 . . . . . . . . . . . . A . 13 CYS C . . . . . . . . . c30497_6e5i 1 . 9 . 3776 . 1 1 13 CYS CA C 8.519 -1.596 -1.056 . . . 1.0 . . . . . . . . . . . . A . 13 CYS CA . . . . . . . . . c30497_6e5i 1 . 9 . 3777 . 1 1 13 CYS CB C 8.073 -1.794 0.393 . . . 1.0 . . . . . . . . . . . . A . 13 CYS CB . . . . . . . . . c30497_6e5i 1 . 9 . 3778 . 1 1 13 CYS H H 9.233 0.308 -0.459 . . . 1.0 . . . . . . . . . . . . A . 13 CYS H . . . . . . . . . c30497_6e5i 1 . 9 . 3779 . 1 1 13 CYS HA H 9.178 -2.401 -1.340 . . . 1.0 . . . . . . . . . . . . A . 13 CYS HA . . . . . . . . . c30497_6e5i 1 . 9 . 3780 . 1 1 13 CYS HB2 H 7.351 -1.034 0.640 . . . 1.0 . . . . . . . . . . . . A . 13 CYS HB2 . . . . . . . . . c30497_6e5i 1 . 9 . 3781 . 1 1 13 CYS HB3 H 7.610 -2.765 0.486 . . . 1.0 . . . . . . . . . . . . A . 13 CYS HB3 . . . . . . . . . c30497_6e5i 1 . 9 . 3782 . 1 1 13 CYS N N 9.243 -0.338 -1.204 . . . 1.0 . . . . . . . . . . . . A . 13 CYS N . . . . . . . . . c30497_6e5i 1 . 9 . 3783 . 1 1 13 CYS O O 6.719 -0.558 -2.250 . . . 1.0 . . . . . . . . . . . . A . 13 CYS O . . . . . . . . . c30497_6e5i 1 . 9 . 3784 . 1 1 13 CYS SG S 9.417 -1.698 1.619 . . . 1.0 . . . . . . . . . . . . A . 13 CYS SG . . . . . . . . . c30497_6e5i 1 . 9 . 3785 . 1 1 14 GLU C C 4.485 -3.037 -2.383 . . . 1.0 . . . . . . . . . . . . A . 14 GLU C . . . . . . . . . c30497_6e5i 1 . 9 . 3786 . 1 1 14 GLU CA C 5.731 -2.943 -3.240 . . . 1.0 . . . . . . . . . . . . A . 14 GLU CA . . . . . . . . . c30497_6e5i 1 . 9 . 3787 . 1 1 14 GLU CB C 5.850 -4.190 -4.115 . . . 1.0 . . . . . . . . . . . . A . 14 GLU CB . . . . . . . . . c30497_6e5i 1 . 9 . 3788 . 1 1 14 GLU CD C 7.045 -5.362 -5.993 . . . 1.0 . . . . . . . . . . . . A . 14 GLU CD . . . . . . . . . c30497_6e5i 1 . 9 . 3789 . 1 1 14 GLU CG C 6.955 -4.111 -5.151 . . . 1.0 . . . . . . . . . . . . A . 14 GLU CG . . . . . . . . . c30497_6e5i 1 . 9 . 3790 . 1 1 14 GLU H H 7.405 -3.595 -2.125 . . . 1.0 . . . . . . . . . . . . A . 14 GLU H . . . . . . . . . c30497_6e5i 1 . 9 . 3791 . 1 1 14 GLU HA H 5.658 -2.070 -3.869 . . . 1.0 . . . . . . . . . . . . A . 14 GLU HA . . . . . . . . . c30497_6e5i 1 . 9 . 3792 . 1 1 14 GLU HB2 H 6.045 -5.040 -3.479 . . . 1.0 . . . . . . . . . . . . A . 14 GLU HB2 . . . . . . . . . c30497_6e5i 1 . 9 . 3793 . 1 1 14 GLU HB3 H 4.912 -4.343 -4.628 . . . 1.0 . . . . . . . . . . . . A . 14 GLU HB3 . . . . . . . . . c30497_6e5i 1 . 9 . 3794 . 1 1 14 GLU HG2 H 6.761 -3.272 -5.801 . . . 1.0 . . . . . . . . . . . . A . 14 GLU HG2 . . . . . . . . . c30497_6e5i 1 . 9 . 3795 . 1 1 14 GLU HG3 H 7.898 -3.965 -4.645 . . . 1.0 . . . . . . . . . . . . A . 14 GLU HG3 . . . . . . . . . c30497_6e5i 1 . 9 . 3796 . 1 1 14 GLU N N 6.904 -2.792 -2.396 . . . 1.0 . . . . . . . . . . . . A . 14 GLU N . . . . . . . . . c30497_6e5i 1 . 9 . 3797 . 1 1 14 GLU O O 4.332 -3.964 -1.590 . . . 1.0 . . . . . . . . . . . . A . 14 GLU O . . . . . . . . . c30497_6e5i 1 . 9 . 3798 . 1 1 14 GLU OE1 O 7.790 -6.293 -5.608 . . . 1.0 . . . . . . . . . . . . A . 14 GLU OE1 . . . . . . . . . c30497_6e5i 1 . 9 . 3799 . 1 1 14 GLU OE2 O 6.370 -5.430 -7.039 . . . 1.0 . . . . . . . . . . . . A . 14 GLU OE2 . . . . . . . . . c30497_6e5i 1 . 9 . 3800 . 1 1 15 VAL C C 1.185 -2.329 -2.660 . . . 1.0 . . . . . . . . . . . . A . 15 VAL C . . . . . . . . . c30497_6e5i 1 . 9 . 3801 . 1 1 15 VAL CA C 2.380 -2.036 -1.764 . . . 1.0 . . . . . . . . . . . . A . 15 VAL CA . . . . . . . . . c30497_6e5i 1 . 9 . 3802 . 1 1 15 VAL CB C 2.176 -0.675 -1.066 . . . 1.0 . . . . . . . . . . . . A . 15 VAL CB . . . . . . . . . c30497_6e5i 1 . 9 . 3803 . 1 1 15 VAL CG1 C 0.890 -0.671 -0.250 . . . 1.0 . . . . . . . . . . . . A . 15 VAL CG1 . . . . . . . . . c30497_6e5i 1 . 9 . 3804 . 1 1 15 VAL CG2 C 3.370 -0.338 -0.187 . . . 1.0 . . . . . . . . . . . . A . 15 VAL CG2 . . . . . . . . . c30497_6e5i 1 . 9 . 3805 . 1 1 15 VAL H H 3.782 -1.358 -3.186 . . . 1.0 . . . . . . . . . . . . A . 15 VAL H . . . . . . . . . c30497_6e5i 1 . 9 . 3806 . 1 1 15 VAL HA H 2.445 -2.803 -1.006 . . . 1.0 . . . . . . . . . . . . A . 15 VAL HA . . . . . . . . . c30497_6e5i 1 . 9 . 3807 . 1 1 15 VAL HB H 2.093 0.084 -1.827 . . . 1.0 . . . . . . . . . . . . A . 15 VAL HB . . . . . . . . . c30497_6e5i 1 . 9 . 3808 . 1 1 15 VAL HG11 H 0.768 0.291 0.223 . . . 1.0 . . . . . . . . . . . . A . 15 VAL HG11 . . . . . . . . . c30497_6e5i 1 . 9 . 3809 . 1 1 15 VAL HG12 H 0.941 -1.441 0.506 . . . 1.0 . . . . . . . . . . . . A . 15 VAL HG12 . . . . . . . . . c30497_6e5i 1 . 9 . 3810 . 1 1 15 VAL HG13 H 0.050 -0.861 -0.900 . . . 1.0 . . . . . . . . . . . . A . 15 VAL HG13 . . . . . . . . . c30497_6e5i 1 . 9 . 3811 . 1 1 15 VAL HG21 H 3.186 0.597 0.322 . . . 1.0 . . . . . . . . . . . . A . 15 VAL HG21 . . . . . . . . . c30497_6e5i 1 . 9 . 3812 . 1 1 15 VAL HG22 H 4.254 -0.248 -0.800 . . . 1.0 . . . . . . . . . . . . A . 15 VAL HG22 . . . . . . . . . c30497_6e5i 1 . 9 . 3813 . 1 1 15 VAL HG23 H 3.514 -1.122 0.540 . . . 1.0 . . . . . . . . . . . . A . 15 VAL HG23 . . . . . . . . . c30497_6e5i 1 . 9 . 3814 . 1 1 15 VAL N N 3.606 -2.068 -2.534 . . . 1.0 . . . . . . . . . . . . A . 15 VAL N . . . . . . . . . c30497_6e5i 1 . 9 . 3815 . 1 1 15 VAL O O 0.938 -1.619 -3.633 . . . 1.0 . . . . . . . . . . . . A . 15 VAL O . . . . . . . . . c30497_6e5i 1 . 9 . 3816 . 1 1 16 ARG C C -1.958 -3.418 -2.187 . . . 1.0 . . . . . . . . . . . . A . 16 ARG C . . . . . . . . . c30497_6e5i 1 . 9 . 3817 . 1 1 16 ARG CA C -0.751 -3.732 -3.054 . . . 1.0 . . . . . . . . . . . . A . 16 ARG CA . . . . . . . . . c30497_6e5i 1 . 9 . 3818 . 1 1 16 ARG CB C -0.779 -5.214 -3.431 . . . 1.0 . . . . . . . . . . . . A . 16 ARG CB . . . . . . . . . c30497_6e5i 1 . 9 . 3819 . 1 1 16 ARG CD C 0.243 -7.157 -4.611 . . . 1.0 . . . . . . . . . . . . A . 16 ARG CD . . . . . . . . . c30497_6e5i 1 . 9 . 3820 . 1 1 16 ARG CG C 0.372 -5.675 -4.307 . . . 1.0 . . . . . . . . . . . . A . 16 ARG CG . . . . . . . . . c30497_6e5i 1 . 9 . 3821 . 1 1 16 ARG CZ C 1.712 -8.980 -5.373 . . . 1.0 . . . . . . . . . . . . A . 16 ARG CZ . . . . . . . . . c30497_6e5i 1 . 9 . 3822 . 1 1 16 ARG H H 0.754 -3.945 -1.580 . . . 1.0 . . . . . . . . . . . . A . 16 ARG H . . . . . . . . . c30497_6e5i 1 . 9 . 3823 . 1 1 16 ARG HA H -0.798 -3.135 -3.952 . . . 1.0 . . . . . . . . . . . . A . 16 ARG HA . . . . . . . . . c30497_6e5i 1 . 9 . 3824 . 1 1 16 ARG HB2 H -0.760 -5.797 -2.528 . . . 1.0 . . . . . . . . . . . . A . 16 ARG HB2 . . . . . . . . . c30497_6e5i 1 . 9 . 3825 . 1 1 16 ARG HB3 H -1.699 -5.417 -3.955 . . . 1.0 . . . . . . . . . . . . A . 16 ARG HB3 . . . . . . . . . c30497_6e5i 1 . 9 . 3826 . 1 1 16 ARG HD2 H 0.146 -7.691 -3.678 . . . 1.0 . . . . . . . . . . . . A . 16 ARG HD2 . . . . . . . . . c30497_6e5i 1 . 9 . 3827 . 1 1 16 ARG HD3 H -0.647 -7.310 -5.204 . . . 1.0 . . . . . . . . . . . . A . 16 ARG HD3 . . . . . . . . . c30497_6e5i 1 . 9 . 3828 . 1 1 16 ARG HE H 1.961 -7.043 -5.820 . . . 1.0 . . . . . . . . . . . . A . 16 ARG HE . . . . . . . . . c30497_6e5i 1 . 9 . 3829 . 1 1 16 ARG HG2 H 0.356 -5.119 -5.234 . . . 1.0 . . . . . . . . . . . . A . 16 ARG HG2 . . . . . . . . . c30497_6e5i 1 . 9 . 3830 . 1 1 16 ARG HG3 H 1.304 -5.499 -3.791 . . . 1.0 . . . . . . . . . . . . A . 16 ARG HG3 . . . . . . . . . c30497_6e5i 1 . 9 . 3831 . 1 1 16 ARG HH11 H 0.152 -9.572 -4.219 . . . 1.0 . . . . . . . . . . . . A . 16 ARG HH11 . . . . . . . . . c30497_6e5i 1 . 9 . 3832 . 1 1 16 ARG HH12 H 1.208 -10.844 -4.749 . . . 1.0 . . . . . . . . . . . . A . 16 ARG HH12 . . . . . . . . . c30497_6e5i 1 . 9 . 3833 . 1 1 16 ARG HH21 H 3.021 -10.357 -6.070 . . . 1.0 . . . . . . . . . . . . A . 16 ARG HH21 . . . . . . . . . c30497_6e5i 1 . 9 . 3834 . 1 1 16 ARG HH22 H 3.357 -8.716 -6.528 . . . 1.0 . . . . . . . . . . . . A . 16 ARG HH22 . . . . . . . . . c30497_6e5i 1 . 9 . 3835 . 1 1 16 ARG N N 0.466 -3.387 -2.337 . . . 1.0 . . . . . . . . . . . . A . 16 ARG N . . . . . . . . . c30497_6e5i 1 . 9 . 3836 . 1 1 16 ARG NE N 1.393 -7.687 -5.340 . . . 1.0 . . . . . . . . . . . . A . 16 ARG NE . . . . . . . . . c30497_6e5i 1 . 9 . 3837 . 1 1 16 ARG NH1 N 0.962 -9.869 -4.731 . . . 1.0 . . . . . . . . . . . . A . 16 ARG NH1 . . . . . . . . . c30497_6e5i 1 . 9 . 3838 . 1 1 16 ARG NH2 N 2.781 -9.383 -6.046 . . . 1.0 . . . . . . . . . . . . A . 16 ARG NH2 . . . . . . . . . c30497_6e5i 1 . 9 . 3839 . 1 1 16 ARG O O -1.872 -3.455 -0.960 . . . 1.0 . . . . . . . . . . . . A . 16 ARG O . . . . . . . . . c30497_6e5i 1 . 9 . 3840 . 1 1 17 CYS C C -5.365 -3.838 -2.449 . . . 1.0 . . . . . . . . . . . . A . 17 CYS C . . . . . . . . . c30497_6e5i 1 . 9 . 3841 . 1 1 17 CYS CA C -4.294 -2.816 -2.104 . . . 1.0 . . . . . . . . . . . . A . 17 CYS CA . . . . . . . . . c30497_6e5i 1 . 9 . 3842 . 1 1 17 CYS CB C -4.766 -1.403 -2.445 . . . 1.0 . . . . . . . . . . . . A . 17 CYS CB . . . . . . . . . c30497_6e5i 1 . 9 . 3843 . 1 1 17 CYS H H -3.080 -3.106 -3.801 . . . 1.0 . . . . . . . . . . . . A . 17 CYS H . . . . . . . . . c30497_6e5i 1 . 9 . 3844 . 1 1 17 CYS HA H -4.080 -2.875 -1.045 . . . 1.0 . . . . . . . . . . . . A . 17 CYS HA . . . . . . . . . c30497_6e5i 1 . 9 . 3845 . 1 1 17 CYS HB2 H -4.984 -1.353 -3.499 . . . 1.0 . . . . . . . . . . . . A . 17 CYS HB2 . . . . . . . . . c30497_6e5i 1 . 9 . 3846 . 1 1 17 CYS HB3 H -5.661 -1.181 -1.883 . . . 1.0 . . . . . . . . . . . . A . 17 CYS HB3 . . . . . . . . . c30497_6e5i 1 . 9 . 3847 . 1 1 17 CYS N N -3.073 -3.120 -2.822 . . . 1.0 . . . . . . . . . . . . A . 17 CYS N . . . . . . . . . c30497_6e5i 1 . 9 . 3848 . 1 1 17 CYS O O -5.705 -4.026 -3.618 . . . 1.0 . . . . . . . . . . . . A . 17 CYS O . . . . . . . . . c30497_6e5i 1 . 9 . 3849 . 1 1 17 CYS SG S -3.530 -0.113 -2.070 . . . 1.0 . . . . . . . . . . . . A . 17 CYS SG . . . . . . . . . c30497_6e5i 1 . 9 . 3850 . 1 1 18 ASP C C -8.087 -5.180 -0.732 . . . 1.0 . . . . . . . . . . . . A . 18 ASP C . . . . . . . . . c30497_6e5i 1 . 9 . 3851 . 1 1 18 ASP CA C -6.907 -5.515 -1.630 . . . 1.0 . . . . . . . . . . . . A . 18 ASP CA . . . . . . . . . c30497_6e5i 1 . 9 . 3852 . 1 1 18 ASP CB C -6.376 -6.913 -1.309 . . . 1.0 . . . . . . . . . . . . A . 18 ASP CB . . . . . . . . . c30497_6e5i 1 . 9 . 3853 . 1 1 18 ASP CG C -7.280 -8.016 -1.820 . . . 1.0 . . . . . . . . . . . . A . 18 ASP CG . . . . . . . . . c30497_6e5i 1 . 9 . 3854 . 1 1 18 ASP H H -5.544 -4.339 -0.528 . . . 1.0 . . . . . . . . . . . . A . 18 ASP H . . . . . . . . . c30497_6e5i 1 . 9 . 3855 . 1 1 18 ASP HA H -7.223 -5.480 -2.660 . . . 1.0 . . . . . . . . . . . . A . 18 ASP HA . . . . . . . . . c30497_6e5i 1 . 9 . 3856 . 1 1 18 ASP HB2 H -5.404 -7.032 -1.759 . . . 1.0 . . . . . . . . . . . . A . 18 ASP HB2 . . . . . . . . . c30497_6e5i 1 . 9 . 3857 . 1 1 18 ASP HB3 H -6.286 -7.016 -0.237 . . . 1.0 . . . . . . . . . . . . A . 18 ASP HB3 . . . . . . . . . c30497_6e5i 1 . 9 . 3858 . 1 1 18 ASP N N -5.869 -4.519 -1.438 . . . 1.0 . . . . . . . . . . . . A . 18 ASP N . . . . . . . . . c30497_6e5i 1 . 9 . 3859 . 1 1 18 ASP O O -8.188 -5.677 0.395 . . . 1.0 . . . . . . . . . . . . A . 18 ASP O . . . . . . . . . c30497_6e5i 1 . 9 . 3860 . 1 1 18 ASP OD1 O -8.183 -8.448 -1.069 . . . 1.0 . . . . . . . . . . . . A . 18 ASP OD1 . . . . . . . . . c30497_6e5i 1 . 9 . 3861 . 1 1 18 ASP OD2 O -7.110 -8.447 -2.980 . . . 1.0 . . . . . . . . . . . . A . 18 ASP OD2 . . . . . . . . . c30497_6e5i 1 . 9 . 3862 . 1 1 19 DPR C C -9.556 -3.086 0.843 . . . 1.0 . . . . . . . . . . . . A . 19 DPR C . . . . . . . . . c30497_6e5i 1 . 9 . 3863 . 1 1 19 DPR CA C -10.086 -3.793 -0.403 . . . 1.0 . . . . . . . . . . . . A . 19 DPR CA . . . . . . . . . c30497_6e5i 1 . 9 . 3864 . 1 1 19 DPR CB C -10.795 -2.800 -1.325 . . . 1.0 . . . . . . . . . . . . A . 19 DPR CB . . . . . . . . . c30497_6e5i 1 . 9 . 3865 . 1 1 19 DPR CD C -9.014 -3.777 -2.585 . . . 1.0 . . . . . . . . . . . . A . 19 DPR CD . . . . . . . . . c30497_6e5i 1 . 9 . 3866 . 1 1 19 DPR CG C -10.394 -3.194 -2.703 . . . 1.0 . . . . . . . . . . . . A . 19 DPR CG . . . . . . . . . c30497_6e5i 1 . 9 . 3867 . 1 1 19 DPR HA H -10.774 -4.569 -0.116 . . . 1.0 . . . . . . . . . . . . A . 19 DPR HA . . . . . . . . . c30497_6e5i 1 . 9 . 3868 . 1 1 19 DPR HB2 H -10.472 -1.798 -1.093 . . . 1.0 . . . . . . . . . . . . A . 19 DPR HB2 . . . . . . . . . c30497_6e5i 1 . 9 . 3869 . 1 1 19 DPR HB3 H -11.862 -2.881 -1.187 . . . 1.0 . . . . . . . . . . . . A . 19 DPR HB3 . . . . . . . . . c30497_6e5i 1 . 9 . 3870 . 1 1 19 DPR HD2 H -8.264 -3.008 -2.712 . . . 1.0 . . . . . . . . . . . . A . 19 DPR HD2 . . . . . . . . . c30497_6e5i 1 . 9 . 3871 . 1 1 19 DPR HD3 H -8.877 -4.564 -3.310 . . . 1.0 . . . . . . . . . . . . A . 19 DPR HD3 . . . . . . . . . c30497_6e5i 1 . 9 . 3872 . 1 1 19 DPR HG2 H -10.380 -2.325 -3.344 . . . 1.0 . . . . . . . . . . . . A . 19 DPR HG2 . . . . . . . . . c30497_6e5i 1 . 9 . 3873 . 1 1 19 DPR HG3 H -11.080 -3.934 -3.088 . . . 1.0 . . . . . . . . . . . . A . 19 DPR HG3 . . . . . . . . . c30497_6e5i 1 . 9 . 3874 . 1 1 19 DPR N N -8.988 -4.314 -1.214 . . . 1.0 . . . . . . . . . . . . A . 19 DPR N . . . . . . . . . c30497_6e5i 1 . 9 . 3875 . 1 1 19 DPR O O -8.759 -2.154 0.746 . . . 1.0 . . . . . . . . . . . . A . 19 DPR O . . . . . . . . . c30497_6e5i 1 . 9 . 3876 . 1 1 20 PRO C C -8.137 -3.461 3.717 . . . 1.0 . . . . . . . . . . . . A . 20 PRO C . . . . . . . . . c30497_6e5i 1 . 9 . 3877 . 1 1 20 PRO CA C -9.522 -2.964 3.297 . . . 1.0 . . . . . . . . . . . . A . 20 PRO CA . . . . . . . . . c30497_6e5i 1 . 9 . 3878 . 1 1 20 PRO CB C -10.580 -3.450 4.285 . . . 1.0 . . . . . . . . . . . . A . 20 PRO CB . . . . . . . . . c30497_6e5i 1 . 9 . 3879 . 1 1 20 PRO CD C -10.959 -4.615 2.230 . . . 1.0 . . . . . . . . . . . . A . 20 PRO CD . . . . . . . . . c30497_6e5i 1 . 9 . 3880 . 1 1 20 PRO CG C -11.039 -4.751 3.727 . . . 1.0 . . . . . . . . . . . . A . 20 PRO CG . . . . . . . . . c30497_6e5i 1 . 9 . 3881 . 1 1 20 PRO HA H -9.523 -1.886 3.270 . . . 1.0 . . . . . . . . . . . . A . 20 PRO HA . . . . . . . . . c30497_6e5i 1 . 9 . 3882 . 1 1 20 PRO HB2 H -10.136 -3.570 5.261 . . . 1.0 . . . . . . . . . . . . A . 20 PRO HB2 . . . . . . . . . c30497_6e5i 1 . 9 . 3883 . 1 1 20 PRO HB3 H -11.387 -2.736 4.334 . . . 1.0 . . . . . . . . . . . . A . 20 PRO HB3 . . . . . . . . . c30497_6e5i 1 . 9 . 3884 . 1 1 20 PRO HD2 H -10.615 -5.536 1.783 . . . 1.0 . . . . . . . . . . . . A . 20 PRO HD2 . . . . . . . . . c30497_6e5i 1 . 9 . 3885 . 1 1 20 PRO HD3 H -11.921 -4.336 1.830 . . . 1.0 . . . . . . . . . . . . A . 20 PRO HD3 . . . . . . . . . c30497_6e5i 1 . 9 . 3886 . 1 1 20 PRO HG2 H -10.391 -5.546 4.066 . . . 1.0 . . . . . . . . . . . . A . 20 PRO HG2 . . . . . . . . . c30497_6e5i 1 . 9 . 3887 . 1 1 20 PRO HG3 H -12.057 -4.942 4.030 . . . 1.0 . . . . . . . . . . . . A . 20 PRO HG3 . . . . . . . . . c30497_6e5i 1 . 9 . 3888 . 1 1 20 PRO N N -9.976 -3.535 2.029 . . . 1.0 . . . . . . . . . . . . A . 20 PRO N . . . . . . . . . c30497_6e5i 1 . 9 . 3889 . 1 1 20 PRO O O -7.590 -3.014 4.726 . . . 1.0 . . . . . . . . . . . . A . 20 PRO O . . . . . . . . . c30497_6e5i 1 . 9 . 3890 . 1 1 21 ARG C C -5.188 -4.428 2.372 . . . 1.0 . . . . . . . . . . . . A . 21 ARG C . . . . . . . . . c30497_6e5i 1 . 9 . 3891 . 1 1 21 ARG CA C -6.272 -4.953 3.297 . . . 1.0 . . . . . . . . . . . . A . 21 ARG CA . . . . . . . . . c30497_6e5i 1 . 9 . 3892 . 1 1 21 ARG CB C -6.316 -6.480 3.223 . . . 1.0 . . . . . . . . . . . . A . 21 ARG CB . . . . . . . . . c30497_6e5i 1 . 9 . 3893 . 1 1 21 ARG CD C -7.160 -6.785 5.582 . . . 1.0 . . . . . . . . . . . . A . 21 ARG CD . . . . . . . . . c30497_6e5i 1 . 9 . 3894 . 1 1 21 ARG CG C -7.374 -7.111 4.113 . . . 1.0 . . . . . . . . . . . . A . 21 ARG CG . . . . . . . . . c30497_6e5i 1 . 9 . 3895 . 1 1 21 ARG CZ C -8.573 -6.911 7.607 . . . 1.0 . . . . . . . . . . . . A . 21 ARG CZ . . . . . . . . . c30497_6e5i 1 . 9 . 3896 . 1 1 21 ARG H H -8.014 -4.666 2.118 . . . 1.0 . . . . . . . . . . . . A . 21 ARG H . . . . . . . . . c30497_6e5i 1 . 9 . 3897 . 1 1 21 ARG HA H -6.041 -4.656 4.307 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HA . . . . . . . . . c30497_6e5i 1 . 9 . 3898 . 1 1 21 ARG HB2 H -6.516 -6.771 2.202 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HB2 . . . . . . . . . c30497_6e5i 1 . 9 . 3899 . 1 1 21 ARG HB3 H -5.352 -6.870 3.516 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HB3 . . . . . . . . . c30497_6e5i 1 . 9 . 3900 . 1 1 21 ARG HD2 H -6.193 -7.156 5.885 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HD2 . . . . . . . . . c30497_6e5i 1 . 9 . 3901 . 1 1 21 ARG HD3 H -7.190 -5.712 5.710 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HD3 . . . . . . . . . c30497_6e5i 1 . 9 . 3902 . 1 1 21 ARG HE H -8.621 -8.210 6.083 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HE . . . . . . . . . c30497_6e5i 1 . 9 . 3903 . 1 1 21 ARG HG2 H -8.342 -6.741 3.814 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HG2 . . . . . . . . . c30497_6e5i 1 . 9 . 3904 . 1 1 21 ARG HG3 H -7.342 -8.182 3.983 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HG3 . . . . . . . . . c30497_6e5i 1 . 9 . 3905 . 1 1 21 ARG HH11 H -7.261 -5.363 7.614 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HH11 . . . . . . . . . c30497_6e5i 1 . 9 . 3906 . 1 1 21 ARG HH12 H -8.298 -5.465 9.002 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HH12 . . . . . . . . . c30497_6e5i 1 . 9 . 3907 . 1 1 21 ARG HH21 H -9.968 -8.349 7.915 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HH21 . . . . . . . . . c30497_6e5i 1 . 9 . 3908 . 1 1 21 ARG HH22 H -9.827 -7.166 9.176 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HH22 . . . . . . . . . c30497_6e5i 1 . 9 . 3909 . 1 1 21 ARG N N -7.567 -4.381 2.948 . . . 1.0 . . . . . . . . . . . . A . 21 ARG N . . . . . . . . . c30497_6e5i 1 . 9 . 3910 . 1 1 21 ARG NE N -8.188 -7.392 6.424 . . . 1.0 . . . . . . . . . . . . A . 21 ARG NE . . . . . . . . . c30497_6e5i 1 . 9 . 3911 . 1 1 21 ARG NH1 N -7.998 -5.827 8.115 . . . 1.0 . . . . . . . . . . . . A . 21 ARG NH1 . . . . . . . . . c30497_6e5i 1 . 9 . 3912 . 1 1 21 ARG NH2 N -9.534 -7.522 8.286 . . . 1.0 . . . . . . . . . . . . A . 21 ARG NH2 . . . . . . . . . c30497_6e5i 1 . 9 . 3913 . 1 1 21 ARG O O -5.467 -4.000 1.255 . . . 1.0 . . . . . . . . . . . . A . 21 ARG O . . . . . . . . . c30497_6e5i 1 . 9 . 3914 . 1 1 22 TYR C C -1.661 -4.971 2.195 . . . 1.0 . . . . . . . . . . . . A . 22 TYR C . . . . . . . . . c30497_6e5i 1 . 9 . 3915 . 1 1 22 TYR CA C -2.821 -4.000 2.057 . . . 1.0 . . . . . . . . . . . . A . 22 TYR CA . . . . . . . . . c30497_6e5i 1 . 9 . 3916 . 1 1 22 TYR CB C -2.375 -2.606 2.506 . . . 1.0 . . . . . . . . . . . . A . 22 TYR CB . . . . . . . . . c30497_6e5i 1 . 9 . 3917 . 1 1 22 TYR CD1 C -3.624 -0.813 1.260 . . . 1.0 . . . . . . . . . . . . A . 22 TYR CD1 . . . . . . . . . c30497_6e5i 1 . 9 . 3918 . 1 1 22 TYR CD2 C -4.315 -1.333 3.480 . . . 1.0 . . . . . . . . . . . . A . 22 TYR CD2 . . . . . . . . . c30497_6e5i 1 . 9 . 3919 . 1 1 22 TYR CE1 C -4.612 0.142 1.170 . . . 1.0 . . . . . . . . . . . . A . 22 TYR CE1 . . . . . . . . . c30497_6e5i 1 . 9 . 3920 . 1 1 22 TYR CE2 C -5.307 -0.378 3.399 . . . 1.0 . . . . . . . . . . . . A . 22 TYR CE2 . . . . . . . . . c30497_6e5i 1 . 9 . 3921 . 1 1 22 TYR CG C -3.459 -1.564 2.415 . . . 1.0 . . . . . . . . . . . . A . 22 TYR CG . . . . . . . . . c30497_6e5i 1 . 9 . 3922 . 1 1 22 TYR CZ C -5.454 0.355 2.255 . . . 1.0 . . . . . . . . . . . . A . 22 TYR CZ . . . . . . . . . c30497_6e5i 1 . 9 . 3923 . 1 1 22 TYR H H -3.795 -4.805 3.746 . . . 1.0 . . . . . . . . . . . . A . 22 TYR H . . . . . . . . . c30497_6e5i 1 . 9 . 3924 . 1 1 22 TYR HA H -3.126 -3.958 1.020 . . . 1.0 . . . . . . . . . . . . A . 22 TYR HA . . . . . . . . . c30497_6e5i 1 . 9 . 3925 . 1 1 22 TYR HB2 H -2.050 -2.652 3.532 . . . 1.0 . . . . . . . . . . . . A . 22 TYR HB2 . . . . . . . . . c30497_6e5i 1 . 9 . 3926 . 1 1 22 TYR HB3 H -1.552 -2.282 1.888 . . . 1.0 . . . . . . . . . . . . A . 22 TYR HB3 . . . . . . . . . c30497_6e5i 1 . 9 . 3927 . 1 1 22 TYR HD1 H -2.962 -0.983 0.425 . . . 1.0 . . . . . . . . . . . . A . 22 TYR HD1 . . . . . . . . . c30497_6e5i 1 . 9 . 3928 . 1 1 22 TYR HD2 H -4.199 -1.911 4.384 . . . 1.0 . . . . . . . . . . . . A . 22 TYR HD2 . . . . . . . . . c30497_6e5i 1 . 9 . 3929 . 1 1 22 TYR HE1 H -4.723 0.717 0.264 . . . 1.0 . . . . . . . . . . . . A . 22 TYR HE1 . . . . . . . . . c30497_6e5i 1 . 9 . 3930 . 1 1 22 TYR HE2 H -5.964 -0.212 4.239 . . . 1.0 . . . . . . . . . . . . A . 22 TYR HE2 . . . . . . . . . c30497_6e5i 1 . 9 . 3931 . 1 1 22 TYR HH H -6.447 1.840 2.950 . . . 1.0 . . . . . . . . . . . . A . 22 TYR HH . . . . . . . . . c30497_6e5i 1 . 9 . 3932 . 1 1 22 TYR N N -3.953 -4.459 2.844 . . . 1.0 . . . . . . . . . . . . A . 22 TYR N . . . . . . . . . c30497_6e5i 1 . 9 . 3933 . 1 1 22 TYR O O -1.435 -5.527 3.270 . . . 1.0 . . . . . . . . . . . . A . 22 TYR O . . . . . . . . . c30497_6e5i 1 . 9 . 3934 . 1 1 22 TYR OH O -6.447 1.301 2.149 . . . 1.0 . . . . . . . . . . . . A . 22 TYR OH . . . . . . . . . c30497_6e5i 1 . 9 . 3935 . 1 1 23 GLU C C 1.494 -5.211 0.957 . . . 1.0 . . . . . . . . . . . . A . 23 GLU C . . . . . . . . . c30497_6e5i 1 . 9 . 3936 . 1 1 23 GLU CA C 0.230 -6.037 1.108 . . . 1.0 . . . . . . . . . . . . A . 23 GLU CA . . . . . . . . . c30497_6e5i 1 . 9 . 3937 . 1 1 23 GLU CB C 0.149 -7.051 -0.032 . . . 1.0 . . . . . . . . . . . . A . 23 GLU CB . . . . . . . . . c30497_6e5i 1 . 9 . 3938 . 1 1 23 GLU CD C -0.340 -9.162 1.252 . . . 1.0 . . . . . . . . . . . . A . 23 GLU CD . . . . . . . . . c30497_6e5i 1 . 9 . 3939 . 1 1 23 GLU CG C -0.829 -8.187 0.205 . . . 1.0 . . . . . . . . . . . . A . 23 GLU CG . . . . . . . . . c30497_6e5i 1 . 9 . 3940 . 1 1 23 GLU H H -1.192 -4.705 0.280 . . . 1.0 . . . . . . . . . . . . A . 23 GLU H . . . . . . . . . c30497_6e5i 1 . 9 . 3941 . 1 1 23 GLU HA H 0.261 -6.562 2.051 . . . 1.0 . . . . . . . . . . . . A . 23 GLU HA . . . . . . . . . c30497_6e5i 1 . 9 . 3942 . 1 1 23 GLU HB2 H -0.146 -6.537 -0.929 . . . 1.0 . . . . . . . . . . . . A . 23 GLU HB2 . . . . . . . . . c30497_6e5i 1 . 9 . 3943 . 1 1 23 GLU HB3 H 1.127 -7.478 -0.182 . . . 1.0 . . . . . . . . . . . . A . 23 GLU HB3 . . . . . . . . . c30497_6e5i 1 . 9 . 3944 . 1 1 23 GLU HG2 H -1.771 -7.773 0.533 . . . 1.0 . . . . . . . . . . . . A . 23 GLU HG2 . . . . . . . . . c30497_6e5i 1 . 9 . 3945 . 1 1 23 GLU HG3 H -0.975 -8.720 -0.724 . . . 1.0 . . . . . . . . . . . . A . 23 GLU HG3 . . . . . . . . . c30497_6e5i 1 . 9 . 3946 . 1 1 23 GLU N N -0.939 -5.170 1.110 . . . 1.0 . . . . . . . . . . . . A . 23 GLU N . . . . . . . . . c30497_6e5i 1 . 9 . 3947 . 1 1 23 GLU O O 1.711 -4.584 -0.078 . . . 1.0 . . . . . . . . . . . . A . 23 GLU O . . . . . . . . . c30497_6e5i 1 . 9 . 3948 . 1 1 23 GLU OE1 O -0.965 -9.247 2.327 . . . 1.0 . . . . . . . . . . . . A . 23 GLU OE1 . . . . . . . . . c30497_6e5i 1 . 9 . 3949 . 1 1 23 GLU OE2 O 0.679 -9.848 1.002 . . . 1.0 . . . . . . . . . . . . A . 23 GLU OE2 . . . . . . . . . c30497_6e5i 1 . 9 . 3950 . 1 1 24 VAL C C 4.730 -5.470 1.760 . . . 1.0 . . . . . . . . . . . . A . 24 VAL C . . . . . . . . . c30497_6e5i 1 . 9 . 3951 . 1 1 24 VAL CA C 3.583 -4.488 1.937 . . . 1.0 . . . . . . . . . . . . A . 24 VAL CA . . . . . . . . . c30497_6e5i 1 . 9 . 3952 . 1 1 24 VAL CB C 3.821 -3.638 3.202 . . . 1.0 . . . . . . . . . . . . A . 24 VAL CB . . . . . . . . . c30497_6e5i 1 . 9 . 3953 . 1 1 24 VAL CG1 C 5.184 -2.963 3.145 . . . 1.0 . . . . . . . . . . . . A . 24 VAL CG1 . . . . . . . . . c30497_6e5i 1 . 9 . 3954 . 1 1 24 VAL CG2 C 2.720 -2.601 3.360 . . . 1.0 . . . . . . . . . . . . A . 24 VAL CG2 . . . . . . . . . c30497_6e5i 1 . 9 . 3955 . 1 1 24 VAL H H 2.080 -5.698 2.799 . . . 1.0 . . . . . . . . . . . . A . 24 VAL H . . . . . . . . . c30497_6e5i 1 . 9 . 3956 . 1 1 24 VAL HA H 3.554 -3.828 1.081 . . . 1.0 . . . . . . . . . . . . A . 24 VAL HA . . . . . . . . . c30497_6e5i 1 . 9 . 3957 . 1 1 24 VAL HB H 3.800 -4.290 4.062 . . . 1.0 . . . . . . . . . . . . A . 24 VAL HB . . . . . . . . . c30497_6e5i 1 . 9 . 3958 . 1 1 24 VAL HG11 H 5.228 -2.312 2.285 . . . 1.0 . . . . . . . . . . . . A . 24 VAL HG11 . . . . . . . . . c30497_6e5i 1 . 9 . 3959 . 1 1 24 VAL HG12 H 5.954 -3.717 3.065 . . . 1.0 . . . . . . . . . . . . A . 24 VAL HG12 . . . . . . . . . c30497_6e5i 1 . 9 . 3960 . 1 1 24 VAL HG13 H 5.338 -2.384 4.043 . . . 1.0 . . . . . . . . . . . . A . 24 VAL HG13 . . . . . . . . . c30497_6e5i 1 . 9 . 3961 . 1 1 24 VAL HG21 H 2.725 -1.940 2.506 . . . 1.0 . . . . . . . . . . . . A . 24 VAL HG21 . . . . . . . . . c30497_6e5i 1 . 9 . 3962 . 1 1 24 VAL HG22 H 2.891 -2.028 4.260 . . . 1.0 . . . . . . . . . . . . A . 24 VAL HG22 . . . . . . . . . c30497_6e5i 1 . 9 . 3963 . 1 1 24 VAL HG23 H 1.764 -3.098 3.425 . . . 1.0 . . . . . . . . . . . . A . 24 VAL HG23 . . . . . . . . . c30497_6e5i 1 . 9 . 3964 . 1 1 24 VAL N N 2.320 -5.204 1.987 . . . 1.0 . . . . . . . . . . . . A . 24 VAL N . . . . . . . . . c30497_6e5i 1 . 9 . 3965 . 1 1 24 VAL O O 5.115 -6.174 2.694 . . . 1.0 . . . . . . . . . . . . A . 24 VAL O . . . . . . . . . c30497_6e5i 1 . 9 . 3966 . 1 1 25 HIS C C 7.629 -5.707 -0.010 . . . 1.0 . . . . . . . . . . . . A . 25 HIS C . . . . . . . . . c30497_6e5i 1 . 9 . 3967 . 1 1 25 HIS CA C 6.322 -6.449 0.217 . . . 1.0 . . . . . . . . . . . . A . 25 HIS CA . . . . . . . . . c30497_6e5i 1 . 9 . 3968 . 1 1 25 HIS CB C 5.947 -7.264 -1.022 . . . 1.0 . . . . . . . . . . . . A . 25 HIS CB . . . . . . . . . c30497_6e5i 1 . 9 . 3969 . 1 1 25 HIS CD2 C 3.606 -8.156 -0.353 . . . 1.0 . . . . . . . . . . . . A . 25 HIS CD2 . . . . . . . . . c30497_6e5i 1 . 9 . 3970 . 1 1 25 HIS CE1 C 3.977 -10.292 -0.646 . . . 1.0 . . . . . . . . . . . . A . 25 HIS CE1 . . . . . . . . . c30497_6e5i 1 . 9 . 3971 . 1 1 25 HIS CG C 4.887 -8.292 -0.768 . . . 1.0 . . . . . . . . . . . . A . 25 HIS CG . . . . . . . . . c30497_6e5i 1 . 9 . 3972 . 1 1 25 HIS H H 4.926 -4.903 -0.141 . . . 1.0 . . . . . . . . . . . . A . 25 HIS H . . . . . . . . . c30497_6e5i 1 . 9 . 3973 . 1 1 25 HIS HA H 6.447 -7.121 1.052 . . . 1.0 . . . . . . . . . . . . A . 25 HIS HA . . . . . . . . . c30497_6e5i 1 . 9 . 3974 . 1 1 25 HIS HB2 H 5.582 -6.595 -1.784 . . . 1.0 . . . . . . . . . . . . A . 25 HIS HB2 . . . . . . . . . c30497_6e5i 1 . 9 . 3975 . 1 1 25 HIS HB3 H 6.824 -7.772 -1.389 . . . 1.0 . . . . . . . . . . . . A . 25 HIS HB3 . . . . . . . . . c30497_6e5i 1 . 9 . 3976 . 1 1 25 HIS HD1 H 5.922 -10.063 -1.245 . . . 1.0 . . . . . . . . . . . . A . 25 HIS HD1 . . . . . . . . . c30497_6e5i 1 . 9 . 3977 . 1 1 25 HIS HD2 H 3.105 -7.228 -0.122 . . . 1.0 . . . . . . . . . . . . A . 25 HIS HD2 . . . . . . . . . c30497_6e5i 1 . 9 . 3978 . 1 1 25 HIS HE1 H 3.841 -11.361 -0.693 . . . 1.0 . . . . . . . . . . . . A . 25 HIS HE1 . . . . . . . . . c30497_6e5i 1 . 9 . 3979 . 1 1 25 HIS HE2 H 2.209 -9.639 0.172 . . . 1.0 . . . . . . . . . . . . A . 25 HIS HE2 . . . . . . . . . c30497_6e5i 1 . 9 . 3980 . 1 1 25 HIS N N 5.259 -5.519 0.552 . . . 1.0 . . . . . . . . . . . . A . 25 HIS N . . . . . . . . . c30497_6e5i 1 . 9 . 3981 . 1 1 25 HIS ND1 N 5.087 -9.642 -0.943 . . . 1.0 . . . . . . . . . . . . A . 25 HIS ND1 . . . . . . . . . c30497_6e5i 1 . 9 . 3982 . 1 1 25 HIS NE2 N 3.061 -9.413 -0.283 . . . 1.0 . . . . . . . . . . . . A . 25 HIS NE2 . . . . . . . . . c30497_6e5i 1 . 9 . 3983 . 1 1 25 HIS O O 7.822 -5.060 -1.039 . . . 1.0 . . . . . . . . . . . . A . 25 HIS O . . . . . . . . . c30497_6e5i 1 . 9 . 3984 . 1 1 26 CYS C C 10.856 -6.137 0.394 . . . 1.0 . . . . . . . . . . . . A . 26 CYS C . . . . . . . . . c30497_6e5i 1 . 9 . 3985 . 1 1 26 CYS CA C 9.808 -5.142 0.872 . . . 1.0 . . . . . . . . . . . . A . 26 CYS CA . . . . . . . . . c30497_6e5i 1 . 9 . 3986 . 1 1 26 CYS CB C 10.206 -4.559 2.229 . . . 1.0 . . . . . . . . . . . . A . 26 CYS CB . . . . . . . . . c30497_6e5i 1 . 9 . 3987 . 1 1 26 CYS H H 8.289 -6.290 1.773 . . . 1.0 . . . . . . . . . . . . A . 26 CYS H . . . . . . . . . c30497_6e5i 1 . 9 . 3988 . 1 1 26 CYS HA H 9.731 -4.340 0.153 . . . 1.0 . . . . . . . . . . . . A . 26 CYS HA . . . . . . . . . c30497_6e5i 1 . 9 . 3989 . 1 1 26 CYS HB2 H 10.233 -5.354 2.959 . . . 1.0 . . . . . . . . . . . . A . 26 CYS HB2 . . . . . . . . . c30497_6e5i 1 . 9 . 3990 . 1 1 26 CYS HB3 H 11.188 -4.116 2.148 . . . 1.0 . . . . . . . . . . . . A . 26 CYS HB3 . . . . . . . . . c30497_6e5i 1 . 9 . 3991 . 1 1 26 CYS N N 8.512 -5.784 0.965 . . . 1.0 . . . . . . . . . . . . A . 26 CYS N . . . . . . . . . c30497_6e5i 1 . 9 . 3992 . 1 1 26 CYS O O 11.593 -6.723 1.189 . . . 1.0 . . . . . . . . . . . . A . 26 CYS O . . . . . . . . . c30497_6e5i 1 . 9 . 3993 . 1 1 26 CYS SG S 9.066 -3.278 2.845 . . . 1.0 . . . . . . . . . . . . A . 26 CYS SG . . . . . . . . . c30497_6e5i 1 . 9 . 3994 . 1 1 27 NH2 HN1 H 10.290 -5.836 -1.485 . . . 1.0 . . . . . . . . . . . . A . 27 NH2 HN1 . . . . . . . . . c30497_6e5i 1 . 9 . 3995 . 1 1 27 NH2 HN2 H 11.564 -6.980 -1.252 . . . 1.0 . . . . . . . . . . . . A . 27 NH2 HN2 . . . . . . . . . c30497_6e5i 1 . 9 . 3996 . 1 1 27 NH2 N N 10.911 -6.340 -0.911 . . . 1.0 . . . . . . . . . . . . A . 27 NH2 N . . . . . . . . . c30497_6e5i 1 . 10 . 3997 . 1 1 1 ASN C C -5.541 6.708 -4.462 . . . 1.0 . . . . . . . . . . . . A . 1 ASN C . . . . . . . . . c30497_6e5i 1 . 10 . 3998 . 1 1 1 ASN CA C -6.827 6.100 -5.016 . . . 1.0 . . . . . . . . . . . . A . 1 ASN CA . . . . . . . . . c30497_6e5i 1 . 10 . 3999 . 1 1 1 ASN CB C -6.763 6.093 -6.548 . . . 1.0 . . . . . . . . . . . . A . 1 ASN CB . . . . . . . . . c30497_6e5i 1 . 10 . 4000 . 1 1 1 ASN CG C -6.543 7.477 -7.138 . . . 1.0 . . . . . . . . . . . . A . 1 ASN CG . . . . . . . . . c30497_6e5i 1 . 10 . 4001 . 1 1 1 ASN H1 H -8.881 6.429 -4.966 . . . 1.0 . . . . . . . . . . . . A . 1 ASN H1 . . . . . . . . . c30497_6e5i 1 . 10 . 4002 . 1 1 1 ASN H2 H -7.960 7.842 -4.841 . . . 1.0 . . . . . . . . . . . . A . 1 ASN H2 . . . . . . . . . c30497_6e5i 1 . 10 . 4003 . 1 1 1 ASN H3 H -8.094 6.795 -3.517 . . . 1.0 . . . . . . . . . . . . A . 1 ASN H3 . . . . . . . . . c30497_6e5i 1 . 10 . 4004 . 1 1 1 ASN HA H -6.907 5.084 -4.663 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HA . . . . . . . . . c30497_6e5i 1 . 10 . 4005 . 1 1 1 ASN HB2 H -5.951 5.458 -6.864 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HB2 . . . . . . . . . c30497_6e5i 1 . 10 . 4006 . 1 1 1 ASN HB3 H -7.692 5.703 -6.936 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HB3 . . . . . . . . . c30497_6e5i 1 . 10 . 4007 . 1 1 1 ASN HD21 H -5.556 6.690 -8.673 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HD21 . . . . . . . . . c30497_6e5i 1 . 10 . 4008 . 1 1 1 ASN HD22 H -5.719 8.413 -8.685 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HD22 . . . . . . . . . c30497_6e5i 1 . 10 . 4009 . 1 1 1 ASN N N -8.021 6.844 -4.552 . . . 1.0 . . . . . . . . . . . . A . 1 ASN N . . . . . . . . . c30497_6e5i 1 . 10 . 4010 . 1 1 1 ASN ND2 N -5.872 7.532 -8.277 . . . 1.0 . . . . . . . . . . . . A . 1 ASN ND2 . . . . . . . . . c30497_6e5i 1 . 10 . 4011 . 1 1 1 ASN O O -4.442 6.265 -4.799 . . . 1.0 . . . . . . . . . . . . A . 1 ASN O . . . . . . . . . c30497_6e5i 1 . 10 . 4012 . 1 1 1 ASN OD1 O -6.967 8.487 -6.572 . . . 1.0 . . . . . . . . . . . . A . 1 ASN OD1 . . . . . . . . . c30497_6e5i 1 . 10 . 4013 . 1 1 2 ASP C C -3.877 7.645 -1.915 . . . 1.0 . . . . . . . . . . . . A . 2 ASP C . . . . . . . . . c30497_6e5i 1 . 10 . 4014 . 1 1 2 ASP CA C -4.491 8.404 -3.084 . . . 1.0 . . . . . . . . . . . . A . 2 ASP CA . . . . . . . . . c30497_6e5i 1 . 10 . 4015 . 1 1 2 ASP CB C -4.822 9.836 -2.655 . . . 1.0 . . . . . . . . . . . . A . 2 ASP CB . . . . . . . . . c30497_6e5i 1 . 10 . 4016 . 1 1 2 ASP CG C -5.766 9.901 -1.472 . . . 1.0 . . . . . . . . . . . . A . 2 ASP CG . . . . . . . . . c30497_6e5i 1 . 10 . 4017 . 1 1 2 ASP H H -6.561 8.009 -3.330 . . . 1.0 . . . . . . . . . . . . A . 2 ASP H . . . . . . . . . c30497_6e5i 1 . 10 . 4018 . 1 1 2 ASP HA H -3.762 8.444 -3.880 . . . 1.0 . . . . . . . . . . . . A . 2 ASP HA . . . . . . . . . c30497_6e5i 1 . 10 . 4019 . 1 1 2 ASP HB2 H -3.908 10.339 -2.383 . . . 1.0 . . . . . . . . . . . . A . 2 ASP HB2 . . . . . . . . . c30497_6e5i 1 . 10 . 4020 . 1 1 2 ASP HB3 H -5.280 10.357 -3.485 . . . 1.0 . . . . . . . . . . . . A . 2 ASP HB3 . . . . . . . . . c30497_6e5i 1 . 10 . 4021 . 1 1 2 ASP N N -5.667 7.719 -3.611 . . . 1.0 . . . . . . . . . . . . A . 2 ASP N . . . . . . . . . c30497_6e5i 1 . 10 . 4022 . 1 1 2 ASP O O -2.676 7.754 -1.674 . . . 1.0 . . . . . . . . . . . . A . 2 ASP O . . . . . . . . . c30497_6e5i 1 . 10 . 4023 . 1 1 2 ASP OD1 O -5.290 9.941 -0.319 . . . 1.0 . . . . . . . . . . . . A . 2 ASP OD1 . . . . . . . . . c30497_6e5i 1 . 10 . 4024 . 1 1 2 ASP OD2 O -6.993 9.924 -1.693 . . . 1.0 . . . . . . . . . . . . A . 2 ASP OD2 . . . . . . . . . c30497_6e5i 1 . 10 . 4025 . 1 1 3 LYS C C -3.165 5.101 -0.451 . . . 1.0 . . . . . . . . . . . . A . 3 LYS C . . . . . . . . . c30497_6e5i 1 . 10 . 4026 . 1 1 3 LYS CA C -4.210 6.128 -0.039 . . . 1.0 . . . . . . . . . . . . A . 3 LYS CA . . . . . . . . . c30497_6e5i 1 . 10 . 4027 . 1 1 3 LYS CB C -5.373 5.438 0.685 . . . 1.0 . . . . . . . . . . . . A . 3 LYS CB . . . . . . . . . c30497_6e5i 1 . 10 . 4028 . 1 1 3 LYS CD C -4.368 5.537 3.002 . . . 1.0 . . . . . . . . . . . . A . 3 LYS CD . . . . . . . . . c30497_6e5i 1 . 10 . 4029 . 1 1 3 LYS CE C -5.443 6.391 3.657 . . . 1.0 . . . . . . . . . . . . A . 3 LYS CE . . . . . . . . . c30497_6e5i 1 . 10 . 4030 . 1 1 3 LYS CG C -4.947 4.643 1.912 . . . 1.0 . . . . . . . . . . . . A . 3 LYS CG . . . . . . . . . c30497_6e5i 1 . 10 . 4031 . 1 1 3 LYS H H -5.630 6.783 -1.468 . . . 1.0 . . . . . . . . . . . . A . 3 LYS H . . . . . . . . . c30497_6e5i 1 . 10 . 4032 . 1 1 3 LYS HA H -3.752 6.836 0.631 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HA . . . . . . . . . c30497_6e5i 1 . 10 . 4033 . 1 1 3 LYS HB2 H -6.082 6.188 0.997 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HB2 . . . . . . . . . c30497_6e5i 1 . 10 . 4034 . 1 1 3 LYS HB3 H -5.857 4.762 -0.001 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HB3 . . . . . . . . . c30497_6e5i 1 . 10 . 4035 . 1 1 3 LYS HD2 H -3.910 4.915 3.756 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HD2 . . . . . . . . . c30497_6e5i 1 . 10 . 4036 . 1 1 3 LYS HD3 H -3.622 6.182 2.567 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HD3 . . . . . . . . . c30497_6e5i 1 . 10 . 4037 . 1 1 3 LYS HE2 H -6.004 6.896 2.886 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HE2 . . . . . . . . . c30497_6e5i 1 . 10 . 4038 . 1 1 3 LYS HE3 H -6.103 5.748 4.216 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HE3 . . . . . . . . . c30497_6e5i 1 . 10 . 4039 . 1 1 3 LYS HG2 H -5.808 4.127 2.306 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HG2 . . . . . . . . . c30497_6e5i 1 . 10 . 4040 . 1 1 3 LYS HG3 H -4.199 3.922 1.616 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HG3 . . . . . . . . . c30497_6e5i 1 . 10 . 4041 . 1 1 3 LYS HZ1 H -4.282 6.947 5.304 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HZ1 . . . . . . . . . c30497_6e5i 1 . 10 . 4042 . 1 1 3 LYS HZ2 H -5.623 7.940 5.044 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HZ2 . . . . . . . . . c30497_6e5i 1 . 10 . 4043 . 1 1 3 LYS HZ3 H -4.269 8.073 4.044 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HZ3 . . . . . . . . . c30497_6e5i 1 . 10 . 4044 . 1 1 3 LYS N N -4.690 6.867 -1.204 . . . 1.0 . . . . . . . . . . . . A . 3 LYS N . . . . . . . . . c30497_6e5i 1 . 10 . 4045 . 1 1 3 LYS NZ N -4.864 7.406 4.577 . . . 1.0 . . . . . . . . . . . . A . 3 LYS NZ . . . . . . . . . c30497_6e5i 1 . 10 . 4046 . 1 1 3 LYS O O -2.147 4.931 0.220 . . . 1.0 . . . . . . . . . . . . A . 3 LYS O . . . . . . . . . c30497_6e5i 1 . 10 . 4047 . 1 1 4 CYS C C -1.135 4.087 -2.405 . . . 1.0 . . . . . . . . . . . . A . 4 CYS C . . . . . . . . . c30497_6e5i 1 . 10 . 4048 . 1 1 4 CYS CA C -2.486 3.449 -2.104 . . . 1.0 . . . . . . . . . . . . A . 4 CYS CA . . . . . . . . . c30497_6e5i 1 . 10 . 4049 . 1 1 4 CYS CB C -3.062 2.806 -3.367 . . . 1.0 . . . . . . . . . . . . A . 4 CYS CB . . . . . . . . . c30497_6e5i 1 . 10 . 4050 . 1 1 4 CYS H H -4.258 4.604 -2.046 . . . 1.0 . . . . . . . . . . . . A . 4 CYS H . . . . . . . . . c30497_6e5i 1 . 10 . 4051 . 1 1 4 CYS HA H -2.349 2.686 -1.355 . . . 1.0 . . . . . . . . . . . . A . 4 CYS HA . . . . . . . . . c30497_6e5i 1 . 10 . 4052 . 1 1 4 CYS HB2 H -3.415 3.585 -4.027 . . . 1.0 . . . . . . . . . . . . A . 4 CYS HB2 . . . . . . . . . c30497_6e5i 1 . 10 . 4053 . 1 1 4 CYS HB3 H -2.283 2.247 -3.864 . . . 1.0 . . . . . . . . . . . . A . 4 CYS HB3 . . . . . . . . . c30497_6e5i 1 . 10 . 4054 . 1 1 4 CYS N N -3.417 4.434 -1.569 . . . 1.0 . . . . . . . . . . . . A . 4 CYS N . . . . . . . . . c30497_6e5i 1 . 10 . 4055 . 1 1 4 CYS O O -0.085 3.491 -2.165 . . . 1.0 . . . . . . . . . . . . A . 4 CYS O . . . . . . . . . c30497_6e5i 1 . 10 . 4056 . 1 1 4 CYS SG S -4.452 1.670 -3.057 . . . 1.0 . . . . . . . . . . . . A . 4 CYS SG . . . . . . . . . c30497_6e5i 1 . 10 . 4057 . 1 1 5 LYS C C 0.737 6.547 -1.978 . . . 1.0 . . . . . . . . . . . . A . 5 LYS C . . . . . . . . . c30497_6e5i 1 . 10 . 4058 . 1 1 5 LYS CA C 0.048 6.038 -3.237 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CA . . . . . . . . . c30497_6e5i 1 . 10 . 4059 . 1 1 5 LYS CB C -0.265 7.197 -4.185 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CB . . . . . . . . . c30497_6e5i 1 . 10 . 4060 . 1 1 5 LYS CD C -1.063 7.930 -6.452 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CD . . . . . . . . . c30497_6e5i 1 . 10 . 4061 . 1 1 5 LYS CE C -1.554 7.477 -7.818 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CE . . . . . . . . . c30497_6e5i 1 . 10 . 4062 . 1 1 5 LYS CG C -0.764 6.747 -5.549 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CG . . . . . . . . . c30497_6e5i 1 . 10 . 4063 . 1 1 5 LYS H H -2.036 5.749 -3.037 . . . 1.0 . . . . . . . . . . . . A . 5 LYS H . . . . . . . . . c30497_6e5i 1 . 10 . 4064 . 1 1 5 LYS HA H 0.712 5.347 -3.735 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HA . . . . . . . . . c30497_6e5i 1 . 10 . 4065 . 1 1 5 LYS HB2 H -1.026 7.819 -3.735 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HB2 . . . . . . . . . c30497_6e5i 1 . 10 . 4066 . 1 1 5 LYS HB3 H 0.631 7.784 -4.328 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HB3 . . . . . . . . . c30497_6e5i 1 . 10 . 4067 . 1 1 5 LYS HD2 H -1.825 8.540 -5.990 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HD2 . . . . . . . . . c30497_6e5i 1 . 10 . 4068 . 1 1 5 LYS HD3 H -0.162 8.512 -6.577 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HD3 . . . . . . . . . c30497_6e5i 1 . 10 . 4069 . 1 1 5 LYS HE2 H -2.447 6.885 -7.685 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HE2 . . . . . . . . . c30497_6e5i 1 . 10 . 4070 . 1 1 5 LYS HE3 H -1.786 8.349 -8.409 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HE3 . . . . . . . . . c30497_6e5i 1 . 10 . 4071 . 1 1 5 LYS HG2 H -0.006 6.137 -6.016 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HG2 . . . . . . . . . c30497_6e5i 1 . 10 . 4072 . 1 1 5 LYS HG3 H -1.666 6.168 -5.420 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HG3 . . . . . . . . . c30497_6e5i 1 . 10 . 4073 . 1 1 5 LYS HZ1 H -0.350 5.777 -8.018 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HZ1 . . . . . . . . . c30497_6e5i 1 . 10 . 4074 . 1 1 5 LYS HZ2 H 0.351 7.194 -8.621 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HZ2 . . . . . . . . . c30497_6e5i 1 . 10 . 4075 . 1 1 5 LYS HZ3 H -0.877 6.428 -9.490 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HZ3 . . . . . . . . . c30497_6e5i 1 . 10 . 4076 . 1 1 5 LYS N N -1.169 5.315 -2.902 . . . 1.0 . . . . . . . . . . . . A . 5 LYS N . . . . . . . . . c30497_6e5i 1 . 10 . 4077 . 1 1 5 LYS NZ N -0.538 6.662 -8.535 . . . 1.0 . . . . . . . . . . . . A . 5 LYS NZ . . . . . . . . . c30497_6e5i 1 . 10 . 4078 . 1 1 5 LYS O O 1.962 6.541 -1.885 . . . 1.0 . . . . . . . . . . . . A . 5 LYS O . . . . . . . . . c30497_6e5i 1 . 10 . 4079 . 1 1 6 GLU C C 1.236 6.292 0.952 . . . 1.0 . . . . . . . . . . . . A . 6 GLU C . . . . . . . . . c30497_6e5i 1 . 10 . 4080 . 1 1 6 GLU CA C 0.477 7.419 0.274 . . . 1.0 . . . . . . . . . . . . A . 6 GLU CA . . . . . . . . . c30497_6e5i 1 . 10 . 4081 . 1 1 6 GLU CB C -0.643 7.916 1.188 . . . 1.0 . . . . . . . . . . . . A . 6 GLU CB . . . . . . . . . c30497_6e5i 1 . 10 . 4082 . 1 1 6 GLU CD C -0.191 10.370 0.852 . . . 1.0 . . . . . . . . . . . . A . 6 GLU CD . . . . . . . . . c30497_6e5i 1 . 10 . 4083 . 1 1 6 GLU CG C -1.215 9.261 0.777 . . . 1.0 . . . . . . . . . . . . A . 6 GLU CG . . . . . . . . . c30497_6e5i 1 . 10 . 4084 . 1 1 6 GLU H H -1.029 6.957 -1.138 . . . 1.0 . . . . . . . . . . . . A . 6 GLU H . . . . . . . . . c30497_6e5i 1 . 10 . 4085 . 1 1 6 GLU HA H 1.160 8.231 0.075 . . . 1.0 . . . . . . . . . . . . A . 6 GLU HA . . . . . . . . . c30497_6e5i 1 . 10 . 4086 . 1 1 6 GLU HB2 H -1.444 7.192 1.183 . . . 1.0 . . . . . . . . . . . . A . 6 GLU HB2 . . . . . . . . . c30497_6e5i 1 . 10 . 4087 . 1 1 6 GLU HB3 H -0.258 8.005 2.192 . . . 1.0 . . . . . . . . . . . . A . 6 GLU HB3 . . . . . . . . . c30497_6e5i 1 . 10 . 4088 . 1 1 6 GLU HG2 H -1.574 9.192 -0.239 . . . 1.0 . . . . . . . . . . . . A . 6 GLU HG2 . . . . . . . . . c30497_6e5i 1 . 10 . 4089 . 1 1 6 GLU HG3 H -2.036 9.503 1.432 . . . 1.0 . . . . . . . . . . . . A . 6 GLU HG3 . . . . . . . . . c30497_6e5i 1 . 10 . 4090 . 1 1 6 GLU N N -0.057 6.964 -1.001 . . . 1.0 . . . . . . . . . . . . A . 6 GLU N . . . . . . . . . c30497_6e5i 1 . 10 . 4091 . 1 1 6 GLU O O 2.352 6.480 1.430 . . . 1.0 . . . . . . . . . . . . A . 6 GLU O . . . . . . . . . c30497_6e5i 1 . 10 . 4092 . 1 1 6 GLU OE1 O 0.159 10.785 1.974 . . . 1.0 . . . . . . . . . . . . A . 6 GLU OE1 . . . . . . . . . c30497_6e5i 1 . 10 . 4093 . 1 1 6 GLU OE2 O 0.267 10.837 -0.212 . . . 1.0 . . . . . . . . . . . . A . 6 GLU OE2 . . . . . . . . . c30497_6e5i 1 . 10 . 4094 . 1 1 7 LEU C C 2.452 3.502 0.697 . . . 1.0 . . . . . . . . . . . . A . 7 LEU C . . . . . . . . . c30497_6e5i 1 . 10 . 4095 . 1 1 7 LEU CA C 1.252 3.933 1.532 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CA . . . . . . . . . c30497_6e5i 1 . 10 . 4096 . 1 1 7 LEU CB C 0.231 2.801 1.623 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CB . . . . . . . . . c30497_6e5i 1 . 10 . 4097 . 1 1 7 LEU CD1 C -2.070 2.115 2.350 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CD1 . . . . . . . . . c30497_6e5i 1 . 10 . 4098 . 1 1 7 LEU CD2 C -0.399 2.820 4.051 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CD2 . . . . . . . . . c30497_6e5i 1 . 10 . 4099 . 1 1 7 LEU CG C -0.898 3.037 2.631 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CG . . . . . . . . . c30497_6e5i 1 . 10 . 4100 . 1 1 7 LEU H H -0.276 5.041 0.583 . . . 1.0 . . . . . . . . . . . . A . 7 LEU H . . . . . . . . . c30497_6e5i 1 . 10 . 4101 . 1 1 7 LEU HA H 1.590 4.182 2.523 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HA . . . . . . . . . c30497_6e5i 1 . 10 . 4102 . 1 1 7 LEU HB2 H -0.206 2.663 0.646 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HB2 . . . . . . . . . c30497_6e5i 1 . 10 . 4103 . 1 1 7 LEU HB3 H 0.750 1.897 1.899 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HB3 . . . . . . . . . c30497_6e5i 1 . 10 . 4104 . 1 1 7 LEU HD11 H -1.747 1.087 2.415 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD11 . . . . . . . . . c30497_6e5i 1 . 10 . 4105 . 1 1 7 LEU HD12 H -2.453 2.309 1.359 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD12 . . . . . . . . . c30497_6e5i 1 . 10 . 4106 . 1 1 7 LEU HD13 H -2.850 2.295 3.076 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD13 . . . . . . . . . c30497_6e5i 1 . 10 . 4107 . 1 1 7 LEU HD21 H 0.430 3.481 4.246 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD21 . . . . . . . . . c30497_6e5i 1 . 10 . 4108 . 1 1 7 LEU HD22 H -0.081 1.795 4.166 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD22 . . . . . . . . . c30497_6e5i 1 . 10 . 4109 . 1 1 7 LEU HD23 H -1.197 3.029 4.748 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD23 . . . . . . . . . c30497_6e5i 1 . 10 . 4110 . 1 1 7 LEU HG H -1.244 4.057 2.547 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HG . . . . . . . . . c30497_6e5i 1 . 10 . 4111 . 1 1 7 LEU N N 0.628 5.116 0.964 . . . 1.0 . . . . . . . . . . . . A . 7 LEU N . . . . . . . . . c30497_6e5i 1 . 10 . 4112 . 1 1 7 LEU O O 3.465 3.060 1.234 . . . 1.0 . . . . . . . . . . . . A . 7 LEU O . . . . . . . . . c30497_6e5i 1 . 10 . 4113 . 1 1 8 LYS C C 4.667 4.157 -1.204 . . . 1.0 . . . . . . . . . . . . A . 8 LYS C . . . . . . . . . c30497_6e5i 1 . 10 . 4114 . 1 1 8 LYS CA C 3.419 3.337 -1.535 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CA . . . . . . . . . c30497_6e5i 1 . 10 . 4115 . 1 1 8 LYS CB C 2.973 3.609 -2.973 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CB . . . . . . . . . c30497_6e5i 1 . 10 . 4116 . 1 1 8 LYS CD C 3.545 3.664 -5.412 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CD . . . . . . . . . c30497_6e5i 1 . 10 . 4117 . 1 1 8 LYS CE C 4.628 3.439 -6.453 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CE . . . . . . . . . c30497_6e5i 1 . 10 . 4118 . 1 1 8 LYS CG C 4.048 3.360 -4.012 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CG . . . . . . . . . c30497_6e5i 1 . 10 . 4119 . 1 1 8 LYS H H 1.473 3.954 -0.986 . . . 1.0 . . . . . . . . . . . . A . 8 LYS H . . . . . . . . . c30497_6e5i 1 . 10 . 4120 . 1 1 8 LYS HA H 3.655 2.289 -1.430 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HA . . . . . . . . . c30497_6e5i 1 . 10 . 4121 . 1 1 8 LYS HB2 H 2.131 2.972 -3.200 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HB2 . . . . . . . . . c30497_6e5i 1 . 10 . 4122 . 1 1 8 LYS HB3 H 2.661 4.641 -3.049 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HB3 . . . . . . . . . c30497_6e5i 1 . 10 . 4123 . 1 1 8 LYS HD2 H 2.708 3.018 -5.632 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HD2 . . . . . . . . . c30497_6e5i 1 . 10 . 4124 . 1 1 8 LYS HD3 H 3.226 4.695 -5.452 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HD3 . . . . . . . . . c30497_6e5i 1 . 10 . 4125 . 1 1 8 LYS HE2 H 4.215 3.640 -7.430 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HE2 . . . . . . . . . c30497_6e5i 1 . 10 . 4126 . 1 1 8 LYS HE3 H 5.442 4.123 -6.262 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HE3 . . . . . . . . . c30497_6e5i 1 . 10 . 4127 . 1 1 8 LYS HG2 H 4.895 3.993 -3.799 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HG2 . . . . . . . . . c30497_6e5i 1 . 10 . 4128 . 1 1 8 LYS HG3 H 4.349 2.324 -3.965 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HG3 . . . . . . . . . c30497_6e5i 1 . 10 . 4129 . 1 1 8 LYS HZ1 H 4.372 1.371 -6.569 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ1 . . . . . . . . . c30497_6e5i 1 . 10 . 4130 . 1 1 8 LYS HZ2 H 5.601 1.850 -5.513 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ2 . . . . . . . . . c30497_6e5i 1 . 10 . 4131 . 1 1 8 LYS HZ3 H 5.852 1.911 -7.183 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ3 . . . . . . . . . c30497_6e5i 1 . 10 . 4132 . 1 1 8 LYS N N 2.331 3.646 -0.617 . . . 1.0 . . . . . . . . . . . . A . 8 LYS N . . . . . . . . . c30497_6e5i 1 . 10 . 4133 . 1 1 8 LYS NZ N 5.149 2.046 -6.426 . . . 1.0 . . . . . . . . . . . . A . 8 LYS NZ . . . . . . . . . c30497_6e5i 1 . 10 . 4134 . 1 1 8 LYS O O 5.780 3.630 -1.183 . . . 1.0 . . . . . . . . . . . . A . 8 LYS O . . . . . . . . . c30497_6e5i 1 . 10 . 4135 . 1 1 9 LYS C C 6.018 6.072 0.864 . . . 1.0 . . . . . . . . . . . . A . 9 LYS C . . . . . . . . . c30497_6e5i 1 . 10 . 4136 . 1 1 9 LYS CA C 5.583 6.320 -0.581 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CA . . . . . . . . . c30497_6e5i 1 . 10 . 4137 . 1 1 9 LYS CB C 5.194 7.791 -0.761 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CB . . . . . . . . . c30497_6e5i 1 . 10 . 4138 . 1 1 9 LYS CD C 4.444 7.631 -3.182 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CD . . . . . . . . . c30497_6e5i 1 . 10 . 4139 . 1 1 9 LYS CE C 4.485 8.301 -4.549 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CE . . . . . . . . . c30497_6e5i 1 . 10 . 4140 . 1 1 9 LYS CG C 5.352 8.330 -2.184 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CG . . . . . . . . . c30497_6e5i 1 . 10 . 4141 . 1 1 9 LYS H H 3.566 5.815 -1.010 . . . 1.0 . . . . . . . . . . . . A . 9 LYS H . . . . . . . . . c30497_6e5i 1 . 10 . 4142 . 1 1 9 LYS HA H 6.411 6.092 -1.234 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HA . . . . . . . . . c30497_6e5i 1 . 10 . 4143 . 1 1 9 LYS HB2 H 4.160 7.909 -0.474 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HB2 . . . . . . . . . c30497_6e5i 1 . 10 . 4144 . 1 1 9 LYS HB3 H 5.806 8.391 -0.104 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HB3 . . . . . . . . . c30497_6e5i 1 . 10 . 4145 . 1 1 9 LYS HD2 H 4.764 6.605 -3.288 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HD2 . . . . . . . . . c30497_6e5i 1 . 10 . 4146 . 1 1 9 LYS HD3 H 3.430 7.657 -2.810 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HD3 . . . . . . . . . c30497_6e5i 1 . 10 . 4147 . 1 1 9 LYS HE2 H 3.750 7.834 -5.186 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HE2 . . . . . . . . . c30497_6e5i 1 . 10 . 4148 . 1 1 9 LYS HE3 H 4.241 9.346 -4.428 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HE3 . . . . . . . . . c30497_6e5i 1 . 10 . 4149 . 1 1 9 LYS HG2 H 5.114 9.381 -2.182 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HG2 . . . . . . . . . c30497_6e5i 1 . 10 . 4150 . 1 1 9 LYS HG3 H 6.377 8.198 -2.493 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HG3 . . . . . . . . . c30497_6e5i 1 . 10 . 4151 . 1 1 9 LYS HZ1 H 6.554 8.603 -4.586 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HZ1 . . . . . . . . . c30497_6e5i 1 . 10 . 4152 . 1 1 9 LYS HZ2 H 5.821 8.691 -6.105 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HZ2 . . . . . . . . . c30497_6e5i 1 . 10 . 4153 . 1 1 9 LYS HZ3 H 6.054 7.190 -5.366 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HZ3 . . . . . . . . . c30497_6e5i 1 . 10 . 4154 . 1 1 9 LYS N N 4.477 5.443 -0.946 . . . 1.0 . . . . . . . . . . . . A . 9 LYS N . . . . . . . . . c30497_6e5i 1 . 10 . 4155 . 1 1 9 LYS NZ N 5.821 8.188 -5.193 . . . 1.0 . . . . . . . . . . . . A . 9 LYS NZ . . . . . . . . . c30497_6e5i 1 . 10 . 4156 . 1 1 9 LYS O O 7.207 6.121 1.186 . . . 1.0 . . . . . . . . . . . . A . 9 LYS O . . . . . . . . . c30497_6e5i 1 . 10 . 4157 . 1 1 10 ARG C C 6.146 4.310 3.349 . . . 1.0 . . . . . . . . . . . . A . 10 ARG C . . . . . . . . . c30497_6e5i 1 . 10 . 4158 . 1 1 10 ARG CA C 5.284 5.550 3.140 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CA . . . . . . . . . c30497_6e5i 1 . 10 . 4159 . 1 1 10 ARG CB C 3.942 5.386 3.855 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CB . . . . . . . . . c30497_6e5i 1 . 10 . 4160 . 1 1 10 ARG CD C 2.664 4.958 5.967 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CD . . . . . . . . . c30497_6e5i 1 . 10 . 4161 . 1 1 10 ARG CG C 4.046 5.033 5.329 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CG . . . . . . . . . c30497_6e5i 1 . 10 . 4162 . 1 1 10 ARG CZ C 1.598 4.247 8.074 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CZ . . . . . . . . . c30497_6e5i 1 . 10 . 4163 . 1 1 10 ARG H H 4.119 5.769 1.391 . . . 1.0 . . . . . . . . . . . . A . 10 ARG H . . . . . . . . . c30497_6e5i 1 . 10 . 4164 . 1 1 10 ARG HA H 5.796 6.407 3.546 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HA . . . . . . . . . c30497_6e5i 1 . 10 . 4165 . 1 1 10 ARG HB2 H 3.390 6.308 3.768 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HB2 . . . . . . . . . c30497_6e5i 1 . 10 . 4166 . 1 1 10 ARG HB3 H 3.388 4.601 3.362 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HB3 . . . . . . . . . c30497_6e5i 1 . 10 . 4167 . 1 1 10 ARG HD2 H 2.260 5.957 6.028 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HD2 . . . . . . . . . c30497_6e5i 1 . 10 . 4168 . 1 1 10 ARG HD3 H 2.027 4.355 5.338 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HD3 . . . . . . . . . c30497_6e5i 1 . 10 . 4169 . 1 1 10 ARG HE H 3.551 4.067 7.661 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HE . . . . . . . . . c30497_6e5i 1 . 10 . 4170 . 1 1 10 ARG HG2 H 4.536 4.073 5.427 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HG2 . . . . . . . . . c30497_6e5i 1 . 10 . 4171 . 1 1 10 ARG HG3 H 4.628 5.793 5.830 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HG3 . . . . . . . . . c30497_6e5i 1 . 10 . 4172 . 1 1 10 ARG HH11 H -0.402 4.570 8.196 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HH11 . . . . . . . . . c30497_6e5i 1 . 10 . 4173 . 1 1 10 ARG HH12 H 0.343 5.082 6.716 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HH12 . . . . . . . . . c30497_6e5i 1 . 10 . 4174 . 1 1 10 ARG HH21 H 2.581 3.376 9.619 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HH21 . . . . . . . . . c30497_6e5i 1 . 10 . 4175 . 1 1 10 ARG HH22 H 0.877 3.593 9.853 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HH22 . . . . . . . . . c30497_6e5i 1 . 10 . 4176 . 1 1 10 ARG N N 5.044 5.798 1.722 . . . 1.0 . . . . . . . . . . . . A . 10 ARG N . . . . . . . . . c30497_6e5i 1 . 10 . 4177 . 1 1 10 ARG NE N 2.684 4.381 7.313 . . . 1.0 . . . . . . . . . . . . A . 10 ARG NE . . . . . . . . . c30497_6e5i 1 . 10 . 4178 . 1 1 10 ARG NH1 N 0.419 4.666 7.629 . . . 1.0 . . . . . . . . . . . . A . 10 ARG NH1 . . . . . . . . . c30497_6e5i 1 . 10 . 4179 . 1 1 10 ARG NH2 N 1.693 3.695 9.278 . . . 1.0 . . . . . . . . . . . . A . 10 ARG NH2 . . . . . . . . . c30497_6e5i 1 . 10 . 4180 . 1 1 10 ARG O O 7.000 4.275 4.233 . . . 1.0 . . . . . . . . . . . . A . 10 ARG O . . . . . . . . . c30497_6e5i 1 . 10 . 4181 . 1 1 11 TYR C C 7.898 2.010 1.791 . . . 1.0 . . . . . . . . . . . . A . 11 TYR C . . . . . . . . . c30497_6e5i 1 . 10 . 4182 . 1 1 11 TYR CA C 6.651 2.045 2.664 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CA . . . . . . . . . c30497_6e5i 1 . 10 . 4183 . 1 1 11 TYR CB C 5.739 0.860 2.356 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CB . . . . . . . . . c30497_6e5i 1 . 10 . 4184 . 1 1 11 TYR CD1 C 5.221 -0.509 4.399 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CD1 . . . . . . . . . c30497_6e5i 1 . 10 . 4185 . 1 1 11 TYR CD2 C 3.662 1.173 3.753 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CD2 . . . . . . . . . c30497_6e5i 1 . 10 . 4186 . 1 1 11 TYR CE1 C 4.428 -0.836 5.481 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CE1 . . . . . . . . . c30497_6e5i 1 . 10 . 4187 . 1 1 11 TYR CE2 C 2.862 0.852 4.831 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CE2 . . . . . . . . . c30497_6e5i 1 . 10 . 4188 . 1 1 11 TYR CG C 4.851 0.497 3.520 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CG . . . . . . . . . c30497_6e5i 1 . 10 . 4189 . 1 1 11 TYR CZ C 3.249 -0.153 5.693 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CZ . . . . . . . . . c30497_6e5i 1 . 10 . 4190 . 1 1 11 TYR H H 5.244 3.388 1.822 . . . 1.0 . . . . . . . . . . . . A . 11 TYR H . . . . . . . . . c30497_6e5i 1 . 10 . 4191 . 1 1 11 TYR HA H 6.963 1.971 3.693 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HA . . . . . . . . . c30497_6e5i 1 . 10 . 4192 . 1 1 11 TYR HB2 H 5.107 1.105 1.516 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HB2 . . . . . . . . . c30497_6e5i 1 . 10 . 4193 . 1 1 11 TYR HB3 H 6.340 0.000 2.111 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HB3 . . . . . . . . . c30497_6e5i 1 . 10 . 4194 . 1 1 11 TYR HD1 H 6.145 -1.041 4.229 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HD1 . . . . . . . . . c30497_6e5i 1 . 10 . 4195 . 1 1 11 TYR HD2 H 3.360 1.959 3.075 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HD2 . . . . . . . . . c30497_6e5i 1 . 10 . 4196 . 1 1 11 TYR HE1 H 4.734 -1.621 6.155 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HE1 . . . . . . . . . c30497_6e5i 1 . 10 . 4197 . 1 1 11 TYR HE2 H 1.942 1.389 4.998 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HE2 . . . . . . . . . c30497_6e5i 1 . 10 . 4198 . 1 1 11 TYR HH H 1.527 -0.403 6.520 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HH . . . . . . . . . c30497_6e5i 1 . 10 . 4199 . 1 1 11 TYR N N 5.924 3.296 2.530 . . . 1.0 . . . . . . . . . . . . A . 11 TYR N . . . . . . . . . c30497_6e5i 1 . 10 . 4200 . 1 1 11 TYR O O 8.577 0.990 1.709 . . . 1.0 . . . . . . . . . . . . A . 11 TYR O . . . . . . . . . c30497_6e5i 1 . 10 . 4201 . 1 1 11 TYR OH O 2.457 -0.473 6.774 . . . 1.0 . . . . . . . . . . . . A . 11 TYR OH . . . . . . . . . c30497_6e5i 1 . 10 . 4202 . 1 1 12 ORN C C 10.079 0.008 -1.640 . . . 1.0 . . . . . . . . . . . . A . 12 ORN C . . . . . . . . . c30497_6e5i 1 . 10 . 4203 . 1 1 12 ORN CA C 11.016 1.179 -1.376 . . . 1.0 . . . . . . . . . . . . A . 12 ORN CA . . . . . . . . . c30497_6e5i 1 . 10 . 4204 . 1 1 12 ORN CB C 10.377 2.484 -1.873 . . . 1.0 . . . . . . . . . . . . A . 12 ORN CB . . . . . . . . . c30497_6e5i 1 . 10 . 4205 . 1 1 12 ORN CD C 9.385 3.260 0.301 . . . 1.0 . . . . . . . . . . . . A . 12 ORN CD . . . . . . . . . c30497_6e5i 1 . 10 . 4206 . 1 1 12 ORN CG C 9.099 2.856 -1.133 . . . 1.0 . . . . . . . . . . . . A . 12 ORN CG . . . . . . . . . c30497_6e5i 1 . 10 . 4207 . 1 1 12 ORN H H 12.945 1.754 -1.902 . . . 1.0 . . . . . . . . . . . . A . 12 ORN H . . . . . . . . . c30497_6e5i 1 . 10 . 4208 . 1 1 12 ORN HA H 11.197 1.251 -0.314 . . . 1.0 . . . . . . . . . . . . A . 12 ORN HA . . . . . . . . . c30497_6e5i 1 . 10 . 4209 . 1 1 12 ORN HB2 H 10.143 2.380 -2.922 . . . 1.0 . . . . . . . . . . . . A . 12 ORN HB2 . . . . . . . . . c30497_6e5i 1 . 10 . 4210 . 1 1 12 ORN HB3 H 11.086 3.288 -1.749 . . . 1.0 . . . . . . . . . . . . A . 12 ORN HB3 . . . . . . . . . c30497_6e5i 1 . 10 . 4211 . 1 1 12 ORN HD2 H 9.712 4.287 0.310 . . . 1.0 . . . . . . . . . . . . A . 12 ORN HD2 . . . . . . . . . c30497_6e5i 1 . 10 . 4212 . 1 1 12 ORN HD3 H 10.169 2.632 0.690 . . . 1.0 . . . . . . . . . . . . A . 12 ORN HD3 . . . . . . . . . c30497_6e5i 1 . 10 . 4213 . 1 1 12 ORN HE1 H 7.627 3.911 1.257 . . . 1.0 . . . . . . . . . . . . A . 12 ORN HE1 . . . . . . . . . c30497_6e5i 1 . 10 . 4214 . 1 1 12 ORN HG2 H 8.435 2.004 -1.130 . . . 1.0 . . . . . . . . . . . . A . 12 ORN HG2 . . . . . . . . . c30497_6e5i 1 . 10 . 4215 . 1 1 12 ORN HG3 H 8.625 3.682 -1.641 . . . 1.0 . . . . . . . . . . . . A . 12 ORN HG3 . . . . . . . . . c30497_6e5i 1 . 10 . 4216 . 1 1 12 ORN N N 12.307 0.949 -2.056 . . . 1.0 . . . . . . . . . . . . A . 12 ORN N . . . . . . . . . c30497_6e5i 1 . 10 . 4217 . 1 1 12 ORN NE N 8.211 3.131 1.157 . . . 1.0 . . . . . . . . . . . . A . 12 ORN NE . . . . . . . . . c30497_6e5i 1 . 10 . 4218 . 1 1 12 ORN O O 10.114 -0.593 -2.716 . . . 1.0 . . . . . . . . . . . . A . 12 ORN O . . . . . . . . . c30497_6e5i 1 . 10 . 4219 . 1 1 13 CYS C C 7.027 -0.895 -1.447 . . . 1.0 . . . . . . . . . . . . A . 13 CYS C . . . . . . . . . c30497_6e5i 1 . 10 . 4220 . 1 1 13 CYS CA C 8.304 -1.408 -0.803 . . . 1.0 . . . . . . . . . . . . A . 13 CYS CA . . . . . . . . . c30497_6e5i 1 . 10 . 4221 . 1 1 13 CYS CB C 7.984 -2.018 0.560 . . . 1.0 . . . . . . . . . . . . A . 13 CYS CB . . . . . . . . . c30497_6e5i 1 . 10 . 4222 . 1 1 13 CYS H H 9.270 0.189 0.181 . . . 1.0 . . . . . . . . . . . . A . 13 CYS H . . . . . . . . . c30497_6e5i 1 . 10 . 4223 . 1 1 13 CYS HA H 8.745 -2.160 -1.437 . . . 1.0 . . . . . . . . . . . . A . 13 CYS HA . . . . . . . . . c30497_6e5i 1 . 10 . 4224 . 1 1 13 CYS HB2 H 7.372 -1.330 1.117 . . . 1.0 . . . . . . . . . . . . A . 13 CYS HB2 . . . . . . . . . c30497_6e5i 1 . 10 . 4225 . 1 1 13 CYS HB3 H 7.438 -2.937 0.412 . . . 1.0 . . . . . . . . . . . . A . 13 CYS HB3 . . . . . . . . . c30497_6e5i 1 . 10 . 4226 . 1 1 13 CYS N N 9.253 -0.320 -0.661 . . . 1.0 . . . . . . . . . . . . A . 13 CYS N . . . . . . . . . c30497_6e5i 1 . 10 . 4227 . 1 1 13 CYS O O 6.598 0.228 -1.189 . . . 1.0 . . . . . . . . . . . . A . 13 CYS O . . . . . . . . . c30497_6e5i 1 . 10 . 4228 . 1 1 13 CYS SG S 9.449 -2.401 1.574 . . . 1.0 . . . . . . . . . . . . A . 13 CYS SG . . . . . . . . . c30497_6e5i 1 . 10 . 4229 . 1 1 14 GLU C C 4.040 -2.094 -2.315 . . . 1.0 . . . . . . . . . . . . A . 14 GLU C . . . . . . . . . c30497_6e5i 1 . 10 . 4230 . 1 1 14 GLU CA C 5.193 -1.352 -2.956 . . . 1.0 . . . . . . . . . . . . A . 14 GLU CA . . . . . . . . . c30497_6e5i 1 . 10 . 4231 . 1 1 14 GLU CB C 5.259 -1.702 -4.437 . . . 1.0 . . . . . . . . . . . . A . 14 GLU CB . . . . . . . . . c30497_6e5i 1 . 10 . 4232 . 1 1 14 GLU CD C 6.377 -1.360 -6.658 . . . 1.0 . . . . . . . . . . . . A . 14 GLU CD . . . . . . . . . c30497_6e5i 1 . 10 . 4233 . 1 1 14 GLU CG C 6.392 -1.025 -5.186 . . . 1.0 . . . . . . . . . . . . A . 14 GLU CG . . . . . . . . . c30497_6e5i 1 . 10 . 4234 . 1 1 14 GLU H H 6.830 -2.593 -2.467 . . . 1.0 . . . . . . . . . . . . A . 14 GLU H . . . . . . . . . c30497_6e5i 1 . 10 . 4235 . 1 1 14 GLU HA H 5.040 -0.289 -2.841 . . . 1.0 . . . . . . . . . . . . A . 14 GLU HA . . . . . . . . . c30497_6e5i 1 . 10 . 4236 . 1 1 14 GLU HB2 H 5.387 -2.769 -4.530 . . . 1.0 . . . . . . . . . . . . A . 14 GLU HB2 . . . . . . . . . c30497_6e5i 1 . 10 . 4237 . 1 1 14 GLU HB3 H 4.327 -1.418 -4.904 . . . 1.0 . . . . . . . . . . . . A . 14 GLU HB3 . . . . . . . . . c30497_6e5i 1 . 10 . 4238 . 1 1 14 GLU HG2 H 6.298 0.045 -5.073 . . . 1.0 . . . . . . . . . . . . A . 14 GLU HG2 . . . . . . . . . c30497_6e5i 1 . 10 . 4239 . 1 1 14 GLU HG3 H 7.333 -1.351 -4.766 . . . 1.0 . . . . . . . . . . . . A . 14 GLU HG3 . . . . . . . . . c30497_6e5i 1 . 10 . 4240 . 1 1 14 GLU N N 6.432 -1.712 -2.293 . . . 1.0 . . . . . . . . . . . . A . 14 GLU N . . . . . . . . . c30497_6e5i 1 . 10 . 4241 . 1 1 14 GLU O O 4.129 -3.298 -2.078 . . . 1.0 . . . . . . . . . . . . A . 14 GLU O . . . . . . . . . c30497_6e5i 1 . 10 . 4242 . 1 1 14 GLU OE1 O 7.012 -2.360 -7.055 . . . 1.0 . . . . . . . . . . . . A . 14 GLU OE1 . . . . . . . . . c30497_6e5i 1 . 10 . 4243 . 1 1 14 GLU OE2 O 5.723 -0.628 -7.427 . . . 1.0 . . . . . . . . . . . . A . 14 GLU OE2 . . . . . . . . . c30497_6e5i 1 . 10 . 4244 . 1 1 15 VAL C C 0.768 -2.432 -2.396 . . . 1.0 . . . . . . . . . . . . A . 15 VAL C . . . . . . . . . c30497_6e5i 1 . 10 . 4245 . 1 1 15 VAL CA C 1.825 -2.009 -1.382 . . . 1.0 . . . . . . . . . . . . A . 15 VAL CA . . . . . . . . . c30497_6e5i 1 . 10 . 4246 . 1 1 15 VAL CB C 1.194 -1.088 -0.312 . . . 1.0 . . . . . . . . . . . . A . 15 VAL CB . . . . . . . . . c30497_6e5i 1 . 10 . 4247 . 1 1 15 VAL CG1 C 2.238 -0.662 0.711 . . . 1.0 . . . . . . . . . . . . A . 15 VAL CG1 . . . . . . . . . c30497_6e5i 1 . 10 . 4248 . 1 1 15 VAL CG2 C 0.535 0.126 -0.946 . . . 1.0 . . . . . . . . . . . . A . 15 VAL CG2 . . . . . . . . . c30497_6e5i 1 . 10 . 4249 . 1 1 15 VAL H H 2.916 -0.447 -2.298 . . . 1.0 . . . . . . . . . . . . A . 15 VAL H . . . . . . . . . c30497_6e5i 1 . 10 . 4250 . 1 1 15 VAL HA H 2.189 -2.896 -0.883 . . . 1.0 . . . . . . . . . . . . A . 15 VAL HA . . . . . . . . . c30497_6e5i 1 . 10 . 4251 . 1 1 15 VAL HB H 0.431 -1.651 0.209 . . . 1.0 . . . . . . . . . . . . A . 15 VAL HB . . . . . . . . . c30497_6e5i 1 . 10 . 4252 . 1 1 15 VAL HG11 H 2.691 -1.538 1.150 . . . 1.0 . . . . . . . . . . . . A . 15 VAL HG11 . . . . . . . . . c30497_6e5i 1 . 10 . 4253 . 1 1 15 VAL HG12 H 1.765 -0.076 1.485 . . . 1.0 . . . . . . . . . . . . A . 15 VAL HG12 . . . . . . . . . c30497_6e5i 1 . 10 . 4254 . 1 1 15 VAL HG13 H 2.998 -0.068 0.225 . . . 1.0 . . . . . . . . . . . . A . 15 VAL HG13 . . . . . . . . . c30497_6e5i 1 . 10 . 4255 . 1 1 15 VAL HG21 H -0.227 -0.201 -1.639 . . . 1.0 . . . . . . . . . . . . A . 15 VAL HG21 . . . . . . . . . c30497_6e5i 1 . 10 . 4256 . 1 1 15 VAL HG22 H 1.278 0.703 -1.474 . . . 1.0 . . . . . . . . . . . . A . 15 VAL HG22 . . . . . . . . . c30497_6e5i 1 . 10 . 4257 . 1 1 15 VAL HG23 H 0.087 0.734 -0.176 . . . 1.0 . . . . . . . . . . . . A . 15 VAL HG23 . . . . . . . . . c30497_6e5i 1 . 10 . 4258 . 1 1 15 VAL N N 2.959 -1.391 -2.040 . . . 1.0 . . . . . . . . . . . . A . 15 VAL N . . . . . . . . . c30497_6e5i 1 . 10 . 4259 . 1 1 15 VAL O O 0.528 -1.754 -3.399 . . . 1.0 . . . . . . . . . . . . A . 15 VAL O . . . . . . . . . c30497_6e5i 1 . 10 . 4260 . 1 1 16 ARG C C -2.225 -3.856 -2.244 . . . 1.0 . . . . . . . . . . . . A . 16 ARG C . . . . . . . . . c30497_6e5i 1 . 10 . 4261 . 1 1 16 ARG CA C -0.911 -4.085 -2.964 . . . 1.0 . . . . . . . . . . . . A . 16 ARG CA . . . . . . . . . c30497_6e5i 1 . 10 . 4262 . 1 1 16 ARG CB C -0.730 -5.574 -3.243 . . . 1.0 . . . . . . . . . . . . A . 16 ARG CB . . . . . . . . . c30497_6e5i 1 . 10 . 4263 . 1 1 16 ARG CD C -1.725 -7.662 -4.227 . . . 1.0 . . . . . . . . . . . . A . 16 ARG CD . . . . . . . . . c30497_6e5i 1 . 10 . 4264 . 1 1 16 ARG CG C -1.755 -6.143 -4.214 . . . 1.0 . . . . . . . . . . . . A . 16 ARG CG . . . . . . . . . c30497_6e5i 1 . 10 . 4265 . 1 1 16 ARG CZ C -0.085 -9.490 -4.473 . . . 1.0 . . . . . . . . . . . . A . 16 ARG CZ . . . . . . . . . c30497_6e5i 1 . 10 . 4266 . 1 1 16 ARG H H 0.465 -4.104 -1.366 . . . 1.0 . . . . . . . . . . . . A . 16 ARG H . . . . . . . . . c30497_6e5i 1 . 10 . 4267 . 1 1 16 ARG HA H -0.916 -3.538 -3.895 . . . 1.0 . . . . . . . . . . . . A . 16 ARG HA . . . . . . . . . c30497_6e5i 1 . 10 . 4268 . 1 1 16 ARG HB2 H 0.254 -5.735 -3.656 . . . 1.0 . . . . . . . . . . . . A . 16 ARG HB2 . . . . . . . . . c30497_6e5i 1 . 10 . 4269 . 1 1 16 ARG HB3 H -0.813 -6.112 -2.313 . . . 1.0 . . . . . . . . . . . . A . 16 ARG HB3 . . . . . . . . . c30497_6e5i 1 . 10 . 4270 . 1 1 16 ARG HD2 H -2.047 -8.020 -3.260 . . . 1.0 . . . . . . . . . . . . A . 16 ARG HD2 . . . . . . . . . c30497_6e5i 1 . 10 . 4271 . 1 1 16 ARG HD3 H -2.410 -8.011 -4.984 . . . 1.0 . . . . . . . . . . . . A . 16 ARG HD3 . . . . . . . . . c30497_6e5i 1 . 10 . 4272 . 1 1 16 ARG HE H 0.319 -7.549 -4.729 . . . 1.0 . . . . . . . . . . . . A . 16 ARG HE . . . . . . . . . c30497_6e5i 1 . 10 . 4273 . 1 1 16 ARG HG2 H -2.740 -5.817 -3.912 . . . 1.0 . . . . . . . . . . . . A . 16 ARG HG2 . . . . . . . . . c30497_6e5i 1 . 10 . 4274 . 1 1 16 ARG HG3 H -1.541 -5.775 -5.208 . . . 1.0 . . . . . . . . . . . . A . 16 ARG HG3 . . . . . . . . . c30497_6e5i 1 . 10 . 4275 . 1 1 16 ARG HH11 H -1.968 -10.110 -4.034 . . . 1.0 . . . . . . . . . . . . A . 16 ARG HH11 . . . . . . . . . c30497_6e5i 1 . 10 . 4276 . 1 1 16 ARG HH12 H -0.789 -11.373 -4.183 . . . 1.0 . . . . . . . . . . . . A . 16 ARG HH12 . . . . . . . . . c30497_6e5i 1 . 10 . 4277 . 1 1 16 ARG HH21 H 1.394 -10.858 -4.685 . . . 1.0 . . . . . . . . . . . . A . 16 ARG HH21 . . . . . . . . . c30497_6e5i 1 . 10 . 4278 . 1 1 16 ARG HH22 H 1.872 -9.204 -4.918 . . . 1.0 . . . . . . . . . . . . A . 16 ARG HH22 . . . . . . . . . c30497_6e5i 1 . 10 . 4279 . 1 1 16 ARG N N 0.171 -3.580 -2.143 . . . 1.0 . . . . . . . . . . . . A . 16 ARG N . . . . . . . . . c30497_6e5i 1 . 10 . 4280 . 1 1 16 ARG NE N -0.391 -8.195 -4.509 . . . 1.0 . . . . . . . . . . . . A . 16 ARG NE . . . . . . . . . c30497_6e5i 1 . 10 . 4281 . 1 1 16 ARG NH1 N -1.023 -10.395 -4.208 . . . 1.0 . . . . . . . . . . . . A . 16 ARG NH1 . . . . . . . . . c30497_6e5i 1 . 10 . 4282 . 1 1 16 ARG NH2 N 1.158 -9.882 -4.712 . . . 1.0 . . . . . . . . . . . . A . 16 ARG NH2 . . . . . . . . . c30497_6e5i 1 . 10 . 4283 . 1 1 16 ARG O O -2.437 -4.370 -1.143 . . . 1.0 . . . . . . . . . . . . A . 16 ARG O . . . . . . . . . c30497_6e5i 1 . 10 . 4284 . 1 1 17 CYS C C -5.403 -3.775 -2.493 . . . 1.0 . . . . . . . . . . . . A . 17 CYS C . . . . . . . . . c30497_6e5i 1 . 10 . 4285 . 1 1 17 CYS CA C -4.346 -2.713 -2.237 . . . 1.0 . . . . . . . . . . . . A . 17 CYS CA . . . . . . . . . c30497_6e5i 1 . 10 . 4286 . 1 1 17 CYS CB C -4.794 -1.356 -2.772 . . . 1.0 . . . . . . . . . . . . A . 17 CYS CB . . . . . . . . . c30497_6e5i 1 . 10 . 4287 . 1 1 17 CYS H H -2.895 -2.756 -3.761 . . . 1.0 . . . . . . . . . . . . A . 17 CYS H . . . . . . . . . c30497_6e5i 1 . 10 . 4288 . 1 1 17 CYS HA H -4.177 -2.634 -1.172 . . . 1.0 . . . . . . . . . . . . A . 17 CYS HA . . . . . . . . . c30497_6e5i 1 . 10 . 4289 . 1 1 17 CYS HB2 H -5.042 -1.455 -3.817 . . . 1.0 . . . . . . . . . . . . A . 17 CYS HB2 . . . . . . . . . c30497_6e5i 1 . 10 . 4290 . 1 1 17 CYS HB3 H -5.665 -1.027 -2.227 . . . 1.0 . . . . . . . . . . . . A . 17 CYS HB3 . . . . . . . . . c30497_6e5i 1 . 10 . 4291 . 1 1 17 CYS N N -3.094 -3.083 -2.857 . . . 1.0 . . . . . . . . . . . . A . 17 CYS N . . . . . . . . . c30497_6e5i 1 . 10 . 4292 . 1 1 17 CYS O O -5.891 -3.932 -3.613 . . . 1.0 . . . . . . . . . . . . A . 17 CYS O . . . . . . . . . c30497_6e5i 1 . 10 . 4293 . 1 1 17 CYS SG S -3.510 -0.072 -2.617 . . . 1.0 . . . . . . . . . . . . A . 17 CYS SG . . . . . . . . . c30497_6e5i 1 . 10 . 4294 . 1 1 18 ASP C C -7.879 -5.192 -0.576 . . . 1.0 . . . . . . . . . . . . A . 18 ASP C . . . . . . . . . c30497_6e5i 1 . 10 . 4295 . 1 1 18 ASP CA C -6.753 -5.543 -1.535 . . . 1.0 . . . . . . . . . . . . A . 18 ASP CA . . . . . . . . . c30497_6e5i 1 . 10 . 4296 . 1 1 18 ASP CB C -6.173 -6.919 -1.196 . . . 1.0 . . . . . . . . . . . . A . 18 ASP CB . . . . . . . . . c30497_6e5i 1 . 10 . 4297 . 1 1 18 ASP CG C -7.103 -8.046 -1.592 . . . 1.0 . . . . . . . . . . . . A . 18 ASP CG . . . . . . . . . c30497_6e5i 1 . 10 . 4298 . 1 1 18 ASP H H -5.279 -4.366 -0.592 . . . 1.0 . . . . . . . . . . . . A . 18 ASP H . . . . . . . . . c30497_6e5i 1 . 10 . 4299 . 1 1 18 ASP HA H -7.137 -5.556 -2.544 . . . 1.0 . . . . . . . . . . . . A . 18 ASP HA . . . . . . . . . c30497_6e5i 1 . 10 . 4300 . 1 1 18 ASP HB2 H -5.235 -7.048 -1.717 . . . 1.0 . . . . . . . . . . . . A . 18 ASP HB2 . . . . . . . . . c30497_6e5i 1 . 10 . 4301 . 1 1 18 ASP HB3 H -5.999 -6.975 -0.132 . . . 1.0 . . . . . . . . . . . . A . 18 ASP HB3 . . . . . . . . . c30497_6e5i 1 . 10 . 4302 . 1 1 18 ASP N N -5.730 -4.521 -1.453 . . . 1.0 . . . . . . . . . . . . A . 18 ASP N . . . . . . . . . c30497_6e5i 1 . 10 . 4303 . 1 1 18 ASP O O -7.882 -5.622 0.581 . . . 1.0 . . . . . . . . . . . . A . 18 ASP O . . . . . . . . . c30497_6e5i 1 . 10 . 4304 . 1 1 18 ASP OD1 O -7.858 -8.539 -0.728 . . . 1.0 . . . . . . . . . . . . A . 18 ASP OD1 . . . . . . . . . c30497_6e5i 1 . 10 . 4305 . 1 1 18 ASP OD2 O -7.088 -8.443 -2.776 . . . 1.0 . . . . . . . . . . . . A . 18 ASP OD2 . . . . . . . . . c30497_6e5i 1 . 10 . 4306 . 1 1 19 DPR C C -9.356 -3.114 1.014 . . . 1.0 . . . . . . . . . . . . A . 19 DPR C . . . . . . . . . c30497_6e5i 1 . 10 . 4307 . 1 1 19 DPR CA C -9.912 -3.867 -0.190 . . . 1.0 . . . . . . . . . . . . A . 19 DPR CA . . . . . . . . . c30497_6e5i 1 . 10 . 4308 . 1 1 19 DPR CB C -10.683 -2.917 -1.104 . . . 1.0 . . . . . . . . . . . . A . 19 DPR CB . . . . . . . . . c30497_6e5i 1 . 10 . 4309 . 1 1 19 DPR CD C -8.968 -3.918 -2.430 . . . 1.0 . . . . . . . . . . . . A . 19 DPR CD . . . . . . . . . c30497_6e5i 1 . 10 . 4310 . 1 1 19 DPR CG C -10.364 -3.368 -2.484 . . . 1.0 . . . . . . . . . . . . A . 19 DPR CG . . . . . . . . . c30497_6e5i 1 . 10 . 4311 . 1 1 19 DPR HA H -10.569 -4.652 0.144 . . . 1.0 . . . . . . . . . . . . A . 19 DPR HA . . . . . . . . . c30497_6e5i 1 . 10 . 4312 . 1 1 19 DPR HB2 H -10.352 -1.904 -0.934 . . . 1.0 . . . . . . . . . . . . A . 19 DPR HB2 . . . . . . . . . c30497_6e5i 1 . 10 . 4313 . 1 1 19 DPR HB3 H -11.739 -2.996 -0.897 . . . 1.0 . . . . . . . . . . . . A . 19 DPR HB3 . . . . . . . . . c30497_6e5i 1 . 10 . 4314 . 1 1 19 DPR HD2 H -8.245 -3.144 -2.645 . . . 1.0 . . . . . . . . . . . . A . 19 DPR HD2 . . . . . . . . . c30497_6e5i 1 . 10 . 4315 . 1 1 19 DPR HD3 H -8.861 -4.738 -3.123 . . . 1.0 . . . . . . . . . . . . A . 19 DPR HD3 . . . . . . . . . c30497_6e5i 1 . 10 . 4316 . 1 1 19 DPR HG2 H -10.411 -2.530 -3.161 . . . 1.0 . . . . . . . . . . . . A . 19 DPR HG2 . . . . . . . . . c30497_6e5i 1 . 10 . 4317 . 1 1 19 DPR HG3 H -11.059 -4.136 -2.787 . . . 1.0 . . . . . . . . . . . . A . 19 DPR HG3 . . . . . . . . . c30497_6e5i 1 . 10 . 4318 . 1 1 19 DPR N N -8.841 -4.383 -1.039 . . . 1.0 . . . . . . . . . . . . A . 19 DPR N . . . . . . . . . c30497_6e5i 1 . 10 . 4319 . 1 1 19 DPR O O -8.584 -2.167 0.863 . . . 1.0 . . . . . . . . . . . . A . 19 DPR O . . . . . . . . . c30497_6e5i 1 . 10 . 4320 . 1 1 20 PRO C C -7.853 -3.339 3.851 . . . 1.0 . . . . . . . . . . . . A . 20 PRO C . . . . . . . . . c30497_6e5i 1 . 10 . 4321 . 1 1 20 PRO CA C -9.265 -2.904 3.459 . . . 1.0 . . . . . . . . . . . . A . 20 PRO CA . . . . . . . . . c30497_6e5i 1 . 10 . 4322 . 1 1 20 PRO CB C -10.279 -3.391 4.490 . . . 1.0 . . . . . . . . . . . . A . 20 PRO CB . . . . . . . . . c30497_6e5i 1 . 10 . 4323 . 1 1 20 PRO CD C -10.668 -4.643 2.489 . . . 1.0 . . . . . . . . . . . . A . 20 PRO CD . . . . . . . . . c30497_6e5i 1 . 10 . 4324 . 1 1 20 PRO CG C -10.708 -4.727 3.991 . . . 1.0 . . . . . . . . . . . . A . 20 PRO CG . . . . . . . . . c30497_6e5i 1 . 10 . 4325 . 1 1 20 PRO HA H -9.304 -1.828 3.395 . . . 1.0 . . . . . . . . . . . . A . 20 PRO HA . . . . . . . . . c30497_6e5i 1 . 10 . 4326 . 1 1 20 PRO HB2 H -9.807 -3.461 5.457 . . . 1.0 . . . . . . . . . . . . A . 20 PRO HB2 . . . . . . . . . c30497_6e5i 1 . 10 . 4327 . 1 1 20 PRO HB3 H -11.108 -2.703 4.535 . . . 1.0 . . . . . . . . . . . . A . 20 PRO HB3 . . . . . . . . . c30497_6e5i 1 . 10 . 4328 . 1 1 20 PRO HD2 H -10.298 -5.566 2.068 . . . 1.0 . . . . . . . . . . . . A . 20 PRO HD2 . . . . . . . . . c30497_6e5i 1 . 10 . 4329 . 1 1 20 PRO HD3 H -11.649 -4.418 2.102 . . . 1.0 . . . . . . . . . . . . A . 20 PRO HD3 . . . . . . . . . c30497_6e5i 1 . 10 . 4330 . 1 1 20 PRO HG2 H -10.027 -5.486 4.342 . . . 1.0 . . . . . . . . . . . . A . 20 PRO HG2 . . . . . . . . . c30497_6e5i 1 . 10 . 4331 . 1 1 20 PRO HG3 H -11.711 -4.939 4.326 . . . 1.0 . . . . . . . . . . . . A . 20 PRO HG3 . . . . . . . . . c30497_6e5i 1 . 10 . 4332 . 1 1 20 PRO N N -9.733 -3.534 2.225 . . . 1.0 . . . . . . . . . . . . A . 20 PRO N . . . . . . . . . c30497_6e5i 1 . 10 . 4333 . 1 1 20 PRO O O -7.319 -2.893 4.867 . . . 1.0 . . . . . . . . . . . . A . 20 PRO O . . . . . . . . . c30497_6e5i 1 . 10 . 4334 . 1 1 21 ARG C C -4.892 -4.208 2.368 . . . 1.0 . . . . . . . . . . . . A . 21 ARG C . . . . . . . . . c30497_6e5i 1 . 10 . 4335 . 1 1 21 ARG CA C -5.924 -4.724 3.357 . . . 1.0 . . . . . . . . . . . . A . 21 ARG CA . . . . . . . . . c30497_6e5i 1 . 10 . 4336 . 1 1 21 ARG CB C -5.925 -6.250 3.340 . . . 1.0 . . . . . . . . . . . . A . 21 ARG CB . . . . . . . . . c30497_6e5i 1 . 10 . 4337 . 1 1 21 ARG CD C -6.760 -8.379 4.361 . . . 1.0 . . . . . . . . . . . . A . 21 ARG CD . . . . . . . . . c30497_6e5i 1 . 10 . 4338 . 1 1 21 ARG CG C -6.923 -6.871 4.298 . . . 1.0 . . . . . . . . . . . . A . 21 ARG CG . . . . . . . . . c30497_6e5i 1 . 10 . 4339 . 1 1 21 ARG CZ C -7.541 -9.247 6.535 . . . 1.0 . . . . . . . . . . . . A . 21 ARG CZ . . . . . . . . . c30497_6e5i 1 . 10 . 4340 . 1 1 21 ARG H H -7.694 -4.490 2.218 . . . 1.0 . . . . . . . . . . . . A . 21 ARG H . . . . . . . . . c30497_6e5i 1 . 10 . 4341 . 1 1 21 ARG HA H -5.658 -4.383 4.346 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HA . . . . . . . . . c30497_6e5i 1 . 10 . 4342 . 1 1 21 ARG HB2 H -6.160 -6.585 2.340 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HB2 . . . . . . . . . c30497_6e5i 1 . 10 . 4343 . 1 1 21 ARG HB3 H -4.938 -6.601 3.604 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HB3 . . . . . . . . . c30497_6e5i 1 . 10 . 4344 . 1 1 21 ARG HD2 H -6.874 -8.783 3.366 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HD2 . . . . . . . . . c30497_6e5i 1 . 10 . 4345 . 1 1 21 ARG HD3 H -5.770 -8.606 4.729 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HD3 . . . . . . . . . c30497_6e5i 1 . 10 . 4346 . 1 1 21 ARG HE H -8.609 -9.263 4.842 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HE . . . . . . . . . c30497_6e5i 1 . 10 . 4347 . 1 1 21 ARG HG2 H -6.765 -6.460 5.283 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HG2 . . . . . . . . . c30497_6e5i 1 . 10 . 4348 . 1 1 21 ARG HG3 H -7.924 -6.637 3.962 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HG3 . . . . . . . . . c30497_6e5i 1 . 10 . 4349 . 1 1 21 ARG HH11 H -5.696 -8.406 6.590 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HH11 . . . . . . . . . c30497_6e5i 1 . 10 . 4350 . 1 1 21 ARG HH12 H -6.251 -9.073 8.090 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HH12 . . . . . . . . . c30497_6e5i 1 . 10 . 4351 . 1 1 21 ARG HH21 H -9.346 -10.121 6.816 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HH21 . . . . . . . . . c30497_6e5i 1 . 10 . 4352 . 1 1 21 ARG HH22 H -8.327 -10.050 8.221 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HH22 . . . . . . . . . c30497_6e5i 1 . 10 . 4353 . 1 1 21 ARG N N -7.247 -4.204 3.047 . . . 1.0 . . . . . . . . . . . . A . 21 ARG N . . . . . . . . . c30497_6e5i 1 . 10 . 4354 . 1 1 21 ARG NE N -7.747 -9.000 5.243 . . . 1.0 . . . . . . . . . . . . A . 21 ARG NE . . . . . . . . . c30497_6e5i 1 . 10 . 4355 . 1 1 21 ARG NH1 N -6.406 -8.877 7.118 . . . 1.0 . . . . . . . . . . . . A . 21 ARG NH1 . . . . . . . . . c30497_6e5i 1 . 10 . 4356 . 1 1 21 ARG NH2 N -8.481 -9.852 7.249 . . . 1.0 . . . . . . . . . . . . A . 21 ARG NH2 . . . . . . . . . c30497_6e5i 1 . 10 . 4357 . 1 1 21 ARG O O -5.202 -3.956 1.206 . . . 1.0 . . . . . . . . . . . . A . 21 ARG O . . . . . . . . . c30497_6e5i 1 . 10 . 4358 . 1 1 22 TYR C C -1.367 -4.518 2.210 . . . 1.0 . . . . . . . . . . . . A . 22 TYR C . . . . . . . . . c30497_6e5i 1 . 10 . 4359 . 1 1 22 TYR CA C -2.572 -3.620 1.988 . . . 1.0 . . . . . . . . . . . . A . 22 TYR CA . . . . . . . . . c30497_6e5i 1 . 10 . 4360 . 1 1 22 TYR CB C -2.201 -2.163 2.268 . . . 1.0 . . . . . . . . . . . . A . 22 TYR CB . . . . . . . . . c30497_6e5i 1 . 10 . 4361 . 1 1 22 TYR CD1 C -3.521 -0.573 0.824 . . . 1.0 . . . . . . . . . . . . A . 22 TYR CD1 . . . . . . . . . c30497_6e5i 1 . 10 . 4362 . 1 1 22 TYR CD2 C -4.231 -0.904 3.075 . . . 1.0 . . . . . . . . . . . . A . 22 TYR CD2 . . . . . . . . . c30497_6e5i 1 . 10 . 4363 . 1 1 22 TYR CE1 C -4.560 0.312 0.621 . . . 1.0 . . . . . . . . . . . . A . 22 TYR CE1 . . . . . . . . . c30497_6e5i 1 . 10 . 4364 . 1 1 22 TYR CE2 C -5.274 -0.021 2.879 . . . 1.0 . . . . . . . . . . . . A . 22 TYR CE2 . . . . . . . . . c30497_6e5i 1 . 10 . 4365 . 1 1 22 TYR CG C -3.339 -1.194 2.053 . . . 1.0 . . . . . . . . . . . . A . 22 TYR CG . . . . . . . . . c30497_6e5i 1 . 10 . 4366 . 1 1 22 TYR CZ C -5.434 0.589 1.663 . . . 1.0 . . . . . . . . . . . . A . 22 TYR CZ . . . . . . . . . c30497_6e5i 1 . 10 . 4367 . 1 1 22 TYR H H -3.497 -4.216 3.790 . . . 1.0 . . . . . . . . . . . . A . 22 TYR H . . . . . . . . . c30497_6e5i 1 . 10 . 4368 . 1 1 22 TYR HA H -2.892 -3.712 0.961 . . . 1.0 . . . . . . . . . . . . A . 22 TYR HA . . . . . . . . . c30497_6e5i 1 . 10 . 4369 . 1 1 22 TYR HB2 H -1.877 -2.069 3.291 . . . 1.0 . . . . . . . . . . . . A . 22 TYR HB2 . . . . . . . . . c30497_6e5i 1 . 10 . 4370 . 1 1 22 TYR HB3 H -1.392 -1.875 1.613 . . . 1.0 . . . . . . . . . . . . A . 22 TYR HB3 . . . . . . . . . c30497_6e5i 1 . 10 . 4371 . 1 1 22 TYR HD1 H -2.833 -0.788 0.020 . . . 1.0 . . . . . . . . . . . . A . 22 TYR HD1 . . . . . . . . . c30497_6e5i 1 . 10 . 4372 . 1 1 22 TYR HD2 H -4.104 -1.381 4.035 . . . 1.0 . . . . . . . . . . . . A . 22 TYR HD2 . . . . . . . . . c30497_6e5i 1 . 10 . 4373 . 1 1 22 TYR HE1 H -4.682 0.784 -0.342 . . . 1.0 . . . . . . . . . . . . A . 22 TYR HE1 . . . . . . . . . c30497_6e5i 1 . 10 . 4374 . 1 1 22 TYR HE2 H -5.958 0.191 3.686 . . . 1.0 . . . . . . . . . . . . A . 22 TYR HE2 . . . . . . . . . c30497_6e5i 1 . 10 . 4375 . 1 1 22 TYR HH H -6.916 1.257 0.618 . . . 1.0 . . . . . . . . . . . . A . 22 TYR HH . . . . . . . . . c30497_6e5i 1 . 10 . 4376 . 1 1 22 TYR N N -3.669 -4.046 2.839 . . . 1.0 . . . . . . . . . . . . A . 22 TYR N . . . . . . . . . c30497_6e5i 1 . 10 . 4377 . 1 1 22 TYR O O -0.789 -4.538 3.299 . . . 1.0 . . . . . . . . . . . . A . 22 TYR O . . . . . . . . . c30497_6e5i 1 . 10 . 4378 . 1 1 22 TYR OH O -6.475 1.466 1.453 . . . 1.0 . . . . . . . . . . . . A . 22 TYR OH . . . . . . . . . c30497_6e5i 1 . 10 . 4379 . 1 1 23 GLU C C 1.411 -5.445 0.939 . . . 1.0 . . . . . . . . . . . . A . 23 GLU C . . . . . . . . . c30497_6e5i 1 . 10 . 4380 . 1 1 23 GLU CA C 0.125 -6.185 1.266 . . . 1.0 . . . . . . . . . . . . A . 23 GLU CA . . . . . . . . . c30497_6e5i 1 . 10 . 4381 . 1 1 23 GLU CB C -0.061 -7.370 0.317 . . . 1.0 . . . . . . . . . . . . A . 23 GLU CB . . . . . . . . . c30497_6e5i 1 . 10 . 4382 . 1 1 23 GLU CD C -0.926 -8.965 2.062 . . . 1.0 . . . . . . . . . . . . A . 23 GLU CD . . . . . . . . . c30497_6e5i 1 . 10 . 4383 . 1 1 23 GLU CG C -1.187 -8.304 0.725 . . . 1.0 . . . . . . . . . . . . A . 23 GLU CG . . . . . . . . . c30497_6e5i 1 . 10 . 4384 . 1 1 23 GLU H H -1.507 -5.196 0.343 . . . 1.0 . . . . . . . . . . . . A . 23 GLU H . . . . . . . . . c30497_6e5i 1 . 10 . 4385 . 1 1 23 GLU HA H 0.183 -6.551 2.280 . . . 1.0 . . . . . . . . . . . . A . 23 GLU HA . . . . . . . . . c30497_6e5i 1 . 10 . 4386 . 1 1 23 GLU HB2 H -0.273 -6.998 -0.672 . . . 1.0 . . . . . . . . . . . . A . 23 GLU HB2 . . . . . . . . . c30497_6e5i 1 . 10 . 4387 . 1 1 23 GLU HB3 H 0.855 -7.940 0.288 . . . 1.0 . . . . . . . . . . . . A . 23 GLU HB3 . . . . . . . . . c30497_6e5i 1 . 10 . 4388 . 1 1 23 GLU HG2 H -2.103 -7.738 0.794 . . . 1.0 . . . . . . . . . . . . A . 23 GLU HG2 . . . . . . . . . c30497_6e5i 1 . 10 . 4389 . 1 1 23 GLU HG3 H -1.294 -9.073 -0.026 . . . 1.0 . . . . . . . . . . . . A . 23 GLU HG3 . . . . . . . . . c30497_6e5i 1 . 10 . 4390 . 1 1 23 GLU N N -1.008 -5.271 1.185 . . . 1.0 . . . . . . . . . . . . A . 23 GLU N . . . . . . . . . c30497_6e5i 1 . 10 . 4391 . 1 1 23 GLU O O 1.418 -4.532 0.123 . . . 1.0 . . . . . . . . . . . . A . 23 GLU O . . . . . . . . . c30497_6e5i 1 . 10 . 4392 . 1 1 23 GLU OE1 O -1.408 -8.446 3.090 . . . 1.0 . . . . . . . . . . . . A . 23 GLU OE1 . . . . . . . . . c30497_6e5i 1 . 10 . 4393 . 1 1 23 GLU OE2 O -0.247 -10.010 2.096 . . . 1.0 . . . . . . . . . . . . A . 23 GLU OE2 . . . . . . . . . c30497_6e5i 1 . 10 . 4394 . 1 1 24 VAL C C 4.729 -5.974 0.594 . . . 1.0 . . . . . . . . . . . . A . 24 VAL C . . . . . . . . . c30497_6e5i 1 . 10 . 4395 . 1 1 24 VAL CA C 3.755 -5.141 1.412 . . . 1.0 . . . . . . . . . . . . A . 24 VAL CA . . . . . . . . . c30497_6e5i 1 . 10 . 4396 . 1 1 24 VAL CB C 4.381 -4.792 2.779 . . . 1.0 . . . . . . . . . . . . A . 24 VAL CB . . . . . . . . . c30497_6e5i 1 . 10 . 4397 . 1 1 24 VAL CG1 C 5.694 -4.045 2.600 . . . 1.0 . . . . . . . . . . . . A . 24 VAL CG1 . . . . . . . . . c30497_6e5i 1 . 10 . 4398 . 1 1 24 VAL CG2 C 3.406 -3.972 3.612 . . . 1.0 . . . . . . . . . . . . A . 24 VAL CG2 . . . . . . . . . c30497_6e5i 1 . 10 . 4399 . 1 1 24 VAL H H 2.451 -6.618 2.167 . . . 1.0 . . . . . . . . . . . . A . 24 VAL H . . . . . . . . . c30497_6e5i 1 . 10 . 4400 . 1 1 24 VAL HA H 3.557 -4.220 0.884 . . . 1.0 . . . . . . . . . . . . A . 24 VAL HA . . . . . . . . . c30497_6e5i 1 . 10 . 4401 . 1 1 24 VAL HB H 4.585 -5.715 3.305 . . . 1.0 . . . . . . . . . . . . A . 24 VAL HB . . . . . . . . . c30497_6e5i 1 . 10 . 4402 . 1 1 24 VAL HG11 H 6.379 -4.654 2.029 . . . 1.0 . . . . . . . . . . . . A . 24 VAL HG11 . . . . . . . . . c30497_6e5i 1 . 10 . 4403 . 1 1 24 VAL HG12 H 6.123 -3.832 3.568 . . . 1.0 . . . . . . . . . . . . A . 24 VAL HG12 . . . . . . . . . c30497_6e5i 1 . 10 . 4404 . 1 1 24 VAL HG13 H 5.511 -3.119 2.075 . . . 1.0 . . . . . . . . . . . . A . 24 VAL HG13 . . . . . . . . . c30497_6e5i 1 . 10 . 4405 . 1 1 24 VAL HG21 H 3.845 -3.757 4.575 . . . 1.0 . . . . . . . . . . . . A . 24 VAL HG21 . . . . . . . . . c30497_6e5i 1 . 10 . 4406 . 1 1 24 VAL HG22 H 2.492 -4.531 3.751 . . . 1.0 . . . . . . . . . . . . A . 24 VAL HG22 . . . . . . . . . c30497_6e5i 1 . 10 . 4407 . 1 1 24 VAL HG23 H 3.185 -3.045 3.100 . . . 1.0 . . . . . . . . . . . . A . 24 VAL HG23 . . . . . . . . . c30497_6e5i 1 . 10 . 4408 . 1 1 24 VAL N N 2.494 -5.837 1.578 . . . 1.0 . . . . . . . . . . . . A . 24 VAL N . . . . . . . . . c30497_6e5i 1 . 10 . 4409 . 1 1 24 VAL O O 5.137 -7.060 1.008 . . . 1.0 . . . . . . . . . . . . A . 24 VAL O . . . . . . . . . c30497_6e5i 1 . 10 . 4410 . 1 1 25 HIS C C 7.316 -5.335 -1.556 . . . 1.0 . . . . . . . . . . . . A . 25 HIS C . . . . . . . . . c30497_6e5i 1 . 10 . 4411 . 1 1 25 HIS CA C 6.028 -6.144 -1.452 . . . 1.0 . . . . . . . . . . . . A . 25 HIS CA . . . . . . . . . c30497_6e5i 1 . 10 . 4412 . 1 1 25 HIS CB C 5.411 -6.348 -2.839 . . . 1.0 . . . . . . . . . . . . A . 25 HIS CB . . . . . . . . . c30497_6e5i 1 . 10 . 4413 . 1 1 25 HIS CD2 C 7.276 -6.799 -4.592 . . . 1.0 . . . . . . . . . . . . A . 25 HIS CD2 . . . . . . . . . c30497_6e5i 1 . 10 . 4414 . 1 1 25 HIS CE1 C 6.983 -8.956 -4.819 . . . 1.0 . . . . . . . . . . . . A . 25 HIS CE1 . . . . . . . . . c30497_6e5i 1 . 10 . 4415 . 1 1 25 HIS CG C 6.261 -7.160 -3.771 . . . 1.0 . . . . . . . . . . . . A . 25 HIS CG . . . . . . . . . c30497_6e5i 1 . 10 . 4416 . 1 1 25 HIS H H 4.696 -4.609 -0.863 . . . 1.0 . . . . . . . . . . . . A . 25 HIS H . . . . . . . . . c30497_6e5i 1 . 10 . 4417 . 1 1 25 HIS HA H 6.251 -7.106 -1.020 . . . 1.0 . . . . . . . . . . . . A . 25 HIS HA . . . . . . . . . c30497_6e5i 1 . 10 . 4418 . 1 1 25 HIS HB2 H 4.463 -6.851 -2.732 . . . 1.0 . . . . . . . . . . . . A . 25 HIS HB2 . . . . . . . . . c30497_6e5i 1 . 10 . 4419 . 1 1 25 HIS HB3 H 5.248 -5.383 -3.295 . . . 1.0 . . . . . . . . . . . . A . 25 HIS HB3 . . . . . . . . . c30497_6e5i 1 . 10 . 4420 . 1 1 25 HIS HD1 H 5.442 -9.082 -3.478 . . . 1.0 . . . . . . . . . . . . A . 25 HIS HD1 . . . . . . . . . c30497_6e5i 1 . 10 . 4421 . 1 1 25 HIS HD2 H 7.678 -5.805 -4.716 . . . 1.0 . . . . . . . . . . . . A . 25 HIS HD2 . . . . . . . . . c30497_6e5i 1 . 10 . 4422 . 1 1 25 HIS HE1 H 7.091 -9.977 -5.149 . . . 1.0 . . . . . . . . . . . . A . 25 HIS HE1 . . . . . . . . . c30497_6e5i 1 . 10 . 4423 . 1 1 25 HIS HE2 H 8.501 -7.995 -5.804 . . . 1.0 . . . . . . . . . . . . A . 25 HIS HE2 . . . . . . . . . c30497_6e5i 1 . 10 . 4424 . 1 1 25 HIS N N 5.085 -5.467 -0.576 . . . 1.0 . . . . . . . . . . . . A . 25 HIS N . . . . . . . . . c30497_6e5i 1 . 10 . 4425 . 1 1 25 HIS ND1 N 6.103 -8.518 -3.939 . . . 1.0 . . . . . . . . . . . . A . 25 HIS ND1 . . . . . . . . . c30497_6e5i 1 . 10 . 4426 . 1 1 25 HIS NE2 N 7.706 -7.932 -5.230 . . . 1.0 . . . . . . . . . . . . A . 25 HIS NE2 . . . . . . . . . c30497_6e5i 1 . 10 . 4427 . 1 1 25 HIS O O 7.396 -4.370 -2.317 . . . 1.0 . . . . . . . . . . . . A . 25 HIS O . . . . . . . . . c30497_6e5i 1 . 10 . 4428 . 1 1 26 CYS C C 10.502 -5.602 -1.866 . . . 1.0 . . . . . . . . . . . . A . 26 CYS C . . . . . . . . . c30497_6e5i 1 . 10 . 4429 . 1 1 26 CYS CA C 9.592 -5.040 -0.779 . . . 1.0 . . . . . . . . . . . . A . 26 CYS CA . . . . . . . . . c30497_6e5i 1 . 10 . 4430 . 1 1 26 CYS CB C 10.254 -5.154 0.595 . . . 1.0 . . . . . . . . . . . . A . 26 CYS CB . . . . . . . . . c30497_6e5i 1 . 10 . 4431 . 1 1 26 CYS H H 8.178 -6.493 -0.186 . . . 1.0 . . . . . . . . . . . . A . 26 CYS H . . . . . . . . . c30497_6e5i 1 . 10 . 4432 . 1 1 26 CYS HA H 9.407 -3.998 -0.990 . . . 1.0 . . . . . . . . . . . . A . 26 CYS HA . . . . . . . . . c30497_6e5i 1 . 10 . 4433 . 1 1 26 CYS HB2 H 10.385 -6.198 0.837 . . . 1.0 . . . . . . . . . . . . A . 26 CYS HB2 . . . . . . . . . c30497_6e5i 1 . 10 . 4434 . 1 1 26 CYS HB3 H 11.219 -4.671 0.564 . . . 1.0 . . . . . . . . . . . . A . 26 CYS HB3 . . . . . . . . . c30497_6e5i 1 . 10 . 4435 . 1 1 26 CYS N N 8.309 -5.722 -0.778 . . . 1.0 . . . . . . . . . . . . A . 26 CYS N . . . . . . . . . c30497_6e5i 1 . 10 . 4436 . 1 1 26 CYS O O 10.771 -4.939 -2.868 . . . 1.0 . . . . . . . . . . . . A . 26 CYS O . . . . . . . . . c30497_6e5i 1 . 10 . 4437 . 1 1 26 CYS SG S 9.293 -4.391 1.941 . . . 1.0 . . . . . . . . . . . . A . 26 CYS SG . . . . . . . . . c30497_6e5i 1 . 10 . 4438 . 1 1 27 NH2 HN1 H 10.709 -7.299 -0.858 . . . 1.0 . . . . . . . . . . . . A . 27 NH2 HN1 . . . . . . . . . c30497_6e5i 1 . 10 . 4439 . 1 1 27 NH2 HN2 H 11.539 -7.213 -2.371 . . . 1.0 . . . . . . . . . . . . A . 27 NH2 HN2 . . . . . . . . . c30497_6e5i 1 . 10 . 4440 . 1 1 27 NH2 N N 10.963 -6.825 -1.678 . . . 1.0 . . . . . . . . . . . . A . 27 NH2 N . . . . . . . . . c30497_6e5i 1 stop_ save_ ########################### # Constraint Statistics # ########################### save_constraint_statistics _Constraint_stat_list.Sf_framecode constraint_statistics _Constraint_stat_list.Sf_category constraint_statistics _Constraint_stat_list.Entry_ID c30497_6e5i _Constraint_stat_list.ID 1 loop_ _Constraint_file.ID _Constraint_file.Constraint_filename _Constraint_file.Software_ID _Constraint_file.Software_label _Constraint_file.Software_name _Constraint_file.Block_ID _Constraint_file.Constraint_type _Constraint_file.Constraint_subtype _Constraint_file.Constraint_subsubtype _Constraint_file.Constraint_number _Constraint_file.Entry_ID _Constraint_file.Constraint_stat_list_ID 1 6e5i.mr . . 'MR format' 1 comment 'Not applicable' 'Not applicable' 0 c30497_6e5i 1 1 6e5i.mr . . XPLOR/CNS 2 distance NOE ambi 511 c30497_6e5i 1 1 6e5i.mr . . XPLOR/CNS 3 distance 'hydrogen bond' simple 24 c30497_6e5i 1 1 6e5i.mr . . XPLOR/CNS 4 'dihedral angle' 'Not applicable' 'Not applicable' 17 c30497_6e5i 1 1 6e5i.mr . . 'MR format' 5 'nomenclature mapping' 'Not applicable' 'Not applicable' 0 c30497_6e5i 1 stop_ save_ save_CNS/XPLOR_distance_constraints_2 _Gen_dist_constraint_list.Sf_category general_distance_constraints _Gen_dist_constraint_list.Sf_framecode CNS/XPLOR_distance_constraints_2 _Gen_dist_constraint_list.Entry_ID c30497_6e5i _Gen_dist_constraint_list.ID 1 _Gen_dist_constraint_list.Constraint_type NOE _Gen_dist_constraint_list.Details 'Generated by Wattos' _Gen_dist_constraint_list.Constraint_file_ID 1 _Gen_dist_constraint_list.Block_ID 2 loop_ _Gen_dist_constraint_software.Software_ID _Gen_dist_constraint_software.Software_label _Gen_dist_constraint_software.Method_ID _Gen_dist_constraint_software.Method_label _Gen_dist_constraint_software.Entry_ID _Gen_dist_constraint_software.Gen_dist_constraint_list_ID . . . . c30497_6e5i 1 stop_ loop_ _Gen_dist_constraint.ID _Gen_dist_constraint.Member_ID _Gen_dist_constraint.Member_logic_code _Gen_dist_constraint.Assembly_atom_ID_1 _Gen_dist_constraint.Entity_assembly_ID_1 _Gen_dist_constraint.Entity_ID_1 _Gen_dist_constraint.Comp_index_ID_1 _Gen_dist_constraint.Seq_ID_1 _Gen_dist_constraint.Comp_ID_1 _Gen_dist_constraint.Atom_ID_1 _Gen_dist_constraint.Atom_type_1 _Gen_dist_constraint.Atom_isotope_number_1 _Gen_dist_constraint.Resonance_ID_1 _Gen_dist_constraint.Assembly_atom_ID_2 _Gen_dist_constraint.Entity_assembly_ID_2 _Gen_dist_constraint.Entity_ID_2 _Gen_dist_constraint.Comp_index_ID_2 _Gen_dist_constraint.Seq_ID_2 _Gen_dist_constraint.Comp_ID_2 _Gen_dist_constraint.Atom_ID_2 _Gen_dist_constraint.Atom_type_2 _Gen_dist_constraint.Atom_isotope_number_2 _Gen_dist_constraint.Resonance_ID_2 _Gen_dist_constraint.Intensity_val _Gen_dist_constraint.Intensity_lower_val_err _Gen_dist_constraint.Intensity_upper_val_err _Gen_dist_constraint.Distance_val _Gen_dist_constraint.Distance_lower_bound_val _Gen_dist_constraint.Distance_upper_bound_val _Gen_dist_constraint.Contribution_fractional_val _Gen_dist_constraint.Spectral_peak_ID _Gen_dist_constraint.Spectral_peak_list_ID _Gen_dist_constraint.PDB_record_ID_1 _Gen_dist_constraint.PDB_model_num_1 _Gen_dist_constraint.PDB_strand_ID_1 _Gen_dist_constraint.PDB_ins_code_1 _Gen_dist_constraint.PDB_residue_no_1 _Gen_dist_constraint.PDB_residue_name_1 _Gen_dist_constraint.PDB_atom_name_1 _Gen_dist_constraint.PDB_record_ID_2 _Gen_dist_constraint.PDB_model_num_2 _Gen_dist_constraint.PDB_strand_ID_2 _Gen_dist_constraint.PDB_ins_code_2 _Gen_dist_constraint.PDB_residue_no_2 _Gen_dist_constraint.PDB_residue_name_2 _Gen_dist_constraint.PDB_atom_name_2 _Gen_dist_constraint.Auth_entity_assembly_ID_1 _Gen_dist_constraint.Auth_asym_ID_1 _Gen_dist_constraint.Auth_chain_ID_1 _Gen_dist_constraint.Auth_seq_ID_1 _Gen_dist_constraint.Auth_comp_ID_1 _Gen_dist_constraint.Auth_atom_ID_1 _Gen_dist_constraint.Auth_alt_ID_1 _Gen_dist_constraint.Auth_atom_name_1 _Gen_dist_constraint.Auth_entity_assembly_ID_2 _Gen_dist_constraint.Auth_asym_ID_2 _Gen_dist_constraint.Auth_chain_ID_2 _Gen_dist_constraint.Auth_seq_ID_2 _Gen_dist_constraint.Auth_comp_ID_2 _Gen_dist_constraint.Auth_atom_ID_2 _Gen_dist_constraint.Auth_alt_ID_2 _Gen_dist_constraint.Auth_atom_name_2 _Gen_dist_constraint.Entry_ID _Gen_dist_constraint.Gen_dist_constraint_list_ID 1 1 OR . 1 1 9 9 LYS H H . . . 1 1 9 9 LYS HB2 H . . . . . 2.131 1.563 2.699 . . . . . A . 9 LYS H . . A . 9 LYS HB2 . . . 9 . HN . . . . . 9 . HB1 . . c30497_6e5i 1 1 2 OR . 1 1 9 9 LYS H H . . . 1 1 8 8 LYS HB2 H . . . . . 2.131 1.563 2.699 . . . . . A . 9 LYS H . . A . 8 LYS HB2 . . . 9 . HN . . . . . 8 . HB1 . . c30497_6e5i 1 1 3 OR . 1 1 8 8 LYS HB3 H . . . 1 1 9 9 LYS H H . . . . . 2.131 1.563 2.699 . . . . . A . 8 LYS HB3 . . A . 9 LYS H . . . 8 . HB2 . . . . . 9 . HN . . c30497_6e5i 1 2 1 OR . 1 1 7 7 LEU HB3 H . . . 1 1 8 8 LYS H H . . . . . 2.234 1.610 2.858 . . . . . A . 7 LEU HB3 . . A . 8 LYS H . . . 7 . HB2 . . . . . 8 . HN . . c30497_6e5i 1 2 2 OR . 1 1 7 7 LEU HB3 H . . . 1 1 7 7 LEU H H . . . . . 2.234 1.610 2.858 . . . . . A . 7 LEU HB3 . . A . 7 LEU H . . . 7 . HB2 . . . . . 7 . HN . . c30497_6e5i 1 3 1 OR . 1 1 8 8 LYS H H . . . 1 1 7 7 LEU HA H . . . . . 2.319 1.647 2.991 . . . . . A . 8 LYS H . . A . 7 LEU HA . . . 8 . HN . . . . . 7 . HA . . c30497_6e5i 1 3 2 OR . 1 1 7 7 LEU H H . . . 1 1 7 7 LEU HA H . . . . . 2.319 1.647 2.991 . . . . . A . 7 LEU H . . A . 7 LEU HA . . . 7 . HN . . . . . 7 . HA . . c30497_6e5i 1 3 3 OR . 1 1 7 7 LEU H H . . . 1 1 6 6 GLU HA H . . . . . 2.319 1.647 2.991 . . . . . A . 7 LEU H . . A . 6 GLU HA . . . 7 . HN . . . . . 6 . HA . . c30497_6e5i 1 4 1 OR . 1 1 19 19 DPR HB2 H . . . 1 1 19 19 DPR HD2 H . . . . . 2.335 1.653 3.017 . . . . . A . 19 DPR HB2 . . A . 19 DPR HD2 . . . 19 . HB1 . . . . . 19 . HD1 . . c30497_6e5i 1 4 2 OR . 1 1 12 12 ORN HD3 H . . . 1 1 12 12 ORN HG3 H . . . . . 2.335 1.653 3.017 . . . . . A . 12 ORN HD3 . . A . 12 ORN HG3 . . . 12 . HD2 . . . . . 12 . HG2 . . c30497_6e5i 1 4 3 OR . 1 1 12 12 ORN HB3 H . . . 1 1 12 12 ORN HD3 H . . . . . 2.335 1.653 3.017 . . . . . A . 12 ORN HB3 . . A . 12 ORN HD3 . . . 12 . HB2 . . . . . 12 . HD2 . . c30497_6e5i 1 5 1 OR . 1 1 12 12 ORN HG3 H . . . 1 1 12 12 ORN HD2 H . . . . . 2.341 1.656 3.026 . . . . . A . 12 ORN HG3 . . A . 12 ORN HD2 . . . 12 . HG2 . . . . . 12 . HD1 . . c30497_6e5i 1 5 2 OR . 1 1 12 12 ORN HB3 H . . . 1 1 12 12 ORN HD2 H . . . . . 2.341 1.656 3.026 . . . . . A . 12 ORN HB3 . . A . 12 ORN HD2 . . . 12 . HB2 . . . . . 12 . HD1 . . c30497_6e5i 1 6 1 OR . 1 1 7 7 LEU HA H . . . 1 1 10 10 ARG HB2 H . . . . . 2.387 1.675 3.099 . . . . . A . 7 LEU HA . . A . 10 ARG HB2 . . . 7 . HA . . . . . 10 . HB1 . . c30497_6e5i 1 6 2 OR . 1 1 7 7 LEU HA H . . . 1 1 7 7 LEU HG H . . . . . 2.387 1.675 3.099 . . . . . A . 7 LEU HA . . A . 7 LEU HG . . . 7 . HA . . . . . 7 . HG . . c30497_6e5i 1 7 1 OR . 1 1 7 7 LEU HA H . . . 1 1 7 7 LEU HB2 H . . . . . 2.396 1.678 3.114 . . . . . A . 7 LEU HA . . A . 7 LEU HB2 . . . 7 . HA . . . . . 7 . HB1 . . c30497_6e5i 1 7 2 OR . 1 1 3 3 LYS HG3 H . . . 1 1 3 3 LYS HA H . . . . . 2.396 1.678 3.114 . . . . . A . 3 LYS HG3 . . A . 3 LYS HA . . . 3 . HG2 . . . . . 3 . HA . . c30497_6e5i 1 8 1 OR . 1 1 12 12 ORN HA H . . . 1 1 12 12 ORN HG2 H . . . . . 2.470 1.708 3.232 . . . . . A . 12 ORN HA . . A . 12 ORN HG2 . . . 12 . HA . . . . . 12 . HG1 . . c30497_6e5i 1 8 2 OR . 1 1 12 12 ORN HA H . . . 1 1 12 12 ORN HB2 H . . . . . 2.470 1.708 3.232 . . . . . A . 12 ORN HA . . A . 12 ORN HB2 . . . 12 . HA . . . . . 12 . HB1 . . c30497_6e5i 1 9 1 OR . 1 1 26 26 CYS HB3 H . . . 1 1 26 26 CYS H H . . . . . 2.482 1.712 3.252 . . . . . A . 26 CYS HB3 . . A . 26 CYS H . . . 26 . HB2 . . . . . 26 . HN . . c30497_6e5i 1 9 2 OR . 1 1 25 25 HIS HB3 H . . . 1 1 25 25 HIS H H . . . . . 2.482 1.712 3.252 . . . . . A . 25 HIS HB3 . . A . 25 HIS H . . . 25 . HB2 . . . . . 25 . HN . . c30497_6e5i 1 10 1 OR . 1 1 2 2 ASP HA H . . . 1 1 3 3 LYS H H . . . . . 2.494 1.717 3.271 . . . . . A . 2 ASP HA . . A . 3 LYS H . . . 2 . HA . . . . . 3 . HN . . c30497_6e5i 1 10 2 OR . 1 1 15 15 VAL HA H . . . 1 1 15 15 VAL H H . . . . . 2.494 1.717 3.271 . . . . . A . 15 VAL HA . . A . 15 VAL H . . . 15 . HA . . . . . 15 . HN . . c30497_6e5i 1 11 1 OR . 1 1 12 12 ORN HB3 H . . . 1 1 13 13 CYS H H . . . . . 2.587 1.751 3.423 . . . . . A . 12 ORN HB3 . . A . 13 CYS H . . . 12 . HB2 . . . . . 13 . HN . . c30497_6e5i 1 11 2 OR . 1 1 12 12 ORN HG3 H . . . 1 1 13 13 CYS H H . . . . . 2.587 1.751 3.423 . . . . . A . 12 ORN HG3 . . A . 13 CYS H . . . 12 . HG2 . . . . . 13 . HN . . c30497_6e5i 1 12 1 OR . 1 1 16 16 ARG HB3 H . . . 1 1 17 17 CYS H H . . . . . 2.608 1.758 3.458 . . . . . A . 16 ARG HB3 . . A . 17 CYS H . . . 16 . HB2 . . . . . 17 . HN . . c30497_6e5i 1 12 2 OR . 1 1 16 16 ARG HB3 H . . . 1 1 16 16 ARG H H . . . . . 2.608 1.758 3.458 . . . . . A . 16 ARG HB3 . . A . 16 ARG H . . . 16 . HB2 . . . . . 16 . HN . . c30497_6e5i 1 13 1 OR . 1 1 8 8 LYS H H . . . 1 1 7 7 LEU HB2 H . . . . . 2.637 1.768 3.506 . . . . . A . 8 LYS H . . A . 7 LEU HB2 . . . 8 . HN . . . . . 7 . HB1 . . c30497_6e5i 1 13 2 OR . 1 1 7 7 LEU H H . . . 1 1 7 7 LEU HB2 H . . . . . 2.637 1.768 3.506 . . . . . A . 7 LEU H . . A . 7 LEU HB2 . . . 7 . HN . . . . . 7 . HB1 . . c30497_6e5i 1 14 1 OR . 1 1 11 11 TYR H H . . . 1 1 10 10 ARG HA H . . . . . 2.663 1.777 3.549 . . . . . A . 11 TYR H . . A . 10 ARG HA . . . 11 . HN . . . . . 10 . HA . . c30497_6e5i 1 14 2 OR . 1 1 8 8 LYS HA H . . . 1 1 11 11 TYR H H . . . . . 2.663 1.777 3.549 . . . . . A . 8 LYS HA . . A . 11 TYR H . . . 8 . HA . . . . . 11 . HN . . c30497_6e5i 1 15 1 OR . 1 1 11 11 TYR HB3 H . . . 1 1 24 24 VAL MG1 H . . . . . 2.671 1.779 3.563 . . . . . A . 11 TYR HB3 . . A . 24 VAL MG1 . . . 11 . HB2 . . . . . 24 . HG11 . . c30497_6e5i 1 15 2 OR . 1 1 24 24 VAL MG1 H . . . 1 1 13 13 CYS HB3 H . . . . . 2.671 1.779 3.563 . . . . . A . 24 VAL MG1 . . A . 13 CYS HB3 . . . 24 . HG11 . . . . . 13 . HB2 . . c30497_6e5i 1 16 1 OR . 1 1 5 5 LYS HA H . . . 1 1 8 8 LYS HD3 H . . . . . 2.692 1.786 3.598 . . . . . A . 5 LYS HA . . A . 8 LYS HD3 . . . 5 . HA . . . . . 8 . HD2 . . c30497_6e5i 1 16 2 OR . 1 1 5 5 LYS HA H . . . 1 1 8 8 LYS HD2 H . . . . . 2.692 1.786 3.598 . . . . . A . 5 LYS HA . . A . 8 LYS HD2 . . . 5 . HA . . . . . 8 . HD1 . . c30497_6e5i 1 16 3 OR . 1 1 5 5 LYS HA H . . . 1 1 5 5 LYS HD2 H . . . . . 2.692 1.786 3.598 . . . . . A . 5 LYS HA . . A . 5 LYS HD2 . . . 5 . HA . . . . . 5 . HD1 . . c30497_6e5i 1 16 4 OR . 1 1 5 5 LYS HD3 H . . . 1 1 5 5 LYS HA H . . . . . 2.692 1.786 3.598 . . . . . A . 5 LYS HD3 . . A . 5 LYS HA . . . 5 . HD2 . . . . . 5 . HA . . c30497_6e5i 1 17 1 OR . 1 1 16 16 ARG HA H . . . 1 1 16 16 ARG HB2 H . . . . . 2.701 1.789 3.613 . . . . . A . 16 ARG HA . . A . 16 ARG HB2 . . . 16 . HA . . . . . 16 . HB1 . . c30497_6e5i 1 17 2 OR . 1 1 24 24 VAL HA H . . . 1 1 24 24 VAL HB H . . . . . 2.701 1.789 3.613 . . . . . A . 24 VAL HA . . A . 24 VAL HB . . . 24 . HA . . . . . 24 . HB . . c30497_6e5i 1 18 1 OR . 1 1 24 24 VAL MG1 H . . . 1 1 15 15 VAL MG1 H . . . . . 2.703 1.790 3.616 . . . . . A . 24 VAL MG1 . . A . 15 VAL MG1 . . . 24 . HG11 . . . . . 15 . HG11 . . c30497_6e5i 1 18 2 OR . 1 1 15 15 VAL MG1 H . . . 1 1 7 7 LEU MD1 H . . . . . 2.703 1.790 3.616 . . . . . A . 15 VAL MG1 . . A . 7 LEU MD1 . . . 15 . HG11 . . . . . 7 . HD11 . . c30497_6e5i 1 19 1 OR . 1 1 26 26 CYS H H . . . 1 1 24 24 VAL MG1 H . . . . . 2.754 1.806 3.702 . . . . . A . 26 CYS H . . A . 24 VAL MG1 . . . 26 . HN . . . . . 24 . HG11 . . c30497_6e5i 1 19 2 OR . 1 1 25 25 HIS H H . . . 1 1 24 24 VAL MG1 H . . . . . 2.754 1.806 3.702 . . . . . A . 25 HIS H . . A . 24 VAL MG1 . . . 25 . HN . . . . . 24 . HG11 . . c30497_6e5i 1 20 1 OR . 1 1 16 16 ARG H H . . . 1 1 24 24 VAL HA H . . . . . 2.788 1.816 3.760 . . . . . A . 16 ARG H . . A . 24 VAL HA . . . 16 . HN . . . . . 24 . HA . . c30497_6e5i 1 20 2 OR . 1 1 16 16 ARG H H . . . 1 1 16 16 ARG HA H . . . . . 2.788 1.816 3.760 . . . . . A . 16 ARG H . . A . 16 ARG HA . . . 16 . HN . . . . . 16 . HA . . c30497_6e5i 1 21 1 OR . 1 1 9 9 LYS H H . . . 1 1 9 9 LYS HD2 H . . . . . 2.843 1.833 3.853 . . . . . A . 9 LYS H . . A . 9 LYS HD2 . . . 9 . HN . . . . . 9 . HD1 . . c30497_6e5i 1 21 2 OR . 1 1 9 9 LYS H H . . . 1 1 9 9 LYS HD3 H . . . . . 2.843 1.833 3.853 . . . . . A . 9 LYS H . . A . 9 LYS HD3 . . . 9 . HN . . . . . 9 . HD2 . . c30497_6e5i 1 21 3 OR . 1 1 9 9 LYS H H . . . 1 1 8 8 LYS HD2 H . . . . . 2.843 1.833 3.853 . . . . . A . 9 LYS H . . A . 8 LYS HD2 . . . 9 . HN . . . . . 8 . HD1 . . c30497_6e5i 1 21 4 OR . 1 1 9 9 LYS H H . . . 1 1 8 8 LYS HD3 H . . . . . 2.843 1.833 3.853 . . . . . A . 9 LYS H . . A . 8 LYS HD3 . . . 9 . HN . . . . . 8 . HD2 . . c30497_6e5i 1 22 1 OR . 1 1 13 13 CYS HB3 H . . . 1 1 15 15 VAL MG1 H . . . . . 2.908 1.851 3.965 . . . . . A . 13 CYS HB3 . . A . 15 VAL MG1 . . . 13 . HB2 . . . . . 15 . HG11 . . c30497_6e5i 1 22 2 OR . 1 1 11 11 TYR HB3 H . . . 1 1 15 15 VAL MG1 H . . . . . 2.908 1.851 3.965 . . . . . A . 11 TYR HB3 . . A . 15 VAL MG1 . . . 11 . HB2 . . . . . 15 . HG11 . . c30497_6e5i 1 23 1 OR . 1 1 16 16 ARG H H . . . 1 1 23 23 GLU HB2 H . . . . . 2.967 1.867 4.067 . . . . . A . 16 ARG H . . A . 23 GLU HB2 . . . 16 . HN . . . . . 23 . HB1 . . c30497_6e5i 1 23 2 OR . 1 1 16 16 ARG H H . . . 1 1 15 15 VAL HB H . . . . . 2.967 1.867 4.067 . . . . . A . 16 ARG H . . A . 15 VAL HB . . . 16 . HN . . . . . 15 . HB . . c30497_6e5i 1 24 1 OR . 1 1 9 9 LYS H H . . . 1 1 7 7 LEU HA H . . . . . 2.971 1.867 4.075 . . . . . A . 9 LYS H . . A . 7 LEU HA . . . 9 . HN . . . . . 7 . HA . . c30497_6e5i 1 24 2 OR . 1 1 9 9 LYS H H . . . 1 1 6 6 GLU HA H . . . . . 2.971 1.867 4.075 . . . . . A . 9 LYS H . . A . 6 GLU HA . . . 9 . HN . . . . . 6 . HA . . c30497_6e5i 1 25 1 OR . 1 1 15 15 VAL H H . . . 1 1 14 14 GLU H H . . . . . 2.976 1.869 4.083 . . . . . A . 15 VAL H . . A . 14 GLU H . . . 15 . HN . . . . . 14 . HN . . c30497_6e5i 1 25 2 OR . 1 1 8 8 LYS H H . . . 1 1 15 15 VAL H H . . . . . 2.976 1.869 4.083 . . . . . A . 8 LYS H . . A . 15 VAL H . . . 8 . HN . . . . . 15 . HN . . c30497_6e5i 1 26 1 OR . 1 1 8 8 LYS HB3 H . . . 1 1 8 8 LYS QZ H . . . . . 3.004 1.876 4.132 . . . . . A . 8 LYS HB3 . . A . 8 LYS QZ . . . 8 . HB2 . . . . . 8 . HZ1 . . c30497_6e5i 1 26 2 OR . 1 1 8 8 LYS HB2 H . . . 1 1 8 8 LYS QZ H . . . . . 3.004 1.876 4.132 . . . . . A . 8 LYS HB2 . . A . 8 LYS QZ . . . 8 . HB1 . . . . . 8 . HZ1 . . c30497_6e5i 1 26 3 OR . 1 1 20 20 PRO HG2 H . . . 1 1 21 21 ARG H H . . . . . 3.004 1.876 4.132 . . . . . A . 20 PRO HG2 . . A . 21 ARG H . . . 20 . HG1 . . . . . 21 . HN . . c30497_6e5i 1 27 1 OR . 1 1 24 24 VAL HA H . . . 1 1 15 15 VAL MG2 H . . . . . 3.015 1.879 4.151 . . . . . A . 24 VAL HA . . A . 15 VAL MG2 . . . 24 . HA . . . . . 15 . HG21 . . c30497_6e5i 1 27 2 OR . 1 1 16 16 ARG HA H . . . 1 1 15 15 VAL MG2 H . . . . . 3.015 1.879 4.151 . . . . . A . 16 ARG HA . . A . 15 VAL MG2 . . . 16 . HA . . . . . 15 . HG21 . . c30497_6e5i 1 28 1 OR . 1 1 8 8 LYS H H . . . 1 1 4 4 CYS HA H . . . . . 3.023 1.881 4.165 . . . . . A . 8 LYS H . . A . 4 CYS HA . . . 8 . HN . . . . . 4 . HA . . c30497_6e5i 1 28 2 OR . 1 1 7 7 LEU H H . . . 1 1 4 4 CYS HA H . . . . . 3.023 1.881 4.165 . . . . . A . 7 LEU H . . A . 4 CYS HA . . . 7 . HN . . . . . 4 . HA . . c30497_6e5i 1 29 1 OR . 1 1 15 15 VAL HA H . . . 1 1 16 16 ARG HB2 H . . . . . 3.023 1.881 4.165 . . . . . A . 15 VAL HA . . A . 16 ARG HB2 . . . 15 . HA . . . . . 16 . HB1 . . c30497_6e5i 1 29 2 OR . 1 1 2 2 ASP HA H . . . 1 1 5 5 LYS HD2 H . . . . . 3.023 1.881 4.165 . . . . . A . 2 ASP HA . . A . 5 LYS HD2 . . . 2 . HA . . . . . 5 . HD1 . . c30497_6e5i 1 29 3 OR . 1 1 2 2 ASP HA H . . . 1 1 5 5 LYS HD3 H . . . . . 3.023 1.881 4.165 . . . . . A . 2 ASP HA . . A . 5 LYS HD3 . . . 2 . HA . . . . . 5 . HD2 . . c30497_6e5i 1 30 1 OR . 1 1 11 11 TYR H H . . . 1 1 10 10 ARG HB3 H . . . . . 3.057 1.889 4.225 . . . . . A . 11 TYR H . . A . 10 ARG HB3 . . . 11 . HN . . . . . 10 . HB2 . . c30497_6e5i 1 30 2 OR . 1 1 6 6 GLU H H . . . 1 1 3 3 LYS HB2 H . . . . . 3.057 1.889 4.225 . . . . . A . 6 GLU H . . A . 3 LYS HB2 . . . 6 . HN . . . . . 3 . HB1 . . c30497_6e5i 1 30 3 OR . 1 1 3 3 LYS HB3 H . . . 1 1 6 6 GLU H H . . . . . 3.057 1.889 4.225 . . . . . A . 3 LYS HB3 . . A . 6 GLU H . . . 3 . HB2 . . . . . 6 . HN . . c30497_6e5i 1 31 1 OR . 1 1 7 7 LEU H H . . . 1 1 7 7 LEU MD1 H . . . . . 3.107 1.900 4.314 . . . . . A . 7 LEU H . . A . 7 LEU MD1 . . . 7 . HN . . . . . 7 . HD11 . . c30497_6e5i 1 31 2 OR . 1 1 24 24 VAL MG1 H . . . 1 1 14 14 GLU H H . . . . . 3.107 1.900 4.314 . . . . . A . 24 VAL MG1 . . A . 14 GLU H . . . 24 . HG11 . . . . . 14 . HN . . c30497_6e5i 1 32 1 OR . 1 1 26 26 CYS H H . . . 1 1 13 13 CYS HB2 H . . . . . 3.111 1.901 4.321 . . . . . A . 26 CYS H . . A . 13 CYS HB2 . . . 26 . HN . . . . . 13 . HB1 . . c30497_6e5i 1 32 2 OR . 1 1 25 25 HIS H H . . . 1 1 13 13 CYS HB2 H . . . . . 3.111 1.901 4.321 . . . . . A . 25 HIS H . . A . 13 CYS HB2 . . . 25 . HN . . . . . 13 . HB1 . . c30497_6e5i 1 33 1 OR . 1 1 17 17 CYS H H . . . 1 1 22 22 TYR HA H . . . . . 3.135 1.907 4.363 . . . . . A . 17 CYS H . . A . 22 TYR HA . . . 17 . HN . . . . . 22 . HA . . c30497_6e5i 1 33 2 OR . 1 1 16 16 ARG H H . . . 1 1 22 22 TYR HA H . . . . . 3.135 1.907 4.363 . . . . . A . 16 ARG H . . A . 22 TYR HA . . . 16 . HN . . . . . 22 . HA . . c30497_6e5i 1 34 1 OR . 1 1 17 17 CYS H H . . . 1 1 16 16 ARG HG2 H . . . . . 3.160 1.912 4.408 . . . . . A . 17 CYS H . . A . 16 ARG HG2 . . . 17 . HN . . . . . 16 . HG1 . . c30497_6e5i 1 34 2 OR . 1 1 16 16 ARG H H . . . 1 1 16 16 ARG HG2 H . . . . . 3.160 1.912 4.408 . . . . . A . 16 ARG H . . A . 16 ARG HG2 . . . 16 . HN . . . . . 16 . HG1 . . c30497_6e5i 1 35 1 OR . 1 1 11 11 TYR H H . . . 1 1 9 9 LYS HB3 H . . . . . 3.224 1.925 4.523 . . . . . A . 11 TYR H . . A . 9 LYS HB3 . . . 11 . HN . . . . . 9 . HB2 . . c30497_6e5i 1 35 2 OR . 1 1 7 7 LEU HB3 H . . . 1 1 11 11 TYR H H . . . . . 3.224 1.925 4.523 . . . . . A . 7 LEU HB3 . . A . 11 TYR H . . . 7 . HB2 . . . . . 11 . HN . . c30497_6e5i 1 35 3 OR . 1 1 7 7 LEU HB3 H . . . 1 1 6 6 GLU H H . . . . . 3.224 1.925 4.523 . . . . . A . 7 LEU HB3 . . A . 6 GLU H . . . 7 . HB2 . . . . . 6 . HN . . c30497_6e5i 1 36 1 OR . 1 1 23 23 GLU HG2 H . . . 1 1 24 24 VAL H H . . . . . 3.229 1.926 4.532 . . . . . A . 23 GLU HG2 . . A . 24 VAL H . . . 23 . HG1 . . . . . 24 . HN . . c30497_6e5i 1 36 2 OR . 1 1 23 23 GLU HG3 H . . . 1 1 24 24 VAL H H . . . . . 3.229 1.926 4.532 . . . . . A . 23 GLU HG3 . . A . 24 VAL H . . . 23 . HG2 . . . . . 24 . HN . . c30497_6e5i 1 36 3 OR . 1 1 18 18 ASP H H . . . 1 1 23 23 GLU HG2 H . . . . . 3.229 1.926 4.532 . . . . . A . 18 ASP H . . A . 23 GLU HG2 . . . 18 . HN . . . . . 23 . HG1 . . c30497_6e5i 1 36 4 OR . 1 1 23 23 GLU HG3 H . . . 1 1 18 18 ASP H H . . . . . 3.229 1.926 4.532 . . . . . A . 23 GLU HG3 . . A . 18 ASP H . . . 23 . HG2 . . . . . 18 . HN . . c30497_6e5i 1 37 1 OR . 1 1 15 15 VAL HB H . . . 1 1 14 14 GLU HA H . . . . . 3.251 1.930 4.572 . . . . . A . 15 VAL HB . . A . 14 GLU HA . . . 15 . HB . . . . . 14 . HA . . c30497_6e5i 1 37 2 OR . 1 1 8 8 LYS HB2 H . . . 1 1 14 14 GLU HA H . . . . . 3.251 1.930 4.572 . . . . . A . 8 LYS HB2 . . A . 14 GLU HA . . . 8 . HB1 . . . . . 14 . HA . . c30497_6e5i 1 37 3 OR . 1 1 8 8 LYS HB3 H . . . 1 1 14 14 GLU HA H . . . . . 3.251 1.930 4.572 . . . . . A . 8 LYS HB3 . . A . 14 GLU HA . . . 8 . HB2 . . . . . 14 . HA . . c30497_6e5i 1 38 1 OR . 1 1 23 23 GLU HB2 H . . . 1 1 24 24 VAL H H . . . . . 3.265 1.933 4.597 . . . . . A . 23 GLU HB2 . . A . 24 VAL H . . . 23 . HB1 . . . . . 24 . HN . . c30497_6e5i 1 38 2 OR . 1 1 15 15 VAL HB H . . . 1 1 24 24 VAL H H . . . . . 3.265 1.933 4.597 . . . . . A . 15 VAL HB . . A . 24 VAL H . . . 15 . HB . . . . . 24 . HN . . c30497_6e5i 1 39 1 OR . 1 1 25 25 HIS HB3 H . . . 1 1 14 14 GLU H H . . . . . 3.284 1.936 4.632 . . . . . A . 25 HIS HB3 . . A . 14 GLU H . . . 25 . HB2 . . . . . 14 . HN . . c30497_6e5i 1 39 2 OR . 1 1 26 26 CYS HB3 H . . . 1 1 14 14 GLU H H . . . . . 3.284 1.936 4.632 . . . . . A . 26 CYS HB3 . . A . 14 GLU H . . . 26 . HB2 . . . . . 14 . HN . . c30497_6e5i 1 39 3 OR . 1 1 8 8 LYS H H . . . 1 1 4 4 CYS HB2 H . . . . . 3.284 1.936 4.632 . . . . . A . 8 LYS H . . A . 4 CYS HB2 . . . 8 . HN . . . . . 4 . HB1 . . c30497_6e5i 1 39 4 OR . 1 1 8 8 LYS H H . . . 1 1 4 4 CYS HB3 H . . . . . 3.284 1.936 4.632 . . . . . A . 8 LYS H . . A . 4 CYS HB3 . . . 8 . HN . . . . . 4 . HB2 . . c30497_6e5i 1 40 1 OR . 1 1 3 3 LYS HB2 H . . . 1 1 3 3 LYS HE3 H . . . . . 3.284 1.936 4.632 . . . . . A . 3 LYS HB2 . . A . 3 LYS HE3 . . . 3 . HB1 . . . . . 3 . HE2 . . c30497_6e5i 1 40 2 OR . 1 1 10 10 ARG HB3 H . . . 1 1 10 10 ARG HD2 H . . . . . 3.284 1.936 4.632 . . . . . A . 10 ARG HB3 . . A . 10 ARG HD2 . . . 10 . HB2 . . . . . 10 . HD1 . . c30497_6e5i 1 40 3 OR . 1 1 3 3 LYS HB2 H . . . 1 1 3 3 LYS HE2 H . . . . . 3.284 1.936 4.632 . . . . . A . 3 LYS HB2 . . A . 3 LYS HE2 . . . 3 . HB1 . . . . . 3 . HE1 . . c30497_6e5i 1 40 4 OR . 1 1 3 3 LYS HB3 H . . . 1 1 3 3 LYS HE2 H . . . . . 3.284 1.936 4.632 . . . . . A . 3 LYS HB3 . . A . 3 LYS HE2 . . . 3 . HB2 . . . . . 3 . HE1 . . c30497_6e5i 1 40 5 OR . 1 1 3 3 LYS HB3 H . . . 1 1 3 3 LYS HE3 H . . . . . 3.284 1.936 4.632 . . . . . A . 3 LYS HB3 . . A . 3 LYS HE3 . . . 3 . HB2 . . . . . 3 . HE2 . . c30497_6e5i 1 41 1 OR . 1 1 9 9 LYS H H . . . 1 1 11 11 TYR H H . . . . . 3.289 1.937 4.641 . . . . . A . 9 LYS H . . A . 11 TYR H . . . 9 . HN . . . . . 11 . HN . . c30497_6e5i 1 41 2 OR . 1 1 9 9 LYS H H . . . 1 1 6 6 GLU H H . . . . . 3.289 1.937 4.641 . . . . . A . 9 LYS H . . A . 6 GLU H . . . 9 . HN . . . . . 6 . HN . . c30497_6e5i 1 42 1 OR . 1 1 24 24 VAL HA H . . . 1 1 23 23 GLU HB2 H . . . . . 3.294 1.938 4.650 . . . . . A . 24 VAL HA . . A . 23 GLU HB2 . . . 24 . HA . . . . . 23 . HB1 . . c30497_6e5i 1 42 2 OR . 1 1 24 24 VAL HA H . . . 1 1 15 15 VAL HB H . . . . . 3.294 1.938 4.650 . . . . . A . 24 VAL HA . . A . 15 VAL HB . . . 24 . HA . . . . . 15 . HB . . c30497_6e5i 1 43 1 OR . 1 1 8 8 LYS H H . . . 1 1 15 15 VAL MG1 H . . . . . 3.304 1.940 4.668 . . . . . A . 8 LYS H . . A . 15 VAL MG1 . . . 8 . HN . . . . . 15 . HG11 . . c30497_6e5i 1 43 2 OR . 1 1 15 15 VAL MG1 H . . . 1 1 14 14 GLU H H . . . . . 3.304 1.940 4.668 . . . . . A . 15 VAL MG1 . . A . 14 GLU H . . . 15 . HG11 . . . . . 14 . HN . . c30497_6e5i 1 44 1 OR . 1 1 23 23 GLU H H . . . 1 1 17 17 CYS HA H . . . . . 3.341 1.946 4.736 . . . . . A . 23 GLU H . . A . 17 CYS HA . . . 23 . HN . . . . . 17 . HA . . c30497_6e5i 1 44 2 OR . 1 1 15 15 VAL HA H . . . 1 1 23 23 GLU H H . . . . . 3.341 1.946 4.736 . . . . . A . 15 VAL HA . . A . 23 GLU H . . . 15 . HA . . . . . 23 . HN . . c30497_6e5i 1 45 1 OR . 1 1 7 7 LEU H H . . . 1 1 7 7 LEU MD2 H . . . . . 3.346 1.946 4.746 . . . . . A . 7 LEU H . . A . 7 LEU MD2 . . . 7 . HN . . . . . 7 . HD21 . . c30497_6e5i 1 45 2 OR . 1 1 8 8 LYS H H . . . 1 1 7 7 LEU MD2 H . . . . . 3.346 1.946 4.746 . . . . . A . 8 LYS H . . A . 7 LEU MD2 . . . 8 . HN . . . . . 7 . HD21 . . c30497_6e5i 1 46 1 OR . 1 1 13 13 CYS HB3 H . . . 1 1 24 24 VAL MG2 H . . . . . 3.347 1.947 4.747 . . . . . A . 13 CYS HB3 . . A . 24 VAL MG2 . . . 13 . HB2 . . . . . 24 . HG21 . . c30497_6e5i 1 46 2 OR . 1 1 11 11 TYR HB3 H . . . 1 1 24 24 VAL MG2 H . . . . . 3.347 1.947 4.747 . . . . . A . 11 TYR HB3 . . A . 24 VAL MG2 . . . 11 . HB2 . . . . . 24 . HG21 . . c30497_6e5i 1 47 1 OR . 1 1 23 23 GLU H H . . . 1 1 21 21 ARG HB2 H . . . . . 3.361 1.949 4.773 . . . . . A . 23 GLU H . . A . 21 ARG HB2 . . . 23 . HN . . . . . 21 . HB1 . . c30497_6e5i 1 47 2 OR . 1 1 23 23 GLU H H . . . 1 1 21 21 ARG HB3 H . . . . . 3.361 1.949 4.773 . . . . . A . 23 GLU H . . A . 21 ARG HB3 . . . 23 . HN . . . . . 21 . HB2 . . c30497_6e5i 1 47 3 OR . 1 1 16 16 ARG HB3 H . . . 1 1 23 23 GLU H H . . . . . 3.361 1.949 4.773 . . . . . A . 16 ARG HB3 . . A . 23 GLU H . . . 16 . HB2 . . . . . 23 . HN . . c30497_6e5i 1 48 1 OR . 1 1 16 16 ARG H H . . . 1 1 24 24 VAL H H . . . . . 3.361 1.949 4.773 . . . . . A . 16 ARG H . . A . 24 VAL H . . . 16 . HN . . . . . 24 . HN . . c30497_6e5i 1 48 2 OR . 1 1 17 17 CYS H H . . . 1 1 18 18 ASP H H . . . . . 3.361 1.949 4.773 . . . . . A . 17 CYS H . . A . 18 ASP H . . . 17 . HN . . . . . 18 . HN . . c30497_6e5i 1 49 1 OR . 1 1 12 12 ORN HD2 H . . . 1 1 11 11 TYR H H . . . . . 3.383 1.952 4.814 . . . . . A . 12 ORN HD2 . . A . 11 TYR H . . . 12 . HD1 . . . . . 11 . HN . . c30497_6e5i 1 49 2 OR . 1 1 6 6 GLU H H . . . 1 1 4 4 CYS HB2 H . . . . . 3.383 1.952 4.814 . . . . . A . 6 GLU H . . A . 4 CYS HB2 . . . 6 . HN . . . . . 4 . HB1 . . c30497_6e5i 1 49 3 OR . 1 1 6 6 GLU H H . . . 1 1 4 4 CYS HB3 H . . . . . 3.383 1.952 4.814 . . . . . A . 6 GLU H . . A . 4 CYS HB3 . . . 6 . HN . . . . . 4 . HB2 . . c30497_6e5i 1 50 1 OR . 1 1 26 26 CYS H H . . . 1 1 24 24 VAL HB H . . . . . 3.391 1.953 4.829 . . . . . A . 26 CYS H . . A . 24 VAL HB . . . 26 . HN . . . . . 24 . HB . . c30497_6e5i 1 50 2 OR . 1 1 25 25 HIS H H . . . 1 1 24 24 VAL HB H . . . . . 3.391 1.953 4.829 . . . . . A . 25 HIS H . . A . 24 VAL HB . . . 25 . HN . . . . . 24 . HB . . c30497_6e5i 1 51 1 OR . 1 1 8 8 LYS H H . . . 1 1 15 15 VAL MG2 H . . . . . 3.419 1.958 4.880 . . . . . A . 8 LYS H . . A . 15 VAL MG2 . . . 8 . HN . . . . . 15 . HG21 . . c30497_6e5i 1 51 2 OR . 1 1 7 7 LEU H H . . . 1 1 15 15 VAL MG2 H . . . . . 3.419 1.958 4.880 . . . . . A . 7 LEU H . . A . 15 VAL MG2 . . . 7 . HN . . . . . 15 . HG21 . . c30497_6e5i 1 52 1 OR . 1 1 7 7 LEU HB2 H . . . 1 1 4 4 CYS HA H . . . . . 3.424 1.958 4.890 . . . . . A . 7 LEU HB2 . . A . 4 CYS HA . . . 7 . HB1 . . . . . 4 . HA . . c30497_6e5i 1 52 2 OR . 1 1 3 3 LYS HG3 H . . . 1 1 4 4 CYS HA H . . . . . 3.424 1.958 4.890 . . . . . A . 3 LYS HG3 . . A . 4 CYS HA . . . 3 . HG2 . . . . . 4 . HA . . c30497_6e5i 1 53 1 OR . 1 1 11 11 TYR H H . . . 1 1 10 10 ARG HG3 H . . . . . 3.440 1.961 4.919 . . . . . A . 11 TYR H . . A . 10 ARG HG3 . . . 11 . HN . . . . . 10 . HG2 . . c30497_6e5i 1 53 2 OR . 1 1 7 7 LEU HB2 H . . . 1 1 11 11 TYR H H . . . . . 3.440 1.961 4.919 . . . . . A . 7 LEU HB2 . . A . 11 TYR H . . . 7 . HB1 . . . . . 11 . HN . . c30497_6e5i 1 54 1 OR . 1 1 8 8 LYS H H . . . 1 1 5 5 LYS H H . . . . . 3.492 1.967 5.017 . . . . . A . 8 LYS H . . A . 5 LYS H . . . 8 . HN . . . . . 5 . HN . . c30497_6e5i 1 54 2 OR . 1 1 7 7 LEU H H . . . 1 1 5 5 LYS H H . . . . . 3.492 1.967 5.017 . . . . . A . 7 LEU H . . A . 5 LYS H . . . 7 . HN . . . . . 5 . HN . . c30497_6e5i 1 55 1 OR . 1 1 15 15 VAL MG1 H . . . 1 1 11 11 TYR HE2 H . . . . . 3.509 1.970 5.048 . . . . . A . 15 VAL MG1 . . A . 11 TYR HE2 . . . 15 . HG11 . . . . . 11 . HE2 . . c30497_6e5i 1 55 2 OR . 1 1 15 15 VAL MG2 H . . . 1 1 11 11 TYR HE1 H . . . . . 3.509 1.970 5.048 . . . . . A . 15 VAL MG2 . . A . 11 TYR HE1 . . . 15 . HG21 . . . . . 11 . HE1 . . c30497_6e5i 1 55 3 OR . 1 1 15 15 VAL MG1 H . . . 1 1 11 11 TYR HE1 H . . . . . 3.509 1.970 5.048 . . . . . A . 15 VAL MG1 . . A . 11 TYR HE1 . . . 15 . HG11 . . . . . 11 . HE1 . . c30497_6e5i 1 55 4 OR . 1 1 15 15 VAL MG2 H . . . 1 1 11 11 TYR HE2 H . . . . . 3.509 1.970 5.048 . . . . . A . 15 VAL MG2 . . A . 11 TYR HE2 . . . 15 . HG21 . . . . . 11 . HE2 . . c30497_6e5i 1 56 1 OR . 1 1 26 26 CYS H H . . . 1 1 13 13 CYS HB3 H . . . . . 3.514 1.971 5.057 . . . . . A . 26 CYS H . . A . 13 CYS HB3 . . . 26 . HN . . . . . 13 . HB2 . . c30497_6e5i 1 56 2 OR . 1 1 25 25 HIS H H . . . 1 1 13 13 CYS HB3 H . . . . . 3.514 1.971 5.057 . . . . . A . 25 HIS H . . A . 13 CYS HB3 . . . 25 . HN . . . . . 13 . HB2 . . c30497_6e5i 1 57 1 OR . 1 1 25 25 HIS HB3 H . . . 1 1 15 15 VAL H H . . . . . 3.541 1.973 5.109 . . . . . A . 25 HIS HB3 . . A . 15 VAL H . . . 25 . HB2 . . . . . 15 . HN . . c30497_6e5i 1 57 2 OR . 1 1 3 3 LYS H H . . . 1 1 4 4 CYS HB2 H . . . . . 3.541 1.973 5.109 . . . . . A . 3 LYS H . . A . 4 CYS HB2 . . . 3 . HN . . . . . 4 . HB1 . . c30497_6e5i 1 57 3 OR . 1 1 3 3 LYS H H . . . 1 1 4 4 CYS HB3 H . . . . . 3.541 1.973 5.109 . . . . . A . 3 LYS H . . A . 4 CYS HB3 . . . 3 . HN . . . . . 4 . HB2 . . c30497_6e5i 1 58 1 OR . 1 1 7 7 LEU HA H . . . 1 1 10 10 ARG HD2 H . . . . . 3.562 1.976 5.148 . . . . . A . 7 LEU HA . . A . 10 ARG HD2 . . . 7 . HA . . . . . 10 . HD1 . . c30497_6e5i 1 58 2 OR . 1 1 3 3 LYS HA H . . . 1 1 3 3 LYS HE2 H . . . . . 3.562 1.976 5.148 . . . . . A . 3 LYS HA . . A . 3 LYS HE2 . . . 3 . HA . . . . . 3 . HE1 . . c30497_6e5i 1 58 3 OR . 1 1 3 3 LYS HA H . . . 1 1 3 3 LYS HE3 H . . . . . 3.562 1.976 5.148 . . . . . A . 3 LYS HA . . A . 3 LYS HE3 . . . 3 . HA . . . . . 3 . HE2 . . c30497_6e5i 1 59 1 OR . 1 1 15 15 VAL MG2 H . . . 1 1 16 16 ARG HD3 H . . . . . 3.694 1.989 5.399 . . . . . A . 15 VAL MG2 . . A . 16 ARG HD3 . . . 15 . HG21 . . . . . 16 . HD2 . . c30497_6e5i 1 59 2 OR . 1 1 11 11 TYR HB3 H . . . 1 1 15 15 VAL MG2 H . . . . . 3.694 1.989 5.399 . . . . . A . 11 TYR HB3 . . A . 15 VAL MG2 . . . 11 . HB2 . . . . . 15 . HG21 . . c30497_6e5i 1 59 3 OR . 1 1 15 15 VAL MG2 H . . . 1 1 16 16 ARG HD2 H . . . . . 3.694 1.989 5.399 . . . . . A . 15 VAL MG2 . . A . 16 ARG HD2 . . . 15 . HG21 . . . . . 16 . HD1 . . c30497_6e5i 1 60 1 OR . 1 1 17 17 CYS H H . . . 1 1 16 16 ARG HD3 H . . . . . 3.698 1.988 5.408 . . . . . A . 17 CYS H . . A . 16 ARG HD3 . . . 17 . HN . . . . . 16 . HD2 . . c30497_6e5i 1 60 2 OR . 1 1 17 17 CYS H H . . . 1 1 16 16 ARG HD2 H . . . . . 3.698 1.988 5.408 . . . . . A . 17 CYS H . . A . 16 ARG HD2 . . . 17 . HN . . . . . 16 . HD1 . . c30497_6e5i 1 60 3 OR . 1 1 16 16 ARG H H . . . 1 1 16 16 ARG HD2 H . . . . . 3.698 1.988 5.408 . . . . . A . 16 ARG H . . A . 16 ARG HD2 . . . 16 . HN . . . . . 16 . HD1 . . c30497_6e5i 1 60 4 OR . 1 1 16 16 ARG H H . . . 1 1 16 16 ARG HD3 H . . . . . 3.698 1.988 5.408 . . . . . A . 16 ARG H . . A . 16 ARG HD3 . . . 16 . HN . . . . . 16 . HD2 . . c30497_6e5i 1 61 1 OR . 1 1 7 7 LEU HA H . . . 1 1 7 7 LEU MD1 H . . . . . 3.731 1.991 5.471 . . . . . A . 7 LEU HA . . A . 7 LEU MD1 . . . 7 . HA . . . . . 7 . HD11 . . c30497_6e5i 1 61 2 OR . 1 1 3 3 LYS HA H . . . 1 1 7 7 LEU MD1 H . . . . . 3.731 1.991 5.471 . . . . . A . 3 LYS HA . . A . 7 LEU MD1 . . . 3 . HA . . . . . 7 . HD11 . . c30497_6e5i 1 62 1 OR . 1 1 6 6 GLU HA H . . . 1 1 5 5 LYS HG2 H . . . . . 3.824 1.996 5.652 . . . . . A . 6 GLU HA . . A . 5 LYS HG2 . . . 6 . HA . . . . . 5 . HG1 . . c30497_6e5i 1 62 2 OR . 1 1 6 6 GLU HA H . . . 1 1 9 9 LYS HG2 H . . . . . 3.824 1.996 5.652 . . . . . A . 6 GLU HA . . A . 9 LYS HG2 . . . 6 . HA . . . . . 9 . HG1 . . c30497_6e5i 1 63 1 OR . 1 1 9 9 LYS HA H . . . 1 1 10 10 ARG H H . . . . . 3.839 1.997 5.681 . . . . . A . 9 LYS HA . . A . 10 ARG H . . . 9 . HA . . . . . 10 . HN . . c30497_6e5i 1 63 2 OR . 1 1 11 11 TYR H H . . . 1 1 9 9 LYS HA H . . . . . 3.839 1.997 5.681 . . . . . A . 11 TYR H . . A . 9 LYS HA . . . 11 . HN . . . . . 9 . HA . . c30497_6e5i 1 64 1 OR . 1 1 7 7 LEU H H . . . 1 1 10 10 ARG HB3 H . . . . . 3.847 1.997 5.697 . . . . . A . 7 LEU H . . A . 10 ARG HB3 . . . 7 . HN . . . . . 10 . HB2 . . c30497_6e5i 1 64 2 OR . 1 1 8 8 LYS H H . . . 1 1 10 10 ARG HB3 H . . . . . 3.847 1.997 5.697 . . . . . A . 8 LYS H . . A . 10 ARG HB3 . . . 8 . HN . . . . . 10 . HB2 . . c30497_6e5i 1 64 3 OR . 1 1 7 7 LEU H H . . . 1 1 3 3 LYS HB2 H . . . . . 3.847 1.997 5.697 . . . . . A . 7 LEU H . . A . 3 LYS HB2 . . . 7 . HN . . . . . 3 . HB1 . . c30497_6e5i 1 64 4 OR . 1 1 7 7 LEU H H . . . 1 1 3 3 LYS HB3 H . . . . . 3.847 1.997 5.697 . . . . . A . 7 LEU H . . A . 3 LYS HB3 . . . 7 . HN . . . . . 3 . HB2 . . c30497_6e5i 1 65 1 OR . 1 1 15 15 VAL MG2 H . . . 1 1 24 24 VAL H H . . . . . 3.910 1.999 5.821 . . . . . A . 15 VAL MG2 . . A . 24 VAL H . . . 15 . HG21 . . . . . 24 . HN . . c30497_6e5i 1 65 2 OR . 1 1 15 15 VAL MG2 H . . . 1 1 18 18 ASP H H . . . . . 3.910 1.999 5.821 . . . . . A . 15 VAL MG2 . . A . 18 ASP H . . . 15 . HG21 . . . . . 18 . HN . . c30497_6e5i 1 66 1 OR . 1 1 8 8 LYS HB3 H . . . 1 1 11 11 TYR HD2 H . . . . . 3.946 2.000 5.892 . . . . . A . 8 LYS HB3 . . A . 11 TYR HD2 . . . 8 . HB2 . . . . . 11 . HD2 . . c30497_6e5i 1 66 2 OR . 1 1 12 12 ORN HG2 H . . . 1 1 11 11 TYR HD1 H . . . . . 3.946 2.000 5.892 . . . . . A . 12 ORN HG2 . . A . 11 TYR HD1 . . . 12 . HG1 . . . . . 11 . HD1 . . c30497_6e5i 1 66 3 OR . 1 1 8 8 LYS HB3 H . . . 1 1 11 11 TYR HD1 H . . . . . 3.946 2.000 5.892 . . . . . A . 8 LYS HB3 . . A . 11 TYR HD1 . . . 8 . HB2 . . . . . 11 . HD1 . . c30497_6e5i 1 66 4 OR . 1 1 8 8 LYS HB2 H . . . 1 1 11 11 TYR HD2 H . . . . . 3.946 2.000 5.892 . . . . . A . 8 LYS HB2 . . A . 11 TYR HD2 . . . 8 . HB1 . . . . . 11 . HD2 . . c30497_6e5i 1 66 5 OR . 1 1 9 9 LYS HB2 H . . . 1 1 11 11 TYR HD1 H . . . . . 3.946 2.000 5.892 . . . . . A . 9 LYS HB2 . . A . 11 TYR HD1 . . . 9 . HB1 . . . . . 11 . HD1 . . c30497_6e5i 1 66 6 OR . 1 1 8 8 LYS HB2 H . . . 1 1 11 11 TYR HD1 H . . . . . 3.946 2.000 5.892 . . . . . A . 8 LYS HB2 . . A . 11 TYR HD1 . . . 8 . HB1 . . . . . 11 . HD1 . . c30497_6e5i 1 66 7 OR . 1 1 12 12 ORN HG2 H . . . 1 1 11 11 TYR HD2 H . . . . . 3.946 2.000 5.892 . . . . . A . 12 ORN HG2 . . A . 11 TYR HD2 . . . 12 . HG1 . . . . . 11 . HD2 . . c30497_6e5i 1 66 8 OR . 1 1 9 9 LYS HB2 H . . . 1 1 11 11 TYR HD2 H . . . . . 3.946 2.000 5.892 . . . . . A . 9 LYS HB2 . . A . 11 TYR HD2 . . . 9 . HB1 . . . . . 11 . HD2 . . c30497_6e5i 1 67 1 OR . 1 1 10 10 ARG HA H . . . 1 1 9 9 LYS HG2 H . . . . . 3.975 2.000 5.950 . . . . . A . 10 ARG HA . . A . 9 LYS HG2 . . . 10 . HA . . . . . 9 . HG1 . . c30497_6e5i 1 67 2 OR . 1 1 8 8 LYS HA H . . . 1 1 9 9 LYS HG2 H . . . . . 3.975 2.000 5.950 . . . . . A . 8 LYS HA . . A . 9 LYS HG2 . . . 8 . HA . . . . . 9 . HG1 . . c30497_6e5i 1 68 1 OR . 1 1 10 10 ARG HB3 H . . . 1 1 7 7 LEU MD2 H . . . . . 3.982 1.999 5.965 . . . . . A . 10 ARG HB3 . . A . 7 LEU MD2 . . . 10 . HB2 . . . . . 7 . HD21 . . c30497_6e5i 1 68 2 OR . 1 1 3 3 LYS HB2 H . . . 1 1 7 7 LEU MD2 H . . . . . 3.982 1.999 5.965 . . . . . A . 3 LYS HB2 . . A . 7 LEU MD2 . . . 3 . HB1 . . . . . 7 . HD21 . . c30497_6e5i 1 68 3 OR . 1 1 3 3 LYS HB3 H . . . 1 1 7 7 LEU MD2 H . . . . . 3.982 1.999 5.965 . . . . . A . 3 LYS HB3 . . A . 7 LEU MD2 . . . 3 . HB2 . . . . . 7 . HD21 . . c30497_6e5i 1 69 1 OR . 1 1 16 16 ARG HA H . . . 1 1 23 23 GLU H H . . . . . 4.006 2.000 6.012 . . . . . A . 16 ARG HA . . A . 23 GLU H . . . 16 . HA . . . . . 23 . HN . . c30497_6e5i 1 69 2 OR . 1 1 24 24 VAL HA H . . . 1 1 23 23 GLU H H . . . . . 4.006 2.000 6.012 . . . . . A . 24 VAL HA . . A . 23 GLU H . . . 24 . HA . . . . . 23 . HN . . c30497_6e5i 1 70 1 OR . 1 1 21 21 ARG H H . . . 1 1 18 18 ASP HB2 H . . . . . 4.013 2.000 6.026 . . . . . A . 21 ARG H . . A . 18 ASP HB2 . . . 21 . HN . . . . . 18 . HB1 . . c30497_6e5i 1 70 2 OR . 1 1 8 8 LYS QZ H . . . 1 1 14 14 GLU HG3 H . . . . . 4.013 2.000 6.026 . . . . . A . 8 LYS QZ . . A . 14 GLU HG3 . . . 8 . HZ1 . . . . . 14 . HG2 . . c30497_6e5i 1 71 1 OR . 1 1 8 8 LYS H H . . . 1 1 11 11 TYR HD1 H . . . . . 4.297 1.989 6.605 . . . . . A . 8 LYS H . . A . 11 TYR HD1 . . . 8 . HN . . . . . 11 . HD1 . . c30497_6e5i 1 71 2 OR . 1 1 8 8 LYS H H . . . 1 1 11 11 TYR HD2 H . . . . . 4.297 1.989 6.605 . . . . . A . 8 LYS H . . A . 11 TYR HD2 . . . 8 . HN . . . . . 11 . HD2 . . c30497_6e5i 1 71 3 OR . 1 1 7 7 LEU H H . . . 1 1 11 11 TYR HD2 H . . . . . 4.297 1.989 6.605 . . . . . A . 7 LEU H . . A . 11 TYR HD2 . . . 7 . HN . . . . . 11 . HD2 . . c30497_6e5i 1 71 4 OR . 1 1 7 7 LEU H H . . . 1 1 11 11 TYR HD1 H . . . . . 4.297 1.989 6.605 . . . . . A . 7 LEU H . . A . 11 TYR HD1 . . . 7 . HN . . . . . 11 . HD1 . . c30497_6e5i 1 72 1 OR . 1 1 17 17 CYS H H . . . 1 1 22 22 TYR HD1 H . . . . . 4.466 1.973 6.959 . . . . . A . 17 CYS H . . A . 22 TYR HD1 . . . 17 . HN . . . . . 22 . HD1 . . c30497_6e5i 1 72 2 OR . 1 1 17 17 CYS H H . . . 1 1 22 22 TYR HD2 H . . . . . 4.466 1.973 6.959 . . . . . A . 17 CYS H . . A . 22 TYR HD2 . . . 17 . HN . . . . . 22 . HD2 . . c30497_6e5i 1 72 3 OR . 1 1 16 16 ARG H H . . . 1 1 22 22 TYR HD2 H . . . . . 4.466 1.973 6.959 . . . . . A . 16 ARG H . . A . 22 TYR HD2 . . . 16 . HN . . . . . 22 . HD2 . . c30497_6e5i 1 72 4 OR . 1 1 16 16 ARG H H . . . 1 1 22 22 TYR HD1 H . . . . . 4.466 1.973 6.959 . . . . . A . 16 ARG H . . A . 22 TYR HD1 . . . 16 . HN . . . . . 22 . HD1 . . c30497_6e5i 1 73 1 . . 1 1 25 25 HIS HB3 H . . . 1 1 25 25 HIS HB2 H . . . . . 1.688 1.332 2.044 . . . . . A . 25 HIS HB3 . . A . 25 HIS HB2 . . . 25 . HB2 . . . . . 25 . HB1 . . c30497_6e5i 1 74 1 . . 1 1 18 18 ASP HB2 H . . . 1 1 18 18 ASP HB3 H . . . . . 1.780 1.384 2.176 . . . . . A . 18 ASP HB2 . . A . 18 ASP HB3 . . . 18 . HB1 . . . . . 18 . HB2 . . c30497_6e5i 1 75 1 OR . 1 1 22 22 TYR HD1 H . . . 1 1 22 22 TYR HE2 H . . . . . 1.804 1.397 2.211 . . . . . A . 22 TYR HD1 . . A . 22 TYR HE2 . . . 22 . HD1 . . . . . 22 . HE2 . . c30497_6e5i 1 75 2 OR . 1 1 22 22 TYR HD2 H . . . 1 1 22 22 TYR HE2 H . . . . . 1.804 1.397 2.211 . . . . . A . 22 TYR HD2 . . A . 22 TYR HE2 . . . 22 . HD2 . . . . . 22 . HE2 . . c30497_6e5i 1 75 3 OR . 1 1 22 22 TYR HD2 H . . . 1 1 22 22 TYR HE1 H . . . . . 1.804 1.397 2.211 . . . . . A . 22 TYR HD2 . . A . 22 TYR HE1 . . . 22 . HD2 . . . . . 22 . HE1 . . c30497_6e5i 1 75 4 OR . 1 1 22 22 TYR HD1 H . . . 1 1 22 22 TYR HE1 H . . . . . 1.804 1.397 2.211 . . . . . A . 22 TYR HD1 . . A . 22 TYR HE1 . . . 22 . HD1 . . . . . 22 . HE1 . . c30497_6e5i 1 76 1 . . 1 1 11 11 TYR HB3 H . . . 1 1 11 11 TYR HB2 H . . . . . 1.806 1.398 2.214 . . . . . A . 11 TYR HB3 . . A . 11 TYR HB2 . . . 11 . HB2 . . . . . 11 . HB1 . . c30497_6e5i 1 77 1 . . 1 1 13 13 CYS HB3 H . . . 1 1 13 13 CYS HB2 H . . . . . 1.814 1.403 2.225 . . . . . A . 13 CYS HB3 . . A . 13 CYS HB2 . . . 13 . HB2 . . . . . 13 . HB1 . . c30497_6e5i 1 78 1 . . 1 1 26 26 CYS HB3 H . . . 1 1 26 26 CYS HB2 H . . . . . 1.815 1.403 2.227 . . . . . A . 26 CYS HB3 . . A . 26 CYS HB2 . . . 26 . HB2 . . . . . 26 . HB1 . . c30497_6e5i 1 79 1 . . 1 1 12 12 ORN HD3 H . . . 1 1 12 12 ORN HD2 H . . . . . 1.816 1.404 2.228 . . . . . A . 12 ORN HD3 . . A . 12 ORN HD2 . . . 12 . HD2 . . . . . 12 . HD1 . . c30497_6e5i 1 80 1 . . 1 1 1 1 ASN HD21 H . . . 1 1 1 1 ASN HD22 H . . . . . 1.830 1.411 2.249 . . . . . A . 1 ASN HD21 . . A . 1 ASN HD22 . . . 1 . HD21 . . . . . 1 . HD22 . . c30497_6e5i 1 81 1 . . 1 1 17 17 CYS HB2 H . . . 1 1 17 17 CYS HB3 H . . . . . 1.848 1.421 2.275 . . . . . A . 17 CYS HB2 . . A . 17 CYS HB3 . . . 17 . HB1 . . . . . 17 . HB2 . . c30497_6e5i 1 82 1 . . 1 1 20 20 PRO HD2 H . . . 1 1 20 20 PRO HD3 H . . . . . 1.872 1.434 2.310 . . . . . A . 20 PRO HD2 . . A . 20 PRO HD3 . . . 20 . HD1 . . . . . 20 . HD2 . . c30497_6e5i 1 83 1 . . 1 1 19 19 DPR HD2 H . . . 1 1 19 19 DPR HD3 H . . . . . 1.885 1.441 2.329 . . . . . A . 19 DPR HD2 . . A . 19 DPR HD3 . . . 19 . HD1 . . . . . 19 . HD2 . . c30497_6e5i 1 84 1 OR . 1 1 11 11 TYR HE2 H . . . 1 1 11 11 TYR HD2 H . . . . . 2.002 1.501 2.503 . . . . . A . 11 TYR HE2 . . A . 11 TYR HD2 . . . 11 . HE2 . . . . . 11 . HD2 . . c30497_6e5i 1 84 2 OR . 1 1 11 11 TYR HE2 H . . . 1 1 11 11 TYR HD1 H . . . . . 2.002 1.501 2.503 . . . . . A . 11 TYR HE2 . . A . 11 TYR HD1 . . . 11 . HE2 . . . . . 11 . HD1 . . c30497_6e5i 1 84 3 OR . 1 1 11 11 TYR HE1 H . . . 1 1 11 11 TYR HD2 H . . . . . 2.002 1.501 2.503 . . . . . A . 11 TYR HE1 . . A . 11 TYR HD2 . . . 11 . HE1 . . . . . 11 . HD2 . . c30497_6e5i 1 84 4 OR . 1 1 11 11 TYR HE1 H . . . 1 1 11 11 TYR HD1 H . . . . . 2.002 1.501 2.503 . . . . . A . 11 TYR HE1 . . A . 11 TYR HD1 . . . 11 . HE1 . . . . . 11 . HD1 . . c30497_6e5i 1 85 1 . . 1 1 17 17 CYS H H . . . 1 1 16 16 ARG HA H . . . . . 2.054 1.527 2.581 . . . . . A . 17 CYS H . . A . 16 ARG HA . . . 17 . HN . . . . . 16 . HA . . c30497_6e5i 1 86 1 . . 1 1 26 26 CYS H H . . . 1 1 25 25 HIS HA H . . . . . 2.058 1.529 2.587 . . . . . A . 26 CYS H . . A . 25 HIS HA . . . 26 . HN . . . . . 25 . HA . . c30497_6e5i 1 87 1 . . 1 1 15 15 VAL H H . . . 1 1 14 14 GLU HA H . . . . . 2.065 1.532 2.598 . . . . . A . 15 VAL H . . A . 14 GLU HA . . . 15 . HN . . . . . 14 . HA . . c30497_6e5i 1 88 1 . . 1 1 24 24 VAL H H . . . 1 1 23 23 GLU HA H . . . . . 2.089 1.544 2.634 . . . . . A . 24 VAL H . . A . 23 GLU HA . . . 24 . HN . . . . . 23 . HA . . c30497_6e5i 1 89 1 . . 1 1 25 25 HIS H H . . . 1 1 24 24 VAL HA H . . . . . 2.099 1.548 2.650 . . . . . A . 25 HIS H . . A . 24 VAL HA . . . 25 . HN . . . . . 24 . HA . . c30497_6e5i 1 90 1 . . 1 1 24 24 VAL MG1 H . . . 1 1 24 24 VAL MG2 H . . . . . 2.117 1.557 2.677 . . . . . A . 24 VAL MG1 . . A . 24 VAL MG2 . . . 24 . HG11 . . . . . 24 . HG21 . . c30497_6e5i 1 91 1 . . 1 1 15 15 VAL HA H . . . 1 1 16 16 ARG H H . . . . . 2.126 1.561 2.691 . . . . . A . 15 VAL HA . . A . 16 ARG H . . . 15 . HA . . . . . 16 . HN . . c30497_6e5i 1 92 1 . . 1 1 22 22 TYR HA H . . . 1 1 23 23 GLU H H . . . . . 2.148 1.571 2.725 . . . . . A . 22 TYR HA . . A . 23 GLU H . . . 22 . HA . . . . . 23 . HN . . c30497_6e5i 1 93 1 . . 1 1 10 10 ARG HG3 H . . . 1 1 10 10 ARG HG2 H . . . . . 2.150 1.572 2.728 . . . . . A . 10 ARG HG3 . . A . 10 ARG HG2 . . . 10 . HG2 . . . . . 10 . HG1 . . c30497_6e5i 1 94 1 . . 1 1 21 21 ARG HA H . . . 1 1 22 22 TYR H H . . . . . 2.156 1.575 2.737 . . . . . A . 21 ARG HA . . A . 22 TYR H . . . 21 . HA . . . . . 22 . HN . . c30497_6e5i 1 95 1 . . 1 1 19 19 DPR HD3 H . . . 1 1 18 18 ASP HA H . . . . . 2.163 1.578 2.748 . . . . . A . 19 DPR HD3 . . A . 18 ASP HA . . . 19 . HD2 . . . . . 18 . HA . . c30497_6e5i 1 96 1 OR . 1 1 4 4 CYS HB2 H . . . 1 1 4 4 CYS H H . . . . . 2.200 1.595 2.805 . . . . . A . 4 CYS HB2 . . A . 4 CYS H . . . 4 . HB1 . . . . . 4 . HN . . c30497_6e5i 1 96 2 OR . 1 1 4 4 CYS HB3 H . . . 1 1 4 4 CYS H H . . . . . 2.200 1.595 2.805 . . . . . A . 4 CYS HB3 . . A . 4 CYS H . . . 4 . HB2 . . . . . 4 . HN . . c30497_6e5i 1 97 1 . . 1 1 20 20 PRO HD3 H . . . 1 1 19 19 DPR HA H . . . . . 2.206 1.598 2.814 . . . . . A . 20 PRO HD3 . . A . 19 DPR HA . . . 20 . HD2 . . . . . 19 . HA . . c30497_6e5i 1 98 1 OR . 1 1 3 3 LYS HA H . . . 1 1 3 3 LYS HB2 H . . . . . 2.237 1.611 2.863 . . . . . A . 3 LYS HA . . A . 3 LYS HB2 . . . 3 . HA . . . . . 3 . HB1 . . c30497_6e5i 1 98 2 OR . 1 1 3 3 LYS HA H . . . 1 1 3 3 LYS HB3 H . . . . . 2.237 1.611 2.863 . . . . . A . 3 LYS HA . . A . 3 LYS HB3 . . . 3 . HA . . . . . 3 . HB2 . . c30497_6e5i 1 99 1 . . 1 1 12 12 ORN HD3 H . . . 1 1 12 12 ORN HA H . . . . . 2.241 1.613 2.869 . . . . . A . 12 ORN HD3 . . A . 12 ORN HA . . . 12 . HD2 . . . . . 12 . HA . . c30497_6e5i 1 100 1 . . 1 1 20 20 PRO HD2 H . . . 1 1 19 19 DPR HA H . . . . . 2.261 1.622 2.900 . . . . . A . 20 PRO HD2 . . A . 19 DPR HA . . . 20 . HD1 . . . . . 19 . HA . . c30497_6e5i 1 101 1 OR . 1 1 8 8 LYS HB2 H . . . 1 1 8 8 LYS H H . . . . . 2.272 1.627 2.917 . . . . . A . 8 LYS HB2 . . A . 8 LYS H . . . 8 . HB1 . . . . . 8 . HN . . c30497_6e5i 1 101 2 OR . 1 1 8 8 LYS HB3 H . . . 1 1 8 8 LYS H H . . . . . 2.272 1.627 2.917 . . . . . A . 8 LYS HB3 . . A . 8 LYS H . . . 8 . HB2 . . . . . 8 . HN . . c30497_6e5i 1 102 1 . . 1 1 12 12 ORN HD2 H . . . 1 1 12 12 ORN HG2 H . . . . . 2.303 1.640 2.966 . . . . . A . 12 ORN HD2 . . A . 12 ORN HG2 . . . 12 . HD1 . . . . . 12 . HG1 . . c30497_6e5i 1 103 1 OR . 1 1 3 3 LYS H H . . . 1 1 3 3 LYS HB2 H . . . . . 2.305 1.641 2.969 . . . . . A . 3 LYS H . . A . 3 LYS HB2 . . . 3 . HN . . . . . 3 . HB1 . . c30497_6e5i 1 103 2 OR . 1 1 3 3 LYS H H . . . 1 1 3 3 LYS HB3 H . . . . . 2.305 1.641 2.969 . . . . . A . 3 LYS H . . A . 3 LYS HB3 . . . 3 . HN . . . . . 3 . HB2 . . c30497_6e5i 1 104 1 OR . 1 1 11 11 TYR HD2 H . . . 1 1 11 11 TYR HB2 H . . . . . 2.313 1.644 2.982 . . . . . A . 11 TYR HD2 . . A . 11 TYR HB2 . . . 11 . HD2 . . . . . 11 . HB1 . . c30497_6e5i 1 104 2 OR . 1 1 11 11 TYR HD1 H . . . 1 1 11 11 TYR HB2 H . . . . . 2.313 1.644 2.982 . . . . . A . 11 TYR HD1 . . A . 11 TYR HB2 . . . 11 . HD1 . . . . . 11 . HB1 . . c30497_6e5i 1 105 1 . . 1 1 12 12 ORN HA H . . . 1 1 13 13 CYS H H . . . . . 2.313 1.644 2.982 . . . . . A . 12 ORN HA . . A . 13 CYS H . . . 12 . HA . . . . . 13 . HN . . c30497_6e5i 1 106 1 . . 1 1 14 14 GLU H H . . . 1 1 13 13 CYS HA H . . . . . 2.313 1.644 2.982 . . . . . A . 14 GLU H . . A . 13 CYS HA . . . 14 . HN . . . . . 13 . HA . . c30497_6e5i 1 107 1 OR . 1 1 22 22 TYR HD2 H . . . 1 1 22 22 TYR HB2 H . . . . . 2.315 1.645 2.985 . . . . . A . 22 TYR HD2 . . A . 22 TYR HB2 . . . 22 . HD2 . . . . . 22 . HB1 . . c30497_6e5i 1 107 2 OR . 1 1 22 22 TYR HD1 H . . . 1 1 22 22 TYR HB2 H . . . . . 2.315 1.645 2.985 . . . . . A . 22 TYR HD1 . . A . 22 TYR HB2 . . . 22 . HD1 . . . . . 22 . HB1 . . c30497_6e5i 1 108 1 OR . 1 1 22 22 TYR HD2 H . . . 1 1 22 22 TYR HB3 H . . . . . 2.319 1.647 2.991 . . . . . A . 22 TYR HD2 . . A . 22 TYR HB3 . . . 22 . HD2 . . . . . 22 . HB2 . . c30497_6e5i 1 108 2 OR . 1 1 22 22 TYR HD1 H . . . 1 1 22 22 TYR HB3 H . . . . . 2.319 1.647 2.991 . . . . . A . 22 TYR HD1 . . A . 22 TYR HB3 . . . 22 . HD1 . . . . . 22 . HB2 . . c30497_6e5i 1 109 1 OR . 1 1 5 5 LYS H H . . . 1 1 5 5 LYS HB2 H . . . . . 2.324 1.649 2.999 . . . . . A . 5 LYS H . . A . 5 LYS HB2 . . . 5 . HN . . . . . 5 . HB1 . . c30497_6e5i 1 109 2 OR . 1 1 5 5 LYS H H . . . 1 1 5 5 LYS HB3 H . . . . . 2.324 1.649 2.999 . . . . . A . 5 LYS H . . A . 5 LYS HB3 . . . 5 . HN . . . . . 5 . HB2 . . c30497_6e5i 1 110 1 OR . 1 1 6 6 GLU H H . . . 1 1 6 6 GLU HB2 H . . . . . 2.327 1.650 3.004 . . . . . A . 6 GLU H . . A . 6 GLU HB2 . . . 6 . HN . . . . . 6 . HB1 . . c30497_6e5i 1 110 2 OR . 1 1 6 6 GLU H H . . . 1 1 6 6 GLU HB3 H . . . . . 2.327 1.650 3.004 . . . . . A . 6 GLU H . . A . 6 GLU HB3 . . . 6 . HN . . . . . 6 . HB2 . . c30497_6e5i 1 111 1 . . 1 1 19 19 DPR HA H . . . 1 1 19 19 DPR HB3 H . . . . . 2.334 1.653 3.015 . . . . . A . 19 DPR HA . . A . 19 DPR HB3 . . . 19 . HA . . . . . 19 . HB2 . . c30497_6e5i 1 112 1 OR . 1 1 11 11 TYR HB3 H . . . 1 1 11 11 TYR HD2 H . . . . . 2.352 1.661 3.043 . . . . . A . 11 TYR HB3 . . A . 11 TYR HD2 . . . 11 . HB2 . . . . . 11 . HD2 . . c30497_6e5i 1 112 2 OR . 1 1 11 11 TYR HB3 H . . . 1 1 11 11 TYR HD1 H . . . . . 2.352 1.661 3.043 . . . . . A . 11 TYR HB3 . . A . 11 TYR HD1 . . . 11 . HB2 . . . . . 11 . HD1 . . c30497_6e5i 1 113 1 . . 1 1 7 7 LEU MD1 H . . . 1 1 7 7 LEU MD2 H . . . . . 2.357 1.663 3.051 . . . . . A . 7 LEU MD1 . . A . 7 LEU MD2 . . . 7 . HD11 . . . . . 7 . HD21 . . c30497_6e5i 1 114 1 OR . 1 1 21 21 ARG HB2 H . . . 1 1 21 21 ARG HA H . . . . . 2.357 1.662 3.052 . . . . . A . 21 ARG HB2 . . A . 21 ARG HA . . . 21 . HB1 . . . . . 21 . HA . . c30497_6e5i 1 114 2 OR . 1 1 21 21 ARG HB3 H . . . 1 1 21 21 ARG HA H . . . . . 2.357 1.662 3.052 . . . . . A . 21 ARG HB3 . . A . 21 ARG HA . . . 21 . HB2 . . . . . 21 . HA . . c30497_6e5i 1 115 1 . . 1 1 20 20 PRO HA H . . . 1 1 20 20 PRO HB3 H . . . . . 2.360 1.664 3.056 . . . . . A . 20 PRO HA . . A . 20 PRO HB3 . . . 20 . HA . . . . . 20 . HB2 . . c30497_6e5i 1 116 1 OR . 1 1 14 14 GLU H H . . . 1 1 14 14 GLU HB2 H . . . . . 2.366 1.666 3.066 . . . . . A . 14 GLU H . . A . 14 GLU HB2 . . . 14 . HN . . . . . 14 . HB1 . . c30497_6e5i 1 116 2 OR . 1 1 14 14 GLU H H . . . 1 1 14 14 GLU HB3 H . . . . . 2.366 1.666 3.066 . . . . . A . 14 GLU H . . A . 14 GLU HB3 . . . 14 . HN . . . . . 14 . HB2 . . c30497_6e5i 1 117 1 . . 1 1 11 11 TYR H H . . . 1 1 11 11 TYR HB2 H . . . . . 2.368 1.667 3.069 . . . . . A . 11 TYR H . . A . 11 TYR HB2 . . . 11 . HN . . . . . 11 . HB1 . . c30497_6e5i 1 118 1 . . 1 1 24 24 VAL MG1 H . . . 1 1 24 24 VAL HB H . . . . . 2.377 1.671 3.083 . . . . . A . 24 VAL MG1 . . A . 24 VAL HB . . . 24 . HG11 . . . . . 24 . HB . . c30497_6e5i 1 119 1 OR . 1 1 21 21 ARG H H . . . 1 1 21 21 ARG HB2 H . . . . . 2.389 1.675 3.103 . . . . . A . 21 ARG H . . A . 21 ARG HB2 . . . 21 . HN . . . . . 21 . HB1 . . c30497_6e5i 1 119 2 OR . 1 1 21 21 ARG H H . . . 1 1 21 21 ARG HB3 H . . . . . 2.389 1.675 3.103 . . . . . A . 21 ARG H . . A . 21 ARG HB3 . . . 21 . HN . . . . . 21 . HB2 . . c30497_6e5i 1 120 1 OR . 1 1 14 14 GLU HA H . . . 1 1 14 14 GLU HB2 H . . . . . 2.395 1.678 3.112 . . . . . A . 14 GLU HA . . A . 14 GLU HB2 . . . 14 . HA . . . . . 14 . HB1 . . c30497_6e5i 1 120 2 OR . 1 1 14 14 GLU HA H . . . 1 1 14 14 GLU HB3 H . . . . . 2.395 1.678 3.112 . . . . . A . 14 GLU HA . . A . 14 GLU HB3 . . . 14 . HA . . . . . 14 . HB2 . . c30497_6e5i 1 121 1 . . 1 1 24 24 VAL HB H . . . 1 1 24 24 VAL MG2 H . . . . . 2.398 1.679 3.117 . . . . . A . 24 VAL HB . . A . 24 VAL MG2 . . . 24 . HB . . . . . 24 . HG21 . . c30497_6e5i 1 122 1 . . 1 1 13 13 CYS H H . . . 1 1 13 13 CYS HB3 H . . . . . 2.414 1.685 3.143 . . . . . A . 13 CYS H . . A . 13 CYS HB3 . . . 13 . HN . . . . . 13 . HB2 . . c30497_6e5i 1 123 1 . . 1 1 10 10 ARG HA H . . . 1 1 10 10 ARG HB3 H . . . . . 2.414 1.685 3.143 . . . . . A . 10 ARG HA . . A . 10 ARG HB3 . . . 10 . HA . . . . . 10 . HB2 . . c30497_6e5i 1 124 1 . . 1 1 15 15 VAL H H . . . 1 1 15 15 VAL HB H . . . . . 2.417 1.687 3.147 . . . . . A . 15 VAL H . . A . 15 VAL HB . . . 15 . HN . . . . . 15 . HB . . c30497_6e5i 1 125 1 OR . 1 1 4 4 CYS HA H . . . 1 1 4 4 CYS HB2 H . . . . . 2.431 1.692 3.170 . . . . . A . 4 CYS HA . . A . 4 CYS HB2 . . . 4 . HA . . . . . 4 . HB1 . . c30497_6e5i 1 125 2 OR . 1 1 4 4 CYS HA H . . . 1 1 4 4 CYS HB3 H . . . . . 2.431 1.692 3.170 . . . . . A . 4 CYS HA . . A . 4 CYS HB3 . . . 4 . HA . . . . . 4 . HB2 . . c30497_6e5i 1 126 1 . . 1 1 13 13 CYS HB2 H . . . 1 1 13 13 CYS HA H . . . . . 2.434 1.693 3.175 . . . . . A . 13 CYS HB2 . . A . 13 CYS HA . . . 13 . HB1 . . . . . 13 . HA . . c30497_6e5i 1 127 1 . . 1 1 11 11 TYR HB3 H . . . 1 1 11 11 TYR HA H . . . . . 2.440 1.696 3.184 . . . . . A . 11 TYR HB3 . . A . 11 TYR HA . . . 11 . HB2 . . . . . 11 . HA . . c30497_6e5i 1 128 1 OR . 1 1 11 11 TYR HD2 H . . . 1 1 11 11 TYR HA H . . . . . 2.441 1.696 3.186 . . . . . A . 11 TYR HD2 . . A . 11 TYR HA . . . 11 . HD2 . . . . . 11 . HA . . c30497_6e5i 1 128 2 OR . 1 1 11 11 TYR HD1 H . . . 1 1 11 11 TYR HA H . . . . . 2.441 1.696 3.186 . . . . . A . 11 TYR HD1 . . A . 11 TYR HA . . . 11 . HD1 . . . . . 11 . HA . . c30497_6e5i 1 129 1 . . 1 1 19 19 DPR HD2 H . . . 1 1 18 18 ASP HA H . . . . . 2.449 1.699 3.199 . . . . . A . 19 DPR HD2 . . A . 18 ASP HA . . . 19 . HD1 . . . . . 18 . HA . . c30497_6e5i 1 130 1 . . 1 1 7 7 LEU H H . . . 1 1 7 7 LEU HG H . . . . . 2.451 1.700 3.202 . . . . . A . 7 LEU H . . A . 7 LEU HG . . . 7 . HN . . . . . 7 . HG . . c30497_6e5i 1 131 1 . . 1 1 12 12 ORN HG2 H . . . 1 1 13 13 CYS H H . . . . . 2.454 1.701 3.207 . . . . . A . 12 ORN HG2 . . A . 13 CYS H . . . 12 . HG1 . . . . . 13 . HN . . c30497_6e5i 1 132 1 . . 1 1 24 24 VAL HB H . . . 1 1 24 24 VAL H H . . . . . 2.457 1.703 3.211 . . . . . A . 24 VAL HB . . A . 24 VAL H . . . 24 . HB . . . . . 24 . HN . . c30497_6e5i 1 133 1 . . 1 1 6 6 GLU HA H . . . 1 1 6 6 GLU H H . . . . . 2.460 1.703 3.217 . . . . . A . 6 GLU HA . . A . 6 GLU H . . . 6 . HA . . . . . 6 . HN . . c30497_6e5i 1 134 1 . . 1 1 12 12 ORN HD3 H . . . 1 1 12 12 ORN HG2 H . . . . . 2.462 1.704 3.220 . . . . . A . 12 ORN HD3 . . A . 12 ORN HG2 . . . 12 . HD2 . . . . . 12 . HG1 . . c30497_6e5i 1 135 1 . . 1 1 26 26 CYS H H . . . 1 1 26 26 CYS HB2 H . . . . . 2.470 1.707 3.233 . . . . . A . 26 CYS H . . A . 26 CYS HB2 . . . 26 . HN . . . . . 26 . HB1 . . c30497_6e5i 1 136 1 . . 1 1 7 7 LEU HA H . . . 1 1 7 7 LEU MD2 H . . . . . 2.472 1.708 3.236 . . . . . A . 7 LEU HA . . A . 7 LEU MD2 . . . 7 . HA . . . . . 7 . HD21 . . c30497_6e5i 1 137 1 . . 1 1 3 3 LYS H H . . . 1 1 4 4 CYS H H . . . . . 2.473 1.709 3.237 . . . . . A . 3 LYS H . . A . 4 CYS H . . . 3 . HN . . . . . 4 . HN . . c30497_6e5i 1 138 1 . . 1 1 17 17 CYS H H . . . 1 1 17 17 CYS HB2 H . . . . . 2.480 1.711 3.249 . . . . . A . 17 CYS H . . A . 17 CYS HB2 . . . 17 . HN . . . . . 17 . HB1 . . c30497_6e5i 1 139 1 . . 1 1 12 12 ORN HB3 H . . . 1 1 12 12 ORN HA H . . . . . 2.484 1.713 3.255 . . . . . A . 12 ORN HB3 . . A . 12 ORN HA . . . 12 . HB2 . . . . . 12 . HA . . c30497_6e5i 1 140 1 . . 1 1 10 10 ARG HB3 H . . . 1 1 10 10 ARG H H . . . . . 2.485 1.713 3.257 . . . . . A . 10 ARG HB3 . . A . 10 ARG H . . . 10 . HB2 . . . . . 10 . HN . . c30497_6e5i 1 141 1 . . 1 1 7 7 LEU HG H . . . 1 1 7 7 LEU MD2 H . . . . . 2.492 1.716 3.268 . . . . . A . 7 LEU HG . . A . 7 LEU MD2 . . . 7 . HG . . . . . 7 . HD21 . . c30497_6e5i 1 142 1 . . 1 1 10 10 ARG HB2 H . . . 1 1 10 10 ARG H H . . . . . 2.497 1.717 3.277 . . . . . A . 10 ARG HB2 . . A . 10 ARG H . . . 10 . HB1 . . . . . 10 . HN . . c30497_6e5i 1 143 1 . . 1 1 19 19 DPR HD3 H . . . 1 1 19 19 DPR HG2 H . . . . . 2.500 1.719 3.281 . . . . . A . 19 DPR HD3 . . A . 19 DPR HG2 . . . 19 . HD2 . . . . . 19 . HG1 . . c30497_6e5i 1 144 1 . . 1 1 26 26 CYS HB3 H . . . 1 1 26 26 CYS HA H . . . . . 2.504 1.720 3.288 . . . . . A . 26 CYS HB3 . . A . 26 CYS HA . . . 26 . HB2 . . . . . 26 . HA . . c30497_6e5i 1 145 1 . . 1 1 20 20 PRO HA H . . . 1 1 20 20 PRO HB2 H . . . . . 2.505 1.720 3.290 . . . . . A . 20 PRO HA . . A . 20 PRO HB2 . . . 20 . HA . . . . . 20 . HB1 . . c30497_6e5i 1 146 1 OR . 1 1 4 4 CYS HB2 H . . . 1 1 5 5 LYS H H . . . . . 2.505 1.720 3.290 . . . . . A . 4 CYS HB2 . . A . 5 LYS H . . . 4 . HB1 . . . . . 5 . HN . . c30497_6e5i 1 146 2 OR . 1 1 4 4 CYS HB3 H . . . 1 1 5 5 LYS H H . . . . . 2.505 1.720 3.290 . . . . . A . 4 CYS HB3 . . A . 5 LYS H . . . 4 . HB2 . . . . . 5 . HN . . c30497_6e5i 1 147 1 . . 1 1 19 19 DPR HD2 H . . . 1 1 19 19 DPR HG3 H . . . . . 2.510 1.723 3.297 . . . . . A . 19 DPR HD2 . . A . 19 DPR HG3 . . . 19 . HD1 . . . . . 19 . HG2 . . c30497_6e5i 1 148 1 . . 1 1 7 7 LEU H H . . . 1 1 6 6 GLU H H . . . . . 2.510 1.722 3.298 . . . . . A . 7 LEU H . . A . 6 GLU H . . . 7 . HN . . . . . 6 . HN . . c30497_6e5i 1 149 1 . . 1 1 24 24 VAL HA H . . . 1 1 24 24 VAL MG2 H . . . . . 2.526 1.729 3.323 . . . . . A . 24 VAL HA . . A . 24 VAL MG2 . . . 24 . HA . . . . . 24 . HG21 . . c30497_6e5i 1 150 1 . . 1 1 16 16 ARG HB3 H . . . 1 1 16 16 ARG HA H . . . . . 2.529 1.730 3.328 . . . . . A . 16 ARG HB3 . . A . 16 ARG HA . . . 16 . HB2 . . . . . 16 . HA . . c30497_6e5i 1 151 1 . . 1 1 15 15 VAL HA H . . . 1 1 15 15 VAL HB H . . . . . 2.535 1.732 3.338 . . . . . A . 15 VAL HA . . A . 15 VAL HB . . . 15 . HA . . . . . 15 . HB . . c30497_6e5i 1 152 1 . . 1 1 20 20 PRO HD2 H . . . 1 1 20 20 PRO HG3 H . . . . . 2.547 1.736 3.358 . . . . . A . 20 PRO HD2 . . A . 20 PRO HG3 . . . 20 . HD1 . . . . . 20 . HG2 . . c30497_6e5i 1 153 1 . . 1 1 7 7 LEU HG H . . . 1 1 7 7 LEU MD1 H . . . . . 2.547 1.736 3.358 . . . . . A . 7 LEU HG . . A . 7 LEU MD1 . . . 7 . HG . . . . . 7 . HD11 . . c30497_6e5i 1 154 1 . . 1 1 15 15 VAL HA H . . . 1 1 15 15 VAL MG2 H . . . . . 2.548 1.736 3.360 . . . . . A . 15 VAL HA . . A . 15 VAL MG2 . . . 15 . HA . . . . . 15 . HG21 . . c30497_6e5i 1 155 1 . . 1 1 15 15 VAL HA H . . . 1 1 15 15 VAL MG1 H . . . . . 2.550 1.737 3.363 . . . . . A . 15 VAL HA . . A . 15 VAL MG1 . . . 15 . HA . . . . . 15 . HG11 . . c30497_6e5i 1 156 1 . . 1 1 25 25 HIS HB3 H . . . 1 1 25 25 HIS HA H . . . . . 2.551 1.737 3.365 . . . . . A . 25 HIS HB3 . . A . 25 HIS HA . . . 25 . HB2 . . . . . 25 . HA . . c30497_6e5i 1 157 1 . . 1 1 18 18 ASP H H . . . 1 1 17 17 CYS HA H . . . . . 2.558 1.740 3.376 . . . . . A . 18 ASP H . . A . 17 CYS HA . . . 18 . HN . . . . . 17 . HA . . c30497_6e5i 1 158 1 . . 1 1 7 7 LEU HB2 H . . . 1 1 15 15 VAL MG2 H . . . . . 2.563 1.742 3.384 . . . . . A . 7 LEU HB2 . . A . 15 VAL MG2 . . . 7 . HB1 . . . . . 15 . HG21 . . c30497_6e5i 1 159 1 OR . 1 1 7 7 LEU MD2 H . . . 1 1 11 11 TYR HE2 H . . . . . 2.564 1.742 3.386 . . . . . A . 7 LEU MD2 . . A . 11 TYR HE2 . . . 7 . HD21 . . . . . 11 . HE2 . . c30497_6e5i 1 159 2 OR . 1 1 7 7 LEU MD2 H . . . 1 1 11 11 TYR HE1 H . . . . . 2.564 1.742 3.386 . . . . . A . 7 LEU MD2 . . A . 11 TYR HE1 . . . 7 . HD21 . . . . . 11 . HE1 . . c30497_6e5i 1 160 1 . . 1 1 25 25 HIS HB2 H . . . 1 1 25 25 HIS HA H . . . . . 2.564 1.742 3.386 . . . . . A . 25 HIS HB2 . . A . 25 HIS HA . . . 25 . HB1 . . . . . 25 . HA . . c30497_6e5i 1 161 1 OR . 1 1 8 8 LYS HA H . . . 1 1 8 8 LYS HG2 H . . . . . 2.567 1.743 3.391 . . . . . A . 8 LYS HA . . A . 8 LYS HG2 . . . 8 . HA . . . . . 8 . HG1 . . c30497_6e5i 1 161 2 OR . 1 1 8 8 LYS HA H . . . 1 1 8 8 LYS HG3 H . . . . . 2.567 1.743 3.391 . . . . . A . 8 LYS HA . . A . 8 LYS HG3 . . . 8 . HA . . . . . 8 . HG2 . . c30497_6e5i 1 162 1 . . 1 1 20 20 PRO HD3 H . . . 1 1 20 20 PRO HG3 H . . . . . 2.578 1.747 3.409 . . . . . A . 20 PRO HD3 . . A . 20 PRO HG3 . . . 20 . HD2 . . . . . 20 . HG2 . . c30497_6e5i 1 163 1 . . 1 1 16 16 ARG H H . . . 1 1 16 16 ARG HB2 H . . . . . 2.579 1.747 3.411 . . . . . A . 16 ARG H . . A . 16 ARG HB2 . . . 16 . HN . . . . . 16 . HB1 . . c30497_6e5i 1 164 1 . . 1 1 14 14 GLU H H . . . 1 1 13 13 CYS HB2 H . . . . . 2.584 1.750 3.418 . . . . . A . 14 GLU H . . A . 13 CYS HB2 . . . 14 . HN . . . . . 13 . HB1 . . c30497_6e5i 1 165 1 . . 1 1 2 2 ASP HA H . . . 1 1 2 2 ASP HB3 H . . . . . 2.586 1.750 3.422 . . . . . A . 2 ASP HA . . A . 2 ASP HB3 . . . 2 . HA . . . . . 2 . HB2 . . c30497_6e5i 1 166 1 . . 1 1 8 8 LYS HA H . . . 1 1 15 15 VAL MG1 H . . . . . 2.587 1.750 3.424 . . . . . A . 8 LYS HA . . A . 15 VAL MG1 . . . 8 . HA . . . . . 15 . HG11 . . c30497_6e5i 1 167 1 . . 1 1 1 1 ASN HA H . . . 1 1 2 2 ASP H H . . . . . 2.588 1.751 3.425 . . . . . A . 1 ASN HA . . A . 2 ASP H . . . 1 . HA . . . . . 2 . HN . . c30497_6e5i 1 168 1 OR . 1 1 7 7 LEU H H . . . 1 1 6 6 GLU HB2 H . . . . . 2.595 1.753 3.437 . . . . . A . 7 LEU H . . A . 6 GLU HB2 . . . 7 . HN . . . . . 6 . HB1 . . c30497_6e5i 1 168 2 OR . 1 1 7 7 LEU H H . . . 1 1 6 6 GLU HB3 H . . . . . 2.595 1.753 3.437 . . . . . A . 7 LEU H . . A . 6 GLU HB3 . . . 7 . HN . . . . . 6 . HB2 . . c30497_6e5i 1 169 1 . . 1 1 13 13 CYS HB2 H . . . 1 1 26 26 CYS HA H . . . . . 2.597 1.754 3.440 . . . . . A . 13 CYS HB2 . . A . 26 CYS HA . . . 13 . HB1 . . . . . 26 . HA . . c30497_6e5i 1 170 1 OR . 1 1 8 8 LYS HA H . . . 1 1 8 8 LYS HD2 H . . . . . 2.597 1.754 3.440 . . . . . A . 8 LYS HA . . A . 8 LYS HD2 . . . 8 . HA . . . . . 8 . HD1 . . c30497_6e5i 1 170 2 OR . 1 1 8 8 LYS HA H . . . 1 1 8 8 LYS HD3 H . . . . . 2.597 1.754 3.440 . . . . . A . 8 LYS HA . . A . 8 LYS HD3 . . . 8 . HA . . . . . 8 . HD2 . . c30497_6e5i 1 171 1 . . 1 1 23 23 GLU HA H . . . 1 1 23 23 GLU HB3 H . . . . . 2.606 1.757 3.455 . . . . . A . 23 GLU HA . . A . 23 GLU HB3 . . . 23 . HA . . . . . 23 . HB2 . . c30497_6e5i 1 172 1 . . 1 1 7 7 LEU HB3 H . . . 1 1 7 7 LEU MD1 H . . . . . 2.617 1.761 3.473 . . . . . A . 7 LEU HB3 . . A . 7 LEU MD1 . . . 7 . HB2 . . . . . 7 . HD11 . . c30497_6e5i 1 173 1 . . 1 1 15 15 VAL MG1 H . . . 1 1 24 24 VAL MG2 H . . . . . 2.620 1.762 3.478 . . . . . A . 15 VAL MG1 . . A . 24 VAL MG2 . . . 15 . HG11 . . . . . 24 . HG21 . . c30497_6e5i 1 174 1 OR . 1 1 21 21 ARG HA H . . . 1 1 21 21 ARG HG2 H . . . . . 2.630 1.765 3.495 . . . . . A . 21 ARG HA . . A . 21 ARG HG2 . . . 21 . HA . . . . . 21 . HG1 . . c30497_6e5i 1 174 2 OR . 1 1 21 21 ARG HA H . . . 1 1 21 21 ARG HG3 H . . . . . 2.630 1.765 3.495 . . . . . A . 21 ARG HA . . A . 21 ARG HG3 . . . 21 . HA . . . . . 21 . HG2 . . c30497_6e5i 1 175 1 . . 1 1 7 7 LEU MD2 H . . . 1 1 24 24 VAL MG2 H . . . . . 2.631 1.765 3.497 . . . . . A . 7 LEU MD2 . . A . 24 VAL MG2 . . . 7 . HD21 . . . . . 24 . HG21 . . c30497_6e5i 1 176 1 . . 1 1 19 19 DPR HD2 H . . . 1 1 19 19 DPR HG2 H . . . . . 2.635 1.767 3.503 . . . . . A . 19 DPR HD2 . . A . 19 DPR HG2 . . . 19 . HD1 . . . . . 19 . HG1 . . c30497_6e5i 1 177 1 . . 1 1 7 7 LEU HB2 H . . . 1 1 7 7 LEU MD1 H . . . . . 2.636 1.768 3.504 . . . . . A . 7 LEU HB2 . . A . 7 LEU MD1 . . . 7 . HB1 . . . . . 7 . HD11 . . c30497_6e5i 1 178 1 . . 1 1 16 16 ARG HA H . . . 1 1 16 16 ARG HB2 H . . . . . 2.640 1.769 3.511 . . . . . A . 16 ARG HA . . A . 16 ARG HB2 . . . 16 . HA . . . . . 16 . HB1 . . c30497_6e5i 1 179 1 . . 1 1 18 18 ASP H H . . . 1 1 18 18 ASP HB3 H . . . . . 2.641 1.769 3.513 . . . . . A . 18 ASP H . . A . 18 ASP HB3 . . . 18 . HN . . . . . 18 . HB2 . . c30497_6e5i 1 180 1 . . 1 1 9 9 LYS H H . . . 1 1 10 10 ARG H H . . . . . 2.644 1.770 3.518 . . . . . A . 9 LYS H . . A . 10 ARG H . . . 9 . HN . . . . . 10 . HN . . c30497_6e5i 1 181 1 . . 1 1 6 6 GLU H H . . . 1 1 5 5 LYS H H . . . . . 2.646 1.771 3.521 . . . . . A . 6 GLU H . . A . 5 LYS H . . . 6 . HN . . . . . 5 . HN . . c30497_6e5i 1 182 1 . . 1 1 9 9 LYS H H . . . 1 1 8 8 LYS H H . . . . . 2.648 1.771 3.525 . . . . . A . 9 LYS H . . A . 8 LYS H . . . 9 . HN . . . . . 8 . HN . . c30497_6e5i 1 183 1 . . 1 1 24 24 VAL MG1 H . . . 1 1 24 24 VAL HA H . . . . . 2.648 1.771 3.525 . . . . . A . 24 VAL MG1 . . A . 24 VAL HA . . . 24 . HG11 . . . . . 24 . HA . . c30497_6e5i 1 184 1 . . 1 1 10 10 ARG HB2 H . . . 1 1 11 11 TYR H H . . . . . 2.651 1.773 3.529 . . . . . A . 10 ARG HB2 . . A . 11 TYR H . . . 10 . HB1 . . . . . 11 . HN . . c30497_6e5i 1 185 1 OR . 1 1 25 25 HIS HB3 H . . . 1 1 14 14 GLU HB2 H . . . . . 2.654 1.774 3.534 . . . . . A . 25 HIS HB3 . . A . 14 GLU HB2 . . . 25 . HB2 . . . . . 14 . HB1 . . c30497_6e5i 1 185 2 OR . 1 1 25 25 HIS HB3 H . . . 1 1 14 14 GLU HB3 H . . . . . 2.654 1.774 3.534 . . . . . A . 25 HIS HB3 . . A . 14 GLU HB3 . . . 25 . HB2 . . . . . 14 . HB2 . . c30497_6e5i 1 186 1 OR . 1 1 21 21 ARG HB2 H . . . 1 1 22 22 TYR H H . . . . . 2.656 1.774 3.538 . . . . . A . 21 ARG HB2 . . A . 22 TYR H . . . 21 . HB1 . . . . . 22 . HN . . c30497_6e5i 1 186 2 OR . 1 1 21 21 ARG HB3 H . . . 1 1 22 22 TYR H H . . . . . 2.656 1.774 3.538 . . . . . A . 21 ARG HB3 . . A . 22 TYR H . . . 21 . HB2 . . . . . 22 . HN . . c30497_6e5i 1 187 1 . . 1 1 8 8 LYS H H . . . 1 1 8 8 LYS HA H . . . . . 2.659 1.775 3.543 . . . . . A . 8 LYS H . . A . 8 LYS HA . . . 8 . HN . . . . . 8 . HA . . c30497_6e5i 1 188 1 . . 1 1 10 10 ARG HB2 H . . . 1 1 10 10 ARG HA H . . . . . 2.665 1.777 3.553 . . . . . A . 10 ARG HB2 . . A . 10 ARG HA . . . 10 . HB1 . . . . . 10 . HA . . c30497_6e5i 1 189 1 . . 1 1 12 12 ORN HD2 H . . . 1 1 12 12 ORN HA H . . . . . 2.668 1.778 3.558 . . . . . A . 12 ORN HD2 . . A . 12 ORN HA . . . 12 . HD1 . . . . . 12 . HA . . c30497_6e5i 1 190 1 . . 1 1 10 10 ARG HA H . . . 1 1 10 10 ARG H H . . . . . 2.668 1.778 3.558 . . . . . A . 10 ARG HA . . A . 10 ARG H . . . 10 . HA . . . . . 10 . HN . . c30497_6e5i 1 191 1 . . 1 1 15 15 VAL MG1 H . . . 1 1 11 11 TYR HB2 H . . . . . 2.670 1.779 3.561 . . . . . A . 15 VAL MG1 . . A . 11 TYR HB2 . . . 15 . HG11 . . . . . 11 . HB1 . . c30497_6e5i 1 192 1 OR . 1 1 6 6 GLU H H . . . 1 1 5 5 LYS HB2 H . . . . . 2.674 1.780 3.568 . . . . . A . 6 GLU H . . A . 5 LYS HB2 . . . 6 . HN . . . . . 5 . HB1 . . c30497_6e5i 1 192 2 OR . 1 1 6 6 GLU H H . . . 1 1 5 5 LYS HB3 H . . . . . 2.674 1.780 3.568 . . . . . A . 6 GLU H . . A . 5 LYS HB3 . . . 6 . HN . . . . . 5 . HB2 . . c30497_6e5i 1 193 1 . . 1 1 19 19 DPR HD3 H . . . 1 1 19 19 DPR HG3 H . . . . . 2.676 1.781 3.571 . . . . . A . 19 DPR HD3 . . A . 19 DPR HG3 . . . 19 . HD2 . . . . . 19 . HG2 . . c30497_6e5i 1 194 1 . . 1 1 7 7 LEU HB2 H . . . 1 1 7 7 LEU MD2 H . . . . . 2.685 1.784 3.586 . . . . . A . 7 LEU HB2 . . A . 7 LEU MD2 . . . 7 . HB1 . . . . . 7 . HD21 . . c30497_6e5i 1 195 1 . . 1 1 23 23 GLU HB2 H . . . 1 1 23 23 GLU HA H . . . . . 2.687 1.784 3.590 . . . . . A . 23 GLU HB2 . . A . 23 GLU HA . . . 23 . HB1 . . . . . 23 . HA . . c30497_6e5i 1 196 1 . . 1 1 4 4 CYS HA H . . . 1 1 4 4 CYS H H . . . . . 2.688 1.785 3.591 . . . . . A . 4 CYS HA . . A . 4 CYS H . . . 4 . HA . . . . . 4 . HN . . c30497_6e5i 1 197 1 . . 1 1 23 23 GLU H H . . . 1 1 22 22 TYR HB2 H . . . . . 2.690 1.786 3.594 . . . . . A . 23 GLU H . . A . 22 TYR HB2 . . . 23 . HN . . . . . 22 . HB1 . . c30497_6e5i 1 198 1 . . 1 1 25 25 HIS H H . . . 1 1 25 25 HIS HB2 H . . . . . 2.698 1.788 3.608 . . . . . A . 25 HIS H . . A . 25 HIS HB2 . . . 25 . HN . . . . . 25 . HB1 . . c30497_6e5i 1 199 1 . . 1 1 19 19 DPR HB2 H . . . 1 1 19 19 DPR HA H . . . . . 2.706 1.791 3.621 . . . . . A . 19 DPR HB2 . . A . 19 DPR HA . . . 19 . HB1 . . . . . 19 . HA . . c30497_6e5i 1 200 1 . . 1 1 16 16 ARG H H . . . 1 1 23 23 GLU H H . . . . . 2.707 1.791 3.623 . . . . . A . 16 ARG H . . A . 23 GLU H . . . 16 . HN . . . . . 23 . HN . . c30497_6e5i 1 201 1 . . 1 1 9 9 LYS HB2 H . . . 1 1 10 10 ARG H H . . . . . 2.708 1.791 3.625 . . . . . A . 9 LYS HB2 . . A . 10 ARG H . . . 9 . HB1 . . . . . 10 . HN . . c30497_6e5i 1 202 1 . . 1 1 24 24 VAL HA H . . . 1 1 24 24 VAL H H . . . . . 2.709 1.791 3.627 . . . . . A . 24 VAL HA . . A . 24 VAL H . . . 24 . HA . . . . . 24 . HN . . c30497_6e5i 1 203 1 . . 1 1 16 16 ARG H H . . . 1 1 15 15 VAL MG2 H . . . . . 2.709 1.791 3.627 . . . . . A . 16 ARG H . . A . 15 VAL MG2 . . . 16 . HN . . . . . 15 . HG21 . . c30497_6e5i 1 204 1 . . 1 1 11 11 TYR HB2 H . . . 1 1 11 11 TYR HA H . . . . . 2.713 1.793 3.633 . . . . . A . 11 TYR HB2 . . A . 11 TYR HA . . . 11 . HB1 . . . . . 11 . HA . . c30497_6e5i 1 205 1 . . 1 1 5 5 LYS HA H . . . 1 1 5 5 LYS H H . . . . . 2.716 1.794 3.638 . . . . . A . 5 LYS HA . . A . 5 LYS H . . . 5 . HA . . . . . 5 . HN . . c30497_6e5i 1 206 1 . . 1 1 24 24 VAL H H . . . 1 1 24 24 VAL MG2 H . . . . . 2.716 1.794 3.638 . . . . . A . 24 VAL H . . A . 24 VAL MG2 . . . 24 . HN . . . . . 24 . HG21 . . c30497_6e5i 1 207 1 . . 1 1 5 5 LYS H H . . . 1 1 4 4 CYS H H . . . . . 2.726 1.797 3.655 . . . . . A . 5 LYS H . . A . 4 CYS H . . . 5 . HN . . . . . 4 . HN . . c30497_6e5i 1 208 1 . . 1 1 21 21 ARG H H . . . 1 1 21 21 ARG HA H . . . . . 2.730 1.798 3.662 . . . . . A . 21 ARG H . . A . 21 ARG HA . . . 21 . HN . . . . . 21 . HA . . c30497_6e5i 1 209 1 . . 1 1 23 23 GLU HB2 H . . . 1 1 23 23 GLU H H . . . . . 2.736 1.800 3.672 . . . . . A . 23 GLU HB2 . . A . 23 GLU H . . . 23 . HB1 . . . . . 23 . HN . . c30497_6e5i 1 210 1 . . 1 1 3 3 LYS HA H . . . 1 1 3 3 LYS H H . . . . . 2.737 1.801 3.673 . . . . . A . 3 LYS HA . . A . 3 LYS H . . . 3 . HA . . . . . 3 . HN . . c30497_6e5i 1 211 1 . . 1 1 2 2 ASP HA H . . . 1 1 2 2 ASP HB2 H . . . . . 2.738 1.801 3.675 . . . . . A . 2 ASP HA . . A . 2 ASP HB2 . . . 2 . HA . . . . . 2 . HB1 . . c30497_6e5i 1 212 1 OR . 1 1 4 4 CYS HB2 H . . . 1 1 22 22 TYR HE1 H . . . . . 2.740 1.802 3.678 . . . . . A . 4 CYS HB2 . . A . 22 TYR HE1 . . . 4 . HB1 . . . . . 22 . HE1 . . c30497_6e5i 1 212 2 OR . 1 1 4 4 CYS HB2 H . . . 1 1 22 22 TYR HE2 H . . . . . 2.740 1.802 3.678 . . . . . A . 4 CYS HB2 . . A . 22 TYR HE2 . . . 4 . HB1 . . . . . 22 . HE2 . . c30497_6e5i 1 212 3 OR . 1 1 4 4 CYS HB3 H . . . 1 1 22 22 TYR HE2 H . . . . . 2.740 1.802 3.678 . . . . . A . 4 CYS HB3 . . A . 22 TYR HE2 . . . 4 . HB2 . . . . . 22 . HE2 . . c30497_6e5i 1 212 4 OR . 1 1 4 4 CYS HB3 H . . . 1 1 22 22 TYR HE1 H . . . . . 2.740 1.802 3.678 . . . . . A . 4 CYS HB3 . . A . 22 TYR HE1 . . . 4 . HB2 . . . . . 22 . HE1 . . c30497_6e5i 1 213 1 . . 1 1 23 23 GLU H H . . . 1 1 23 23 GLU HA H . . . . . 2.741 1.802 3.680 . . . . . A . 23 GLU H . . A . 23 GLU HA . . . 23 . HN . . . . . 23 . HA . . c30497_6e5i 1 214 1 OR . 1 1 21 21 ARG HB2 H . . . 1 1 18 18 ASP HB3 H . . . . . 2.743 1.803 3.683 . . . . . A . 21 ARG HB2 . . A . 18 ASP HB3 . . . 21 . HB1 . . . . . 18 . HB2 . . c30497_6e5i 1 214 2 OR . 1 1 21 21 ARG HB3 H . . . 1 1 18 18 ASP HB3 H . . . . . 2.743 1.803 3.683 . . . . . A . 21 ARG HB3 . . A . 18 ASP HB3 . . . 21 . HB2 . . . . . 18 . HB2 . . c30497_6e5i 1 215 1 . . 1 1 24 24 VAL MG1 H . . . 1 1 13 13 CYS HB2 H . . . . . 2.750 1.805 3.695 . . . . . A . 24 VAL MG1 . . A . 13 CYS HB2 . . . 24 . HG11 . . . . . 13 . HB1 . . c30497_6e5i 1 216 1 . . 1 1 9 9 LYS H H . . . 1 1 9 9 LYS HA H . . . . . 2.750 1.805 3.695 . . . . . A . 9 LYS H . . A . 9 LYS HA . . . 9 . HN . . . . . 9 . HA . . c30497_6e5i 1 217 1 . . 1 1 26 26 CYS H H . . . 1 1 26 26 CYS HA H . . . . . 2.754 1.806 3.702 . . . . . A . 26 CYS H . . A . 26 CYS HA . . . 26 . HN . . . . . 26 . HA . . c30497_6e5i 1 218 1 OR . 1 1 3 3 LYS HB2 H . . . 1 1 4 4 CYS H H . . . . . 2.757 1.807 3.707 . . . . . A . 3 LYS HB2 . . A . 4 CYS H . . . 3 . HB1 . . . . . 4 . HN . . c30497_6e5i 1 218 2 OR . 1 1 3 3 LYS HB3 H . . . 1 1 4 4 CYS H H . . . . . 2.757 1.807 3.707 . . . . . A . 3 LYS HB3 . . A . 4 CYS H . . . 3 . HB2 . . . . . 4 . HN . . c30497_6e5i 1 219 1 . . 1 1 11 11 TYR H H . . . 1 1 11 11 TYR HA H . . . . . 2.758 1.807 3.709 . . . . . A . 11 TYR H . . A . 11 TYR HA . . . 11 . HN . . . . . 11 . HA . . c30497_6e5i 1 220 1 OR . 1 1 21 21 ARG H H . . . 1 1 21 21 ARG HG2 H . . . . . 2.758 1.807 3.709 . . . . . A . 21 ARG H . . A . 21 ARG HG2 . . . 21 . HN . . . . . 21 . HG1 . . c30497_6e5i 1 220 2 OR . 1 1 21 21 ARG H H . . . 1 1 21 21 ARG HG3 H . . . . . 2.758 1.807 3.709 . . . . . A . 21 ARG H . . A . 21 ARG HG3 . . . 21 . HN . . . . . 21 . HG2 . . c30497_6e5i 1 221 1 OR . 1 1 22 22 TYR HA H . . . 1 1 22 22 TYR HD2 H . . . . . 2.767 1.810 3.724 . . . . . A . 22 TYR HA . . A . 22 TYR HD2 . . . 22 . HA . . . . . 22 . HD2 . . c30497_6e5i 1 221 2 OR . 1 1 22 22 TYR HA H . . . 1 1 22 22 TYR HD1 H . . . . . 2.767 1.810 3.724 . . . . . A . 22 TYR HA . . A . 22 TYR HD1 . . . 22 . HA . . . . . 22 . HD1 . . c30497_6e5i 1 222 1 OR . 1 1 11 11 TYR H H . . . 1 1 11 11 TYR HD2 H . . . . . 2.777 1.813 3.741 . . . . . A . 11 TYR H . . A . 11 TYR HD2 . . . 11 . HN . . . . . 11 . HD2 . . c30497_6e5i 1 222 2 OR . 1 1 11 11 TYR H H . . . 1 1 11 11 TYR HD1 H . . . . . 2.777 1.813 3.741 . . . . . A . 11 TYR H . . A . 11 TYR HD1 . . . 11 . HN . . . . . 11 . HD1 . . c30497_6e5i 1 223 1 OR . 1 1 22 22 TYR HD2 H . . . 1 1 22 22 TYR H H . . . . . 2.780 1.814 3.746 . . . . . A . 22 TYR HD2 . . A . 22 TYR H . . . 22 . HD2 . . . . . 22 . HN . . c30497_6e5i 1 223 2 OR . 1 1 22 22 TYR HD1 H . . . 1 1 22 22 TYR H H . . . . . 2.780 1.814 3.746 . . . . . A . 22 TYR HD1 . . A . 22 TYR H . . . 22 . HD1 . . . . . 22 . HN . . c30497_6e5i 1 224 1 . . 1 1 22 22 TYR HA H . . . 1 1 18 18 ASP H H . . . . . 2.782 1.815 3.749 . . . . . A . 22 TYR HA . . A . 18 ASP H . . . 22 . HA . . . . . 18 . HN . . c30497_6e5i 1 225 1 . . 1 1 14 14 GLU H H . . . 1 1 14 14 GLU HA H . . . . . 2.783 1.815 3.751 . . . . . A . 14 GLU H . . A . 14 GLU HA . . . 14 . HN . . . . . 14 . HA . . c30497_6e5i 1 226 1 OR . 1 1 14 14 GLU HB2 H . . . 1 1 25 25 HIS HB2 H . . . . . 2.785 1.816 3.754 . . . . . A . 14 GLU HB2 . . A . 25 HIS HB2 . . . 14 . HB1 . . . . . 25 . HB1 . . c30497_6e5i 1 226 2 OR . 1 1 14 14 GLU HB3 H . . . 1 1 25 25 HIS HB2 H . . . . . 2.785 1.816 3.754 . . . . . A . 14 GLU HB3 . . A . 25 HIS HB2 . . . 14 . HB2 . . . . . 25 . HB1 . . c30497_6e5i 1 227 1 . . 1 1 22 22 TYR H H . . . 1 1 22 22 TYR HB2 H . . . . . 2.797 1.819 3.775 . . . . . A . 22 TYR H . . A . 22 TYR HB2 . . . 22 . HN . . . . . 22 . HB1 . . c30497_6e5i 1 228 1 . . 1 1 26 26 CYS HB2 H . . . 1 1 26 26 CYS HA H . . . . . 2.797 1.819 3.775 . . . . . A . 26 CYS HB2 . . A . 26 CYS HA . . . 26 . HB1 . . . . . 26 . HA . . c30497_6e5i 1 229 1 . . 1 1 17 17 CYS HA H . . . 1 1 17 17 CYS HB2 H . . . . . 2.802 1.820 3.784 . . . . . A . 17 CYS HA . . A . 17 CYS HB2 . . . 17 . HA . . . . . 17 . HB1 . . c30497_6e5i 1 230 1 OR . 1 1 23 23 GLU HG2 H . . . 1 1 23 23 GLU HA H . . . . . 2.804 1.821 3.787 . . . . . A . 23 GLU HG2 . . A . 23 GLU HA . . . 23 . HG1 . . . . . 23 . HA . . c30497_6e5i 1 230 2 OR . 1 1 23 23 GLU HG3 H . . . 1 1 23 23 GLU HA H . . . . . 2.804 1.821 3.787 . . . . . A . 23 GLU HG3 . . A . 23 GLU HA . . . 23 . HG2 . . . . . 23 . HA . . c30497_6e5i 1 231 1 . . 1 1 13 13 CYS HB3 H . . . 1 1 13 13 CYS HA H . . . . . 2.807 1.822 3.792 . . . . . A . 13 CYS HB3 . . A . 13 CYS HA . . . 13 . HB2 . . . . . 13 . HA . . c30497_6e5i 1 232 1 OR . 1 1 15 15 VAL MG1 H . . . 1 1 11 11 TYR HD1 H . . . . . 2.814 1.824 3.804 . . . . . A . 15 VAL MG1 . . A . 11 TYR HD1 . . . 15 . HG11 . . . . . 11 . HD1 . . c30497_6e5i 1 232 2 OR . 1 1 15 15 VAL MG1 H . . . 1 1 11 11 TYR HD2 H . . . . . 2.814 1.824 3.804 . . . . . A . 15 VAL MG1 . . A . 11 TYR HD2 . . . 15 . HG11 . . . . . 11 . HD2 . . c30497_6e5i 1 233 1 . . 1 1 11 11 TYR H H . . . 1 1 11 11 TYR HB3 H . . . . . 2.817 1.825 3.809 . . . . . A . 11 TYR H . . A . 11 TYR HB3 . . . 11 . HN . . . . . 11 . HB2 . . c30497_6e5i 1 234 1 . . 1 1 21 21 ARG H H . . . 1 1 20 20 PRO HD3 H . . . . . 2.819 1.826 3.812 . . . . . A . 21 ARG H . . A . 20 PRO HD3 . . . 21 . HN . . . . . 20 . HD2 . . c30497_6e5i 1 235 1 . . 1 1 10 10 ARG HA H . . . 1 1 10 10 ARG HG3 H . . . . . 2.822 1.826 3.818 . . . . . A . 10 ARG HA . . A . 10 ARG HG3 . . . 10 . HA . . . . . 10 . HG2 . . c30497_6e5i 1 236 1 . . 1 1 13 13 CYS H H . . . 1 1 13 13 CYS HA H . . . . . 2.832 1.829 3.835 . . . . . A . 13 CYS H . . A . 13 CYS HA . . . 13 . HN . . . . . 13 . HA . . c30497_6e5i 1 237 1 . . 1 1 22 22 TYR HA H . . . 1 1 22 22 TYR H H . . . . . 2.832 1.829 3.835 . . . . . A . 22 TYR HA . . A . 22 TYR H . . . 22 . HA . . . . . 22 . HN . . c30497_6e5i 1 238 1 . . 1 1 2 2 ASP H H . . . 1 1 2 2 ASP HB2 H . . . . . 2.841 1.832 3.850 . . . . . A . 2 ASP H . . A . 2 ASP HB2 . . . 2 . HN . . . . . 2 . HB1 . . c30497_6e5i 1 239 1 OR . 1 1 7 7 LEU MD1 H . . . 1 1 22 22 TYR HD2 H . . . . . 2.841 1.832 3.850 . . . . . A . 7 LEU MD1 . . A . 22 TYR HD2 . . . 7 . HD11 . . . . . 22 . HD2 . . c30497_6e5i 1 239 2 OR . 1 1 7 7 LEU MD1 H . . . 1 1 22 22 TYR HD1 H . . . . . 2.841 1.832 3.850 . . . . . A . 7 LEU MD1 . . A . 22 TYR HD1 . . . 7 . HD11 . . . . . 22 . HD1 . . c30497_6e5i 1 240 1 . . 1 1 15 15 VAL H H . . . 1 1 15 15 VAL MG1 H . . . . . 2.848 1.834 3.862 . . . . . A . 15 VAL H . . A . 15 VAL MG1 . . . 15 . HN . . . . . 15 . HG11 . . c30497_6e5i 1 241 1 . . 1 1 1 1 ASN HA H . . . 1 1 1 1 ASN HB2 H . . . . . 2.854 1.836 3.872 . . . . . A . 1 ASN HA . . A . 1 ASN HB2 . . . 1 . HA . . . . . 1 . HB1 . . c30497_6e5i 1 242 1 . . 1 1 15 15 VAL MG2 H . . . 1 1 24 24 VAL MG2 H . . . . . 2.854 1.836 3.872 . . . . . A . 15 VAL MG2 . . A . 24 VAL MG2 . . . 15 . HG21 . . . . . 24 . HG21 . . c30497_6e5i 1 243 1 . . 1 1 14 14 GLU H H . . . 1 1 26 26 CYS HA H . . . . . 2.854 1.836 3.872 . . . . . A . 14 GLU H . . A . 26 CYS HA . . . 14 . HN . . . . . 26 . HA . . c30497_6e5i 1 244 1 . . 1 1 2 2 ASP H H . . . 1 1 1 1 ASN HB3 H . . . . . 2.856 1.837 3.875 . . . . . A . 2 ASP H . . A . 1 ASN HB3 . . . 2 . HN . . . . . 1 . HB2 . . c30497_6e5i 1 245 1 . . 1 1 18 18 ASP H H . . . 1 1 18 18 ASP HB2 H . . . . . 2.856 1.837 3.875 . . . . . A . 18 ASP H . . A . 18 ASP HB2 . . . 18 . HN . . . . . 18 . HB1 . . c30497_6e5i 1 246 1 OR . 1 1 7 7 LEU HB2 H . . . 1 1 11 11 TYR HD2 H . . . . . 2.865 1.839 3.891 . . . . . A . 7 LEU HB2 . . A . 11 TYR HD2 . . . 7 . HB1 . . . . . 11 . HD2 . . c30497_6e5i 1 246 2 OR . 1 1 7 7 LEU HB2 H . . . 1 1 11 11 TYR HD1 H . . . . . 2.865 1.839 3.891 . . . . . A . 7 LEU HB2 . . A . 11 TYR HD1 . . . 7 . HB1 . . . . . 11 . HD1 . . c30497_6e5i 1 247 1 . . 1 1 1 1 ASN HA H . . . 1 1 1 1 ASN HB3 H . . . . . 2.876 1.842 3.910 . . . . . A . 1 ASN HA . . A . 1 ASN HB3 . . . 1 . HA . . . . . 1 . HB2 . . c30497_6e5i 1 248 1 . . 1 1 19 19 DPR HD2 H . . . 1 1 17 17 CYS HB3 H . . . . . 2.878 1.842 3.914 . . . . . A . 19 DPR HD2 . . A . 17 CYS HB3 . . . 19 . HD1 . . . . . 17 . HB2 . . c30497_6e5i 1 249 1 . . 1 1 9 9 LYS HA H . . . 1 1 10 10 ARG H H . . . . . 2.880 1.843 3.917 . . . . . A . 9 LYS HA . . A . 10 ARG H . . . 9 . HA . . . . . 10 . HN . . c30497_6e5i 1 250 1 . . 1 1 23 23 GLU H H . . . 1 1 22 22 TYR HB3 H . . . . . 2.882 1.844 3.920 . . . . . A . 23 GLU H . . A . 22 TYR HB3 . . . 23 . HN . . . . . 22 . HB2 . . c30497_6e5i 1 251 1 . . 1 1 9 9 LYS H H . . . 1 1 8 8 LYS HA H . . . . . 2.888 1.845 3.931 . . . . . A . 9 LYS H . . A . 8 LYS HA . . . 9 . HN . . . . . 8 . HA . . c30497_6e5i 1 252 1 . . 1 1 5 5 LYS HA H . . . 1 1 6 6 GLU H H . . . . . 2.894 1.847 3.941 . . . . . A . 5 LYS HA . . A . 6 GLU H . . . 5 . HA . . . . . 6 . HN . . c30497_6e5i 1 253 1 . . 1 1 3 3 LYS HA H . . . 1 1 4 4 CYS H H . . . . . 2.896 1.848 3.944 . . . . . A . 3 LYS HA . . A . 4 CYS H . . . 3 . HA . . . . . 4 . HN . . c30497_6e5i 1 254 1 OR . 1 1 24 24 VAL MG1 H . . . 1 1 11 11 TYR HD1 H . . . . . 2.904 1.850 3.958 . . . . . A . 24 VAL MG1 . . A . 11 TYR HD1 . . . 24 . HG11 . . . . . 11 . HD1 . . c30497_6e5i 1 254 2 OR . 1 1 24 24 VAL MG1 H . . . 1 1 11 11 TYR HD2 H . . . . . 2.904 1.850 3.958 . . . . . A . 24 VAL MG1 . . A . 11 TYR HD2 . . . 24 . HG11 . . . . . 11 . HD2 . . c30497_6e5i 1 255 1 . . 1 1 4 4 CYS HA H . . . 1 1 5 5 LYS H H . . . . . 2.904 1.850 3.958 . . . . . A . 4 CYS HA . . A . 5 LYS H . . . 4 . HA . . . . . 5 . HN . . c30497_6e5i 1 256 1 OR . 1 1 15 15 VAL MG2 H . . . 1 1 22 22 TYR HD1 H . . . . . 2.908 1.851 3.965 . . . . . A . 15 VAL MG2 . . A . 22 TYR HD1 . . . 15 . HG21 . . . . . 22 . HD1 . . c30497_6e5i 1 256 2 OR . 1 1 15 15 VAL MG2 H . . . 1 1 22 22 TYR HD2 H . . . . . 2.908 1.851 3.965 . . . . . A . 15 VAL MG2 . . A . 22 TYR HD2 . . . 15 . HG21 . . . . . 22 . HD2 . . c30497_6e5i 1 257 1 . . 1 1 2 2 ASP HB3 H . . . 1 1 2 2 ASP H H . . . . . 2.917 1.853 3.981 . . . . . A . 2 ASP HB3 . . A . 2 ASP H . . . 2 . HB2 . . . . . 2 . HN . . c30497_6e5i 1 258 1 . . 1 1 18 18 ASP H H . . . 1 1 18 18 ASP HA H . . . . . 2.919 1.854 3.984 . . . . . A . 18 ASP H . . A . 18 ASP HA . . . 18 . HN . . . . . 18 . HA . . c30497_6e5i 1 259 1 . . 1 1 7 7 LEU MD1 H . . . 1 1 22 22 TYR HB3 H . . . . . 2.921 1.854 3.988 . . . . . A . 7 LEU MD1 . . A . 22 TYR HB3 . . . 7 . HD11 . . . . . 22 . HB2 . . c30497_6e5i 1 260 1 . . 1 1 25 25 HIS H H . . . 1 1 15 15 VAL HA H . . . . . 2.921 1.854 3.988 . . . . . A . 25 HIS H . . A . 15 VAL HA . . . 25 . HN . . . . . 15 . HA . . c30497_6e5i 1 261 1 . . 1 1 16 16 ARG HA H . . . 1 1 16 16 ARG HG3 H . . . . . 2.923 1.855 3.991 . . . . . A . 16 ARG HA . . A . 16 ARG HG3 . . . 16 . HA . . . . . 16 . HG2 . . c30497_6e5i 1 262 1 . . 1 1 6 6 GLU H H . . . 1 1 6 6 GLU HG3 H . . . . . 2.932 1.857 4.007 . . . . . A . 6 GLU H . . A . 6 GLU HG3 . . . 6 . HN . . . . . 6 . HG2 . . c30497_6e5i 1 263 1 . . 1 1 20 20 PRO HD2 H . . . 1 1 20 20 PRO HB3 H . . . . . 2.934 1.858 4.010 . . . . . A . 20 PRO HD2 . . A . 20 PRO HB3 . . . 20 . HD1 . . . . . 20 . HB2 . . c30497_6e5i 1 264 1 OR . 1 1 15 15 VAL H H . . . 1 1 14 14 GLU HB2 H . . . . . 2.937 1.859 4.015 . . . . . A . 15 VAL H . . A . 14 GLU HB2 . . . 15 . HN . . . . . 14 . HB1 . . c30497_6e5i 1 264 2 OR . 1 1 15 15 VAL H H . . . 1 1 14 14 GLU HB3 H . . . . . 2.937 1.859 4.015 . . . . . A . 15 VAL H . . A . 14 GLU HB3 . . . 15 . HN . . . . . 14 . HB2 . . c30497_6e5i 1 265 1 OR . 1 1 10 10 ARG HB2 H . . . 1 1 11 11 TYR HD2 H . . . . . 2.941 1.860 4.022 . . . . . A . 10 ARG HB2 . . A . 11 TYR HD2 . . . 10 . HB1 . . . . . 11 . HD2 . . c30497_6e5i 1 265 2 OR . 1 1 10 10 ARG HB2 H . . . 1 1 11 11 TYR HD1 H . . . . . 2.941 1.860 4.022 . . . . . A . 10 ARG HB2 . . A . 11 TYR HD1 . . . 10 . HB1 . . . . . 11 . HD1 . . c30497_6e5i 1 266 1 . . 1 1 6 6 GLU HA H . . . 1 1 6 6 GLU HG2 H . . . . . 2.943 1.860 4.026 . . . . . A . 6 GLU HA . . A . 6 GLU HG2 . . . 6 . HA . . . . . 6 . HG1 . . c30497_6e5i 1 267 1 . . 1 1 7 7 LEU MD1 H . . . 1 1 15 15 VAL MG2 H . . . . . 2.950 1.862 4.038 . . . . . A . 7 LEU MD1 . . A . 15 VAL MG2 . . . 7 . HD11 . . . . . 15 . HG21 . . c30497_6e5i 1 268 1 . . 1 1 15 15 VAL MG1 H . . . 1 1 7 7 LEU MD2 H . . . . . 2.957 1.864 4.050 . . . . . A . 15 VAL MG1 . . A . 7 LEU MD2 . . . 15 . HG11 . . . . . 7 . HD21 . . c30497_6e5i 1 269 1 . . 1 1 7 7 LEU HA H . . . 1 1 10 10 ARG H H . . . . . 2.967 1.867 4.067 . . . . . A . 7 LEU HA . . A . 10 ARG H . . . 7 . HA . . . . . 10 . HN . . c30497_6e5i 1 270 1 OR . 1 1 16 16 ARG HD2 H . . . 1 1 16 16 ARG HE H . . . . . 2.974 1.868 4.080 . . . . . A . 16 ARG HD2 . . A . 16 ARG HE . . . 16 . HD1 . . . . . 16 . HE . . c30497_6e5i 1 270 2 OR . 1 1 16 16 ARG HD3 H . . . 1 1 16 16 ARG HE H . . . . . 2.974 1.868 4.080 . . . . . A . 16 ARG HD3 . . A . 16 ARG HE . . . 16 . HD2 . . . . . 16 . HE . . c30497_6e5i 1 271 1 . . 1 1 16 16 ARG HA H . . . 1 1 16 16 ARG HG2 H . . . . . 2.974 1.868 4.080 . . . . . A . 16 ARG HA . . A . 16 ARG HG2 . . . 16 . HA . . . . . 16 . HG1 . . c30497_6e5i 1 272 1 . . 1 1 24 24 VAL H H . . . 1 1 23 23 GLU HB3 H . . . . . 2.981 1.870 4.092 . . . . . A . 24 VAL H . . A . 23 GLU HB3 . . . 24 . HN . . . . . 23 . HB2 . . c30497_6e5i 1 273 1 . . 1 1 10 10 ARG HD2 H . . . 1 1 10 10 ARG HG2 H . . . . . 2.984 1.871 4.097 . . . . . A . 10 ARG HD2 . . A . 10 ARG HG2 . . . 10 . HD1 . . . . . 10 . HG1 . . c30497_6e5i 1 274 1 OR . 1 1 21 21 ARG HB2 H . . . 1 1 18 18 ASP HB2 H . . . . . 2.984 1.871 4.097 . . . . . A . 21 ARG HB2 . . A . 18 ASP HB2 . . . 21 . HB1 . . . . . 18 . HB1 . . c30497_6e5i 1 274 2 OR . 1 1 21 21 ARG HB3 H . . . 1 1 18 18 ASP HB2 H . . . . . 2.984 1.871 4.097 . . . . . A . 21 ARG HB3 . . A . 18 ASP HB2 . . . 21 . HB2 . . . . . 18 . HB1 . . c30497_6e5i 1 275 1 . . 1 1 17 17 CYS H H . . . 1 1 17 17 CYS HB3 H . . . . . 2.986 1.871 4.101 . . . . . A . 17 CYS H . . A . 17 CYS HB3 . . . 17 . HN . . . . . 17 . HB2 . . c30497_6e5i 1 276 1 . . 1 1 24 24 VAL HA H . . . 1 1 15 15 VAL MG1 H . . . . . 2.989 1.872 4.106 . . . . . A . 24 VAL HA . . A . 15 VAL MG1 . . . 24 . HA . . . . . 15 . HG11 . . c30497_6e5i 1 277 1 OR . 1 1 21 21 ARG HE H . . . 1 1 21 21 ARG HD2 H . . . . . 2.994 1.874 4.114 . . . . . A . 21 ARG HE . . A . 21 ARG HD2 . . . 21 . HE . . . . . 21 . HD1 . . c30497_6e5i 1 277 2 OR . 1 1 21 21 ARG HD3 H . . . 1 1 21 21 ARG HE H . . . . . 2.994 1.874 4.114 . . . . . A . 21 ARG HD3 . . A . 21 ARG HE . . . 21 . HD2 . . . . . 21 . HE . . c30497_6e5i 1 278 1 . . 1 1 12 12 ORN HD3 H . . . 1 1 13 13 CYS H H . . . . . 2.996 1.874 4.118 . . . . . A . 12 ORN HD3 . . A . 13 CYS H . . . 12 . HD2 . . . . . 13 . HN . . c30497_6e5i 1 279 1 OR . 1 1 4 4 CYS HA H . . . 1 1 22 22 TYR HE2 H . . . . . 3.002 1.876 4.128 . . . . . A . 4 CYS HA . . A . 22 TYR HE2 . . . 4 . HA . . . . . 22 . HE2 . . c30497_6e5i 1 279 2 OR . 1 1 4 4 CYS HA H . . . 1 1 22 22 TYR HE1 H . . . . . 3.002 1.876 4.128 . . . . . A . 4 CYS HA . . A . 22 TYR HE1 . . . 4 . HA . . . . . 22 . HE1 . . c30497_6e5i 1 280 1 . . 1 1 21 21 ARG H H . . . 1 1 20 20 PRO HA H . . . . . 3.007 1.877 4.137 . . . . . A . 21 ARG H . . A . 20 PRO HA . . . 21 . HN . . . . . 20 . HA . . c30497_6e5i 1 281 1 . . 1 1 18 18 ASP H H . . . 1 1 17 17 CYS HB3 H . . . . . 3.007 1.877 4.137 . . . . . A . 18 ASP H . . A . 17 CYS HB3 . . . 18 . HN . . . . . 17 . HB2 . . c30497_6e5i 1 282 1 . . 1 1 23 23 GLU H H . . . 1 1 23 23 GLU HB3 H . . . . . 3.015 1.879 4.151 . . . . . A . 23 GLU H . . A . 23 GLU HB3 . . . 23 . HN . . . . . 23 . HB2 . . c30497_6e5i 1 283 1 OR . 1 1 7 7 LEU HA H . . . 1 1 11 11 TYR HD2 H . . . . . 3.020 1.880 4.160 . . . . . A . 7 LEU HA . . A . 11 TYR HD2 . . . 7 . HA . . . . . 11 . HD2 . . c30497_6e5i 1 283 2 OR . 1 1 7 7 LEU HA H . . . 1 1 11 11 TYR HD1 H . . . . . 3.020 1.880 4.160 . . . . . A . 7 LEU HA . . A . 11 TYR HD1 . . . 7 . HA . . . . . 11 . HD1 . . c30497_6e5i 1 284 1 . . 1 1 5 5 LYS HA H . . . 1 1 5 5 LYS HG2 H . . . . . 3.023 1.881 4.165 . . . . . A . 5 LYS HA . . A . 5 LYS HG2 . . . 5 . HA . . . . . 5 . HG1 . . c30497_6e5i 1 285 1 OR . 1 1 24 24 VAL MG1 H . . . 1 1 11 11 TYR HE1 H . . . . . 3.026 1.882 4.170 . . . . . A . 24 VAL MG1 . . A . 11 TYR HE1 . . . 24 . HG11 . . . . . 11 . HE1 . . c30497_6e5i 1 285 2 OR . 1 1 24 24 VAL MG1 H . . . 1 1 11 11 TYR HE2 H . . . . . 3.026 1.882 4.170 . . . . . A . 24 VAL MG1 . . A . 11 TYR HE2 . . . 24 . HG11 . . . . . 11 . HE2 . . c30497_6e5i 1 286 1 OR . 1 1 24 24 VAL MG2 H . . . 1 1 11 11 TYR HD1 H . . . . . 3.029 1.883 4.175 . . . . . A . 24 VAL MG2 . . A . 11 TYR HD1 . . . 24 . HG21 . . . . . 11 . HD1 . . c30497_6e5i 1 286 2 OR . 1 1 24 24 VAL MG2 H . . . 1 1 11 11 TYR HD2 H . . . . . 3.029 1.883 4.175 . . . . . A . 24 VAL MG2 . . A . 11 TYR HD2 . . . 24 . HG21 . . . . . 11 . HD2 . . c30497_6e5i 1 287 1 . . 1 1 9 9 LYS HB3 H . . . 1 1 10 10 ARG H H . . . . . 3.029 1.883 4.175 . . . . . A . 9 LYS HB3 . . A . 10 ARG H . . . 9 . HB2 . . . . . 10 . HN . . c30497_6e5i 1 288 1 . . 1 1 20 20 PRO HD2 H . . . 1 1 20 20 PRO HB2 H . . . . . 3.029 1.883 4.175 . . . . . A . 20 PRO HD2 . . A . 20 PRO HB2 . . . 20 . HD1 . . . . . 20 . HB1 . . c30497_6e5i 1 289 1 OR . 1 1 7 7 LEU MD2 H . . . 1 1 11 11 TYR HD2 H . . . . . 3.029 1.883 4.175 . . . . . A . 7 LEU MD2 . . A . 11 TYR HD2 . . . 7 . HD21 . . . . . 11 . HD2 . . c30497_6e5i 1 289 2 OR . 1 1 7 7 LEU MD2 H . . . 1 1 11 11 TYR HD1 H . . . . . 3.029 1.883 4.175 . . . . . A . 7 LEU MD2 . . A . 11 TYR HD1 . . . 7 . HD21 . . . . . 11 . HD1 . . c30497_6e5i 1 290 1 . . 1 1 19 19 DPR HA H . . . 1 1 19 19 DPR HG2 H . . . . . 3.031 1.882 4.180 . . . . . A . 19 DPR HA . . A . 19 DPR HG2 . . . 19 . HA . . . . . 19 . HG1 . . c30497_6e5i 1 291 1 . . 1 1 7 7 LEU MD1 H . . . 1 1 22 22 TYR HB2 H . . . . . 3.031 1.882 4.180 . . . . . A . 7 LEU MD1 . . A . 22 TYR HB2 . . . 7 . HD11 . . . . . 22 . HB1 . . c30497_6e5i 1 292 1 . . 1 1 15 15 VAL MG2 H . . . 1 1 7 7 LEU MD2 H . . . . . 3.037 1.884 4.190 . . . . . A . 15 VAL MG2 . . A . 7 LEU MD2 . . . 15 . HG21 . . . . . 7 . HD21 . . c30497_6e5i 1 293 1 . . 1 1 22 22 TYR H H . . . 1 1 22 22 TYR HB3 H . . . . . 3.043 1.886 4.200 . . . . . A . 22 TYR H . . A . 22 TYR HB3 . . . 22 . HN . . . . . 22 . HB2 . . c30497_6e5i 1 294 1 OR . 1 1 24 24 VAL MG2 H . . . 1 1 11 11 TYR HE2 H . . . . . 3.045 1.886 4.204 . . . . . A . 24 VAL MG2 . . A . 11 TYR HE2 . . . 24 . HG21 . . . . . 11 . HE2 . . c30497_6e5i 1 294 2 OR . 1 1 24 24 VAL MG2 H . . . 1 1 11 11 TYR HE1 H . . . . . 3.045 1.886 4.204 . . . . . A . 24 VAL MG2 . . A . 11 TYR HE1 . . . 24 . HG21 . . . . . 11 . HE1 . . c30497_6e5i 1 295 1 . . 1 1 15 15 VAL MG2 H . . . 1 1 22 22 TYR HB2 H . . . . . 3.048 1.886 4.210 . . . . . A . 15 VAL MG2 . . A . 22 TYR HB2 . . . 15 . HG21 . . . . . 22 . HB1 . . c30497_6e5i 1 296 1 . . 1 1 14 14 GLU H H . . . 1 1 14 14 GLU HG3 H . . . . . 3.051 1.887 4.215 . . . . . A . 14 GLU H . . A . 14 GLU HG3 . . . 14 . HN . . . . . 14 . HG2 . . c30497_6e5i 1 297 1 . . 1 1 16 16 ARG H H . . . 1 1 16 16 ARG HG3 H . . . . . 3.060 1.889 4.231 . . . . . A . 16 ARG H . . A . 16 ARG HG3 . . . 16 . HN . . . . . 16 . HG2 . . c30497_6e5i 1 298 1 . . 1 1 5 5 LYS H H . . . 1 1 5 5 LYS HG3 H . . . . . 3.063 1.890 4.236 . . . . . A . 5 LYS H . . A . 5 LYS HG3 . . . 5 . HN . . . . . 5 . HG2 . . c30497_6e5i 1 299 1 . . 1 1 19 19 DPR HD3 H . . . 1 1 19 19 DPR HA H . . . . . 3.072 1.892 4.252 . . . . . A . 19 DPR HD3 . . A . 19 DPR HA . . . 19 . HD2 . . . . . 19 . HA . . c30497_6e5i 1 300 1 . . 1 1 2 2 ASP HA H . . . 1 1 2 2 ASP H H . . . . . 3.072 1.892 4.252 . . . . . A . 2 ASP HA . . A . 2 ASP H . . . 2 . HA . . . . . 2 . HN . . c30497_6e5i 1 301 1 . . 1 1 13 13 CYS H H . . . 1 1 13 13 CYS HB2 H . . . . . 3.075 1.893 4.257 . . . . . A . 13 CYS H . . A . 13 CYS HB2 . . . 13 . HN . . . . . 13 . HB1 . . c30497_6e5i 1 302 1 . . 1 1 7 7 LEU MD1 H . . . 1 1 4 4 CYS HA H . . . . . 3.078 1.893 4.263 . . . . . A . 7 LEU MD1 . . A . 4 CYS HA . . . 7 . HD11 . . . . . 4 . HA . . c30497_6e5i 1 303 1 . . 1 1 8 8 LYS H H . . . 1 1 5 5 LYS HA H . . . . . 3.078 1.893 4.263 . . . . . A . 8 LYS H . . A . 5 LYS HA . . . 8 . HN . . . . . 5 . HA . . c30497_6e5i 1 304 1 OR . 1 1 25 25 HIS H H . . . 1 1 14 14 GLU HB2 H . . . . . 3.091 1.897 4.285 . . . . . A . 25 HIS H . . A . 14 GLU HB2 . . . 25 . HN . . . . . 14 . HB1 . . c30497_6e5i 1 304 2 OR . 1 1 25 25 HIS H H . . . 1 1 14 14 GLU HB3 H . . . . . 3.091 1.897 4.285 . . . . . A . 25 HIS H . . A . 14 GLU HB3 . . . 25 . HN . . . . . 14 . HB2 . . c30497_6e5i 1 305 1 OR . 1 1 18 18 ASP H H . . . 1 1 21 21 ARG HB2 H . . . . . 3.101 1.899 4.303 . . . . . A . 18 ASP H . . A . 21 ARG HB2 . . . 18 . HN . . . . . 21 . HB1 . . c30497_6e5i 1 305 2 OR . 1 1 18 18 ASP H H . . . 1 1 21 21 ARG HB3 H . . . . . 3.101 1.899 4.303 . . . . . A . 18 ASP H . . A . 21 ARG HB3 . . . 18 . HN . . . . . 21 . HB2 . . c30497_6e5i 1 306 1 . . 1 1 20 20 PRO HD2 H . . . 1 1 19 19 DPR HB3 H . . . . . 3.104 1.900 4.308 . . . . . A . 20 PRO HD2 . . A . 19 DPR HB3 . . . 20 . HD1 . . . . . 19 . HB2 . . c30497_6e5i 1 307 1 . . 1 1 13 13 CYS HB3 H . . . 1 1 14 14 GLU H H . . . . . 3.104 1.900 4.308 . . . . . A . 13 CYS HB3 . . A . 14 GLU H . . . 13 . HB2 . . . . . 14 . HN . . c30497_6e5i 1 308 1 . . 1 1 10 10 ARG HA H . . . 1 1 10 10 ARG HG2 H . . . . . 3.121 1.904 4.338 . . . . . A . 10 ARG HA . . A . 10 ARG HG2 . . . 10 . HA . . . . . 10 . HG1 . . c30497_6e5i 1 309 1 . . 1 1 25 25 HIS H H . . . 1 1 14 14 GLU H H . . . . . 3.124 1.904 4.344 . . . . . A . 25 HIS H . . A . 14 GLU H . . . 25 . HN . . . . . 14 . HN . . c30497_6e5i 1 310 1 . . 1 1 9 9 LYS HA H . . . 1 1 9 9 LYS HG3 H . . . . . 3.128 1.905 4.351 . . . . . A . 9 LYS HA . . A . 9 LYS HG3 . . . 9 . HA . . . . . 9 . HG2 . . c30497_6e5i 1 311 1 . . 1 1 17 17 CYS HA H . . . 1 1 17 17 CYS HB3 H . . . . . 3.128 1.905 4.351 . . . . . A . 17 CYS HA . . A . 17 CYS HB3 . . . 17 . HA . . . . . 17 . HB2 . . c30497_6e5i 1 312 1 . . 1 1 6 6 GLU H H . . . 1 1 6 6 GLU HG2 H . . . . . 3.131 1.905 4.357 . . . . . A . 6 GLU H . . A . 6 GLU HG2 . . . 6 . HN . . . . . 6 . HG1 . . c30497_6e5i 1 313 1 . . 1 1 20 20 PRO HA H . . . 1 1 20 20 PRO HG3 H . . . . . 3.138 1.907 4.369 . . . . . A . 20 PRO HA . . A . 20 PRO HG3 . . . 20 . HA . . . . . 20 . HG2 . . c30497_6e5i 1 314 1 OR . 1 1 17 17 CYS HA H . . . 1 1 22 22 TYR HE2 H . . . . . 3.142 1.908 4.376 . . . . . A . 17 CYS HA . . A . 22 TYR HE2 . . . 17 . HA . . . . . 22 . HE2 . . c30497_6e5i 1 314 2 OR . 1 1 17 17 CYS HA H . . . 1 1 22 22 TYR HE1 H . . . . . 3.142 1.908 4.376 . . . . . A . 17 CYS HA . . A . 22 TYR HE1 . . . 17 . HA . . . . . 22 . HE1 . . c30497_6e5i 1 315 1 OR . 1 1 22 22 TYR HD2 H . . . 1 1 21 21 ARG HA H . . . . . 3.145 1.908 4.382 . . . . . A . 22 TYR HD2 . . A . 21 ARG HA . . . 22 . HD2 . . . . . 21 . HA . . c30497_6e5i 1 315 2 OR . 1 1 22 22 TYR HD1 H . . . 1 1 21 21 ARG HA H . . . . . 3.145 1.908 4.382 . . . . . A . 22 TYR HD1 . . A . 21 ARG HA . . . 22 . HD1 . . . . . 21 . HA . . c30497_6e5i 1 316 1 . . 1 1 3 3 LYS H H . . . 1 1 2 2 ASP HB2 H . . . . . 3.149 1.909 4.389 . . . . . A . 3 LYS H . . A . 2 ASP HB2 . . . 3 . HN . . . . . 2 . HB1 . . c30497_6e5i 1 317 1 OR . 1 1 16 16 ARG HA H . . . 1 1 16 16 ARG HD2 H . . . . . 3.153 1.911 4.395 . . . . . A . 16 ARG HA . . A . 16 ARG HD2 . . . 16 . HA . . . . . 16 . HD1 . . c30497_6e5i 1 317 2 OR . 1 1 16 16 ARG HA H . . . 1 1 16 16 ARG HD3 H . . . . . 3.153 1.911 4.395 . . . . . A . 16 ARG HA . . A . 16 ARG HD3 . . . 16 . HA . . . . . 16 . HD2 . . c30497_6e5i 1 318 1 . . 1 1 7 7 LEU HB3 H . . . 1 1 7 7 LEU MD2 H . . . . . 3.153 1.911 4.395 . . . . . A . 7 LEU HB3 . . A . 7 LEU MD2 . . . 7 . HB2 . . . . . 7 . HD21 . . c30497_6e5i 1 319 1 OR . 1 1 23 23 GLU HG2 H . . . 1 1 23 23 GLU H H . . . . . 3.168 1.914 4.422 . . . . . A . 23 GLU HG2 . . A . 23 GLU H . . . 23 . HG1 . . . . . 23 . HN . . c30497_6e5i 1 319 2 OR . 1 1 23 23 GLU HG3 H . . . 1 1 23 23 GLU H H . . . . . 3.168 1.914 4.422 . . . . . A . 23 GLU HG3 . . A . 23 GLU H . . . 23 . HG2 . . . . . 23 . HN . . c30497_6e5i 1 320 1 . . 1 1 10 10 ARG HD2 H . . . 1 1 10 10 ARG HE H . . . . . 3.168 1.914 4.422 . . . . . A . 10 ARG HD2 . . A . 10 ARG HE . . . 10 . HD1 . . . . . 10 . HE . . c30497_6e5i 1 321 1 . . 1 1 5 5 LYS HA H . . . 1 1 5 5 LYS HG3 H . . . . . 3.171 1.914 4.428 . . . . . A . 5 LYS HA . . A . 5 LYS HG3 . . . 5 . HA . . . . . 5 . HG2 . . c30497_6e5i 1 322 1 . . 1 1 19 19 DPR HA H . . . 1 1 19 19 DPR HG3 H . . . . . 3.175 1.915 4.435 . . . . . A . 19 DPR HA . . A . 19 DPR HG3 . . . 19 . HA . . . . . 19 . HG2 . . c30497_6e5i 1 323 1 OR . 1 1 22 22 TYR HE2 H . . . 1 1 22 22 TYR HB3 H . . . . . 3.175 1.915 4.435 . . . . . A . 22 TYR HE2 . . A . 22 TYR HB3 . . . 22 . HE2 . . . . . 22 . HB2 . . c30497_6e5i 1 323 2 OR . 1 1 22 22 TYR HE1 H . . . 1 1 22 22 TYR HB3 H . . . . . 3.175 1.915 4.435 . . . . . A . 22 TYR HE1 . . A . 22 TYR HB3 . . . 22 . HE1 . . . . . 22 . HB2 . . c30497_6e5i 1 324 1 . . 1 1 19 19 DPR HD2 H . . . 1 1 17 17 CYS HB2 H . . . . . 3.179 1.916 4.442 . . . . . A . 19 DPR HD2 . . A . 17 CYS HB2 . . . 19 . HD1 . . . . . 17 . HB1 . . c30497_6e5i 1 325 1 OR . 1 1 7 7 LEU MD1 H . . . 1 1 22 22 TYR HE2 H . . . . . 3.187 1.917 4.457 . . . . . A . 7 LEU MD1 . . A . 22 TYR HE2 . . . 7 . HD11 . . . . . 22 . HE2 . . c30497_6e5i 1 325 2 OR . 1 1 7 7 LEU MD1 H . . . 1 1 22 22 TYR HE1 H . . . . . 3.187 1.917 4.457 . . . . . A . 7 LEU MD1 . . A . 22 TYR HE1 . . . 7 . HD11 . . . . . 22 . HE1 . . c30497_6e5i 1 326 1 . . 1 1 14 14 GLU HA H . . . 1 1 14 14 GLU HG2 H . . . . . 3.187 1.917 4.457 . . . . . A . 14 GLU HA . . A . 14 GLU HG2 . . . 14 . HA . . . . . 14 . HG1 . . c30497_6e5i 1 327 1 . . 1 1 24 24 VAL MG1 H . . . 1 1 24 24 VAL H H . . . . . 3.187 1.917 4.457 . . . . . A . 24 VAL MG1 . . A . 24 VAL H . . . 24 . HG11 . . . . . 24 . HN . . c30497_6e5i 1 328 1 . . 1 1 3 3 LYS HA H . . . 1 1 3 3 LYS HG2 H . . . . . 3.191 1.918 4.464 . . . . . A . 3 LYS HA . . A . 3 LYS HG2 . . . 3 . HA . . . . . 3 . HG1 . . c30497_6e5i 1 329 1 OR . 1 1 8 8 LYS H H . . . 1 1 8 8 LYS HG2 H . . . . . 3.199 1.920 4.478 . . . . . A . 8 LYS H . . A . 8 LYS HG2 . . . 8 . HN . . . . . 8 . HG1 . . c30497_6e5i 1 329 2 OR . 1 1 8 8 LYS H H . . . 1 1 8 8 LYS HG3 H . . . . . 3.199 1.920 4.478 . . . . . A . 8 LYS H . . A . 8 LYS HG3 . . . 8 . HN . . . . . 8 . HG2 . . c30497_6e5i 1 330 1 OR . 1 1 7 7 LEU HB2 H . . . 1 1 11 11 TYR HE2 H . . . . . 3.203 1.920 4.486 . . . . . A . 7 LEU HB2 . . A . 11 TYR HE2 . . . 7 . HB1 . . . . . 11 . HE2 . . c30497_6e5i 1 330 2 OR . 1 1 7 7 LEU HB2 H . . . 1 1 11 11 TYR HE1 H . . . . . 3.203 1.920 4.486 . . . . . A . 7 LEU HB2 . . A . 11 TYR HE1 . . . 7 . HB1 . . . . . 11 . HE1 . . c30497_6e5i 1 331 1 . . 1 1 13 13 CYS HB3 H . . . 1 1 26 26 CYS HA H . . . . . 3.207 1.921 4.493 . . . . . A . 13 CYS HB3 . . A . 26 CYS HA . . . 13 . HB2 . . . . . 26 . HA . . c30497_6e5i 1 332 1 . . 1 1 3 3 LYS H H . . . 1 1 2 2 ASP H H . . . . . 3.207 1.921 4.493 . . . . . A . 3 LYS H . . A . 2 ASP H . . . 3 . HN . . . . . 2 . HN . . c30497_6e5i 1 333 1 . . 1 1 21 21 ARG H H . . . 1 1 18 18 ASP H H . . . . . 3.211 1.922 4.500 . . . . . A . 21 ARG H . . A . 18 ASP H . . . 21 . HN . . . . . 18 . HN . . c30497_6e5i 1 334 1 OR . 1 1 22 22 TYR H H . . . 1 1 21 21 ARG HG2 H . . . . . 3.224 1.925 4.523 . . . . . A . 22 TYR H . . A . 21 ARG HG2 . . . 22 . HN . . . . . 21 . HG1 . . c30497_6e5i 1 334 2 OR . 1 1 22 22 TYR H H . . . 1 1 21 21 ARG HG3 H . . . . . 3.224 1.925 4.523 . . . . . A . 22 TYR H . . A . 21 ARG HG3 . . . 22 . HN . . . . . 21 . HG2 . . c30497_6e5i 1 335 1 . . 1 1 3 3 LYS HA H . . . 1 1 6 6 GLU HG3 H . . . . . 3.229 1.926 4.532 . . . . . A . 3 LYS HA . . A . 6 GLU HG3 . . . 3 . HA . . . . . 6 . HG2 . . c30497_6e5i 1 336 1 . . 1 1 9 9 LYS HG2 H . . . 1 1 9 9 LYS HA H . . . . . 3.237 1.927 4.547 . . . . . A . 9 LYS HG2 . . A . 9 LYS HA . . . 9 . HG1 . . . . . 9 . HA . . c30497_6e5i 1 337 1 . . 1 1 25 25 HIS H H . . . 1 1 24 24 VAL MG2 H . . . . . 3.246 1.929 4.563 . . . . . A . 25 HIS H . . A . 24 VAL MG2 . . . 25 . HN . . . . . 24 . HG21 . . c30497_6e5i 1 338 1 . . 1 1 24 24 VAL MG1 H . . . 1 1 11 11 TYR HB2 H . . . . . 3.265 1.933 4.597 . . . . . A . 24 VAL MG1 . . A . 11 TYR HB2 . . . 24 . HG11 . . . . . 11 . HB1 . . c30497_6e5i 1 339 1 . . 1 1 8 8 LYS HA H . . . 1 1 11 11 TYR HB2 H . . . . . 3.265 1.933 4.597 . . . . . A . 8 LYS HA . . A . 11 TYR HB2 . . . 8 . HA . . . . . 11 . HB1 . . c30497_6e5i 1 340 1 . . 1 1 10 10 ARG HE H . . . 1 1 10 10 ARG HD3 H . . . . . 3.265 1.933 4.597 . . . . . A . 10 ARG HE . . A . 10 ARG HD3 . . . 10 . HE . . . . . 10 . HD2 . . c30497_6e5i 1 341 1 . . 1 1 25 25 HIS HD2 H . . . 1 1 25 25 HIS HB2 H . . . . . 3.265 1.933 4.597 . . . . . A . 25 HIS HD2 . . A . 25 HIS HB2 . . . 25 . HD2 . . . . . 25 . HB1 . . c30497_6e5i 1 342 1 . . 1 1 16 16 ARG HB2 H . . . 1 1 23 23 GLU H H . . . . . 3.269 1.933 4.605 . . . . . A . 16 ARG HB2 . . A . 23 GLU H . . . 16 . HB1 . . . . . 23 . HN . . c30497_6e5i 1 343 1 . . 1 1 10 10 ARG HB3 H . . . 1 1 10 10 ARG HD3 H . . . . . 3.274 1.934 4.614 . . . . . A . 10 ARG HB3 . . A . 10 ARG HD3 . . . 10 . HB2 . . . . . 10 . HD2 . . c30497_6e5i 1 344 1 . . 1 1 7 7 LEU MD1 H . . . 1 1 3 3 LYS HG2 H . . . . . 3.279 1.935 4.623 . . . . . A . 7 LEU MD1 . . A . 3 LYS HG2 . . . 7 . HD11 . . . . . 3 . HG1 . . c30497_6e5i 1 345 1 OR . 1 1 23 23 GLU H H . . . 1 1 22 22 TYR HD2 H . . . . . 3.279 1.935 4.623 . . . . . A . 23 GLU H . . A . 22 TYR HD2 . . . 23 . HN . . . . . 22 . HD2 . . c30497_6e5i 1 345 2 OR . 1 1 23 23 GLU H H . . . 1 1 22 22 TYR HD1 H . . . . . 3.279 1.935 4.623 . . . . . A . 23 GLU H . . A . 22 TYR HD1 . . . 23 . HN . . . . . 22 . HD1 . . c30497_6e5i 1 346 1 OR . 1 1 22 22 TYR HE2 H . . . 1 1 17 17 CYS HB3 H . . . . . 3.284 1.936 4.632 . . . . . A . 22 TYR HE2 . . A . 17 CYS HB3 . . . 22 . HE2 . . . . . 17 . HB2 . . c30497_6e5i 1 346 2 OR . 1 1 22 22 TYR HE1 H . . . 1 1 17 17 CYS HB3 H . . . . . 3.284 1.936 4.632 . . . . . A . 22 TYR HE1 . . A . 17 CYS HB3 . . . 22 . HE1 . . . . . 17 . HB2 . . c30497_6e5i 1 347 1 . . 1 1 16 16 ARG H H . . . 1 1 15 15 VAL MG1 H . . . . . 3.289 1.937 4.641 . . . . . A . 16 ARG H . . A . 15 VAL MG1 . . . 16 . HN . . . . . 15 . HG11 . . c30497_6e5i 1 348 1 . . 1 1 18 18 ASP H H . . . 1 1 17 17 CYS HB2 H . . . . . 3.289 1.937 4.641 . . . . . A . 18 ASP H . . A . 17 CYS HB2 . . . 18 . HN . . . . . 17 . HB1 . . c30497_6e5i 1 349 1 . . 1 1 9 9 LYS H H . . . 1 1 9 9 LYS HG3 H . . . . . 3.294 1.938 4.650 . . . . . A . 9 LYS H . . A . 9 LYS HG3 . . . 9 . HN . . . . . 9 . HG2 . . c30497_6e5i 1 350 1 OR . 1 1 5 5 LYS HB2 H . . . 1 1 2 2 ASP HB2 H . . . . . 3.294 1.938 4.650 . . . . . A . 5 LYS HB2 . . A . 2 ASP HB2 . . . 5 . HB1 . . . . . 2 . HB1 . . c30497_6e5i 1 350 2 OR . 1 1 5 5 LYS HB3 H . . . 1 1 2 2 ASP HB2 H . . . . . 3.294 1.938 4.650 . . . . . A . 5 LYS HB3 . . A . 2 ASP HB2 . . . 5 . HB2 . . . . . 2 . HB1 . . c30497_6e5i 1 351 1 OR . 1 1 22 22 TYR HE2 H . . . 1 1 22 22 TYR HB2 H . . . . . 3.299 1.939 4.659 . . . . . A . 22 TYR HE2 . . A . 22 TYR HB2 . . . 22 . HE2 . . . . . 22 . HB1 . . c30497_6e5i 1 351 2 OR . 1 1 22 22 TYR HE1 H . . . 1 1 22 22 TYR HB2 H . . . . . 3.299 1.939 4.659 . . . . . A . 22 TYR HE1 . . A . 22 TYR HB2 . . . 22 . HE1 . . . . . 22 . HB1 . . c30497_6e5i 1 352 1 . . 1 1 15 15 VAL HA H . . . 1 1 24 24 VAL MG2 H . . . . . 3.304 1.940 4.668 . . . . . A . 15 VAL HA . . A . 24 VAL MG2 . . . 15 . HA . . . . . 24 . HG21 . . c30497_6e5i 1 353 1 . . 1 1 3 3 LYS HG3 H . . . 1 1 3 3 LYS H H . . . . . 3.309 1.940 4.678 . . . . . A . 3 LYS HG3 . . A . 3 LYS H . . . 3 . HG2 . . . . . 3 . HN . . c30497_6e5i 1 354 1 . . 1 1 15 15 VAL MG2 H . . . 1 1 23 23 GLU H H . . . . . 3.309 1.940 4.678 . . . . . A . 15 VAL MG2 . . A . 23 GLU H . . . 15 . HG21 . . . . . 23 . HN . . c30497_6e5i 1 355 1 . . 1 1 15 15 VAL MG2 H . . . 1 1 22 22 TYR HB3 H . . . . . 3.309 1.940 4.678 . . . . . A . 15 VAL MG2 . . A . 22 TYR HB3 . . . 15 . HG21 . . . . . 22 . HB2 . . c30497_6e5i 1 356 1 . . 1 1 8 8 LYS HA H . . . 1 1 15 15 VAL MG2 H . . . . . 3.314 1.941 4.687 . . . . . A . 8 LYS HA . . A . 15 VAL MG2 . . . 8 . HA . . . . . 15 . HG21 . . c30497_6e5i 1 357 1 . . 1 1 13 13 CYS H H . . . 1 1 11 11 TYR HB2 H . . . . . 3.314 1.941 4.687 . . . . . A . 13 CYS H . . A . 11 TYR HB2 . . . 13 . HN . . . . . 11 . HB1 . . c30497_6e5i 1 358 1 OR . 1 1 21 21 ARG HG2 H . . . 1 1 21 21 ARG HE H . . . . . 3.314 1.941 4.687 . . . . . A . 21 ARG HG2 . . A . 21 ARG HE . . . 21 . HG1 . . . . . 21 . HE . . c30497_6e5i 1 358 2 OR . 1 1 21 21 ARG HG3 H . . . 1 1 21 21 ARG HE H . . . . . 3.314 1.941 4.687 . . . . . A . 21 ARG HG3 . . A . 21 ARG HE . . . 21 . HG2 . . . . . 21 . HE . . c30497_6e5i 1 359 1 . . 1 1 19 19 DPR HD3 H . . . 1 1 19 19 DPR HB3 H . . . . . 3.319 1.942 4.696 . . . . . A . 19 DPR HD3 . . A . 19 DPR HB3 . . . 19 . HD2 . . . . . 19 . HB2 . . c30497_6e5i 1 360 1 . . 1 1 14 14 GLU HA H . . . 1 1 14 14 GLU HG3 H . . . . . 3.319 1.942 4.696 . . . . . A . 14 GLU HA . . A . 14 GLU HG3 . . . 14 . HA . . . . . 14 . HG2 . . c30497_6e5i 1 361 1 OR . 1 1 3 3 LYS HB2 H . . . 1 1 22 22 TYR HE2 H . . . . . 3.319 1.942 4.696 . . . . . A . 3 LYS HB2 . . A . 22 TYR HE2 . . . 3 . HB1 . . . . . 22 . HE2 . . c30497_6e5i 1 361 2 OR . 1 1 3 3 LYS HB2 H . . . 1 1 22 22 TYR HE1 H . . . . . 3.319 1.942 4.696 . . . . . A . 3 LYS HB2 . . A . 22 TYR HE1 . . . 3 . HB1 . . . . . 22 . HE1 . . c30497_6e5i 1 361 3 OR . 1 1 3 3 LYS HB3 H . . . 1 1 22 22 TYR HE2 H . . . . . 3.319 1.942 4.696 . . . . . A . 3 LYS HB3 . . A . 22 TYR HE2 . . . 3 . HB2 . . . . . 22 . HE2 . . c30497_6e5i 1 361 4 OR . 1 1 3 3 LYS HB3 H . . . 1 1 22 22 TYR HE1 H . . . . . 3.319 1.942 4.696 . . . . . A . 3 LYS HB3 . . A . 22 TYR HE1 . . . 3 . HB2 . . . . . 22 . HE1 . . c30497_6e5i 1 362 1 . . 1 1 12 12 ORN HD2 H . . . 1 1 13 13 CYS H H . . . . . 3.325 1.943 4.707 . . . . . A . 12 ORN HD2 . . A . 13 CYS H . . . 12 . HD1 . . . . . 13 . HN . . c30497_6e5i 1 363 1 OR . 1 1 7 7 LEU HB3 H . . . 1 1 11 11 TYR HD2 H . . . . . 3.325 1.943 4.707 . . . . . A . 7 LEU HB3 . . A . 11 TYR HD2 . . . 7 . HB2 . . . . . 11 . HD2 . . c30497_6e5i 1 363 2 OR . 1 1 7 7 LEU HB3 H . . . 1 1 11 11 TYR HD1 H . . . . . 3.325 1.943 4.707 . . . . . A . 7 LEU HB3 . . A . 11 TYR HD1 . . . 7 . HB2 . . . . . 11 . HD1 . . c30497_6e5i 1 364 1 OR . 1 1 21 21 ARG HB2 H . . . 1 1 21 21 ARG HE H . . . . . 3.330 1.944 4.716 . . . . . A . 21 ARG HB2 . . A . 21 ARG HE . . . 21 . HB1 . . . . . 21 . HE . . c30497_6e5i 1 364 2 OR . 1 1 21 21 ARG HB3 H . . . 1 1 21 21 ARG HE H . . . . . 3.330 1.944 4.716 . . . . . A . 21 ARG HB3 . . A . 21 ARG HE . . . 21 . HB2 . . . . . 21 . HE . . c30497_6e5i 1 365 1 . . 1 1 1 1 ASN HD22 H . . . 1 1 1 1 ASN HB3 H . . . . . 3.335 1.944 4.726 . . . . . A . 1 ASN HD22 . . A . 1 ASN HB3 . . . 1 . HD22 . . . . . 1 . HB2 . . c30497_6e5i 1 366 1 . . 1 1 19 19 DPR HA H . . . 1 1 20 20 PRO HG3 H . . . . . 3.350 1.947 4.753 . . . . . A . 19 DPR HA . . A . 20 PRO HG3 . . . 19 . HA . . . . . 20 . HG2 . . c30497_6e5i 1 367 1 . . 1 1 21 21 ARG H H . . . 1 1 18 18 ASP HB3 H . . . . . 3.350 1.947 4.753 . . . . . A . 21 ARG H . . A . 18 ASP HB3 . . . 21 . HN . . . . . 18 . HB2 . . c30497_6e5i 1 368 1 OR . 1 1 10 10 ARG HB2 H . . . 1 1 11 11 TYR HE2 H . . . . . 3.354 1.948 4.760 . . . . . A . 10 ARG HB2 . . A . 11 TYR HE2 . . . 10 . HB1 . . . . . 11 . HE2 . . c30497_6e5i 1 368 2 OR . 1 1 10 10 ARG HB2 H . . . 1 1 11 11 TYR HE1 H . . . . . 3.354 1.948 4.760 . . . . . A . 10 ARG HB2 . . A . 11 TYR HE1 . . . 10 . HB1 . . . . . 11 . HE1 . . c30497_6e5i 1 369 1 . . 1 1 19 19 DPR HD2 H . . . 1 1 18 18 ASP H H . . . . . 3.362 1.949 4.775 . . . . . A . 19 DPR HD2 . . A . 18 ASP H . . . 19 . HD1 . . . . . 18 . HN . . c30497_6e5i 1 370 1 OR . 1 1 5 5 LYS HB2 H . . . 1 1 2 2 ASP HB3 H . . . . . 3.362 1.949 4.775 . . . . . A . 5 LYS HB2 . . A . 2 ASP HB3 . . . 5 . HB1 . . . . . 2 . HB2 . . c30497_6e5i 1 370 2 OR . 1 1 5 5 LYS HB3 H . . . 1 1 2 2 ASP HB3 H . . . . . 3.362 1.949 4.775 . . . . . A . 5 LYS HB3 . . A . 2 ASP HB3 . . . 5 . HB2 . . . . . 2 . HB2 . . c30497_6e5i 1 371 1 . . 1 1 13 13 CYS H H . . . 1 1 14 14 GLU H H . . . . . 3.362 1.949 4.775 . . . . . A . 13 CYS H . . A . 14 GLU H . . . 13 . HN . . . . . 14 . HN . . c30497_6e5i 1 372 1 . . 1 1 6 6 GLU HA H . . . 1 1 6 6 GLU HG3 H . . . . . 3.368 1.950 4.786 . . . . . A . 6 GLU HA . . A . 6 GLU HG3 . . . 6 . HA . . . . . 6 . HG2 . . c30497_6e5i 1 373 1 . . 1 1 16 16 ARG HA H . . . 1 1 17 17 CYS HB2 H . . . . . 3.373 1.951 4.795 . . . . . A . 16 ARG HA . . A . 17 CYS HB2 . . . 16 . HA . . . . . 17 . HB1 . . c30497_6e5i 1 374 1 . . 1 1 15 15 VAL MG1 H . . . 1 1 14 14 GLU HA H . . . . . 3.377 1.952 4.802 . . . . . A . 15 VAL MG1 . . A . 14 GLU HA . . . 15 . HG11 . . . . . 14 . HA . . c30497_6e5i 1 375 1 . . 1 1 1 1 ASN HD22 H . . . 1 1 1 1 ASN HB2 H . . . . . 3.381 1.952 4.810 . . . . . A . 1 ASN HD22 . . A . 1 ASN HB2 . . . 1 . HD22 . . . . . 1 . HB1 . . c30497_6e5i 1 376 1 OR . 1 1 7 7 LEU MD2 H . . . 1 1 22 22 TYR HE2 H . . . . . 3.383 1.952 4.814 . . . . . A . 7 LEU MD2 . . A . 22 TYR HE2 . . . 7 . HD21 . . . . . 22 . HE2 . . c30497_6e5i 1 376 2 OR . 1 1 7 7 LEU MD2 H . . . 1 1 22 22 TYR HE1 H . . . . . 3.383 1.952 4.814 . . . . . A . 7 LEU MD2 . . A . 22 TYR HE1 . . . 7 . HD21 . . . . . 22 . HE1 . . c30497_6e5i 1 377 1 . . 1 1 15 15 VAL H H . . . 1 1 15 15 VAL MG2 H . . . . . 3.383 1.952 4.814 . . . . . A . 15 VAL H . . A . 15 VAL MG2 . . . 15 . HN . . . . . 15 . HG21 . . c30497_6e5i 1 378 1 OR . 1 1 17 17 CYS HA H . . . 1 1 22 22 TYR HD2 H . . . . . 3.397 1.955 4.839 . . . . . A . 17 CYS HA . . A . 22 TYR HD2 . . . 17 . HA . . . . . 22 . HD2 . . c30497_6e5i 1 378 2 OR . 1 1 17 17 CYS HA H . . . 1 1 22 22 TYR HD1 H . . . . . 3.397 1.955 4.839 . . . . . A . 17 CYS HA . . A . 22 TYR HD1 . . . 17 . HA . . . . . 22 . HD1 . . c30497_6e5i 1 379 1 OR . 1 1 10 10 ARG HD2 H . . . 1 1 11 11 TYR HE2 H . . . . . 3.404 1.956 4.852 . . . . . A . 10 ARG HD2 . . A . 11 TYR HE2 . . . 10 . HD1 . . . . . 11 . HE2 . . c30497_6e5i 1 379 2 OR . 1 1 10 10 ARG HD2 H . . . 1 1 11 11 TYR HE1 H . . . . . 3.404 1.956 4.852 . . . . . A . 10 ARG HD2 . . A . 11 TYR HE1 . . . 10 . HD1 . . . . . 11 . HE1 . . c30497_6e5i 1 380 1 OR . 1 1 7 7 LEU HA H . . . 1 1 11 11 TYR HE2 H . . . . . 3.415 1.958 4.872 . . . . . A . 7 LEU HA . . A . 11 TYR HE2 . . . 7 . HA . . . . . 11 . HE2 . . c30497_6e5i 1 380 2 OR . 1 1 7 7 LEU HA H . . . 1 1 11 11 TYR HE1 H . . . . . 3.415 1.958 4.872 . . . . . A . 7 LEU HA . . A . 11 TYR HE1 . . . 7 . HA . . . . . 11 . HE1 . . c30497_6e5i 1 381 1 . . 1 1 21 21 ARG H H . . . 1 1 20 20 PRO HD2 H . . . . . 3.418 1.957 4.879 . . . . . A . 21 ARG H . . A . 20 PRO HD2 . . . 21 . HN . . . . . 20 . HD1 . . c30497_6e5i 1 382 1 . . 1 1 10 10 ARG HG3 H . . . 1 1 10 10 ARG HE H . . . . . 3.422 1.959 4.885 . . . . . A . 10 ARG HG3 . . A . 10 ARG HE . . . 10 . HG2 . . . . . 10 . HE . . c30497_6e5i 1 383 1 OR . 1 1 4 4 CYS HB2 H . . . 1 1 22 22 TYR HD2 H . . . . . 3.422 1.959 4.885 . . . . . A . 4 CYS HB2 . . A . 22 TYR HD2 . . . 4 . HB1 . . . . . 22 . HD2 . . c30497_6e5i 1 383 2 OR . 1 1 4 4 CYS HB2 H . . . 1 1 22 22 TYR HD1 H . . . . . 3.422 1.959 4.885 . . . . . A . 4 CYS HB2 . . A . 22 TYR HD1 . . . 4 . HB1 . . . . . 22 . HD1 . . c30497_6e5i 1 383 3 OR . 1 1 4 4 CYS HB3 H . . . 1 1 22 22 TYR HD2 H . . . . . 3.422 1.959 4.885 . . . . . A . 4 CYS HB3 . . A . 22 TYR HD2 . . . 4 . HB2 . . . . . 22 . HD2 . . c30497_6e5i 1 383 4 OR . 1 1 4 4 CYS HB3 H . . . 1 1 22 22 TYR HD1 H . . . . . 3.422 1.959 4.885 . . . . . A . 4 CYS HB3 . . A . 22 TYR HD1 . . . 4 . HB2 . . . . . 22 . HD1 . . c30497_6e5i 1 384 1 . . 1 1 10 10 ARG HG3 H . . . 1 1 10 10 ARG H H . . . . . 3.424 1.958 4.890 . . . . . A . 10 ARG HG3 . . A . 10 ARG H . . . 10 . HG2 . . . . . 10 . HN . . c30497_6e5i 1 385 1 OR . 1 1 4 4 CYS HA H . . . 1 1 22 22 TYR HD2 H . . . . . 3.436 1.961 4.911 . . . . . A . 4 CYS HA . . A . 22 TYR HD2 . . . 4 . HA . . . . . 22 . HD2 . . c30497_6e5i 1 385 2 OR . 1 1 4 4 CYS HA H . . . 1 1 22 22 TYR HD1 H . . . . . 3.436 1.961 4.911 . . . . . A . 4 CYS HA . . A . 22 TYR HD1 . . . 4 . HA . . . . . 22 . HD1 . . c30497_6e5i 1 386 1 . . 1 1 19 19 DPR HD2 H . . . 1 1 19 19 DPR HB3 H . . . . . 3.438 1.960 4.916 . . . . . A . 19 DPR HD2 . . A . 19 DPR HB3 . . . 19 . HD1 . . . . . 19 . HB2 . . c30497_6e5i 1 387 1 . . 1 1 20 20 PRO HD3 H . . . 1 1 19 19 DPR HB3 H . . . . . 3.442 1.961 4.923 . . . . . A . 20 PRO HD3 . . A . 19 DPR HB3 . . . 20 . HD2 . . . . . 19 . HB2 . . c30497_6e5i 1 388 1 OR . 1 1 11 11 TYR HE2 H . . . 1 1 10 10 ARG HE H . . . . . 3.448 1.962 4.934 . . . . . A . 11 TYR HE2 . . A . 10 ARG HE . . . 11 . HE2 . . . . . 10 . HE . . c30497_6e5i 1 388 2 OR . 1 1 11 11 TYR HE1 H . . . 1 1 10 10 ARG HE H . . . . . 3.448 1.962 4.934 . . . . . A . 11 TYR HE1 . . A . 10 ARG HE . . . 11 . HE1 . . . . . 10 . HE . . c30497_6e5i 1 389 1 . . 1 1 10 10 ARG HG2 H . . . 1 1 10 10 ARG HE H . . . . . 3.452 1.963 4.941 . . . . . A . 10 ARG HG2 . . A . 10 ARG HE . . . 10 . HG1 . . . . . 10 . HE . . c30497_6e5i 1 390 1 OR . 1 1 22 22 TYR HE2 H . . . 1 1 20 20 PRO HA H . . . . . 3.455 1.963 4.947 . . . . . A . 22 TYR HE2 . . A . 20 PRO HA . . . 22 . HE2 . . . . . 20 . HA . . c30497_6e5i 1 390 2 OR . 1 1 22 22 TYR HE1 H . . . 1 1 20 20 PRO HA H . . . . . 3.455 1.963 4.947 . . . . . A . 22 TYR HE1 . . A . 20 PRO HA . . . 22 . HE1 . . . . . 20 . HA . . c30497_6e5i 1 391 1 OR . 1 1 7 7 LEU MD2 H . . . 1 1 22 22 TYR HD2 H . . . . . 3.463 1.964 4.962 . . . . . A . 7 LEU MD2 . . A . 22 TYR HD2 . . . 7 . HD21 . . . . . 22 . HD2 . . c30497_6e5i 1 391 2 OR . 1 1 7 7 LEU MD2 H . . . 1 1 22 22 TYR HD1 H . . . . . 3.463 1.964 4.962 . . . . . A . 7 LEU MD2 . . A . 22 TYR HD1 . . . 7 . HD21 . . . . . 22 . HD1 . . c30497_6e5i 1 392 1 OR . 1 1 11 11 TYR HB3 H . . . 1 1 11 11 TYR HE2 H . . . . . 3.465 1.965 4.965 . . . . . A . 11 TYR HB3 . . A . 11 TYR HE2 . . . 11 . HB2 . . . . . 11 . HE2 . . c30497_6e5i 1 392 2 OR . 1 1 11 11 TYR HB3 H . . . 1 1 11 11 TYR HE1 H . . . . . 3.465 1.965 4.965 . . . . . A . 11 TYR HB3 . . A . 11 TYR HE1 . . . 11 . HB2 . . . . . 11 . HE1 . . c30497_6e5i 1 393 1 OR . 1 1 15 15 VAL MG2 H . . . 1 1 11 11 TYR HD2 H . . . . . 3.466 1.964 4.968 . . . . . A . 15 VAL MG2 . . A . 11 TYR HD2 . . . 15 . HG21 . . . . . 11 . HD2 . . c30497_6e5i 1 393 2 OR . 1 1 15 15 VAL MG2 H . . . 1 1 11 11 TYR HD1 H . . . . . 3.466 1.964 4.968 . . . . . A . 15 VAL MG2 . . A . 11 TYR HD1 . . . 15 . HG21 . . . . . 11 . HD1 . . c30497_6e5i 1 394 1 . . 1 1 25 25 HIS H H . . . 1 1 15 15 VAL MG1 H . . . . . 3.470 1.965 4.975 . . . . . A . 25 HIS H . . A . 15 VAL MG1 . . . 25 . HN . . . . . 15 . HG11 . . c30497_6e5i 1 395 1 OR . 1 1 7 7 LEU MD1 H . . . 1 1 3 3 LYS HE2 H . . . . . 3.472 1.965 4.979 . . . . . A . 7 LEU MD1 . . A . 3 LYS HE2 . . . 7 . HD11 . . . . . 3 . HE1 . . c30497_6e5i 1 395 2 OR . 1 1 7 7 LEU MD1 H . . . 1 1 3 3 LYS HE3 H . . . . . 3.472 1.965 4.979 . . . . . A . 7 LEU MD1 . . A . 3 LYS HE3 . . . 7 . HD11 . . . . . 3 . HE2 . . c30497_6e5i 1 396 1 . . 1 1 15 15 VAL H H . . . 1 1 14 14 GLU HG2 H . . . . . 3.475 1.966 4.984 . . . . . A . 15 VAL H . . A . 14 GLU HG2 . . . 15 . HN . . . . . 14 . HG1 . . c30497_6e5i 1 397 1 . . 1 1 25 25 HIS H H . . . 1 1 24 24 VAL H H . . . . . 3.479 1.966 4.992 . . . . . A . 25 HIS H . . A . 24 VAL H . . . 25 . HN . . . . . 24 . HN . . c30497_6e5i 1 398 1 OR . 1 1 10 10 ARG HB3 H . . . 1 1 11 11 TYR HD2 H . . . . . 3.480 1.966 4.994 . . . . . A . 10 ARG HB3 . . A . 11 TYR HD2 . . . 10 . HB2 . . . . . 11 . HD2 . . c30497_6e5i 1 398 2 OR . 1 1 10 10 ARG HB3 H . . . 1 1 11 11 TYR HD1 H . . . . . 3.480 1.966 4.994 . . . . . A . 10 ARG HB3 . . A . 11 TYR HD1 . . . 10 . HB2 . . . . . 11 . HD1 . . c30497_6e5i 1 399 1 . . 1 1 15 15 VAL H H . . . 1 1 14 14 GLU HG3 H . . . . . 3.483 1.966 5.000 . . . . . A . 15 VAL H . . A . 14 GLU HG3 . . . 15 . HN . . . . . 14 . HG2 . . c30497_6e5i 1 400 1 . . 1 1 10 10 ARG HA H . . . 1 1 10 10 ARG HD3 H . . . . . 3.492 1.968 5.016 . . . . . A . 10 ARG HA . . A . 10 ARG HD3 . . . 10 . HA . . . . . 10 . HD2 . . c30497_6e5i 1 401 1 . . 1 1 15 15 VAL MG1 H . . . 1 1 13 13 CYS HB2 H . . . . . 3.494 1.968 5.020 . . . . . A . 15 VAL MG1 . . A . 13 CYS HB2 . . . 15 . HG11 . . . . . 13 . HB1 . . c30497_6e5i 1 402 1 . . 1 1 15 15 VAL HA H . . . 1 1 24 24 VAL MG1 H . . . . . 3.501 1.969 5.033 . . . . . A . 15 VAL HA . . A . 24 VAL MG1 . . . 15 . HA . . . . . 24 . HG11 . . c30497_6e5i 1 403 1 . . 1 1 21 21 ARG H H . . . 1 1 20 20 PRO HB2 H . . . . . 3.502 1.969 5.035 . . . . . A . 21 ARG H . . A . 20 PRO HB2 . . . 21 . HN . . . . . 20 . HB1 . . c30497_6e5i 1 404 1 . . 1 1 11 11 TYR H H . . . 1 1 15 15 VAL MG1 H . . . . . 3.515 1.970 5.060 . . . . . A . 11 TYR H . . A . 15 VAL MG1 . . . 11 . HN . . . . . 15 . HG11 . . c30497_6e5i 1 405 1 . . 1 1 15 15 VAL HB H . . . 1 1 24 24 VAL MG2 H . . . . . 3.515 1.970 5.060 . . . . . A . 15 VAL HB . . A . 24 VAL MG2 . . . 15 . HB . . . . . 24 . HG21 . . c30497_6e5i 1 406 1 . . 1 1 20 20 PRO HD2 H . . . 1 1 20 20 PRO HA H . . . . . 3.516 1.971 5.061 . . . . . A . 20 PRO HD2 . . A . 20 PRO HA . . . 20 . HD1 . . . . . 20 . HA . . c30497_6e5i 1 407 1 OR . 1 1 11 11 TYR HE2 H . . . 1 1 10 10 ARG HD3 H . . . . . 3.530 1.973 5.087 . . . . . A . 11 TYR HE2 . . A . 10 ARG HD3 . . . 11 . HE2 . . . . . 10 . HD2 . . c30497_6e5i 1 407 2 OR . 1 1 11 11 TYR HE1 H . . . 1 1 10 10 ARG HD3 H . . . . . 3.530 1.973 5.087 . . . . . A . 11 TYR HE1 . . A . 10 ARG HD3 . . . 11 . HE1 . . . . . 10 . HD2 . . c30497_6e5i 1 408 1 . . 1 1 2 2 ASP H H . . . 1 1 1 1 ASN HB2 H . . . . . 3.533 1.973 5.093 . . . . . A . 2 ASP H . . A . 1 ASN HB2 . . . 2 . HN . . . . . 1 . HB1 . . c30497_6e5i 1 409 1 OR . 1 1 4 4 CYS H H . . . 1 1 5 5 LYS HB2 H . . . . . 3.537 1.973 5.101 . . . . . A . 4 CYS H . . A . 5 LYS HB2 . . . 4 . HN . . . . . 5 . HB1 . . c30497_6e5i 1 409 2 OR . 1 1 4 4 CYS H H . . . 1 1 5 5 LYS HB3 H . . . . . 3.537 1.973 5.101 . . . . . A . 4 CYS H . . A . 5 LYS HB3 . . . 4 . HN . . . . . 5 . HB2 . . c30497_6e5i 1 410 1 . . 1 1 3 3 LYS H H . . . 1 1 2 2 ASP HB3 H . . . . . 3.542 1.974 5.110 . . . . . A . 3 LYS H . . A . 2 ASP HB3 . . . 3 . HN . . . . . 2 . HB2 . . c30497_6e5i 1 411 1 . . 1 1 15 15 VAL H H . . . 1 1 16 16 ARG H H . . . . . 3.554 1.975 5.133 . . . . . A . 15 VAL H . . A . 16 ARG H . . . 15 . HN . . . . . 16 . HN . . c30497_6e5i 1 412 1 . . 1 1 10 10 ARG HD2 H . . . 1 1 7 7 LEU MD2 H . . . . . 3.557 1.975 5.139 . . . . . A . 10 ARG HD2 . . A . 7 LEU MD2 . . . 10 . HD1 . . . . . 7 . HD21 . . c30497_6e5i 1 413 1 OR . 1 1 18 18 ASP H H . . . 1 1 22 22 TYR HD2 H . . . . . 3.575 1.978 5.172 . . . . . A . 18 ASP H . . A . 22 TYR HD2 . . . 18 . HN . . . . . 22 . HD2 . . c30497_6e5i 1 413 2 OR . 1 1 18 18 ASP H H . . . 1 1 22 22 TYR HD1 H . . . . . 3.575 1.978 5.172 . . . . . A . 18 ASP H . . A . 22 TYR HD1 . . . 18 . HN . . . . . 22 . HD1 . . c30497_6e5i 1 414 1 . . 1 1 3 3 LYS H H . . . 1 1 3 3 LYS HG2 H . . . . . 3.576 1.978 5.174 . . . . . A . 3 LYS H . . A . 3 LYS HG2 . . . 3 . HN . . . . . 3 . HG1 . . c30497_6e5i 1 415 1 . . 1 1 7 7 LEU MD2 H . . . 1 1 22 22 TYR HB3 H . . . . . 3.577 1.977 5.177 . . . . . A . 7 LEU MD2 . . A . 22 TYR HB3 . . . 7 . HD21 . . . . . 22 . HB2 . . c30497_6e5i 1 416 1 OR . 1 1 8 8 LYS HA H . . . 1 1 11 11 TYR HD2 H . . . . . 3.593 1.980 5.206 . . . . . A . 8 LYS HA . . A . 11 TYR HD2 . . . 8 . HA . . . . . 11 . HD2 . . c30497_6e5i 1 416 2 OR . 1 1 8 8 LYS HA H . . . 1 1 11 11 TYR HD1 H . . . . . 3.593 1.980 5.206 . . . . . A . 8 LYS HA . . A . 11 TYR HD1 . . . 8 . HA . . . . . 11 . HD1 . . c30497_6e5i 1 417 1 . . 1 1 21 21 ARG H H . . . 1 1 20 20 PRO HG3 H . . . . . 3.600 1.980 5.220 . . . . . A . 21 ARG H . . A . 20 PRO HG3 . . . 21 . HN . . . . . 20 . HG2 . . c30497_6e5i 1 418 1 . . 1 1 18 18 ASP H H . . . 1 1 22 22 TYR H H . . . . . 3.607 1.981 5.233 . . . . . A . 18 ASP H . . A . 22 TYR H . . . 18 . HN . . . . . 22 . HN . . c30497_6e5i 1 419 1 . . 1 1 25 25 HIS HD2 H . . . 1 1 25 25 HIS HA H . . . . . 3.613 1.981 5.245 . . . . . A . 25 HIS HD2 . . A . 25 HIS HA . . . 25 . HD2 . . . . . 25 . HA . . c30497_6e5i 1 420 1 . . 1 1 20 20 PRO HD3 H . . . 1 1 20 20 PRO HA H . . . . . 3.615 1.981 5.249 . . . . . A . 20 PRO HD3 . . A . 20 PRO HA . . . 20 . HD2 . . . . . 20 . HA . . c30497_6e5i 1 421 1 OR . 1 1 11 11 TYR HE2 H . . . 1 1 10 10 ARG HG2 H . . . . . 3.615 1.981 5.249 . . . . . A . 11 TYR HE2 . . A . 10 ARG HG2 . . . 11 . HE2 . . . . . 10 . HG1 . . c30497_6e5i 1 421 2 OR . 1 1 11 11 TYR HE1 H . . . 1 1 10 10 ARG HG2 H . . . . . 3.615 1.981 5.249 . . . . . A . 11 TYR HE1 . . A . 10 ARG HG2 . . . 11 . HE1 . . . . . 10 . HG1 . . c30497_6e5i 1 422 1 OR . 1 1 22 22 TYR HE2 H . . . 1 1 4 4 CYS H H . . . . . 3.625 1.983 5.267 . . . . . A . 22 TYR HE2 . . A . 4 CYS H . . . 22 . HE2 . . . . . 4 . HN . . c30497_6e5i 1 422 2 OR . 1 1 22 22 TYR HE1 H . . . 1 1 4 4 CYS H H . . . . . 3.625 1.983 5.267 . . . . . A . 22 TYR HE1 . . A . 4 CYS H . . . 22 . HE1 . . . . . 4 . HN . . c30497_6e5i 1 423 1 . . 1 1 16 16 ARG HB2 H . . . 1 1 16 16 ARG HE H . . . . . 3.625 1.983 5.267 . . . . . A . 16 ARG HB2 . . A . 16 ARG HE . . . 16 . HB1 . . . . . 16 . HE . . c30497_6e5i 1 424 1 OR . 1 1 15 15 VAL H H . . . 1 1 8 8 LYS HG2 H . . . . . 3.630 1.983 5.277 . . . . . A . 15 VAL H . . A . 8 LYS HG2 . . . 15 . HN . . . . . 8 . HG1 . . c30497_6e5i 1 424 2 OR . 1 1 15 15 VAL H H . . . 1 1 8 8 LYS HG3 H . . . . . 3.630 1.983 5.277 . . . . . A . 15 VAL H . . A . 8 LYS HG3 . . . 15 . HN . . . . . 8 . HG2 . . c30497_6e5i 1 425 1 . . 1 1 5 5 LYS H H . . . 1 1 5 5 LYS HG2 H . . . . . 3.630 1.983 5.277 . . . . . A . 5 LYS H . . A . 5 LYS HG2 . . . 5 . HN . . . . . 5 . HG1 . . c30497_6e5i 1 426 1 OR . 1 1 11 11 TYR HD2 H . . . 1 1 10 10 ARG HG2 H . . . . . 3.639 1.984 5.294 . . . . . A . 11 TYR HD2 . . A . 10 ARG HG2 . . . 11 . HD2 . . . . . 10 . HG1 . . c30497_6e5i 1 426 2 OR . 1 1 11 11 TYR HD1 H . . . 1 1 10 10 ARG HG2 H . . . . . 3.639 1.984 5.294 . . . . . A . 11 TYR HD1 . . A . 10 ARG HG2 . . . 11 . HD1 . . . . . 10 . HG1 . . c30497_6e5i 1 427 1 . . 1 1 19 19 DPR HD2 H . . . 1 1 19 19 DPR HA H . . . . . 3.647 1.985 5.309 . . . . . A . 19 DPR HD2 . . A . 19 DPR HA . . . 19 . HD1 . . . . . 19 . HA . . c30497_6e5i 1 428 1 . . 1 1 10 10 ARG H H . . . 1 1 10 10 ARG HG2 H . . . . . 3.648 1.985 5.311 . . . . . A . 10 ARG H . . A . 10 ARG HG2 . . . 10 . HN . . . . . 10 . HG1 . . c30497_6e5i 1 429 1 OR . 1 1 22 22 TYR HD2 H . . . 1 1 17 17 CYS HB3 H . . . . . 3.648 1.985 5.311 . . . . . A . 22 TYR HD2 . . A . 17 CYS HB3 . . . 22 . HD2 . . . . . 17 . HB2 . . c30497_6e5i 1 429 2 OR . 1 1 22 22 TYR HD1 H . . . 1 1 17 17 CYS HB3 H . . . . . 3.648 1.985 5.311 . . . . . A . 22 TYR HD1 . . A . 17 CYS HB3 . . . 22 . HD1 . . . . . 17 . HB2 . . c30497_6e5i 1 430 1 OR . 1 1 22 22 TYR HE1 H . . . 1 1 3 3 LYS HD2 H . . . . . 3.652 1.985 5.319 . . . . . A . 22 TYR HE1 . . A . 3 LYS HD2 . . . 22 . HE1 . . . . . 3 . HD1 . . c30497_6e5i 1 430 2 OR . 1 1 22 22 TYR HE2 H . . . 1 1 3 3 LYS HD2 H . . . . . 3.652 1.985 5.319 . . . . . A . 22 TYR HE2 . . A . 3 LYS HD2 . . . 22 . HE2 . . . . . 3 . HD1 . . c30497_6e5i 1 430 3 OR . 1 1 22 22 TYR HE2 H . . . 1 1 3 3 LYS HD3 H . . . . . 3.652 1.985 5.319 . . . . . A . 22 TYR HE2 . . A . 3 LYS HD3 . . . 22 . HE2 . . . . . 3 . HD2 . . c30497_6e5i 1 430 4 OR . 1 1 22 22 TYR HE1 H . . . 1 1 3 3 LYS HD3 H . . . . . 3.652 1.985 5.319 . . . . . A . 22 TYR HE1 . . A . 3 LYS HD3 . . . 22 . HE1 . . . . . 3 . HD2 . . c30497_6e5i 1 431 1 . . 1 1 17 17 CYS HA H . . . 1 1 22 22 TYR HB3 H . . . . . 3.654 1.985 5.323 . . . . . A . 17 CYS HA . . A . 22 TYR HB3 . . . 17 . HA . . . . . 22 . HB2 . . c30497_6e5i 1 432 1 . . 1 1 16 16 ARG HG3 H . . . 1 1 16 16 ARG HE H . . . . . 3.669 1.987 5.351 . . . . . A . 16 ARG HG3 . . A . 16 ARG HE . . . 16 . HG2 . . . . . 16 . HE . . c30497_6e5i 1 433 1 . . 1 1 25 25 HIS H H . . . 1 1 16 16 ARG H H . . . . . 3.675 1.987 5.363 . . . . . A . 25 HIS H . . A . 16 ARG H . . . 25 . HN . . . . . 16 . HN . . c30497_6e5i 1 434 1 . . 1 1 15 15 VAL MG2 H . . . 1 1 4 4 CYS HA H . . . . . 3.675 1.987 5.363 . . . . . A . 15 VAL MG2 . . A . 4 CYS HA . . . 15 . HG21 . . . . . 4 . HA . . c30497_6e5i 1 435 1 . . 1 1 2 2 ASP HA H . . . 1 1 4 4 CYS H H . . . . . 3.676 1.987 5.365 . . . . . A . 2 ASP HA . . A . 4 CYS H . . . 2 . HA . . . . . 4 . HN . . c30497_6e5i 1 436 1 OR . 1 1 14 14 GLU HB2 H . . . 1 1 13 13 CYS HA H . . . . . 3.676 1.987 5.365 . . . . . A . 14 GLU HB2 . . A . 13 CYS HA . . . 14 . HB1 . . . . . 13 . HA . . c30497_6e5i 1 436 2 OR . 1 1 14 14 GLU HB3 H . . . 1 1 13 13 CYS HA H . . . . . 3.676 1.987 5.365 . . . . . A . 14 GLU HB3 . . A . 13 CYS HA . . . 14 . HB2 . . . . . 13 . HA . . c30497_6e5i 1 437 1 OR . 1 1 5 5 LYS HD2 H . . . 1 1 5 5 LYS H H . . . . . 3.679 1.987 5.371 . . . . . A . 5 LYS HD2 . . A . 5 LYS H . . . 5 . HD1 . . . . . 5 . HN . . c30497_6e5i 1 437 2 OR . 1 1 5 5 LYS HD3 H . . . 1 1 5 5 LYS H H . . . . . 3.679 1.987 5.371 . . . . . A . 5 LYS HD3 . . A . 5 LYS H . . . 5 . HD2 . . . . . 5 . HN . . c30497_6e5i 1 438 1 . . 1 1 13 13 CYS HB2 H . . . 1 1 24 24 VAL MG2 H . . . . . 3.682 1.988 5.376 . . . . . A . 13 CYS HB2 . . A . 24 VAL MG2 . . . 13 . HB1 . . . . . 24 . HG21 . . c30497_6e5i 1 439 1 . . 1 1 17 17 CYS HA H . . . 1 1 22 22 TYR HB2 H . . . . . 3.685 1.988 5.382 . . . . . A . 17 CYS HA . . A . 22 TYR HB2 . . . 17 . HA . . . . . 22 . HB1 . . c30497_6e5i 1 440 1 . . 1 1 2 2 ASP HA H . . . 1 1 5 5 LYS H H . . . . . 3.688 1.988 5.388 . . . . . A . 2 ASP HA . . A . 5 LYS H . . . 2 . HA . . . . . 5 . HN . . c30497_6e5i 1 441 1 . . 1 1 6 6 GLU H H . . . 1 1 4 4 CYS H H . . . . . 3.693 1.989 5.397 . . . . . A . 6 GLU H . . A . 4 CYS H . . . 6 . HN . . . . . 4 . HN . . c30497_6e5i 1 442 1 . . 1 1 9 9 LYS H H . . . 1 1 5 5 LYS HA H . . . . . 3.695 1.989 5.401 . . . . . A . 9 LYS H . . A . 5 LYS HA . . . 9 . HN . . . . . 5 . HA . . c30497_6e5i 1 443 1 . . 1 1 16 16 ARG HG2 H . . . 1 1 16 16 ARG HE H . . . . . 3.697 1.989 5.405 . . . . . A . 16 ARG HG2 . . A . 16 ARG HE . . . 16 . HG1 . . . . . 16 . HE . . c30497_6e5i 1 444 1 . . 1 1 3 3 LYS HA H . . . 1 1 5 5 LYS H H . . . . . 3.709 1.989 5.429 . . . . . A . 3 LYS HA . . A . 5 LYS H . . . 3 . HA . . . . . 5 . HN . . c30497_6e5i 1 445 1 OR . 1 1 11 11 TYR HE2 H . . . 1 1 11 11 TYR HB2 H . . . . . 3.715 1.990 5.440 . . . . . A . 11 TYR HE2 . . A . 11 TYR HB2 . . . 11 . HE2 . . . . . 11 . HB1 . . c30497_6e5i 1 445 2 OR . 1 1 11 11 TYR HE1 H . . . 1 1 11 11 TYR HB2 H . . . . . 3.715 1.990 5.440 . . . . . A . 11 TYR HE1 . . A . 11 TYR HB2 . . . 11 . HE1 . . . . . 11 . HB1 . . c30497_6e5i 1 446 1 . . 1 1 25 25 HIS HD2 H . . . 1 1 25 25 HIS HE1 H . . . . . 3.738 1.992 5.484 . . . . . A . 25 HIS HD2 . . A . 25 HIS HE1 . . . 25 . HD2 . . . . . 25 . HE1 . . c30497_6e5i 1 447 1 . . 1 1 16 16 ARG H H . . . 1 1 24 24 VAL MG2 H . . . . . 3.755 1.993 5.517 . . . . . A . 16 ARG H . . A . 24 VAL MG2 . . . 16 . HN . . . . . 24 . HG21 . . c30497_6e5i 1 448 1 . . 1 1 7 7 LEU MD2 H . . . 1 1 10 10 ARG HD3 H . . . . . 3.757 1.992 5.522 . . . . . A . 7 LEU MD2 . . A . 10 ARG HD3 . . . 7 . HD21 . . . . . 10 . HD2 . . c30497_6e5i 1 449 1 . . 1 1 23 23 GLU H H . . . 1 1 22 22 TYR H H . . . . . 3.760 1.993 5.527 . . . . . A . 23 GLU H . . A . 22 TYR H . . . 23 . HN . . . . . 22 . HN . . c30497_6e5i 1 450 1 OR . 1 1 13 13 CYS HB2 H . . . 1 1 14 14 GLU HB2 H . . . . . 3.762 1.992 5.532 . . . . . A . 13 CYS HB2 . . A . 14 GLU HB2 . . . 13 . HB1 . . . . . 14 . HB1 . . c30497_6e5i 1 450 2 OR . 1 1 13 13 CYS HB2 H . . . 1 1 14 14 GLU HB3 H . . . . . 3.762 1.992 5.532 . . . . . A . 13 CYS HB2 . . A . 14 GLU HB3 . . . 13 . HB1 . . . . . 14 . HB2 . . c30497_6e5i 1 451 1 . . 1 1 24 24 VAL MG2 H . . . 1 1 22 22 TYR HB2 H . . . . . 3.778 1.994 5.562 . . . . . A . 24 VAL MG2 . . A . 22 TYR HB2 . . . 24 . HG21 . . . . . 22 . HB1 . . c30497_6e5i 1 452 1 OR . 1 1 15 15 VAL MG2 H . . . 1 1 22 22 TYR HE1 H . . . . . 3.783 1.994 5.572 . . . . . A . 15 VAL MG2 . . A . 22 TYR HE1 . . . 15 . HG21 . . . . . 22 . HE1 . . c30497_6e5i 1 452 2 OR . 1 1 15 15 VAL MG2 H . . . 1 1 22 22 TYR HE2 H . . . . . 3.783 1.994 5.572 . . . . . A . 15 VAL MG2 . . A . 22 TYR HE2 . . . 15 . HG21 . . . . . 22 . HE2 . . c30497_6e5i 1 453 1 OR . 1 1 21 21 ARG HB2 H . . . 1 1 22 22 TYR HD2 H . . . . . 3.786 1.994 5.578 . . . . . A . 21 ARG HB2 . . A . 22 TYR HD2 . . . 21 . HB1 . . . . . 22 . HD2 . . c30497_6e5i 1 453 2 OR . 1 1 21 21 ARG HB2 H . . . 1 1 22 22 TYR HD1 H . . . . . 3.786 1.994 5.578 . . . . . A . 21 ARG HB2 . . A . 22 TYR HD1 . . . 21 . HB1 . . . . . 22 . HD1 . . c30497_6e5i 1 453 3 OR . 1 1 21 21 ARG HB3 H . . . 1 1 22 22 TYR HD2 H . . . . . 3.786 1.994 5.578 . . . . . A . 21 ARG HB3 . . A . 22 TYR HD2 . . . 21 . HB2 . . . . . 22 . HD2 . . c30497_6e5i 1 453 4 OR . 1 1 21 21 ARG HB3 H . . . 1 1 22 22 TYR HD1 H . . . . . 3.786 1.994 5.578 . . . . . A . 21 ARG HB3 . . A . 22 TYR HD1 . . . 21 . HB2 . . . . . 22 . HD1 . . c30497_6e5i 1 454 1 . . 1 1 9 9 LYS H H . . . 1 1 9 9 LYS HG2 H . . . . . 3.788 1.994 5.582 . . . . . A . 9 LYS H . . A . 9 LYS HG2 . . . 9 . HN . . . . . 9 . HG1 . . c30497_6e5i 1 455 1 . . 1 1 10 10 ARG H H . . . 1 1 11 11 TYR HA H . . . . . 3.805 1.996 5.614 . . . . . A . 10 ARG H . . A . 11 TYR HA . . . 10 . HN . . . . . 11 . HA . . c30497_6e5i 1 456 1 OR . 1 1 22 22 TYR HE2 H . . . 1 1 17 17 CYS HB2 H . . . . . 3.809 1.996 5.622 . . . . . A . 22 TYR HE2 . . A . 17 CYS HB2 . . . 22 . HE2 . . . . . 17 . HB1 . . c30497_6e5i 1 456 2 OR . 1 1 22 22 TYR HE1 H . . . 1 1 17 17 CYS HB2 H . . . . . 3.809 1.996 5.622 . . . . . A . 22 TYR HE1 . . A . 17 CYS HB2 . . . 22 . HE1 . . . . . 17 . HB1 . . c30497_6e5i 1 457 1 . . 1 1 14 14 GLU H H . . . 1 1 14 14 GLU HG2 H . . . . . 3.813 1.996 5.630 . . . . . A . 14 GLU H . . A . 14 GLU HG2 . . . 14 . HN . . . . . 14 . HG1 . . c30497_6e5i 1 458 1 . . 1 1 23 23 GLU H H . . . 1 1 24 24 VAL MG2 H . . . . . 3.823 1.996 5.650 . . . . . A . 23 GLU H . . A . 24 VAL MG2 . . . 23 . HN . . . . . 24 . HG21 . . c30497_6e5i 1 459 1 . . 1 1 14 14 GLU H H . . . 1 1 25 25 HIS HB2 H . . . . . 3.824 1.996 5.652 . . . . . A . 14 GLU H . . A . 25 HIS HB2 . . . 14 . HN . . . . . 25 . HB1 . . c30497_6e5i 1 460 1 . . 1 1 24 24 VAL MG2 H . . . 1 1 22 22 TYR HB3 H . . . . . 3.826 1.997 5.655 . . . . . A . 24 VAL MG2 . . A . 22 TYR HB3 . . . 24 . HG21 . . . . . 22 . HB2 . . c30497_6e5i 1 461 1 . . 1 1 21 21 ARG H H . . . 1 1 22 22 TYR H H . . . . . 3.831 1.996 5.666 . . . . . A . 21 ARG H . . A . 22 TYR H . . . 21 . HN . . . . . 22 . HN . . c30497_6e5i 1 462 1 . . 1 1 8 8 LYS H H . . . 1 1 9 9 LYS HA H . . . . . 3.875 1.998 5.752 . . . . . A . 8 LYS H . . A . 9 LYS HA . . . 8 . HN . . . . . 9 . HA . . c30497_6e5i 1 463 1 . . 1 1 1 1 ASN HD21 H . . . 1 1 1 1 ASN HB2 H . . . . . 3.879 1.998 5.760 . . . . . A . 1 ASN HD21 . . A . 1 ASN HB2 . . . 1 . HD21 . . . . . 1 . HB1 . . c30497_6e5i 1 464 1 . . 1 1 7 7 LEU MD2 H . . . 1 1 22 22 TYR HB2 H . . . . . 3.883 1.999 5.767 . . . . . A . 7 LEU MD2 . . A . 22 TYR HB2 . . . 7 . HD21 . . . . . 22 . HB1 . . c30497_6e5i 1 465 1 OR . 1 1 22 22 TYR HA H . . . 1 1 22 22 TYR HE2 H . . . . . 3.890 1.998 5.782 . . . . . A . 22 TYR HA . . A . 22 TYR HE2 . . . 22 . HA . . . . . 22 . HE2 . . c30497_6e5i 1 465 2 OR . 1 1 22 22 TYR HA H . . . 1 1 22 22 TYR HE1 H . . . . . 3.890 1.998 5.782 . . . . . A . 22 TYR HA . . A . 22 TYR HE1 . . . 22 . HA . . . . . 22 . HE1 . . c30497_6e5i 1 466 1 OR . 1 1 10 10 ARG H H . . . 1 1 11 11 TYR HD2 H . . . . . 3.907 1.999 5.815 . . . . . A . 10 ARG H . . A . 11 TYR HD2 . . . 10 . HN . . . . . 11 . HD2 . . c30497_6e5i 1 466 2 OR . 1 1 10 10 ARG H H . . . 1 1 11 11 TYR HD1 H . . . . . 3.907 1.999 5.815 . . . . . A . 10 ARG H . . A . 11 TYR HD1 . . . 10 . HN . . . . . 11 . HD1 . . c30497_6e5i 1 467 1 . . 1 1 3 3 LYS HA H . . . 1 1 6 6 GLU HG2 H . . . . . 3.917 1.999 5.835 . . . . . A . 3 LYS HA . . A . 6 GLU HG2 . . . 3 . HA . . . . . 6 . HG1 . . c30497_6e5i 1 468 1 OR . 1 1 22 22 TYR HE2 H . . . 1 1 21 21 ARG HA H . . . . . 3.917 1.999 5.835 . . . . . A . 22 TYR HE2 . . A . 21 ARG HA . . . 22 . HE2 . . . . . 21 . HA . . c30497_6e5i 1 468 2 OR . 1 1 22 22 TYR HE1 H . . . 1 1 21 21 ARG HA H . . . . . 3.917 1.999 5.835 . . . . . A . 22 TYR HE1 . . A . 21 ARG HA . . . 22 . HE1 . . . . . 21 . HA . . c30497_6e5i 1 469 1 . . 1 1 15 15 VAL MG1 H . . . 1 1 22 22 TYR HB3 H . . . . . 3.927 1.999 5.855 . . . . . A . 15 VAL MG1 . . A . 22 TYR HB3 . . . 15 . HG11 . . . . . 22 . HB2 . . c30497_6e5i 1 470 1 OR . 1 1 22 22 TYR HD2 H . . . 1 1 17 17 CYS HB2 H . . . . . 3.937 1.999 5.875 . . . . . A . 22 TYR HD2 . . A . 17 CYS HB2 . . . 22 . HD2 . . . . . 17 . HB1 . . c30497_6e5i 1 470 2 OR . 1 1 22 22 TYR HD1 H . . . 1 1 17 17 CYS HB2 H . . . . . 3.937 1.999 5.875 . . . . . A . 22 TYR HD1 . . A . 17 CYS HB2 . . . 22 . HD1 . . . . . 17 . HB1 . . c30497_6e5i 1 471 1 . . 1 1 7 7 LEU HA H . . . 1 1 7 7 LEU MD1 H . . . . . 3.939 2.000 5.878 . . . . . A . 7 LEU HA . . A . 7 LEU MD1 . . . 7 . HA . . . . . 7 . HD11 . . c30497_6e5i 1 472 1 OR . 1 1 21 21 ARG H H . . . 1 1 21 21 ARG HD2 H . . . . . 3.948 2.000 5.896 . . . . . A . 21 ARG H . . A . 21 ARG HD2 . . . 21 . HN . . . . . 21 . HD1 . . c30497_6e5i 1 472 2 OR . 1 1 21 21 ARG H H . . . 1 1 21 21 ARG HD3 H . . . . . 3.948 2.000 5.896 . . . . . A . 21 ARG H . . A . 21 ARG HD3 . . . 21 . HN . . . . . 21 . HD2 . . c30497_6e5i 1 473 1 OR . 1 1 15 15 VAL MG1 H . . . 1 1 22 22 TYR HD1 H . . . . . 3.953 2.000 5.906 . . . . . A . 15 VAL MG1 . . A . 22 TYR HD1 . . . 15 . HG11 . . . . . 22 . HD1 . . c30497_6e5i 1 473 2 OR . 1 1 15 15 VAL MG1 H . . . 1 1 22 22 TYR HD2 H . . . . . 3.953 2.000 5.906 . . . . . A . 15 VAL MG1 . . A . 22 TYR HD2 . . . 15 . HG11 . . . . . 22 . HD2 . . c30497_6e5i 1 474 1 OR . 1 1 5 5 LYS HA H . . . 1 1 8 8 LYS HG2 H . . . . . 3.958 1.999 5.917 . . . . . A . 5 LYS HA . . A . 8 LYS HG2 . . . 5 . HA . . . . . 8 . HG1 . . c30497_6e5i 1 474 2 OR . 1 1 5 5 LYS HA H . . . 1 1 8 8 LYS HG3 H . . . . . 3.958 1.999 5.917 . . . . . A . 5 LYS HA . . A . 8 LYS HG3 . . . 5 . HA . . . . . 8 . HG2 . . c30497_6e5i 1 475 1 . . 1 1 5 5 LYS H H . . . 1 1 2 2 ASP HB3 H . . . . . 3.968 2.000 5.936 . . . . . A . 5 LYS H . . A . 2 ASP HB3 . . . 5 . HN . . . . . 2 . HB2 . . c30497_6e5i 1 476 1 . . 1 1 11 11 TYR H H . . . 1 1 10 10 ARG HG2 H . . . . . 3.969 1.999 5.939 . . . . . A . 11 TYR H . . A . 10 ARG HG2 . . . 11 . HN . . . . . 10 . HG1 . . c30497_6e5i 1 477 1 . . 1 1 4 4 CYS HA H . . . 1 1 6 6 GLU H H . . . . . 3.981 2.000 5.962 . . . . . A . 4 CYS HA . . A . 6 GLU H . . . 4 . HA . . . . . 6 . HN . . c30497_6e5i 1 478 1 . . 1 1 7 7 LEU H H . . . 1 1 6 6 GLU HG2 H . . . . . 4.002 2.000 6.004 . . . . . A . 7 LEU H . . A . 6 GLU HG2 . . . 7 . HN . . . . . 6 . HG1 . . c30497_6e5i 1 479 1 . . 1 1 1 1 ASN HD21 H . . . 1 1 1 1 ASN HB3 H . . . . . 4.006 2.000 6.012 . . . . . A . 1 ASN HD21 . . A . 1 ASN HB3 . . . 1 . HD21 . . . . . 1 . HB2 . . c30497_6e5i 1 480 1 OR . 1 1 22 22 TYR HE2 H . . . 1 1 22 22 TYR H H . . . . . 4.034 2.000 6.068 . . . . . A . 22 TYR HE2 . . A . 22 TYR H . . . 22 . HE2 . . . . . 22 . HN . . c30497_6e5i 1 480 2 OR . 1 1 22 22 TYR HE1 H . . . 1 1 22 22 TYR H H . . . . . 4.034 2.000 6.068 . . . . . A . 22 TYR HE1 . . A . 22 TYR H . . . 22 . HE1 . . . . . 22 . HN . . c30497_6e5i 1 481 1 OR . 1 1 11 11 TYR H H . . . 1 1 11 11 TYR HE2 H . . . . . 4.050 1.999 6.101 . . . . . A . 11 TYR H . . A . 11 TYR HE2 . . . 11 . HN . . . . . 11 . HE2 . . c30497_6e5i 1 481 2 OR . 1 1 11 11 TYR H H . . . 1 1 11 11 TYR HE1 H . . . . . 4.050 1.999 6.101 . . . . . A . 11 TYR H . . A . 11 TYR HE1 . . . 11 . HN . . . . . 11 . HE1 . . c30497_6e5i 1 482 1 OR . 1 1 13 13 CYS HB2 H . . . 1 1 11 11 TYR HD2 H . . . . . 4.063 1.999 6.127 . . . . . A . 13 CYS HB2 . . A . 11 TYR HD2 . . . 13 . HB1 . . . . . 11 . HD2 . . c30497_6e5i 1 482 2 OR . 1 1 13 13 CYS HB2 H . . . 1 1 11 11 TYR HD1 H . . . . . 4.063 1.999 6.127 . . . . . A . 13 CYS HB2 . . A . 11 TYR HD1 . . . 13 . HB1 . . . . . 11 . HD1 . . c30497_6e5i 1 483 1 . . 1 1 21 21 ARG H H . . . 1 1 20 20 PRO HB3 H . . . . . 4.072 1.999 6.145 . . . . . A . 21 ARG H . . A . 20 PRO HB3 . . . 21 . HN . . . . . 20 . HB2 . . c30497_6e5i 1 484 1 OR . 1 1 15 15 VAL MG1 H . . . 1 1 11 11 TYR HE1 H . . . . . 4.140 1.998 6.282 . . . . . A . 15 VAL MG1 . . A . 11 TYR HE1 . . . 15 . HG11 . . . . . 11 . HE1 . . c30497_6e5i 1 484 2 OR . 1 1 15 15 VAL MG1 H . . . 1 1 11 11 TYR HE2 H . . . . . 4.140 1.998 6.282 . . . . . A . 15 VAL MG1 . . A . 11 TYR HE2 . . . 15 . HG11 . . . . . 11 . HE2 . . c30497_6e5i 1 485 1 OR . 1 1 13 13 CYS H H . . . 1 1 11 11 TYR HD2 H . . . . . 4.173 1.996 6.350 . . . . . A . 13 CYS H . . A . 11 TYR HD2 . . . 13 . HN . . . . . 11 . HD2 . . c30497_6e5i 1 485 2 OR . 1 1 13 13 CYS H H . . . 1 1 11 11 TYR HD1 H . . . . . 4.173 1.996 6.350 . . . . . A . 13 CYS H . . A . 11 TYR HD1 . . . 13 . HN . . . . . 11 . HD1 . . c30497_6e5i 1 486 1 . . 1 1 3 3 LYS H H . . . 1 1 5 5 LYS H H . . . . . 4.225 1.994 6.456 . . . . . A . 3 LYS H . . A . 5 LYS H . . . 3 . HN . . . . . 5 . HN . . c30497_6e5i 1 487 1 OR . 1 1 18 18 ASP H H . . . 1 1 22 22 TYR HE2 H . . . . . 4.228 1.994 6.462 . . . . . A . 18 ASP H . . A . 22 TYR HE2 . . . 18 . HN . . . . . 22 . HE2 . . c30497_6e5i 1 487 2 OR . 1 1 18 18 ASP H H . . . 1 1 22 22 TYR HE1 H . . . . . 4.228 1.994 6.462 . . . . . A . 18 ASP H . . A . 22 TYR HE1 . . . 18 . HN . . . . . 22 . HE1 . . c30497_6e5i 1 488 1 . . 1 1 18 18 ASP H H . . . 1 1 19 19 DPR HA H . . . . . 4.354 1.984 6.724 . . . . . A . 18 ASP H . . A . 19 DPR HA . . . 18 . HN . . . . . 19 . HA . . c30497_6e5i 1 489 1 OR . 1 1 10 10 ARG HG3 H . . . 1 1 11 11 TYR HD2 H . . . . . 4.398 1.980 6.816 . . . . . A . 10 ARG HG3 . . A . 11 TYR HD2 . . . 10 . HG2 . . . . . 11 . HD2 . . c30497_6e5i 1 489 2 OR . 1 1 10 10 ARG HG3 H . . . 1 1 11 11 TYR HD1 H . . . . . 4.398 1.980 6.816 . . . . . A . 10 ARG HG3 . . A . 11 TYR HD1 . . . 10 . HG2 . . . . . 11 . HD1 . . c30497_6e5i 1 490 1 . . 1 1 24 24 VAL MG2 H . . . 1 1 11 11 TYR HB2 H . . . . . 4.466 1.973 6.959 . . . . . A . 24 VAL MG2 . . A . 11 TYR HB2 . . . 24 . HG21 . . . . . 11 . HB1 . . c30497_6e5i 1 491 1 . . 1 1 3 3 LYS H H . . . 1 1 6 6 GLU HG3 H . . . . . 5.152 1.834 8.470 . . . . . A . 3 LYS H . . A . 6 GLU HG3 . . . 3 . HN . . . . . 6 . HG2 . . c30497_6e5i 1 stop_ loop_ _Gen_dist_constraint_parse_err.ID _Gen_dist_constraint_parse_err.Content _Gen_dist_constraint_parse_err.Begin_line _Gen_dist_constraint_parse_err.Begin_column _Gen_dist_constraint_parse_err.End_line _Gen_dist_constraint_parse_err.End_column _Gen_dist_constraint_parse_err.Entry_ID _Gen_dist_constraint_parse_err.Gen_dist_constraint_list_ID 1 '# Restraints file 1: ambig.tbl' 1 1 1 30 c30497_6e5i 1 2 '# Restraints file 2: unambig.tbl' 285 1 285 32 c30497_6e5i 1 stop_ loop_ _Gen_dist_constraint_comment_org.ID _Gen_dist_constraint_comment_org.Comment_text _Gen_dist_constraint_comment_org.Comment_begin_line _Gen_dist_constraint_comment_org.Comment_begin_column _Gen_dist_constraint_comment_org.Comment_end_line _Gen_dist_constraint_comment_org.Comment_end_column _Gen_dist_constraint_comment_org.Entry_ID _Gen_dist_constraint_comment_org.Gen_dist_constraint_list_ID 1 'spec=NOESY, no=23, id=20, vol=1.500000e+09' 2 127 2 171 c30497_6e5i 1 2 'spec=NOESY, no=30, id=27, vol=1.130000e+09' 5 127 5 171 c30497_6e5i 1 3 'spec=NOESY, no=42, id=39, vol=9.030000e+08' 7 127 7 171 c30497_6e5i 1 4 'spec=NOESY, no=47, id=44, vol=8.660000e+08' 10 127 10 171 c30497_6e5i 1 5 'spec=NOESY, no=48, id=45, vol=8.540000e+08' 13 127 13 171 c30497_6e5i 1 6 'spec=NOESY, no=57, id=54, vol=7.600000e+08' 15 127 15 171 c30497_6e5i 1 7 'spec=NOESY, no=60, id=57, vol=7.420000e+08' 17 127 17 171 c30497_6e5i 1 8 'spec=NOESY, no=76, id=73, vol=6.190000e+08' 19 127 19 171 c30497_6e5i 1 9 'spec=NOESY, no=81, id=78, vol=6.010000e+08' 21 127 21 171 c30497_6e5i 1 10 'spec=NOESY, no=85, id=82, vol=5.840000e+08' 23 127 23 171 c30497_6e5i 1 11 'spec=NOESY, no=111, id=108, vol=4.690000e+08' 25 127 25 173 c30497_6e5i 1 12 'spec=NOESY, no=118, id=115, vol=4.460000e+08' 27 127 27 173 c30497_6e5i 1 13 'spec=NOESY, no=126, id=123, vol=4.180000e+08' 29 127 29 173 c30497_6e5i 1 14 'spec=NOESY, no=138, id=135, vol=3.940000e+08' 31 127 31 173 c30497_6e5i 1 15 'spec=NOESY, no=143, id=140, vol=3.870000e+08' 33 127 33 173 c30497_6e5i 1 16 'spec=NOESY, no=150, id=147, vol=3.690000e+08' 39 127 39 173 c30497_6e5i 1 17 'spec=NOESY, no=152, id=149, vol=3.620000e+08' 43 127 43 173 c30497_6e5i 1 18 'spec=NOESY, no=153, id=150, vol=3.600000e+08' 45 127 45 173 c30497_6e5i 1 19 'spec=NOESY, no=175, id=172, vol=3.220000e+08' 63 127 63 173 c30497_6e5i 1 20 'spec=NOESY, no=185, id=182, vol=2.990000e+08' 69 127 69 173 c30497_6e5i 1 21 'spec=NOESY, no=202, id=199, vol=2.660000e+08' 71 127 71 173 c30497_6e5i 1 22 'spec=NOESY, no=221, id=218, vol=2.320000e+08' 75 127 75 173 c30497_6e5i 1 23 'spec=NOESY, no=236, id=233, vol=2.060000e+08' 81 127 81 173 c30497_6e5i 1 24 'spec=NOESY, no=238, id=235, vol=2.040000e+08' 83 127 83 173 c30497_6e5i 1 25 'spec=NOESY, no=239, id=236, vol=2.040000e+08' 85 127 85 173 c30497_6e5i 1 26 'spec=NOESY, no=242, id=239, vol=2.020000e+08' 87 127 87 173 c30497_6e5i 1 27 'spec=NOESY, no=251, id=248, vol=1.910000e+08' 89 127 89 173 c30497_6e5i 1 28 'spec=NOESY, no=256, id=253, vol=1.870000e+08' 96 127 96 173 c30497_6e5i 1 29 'spec=NOESY, no=259, id=256, vol=1.840000e+08' 102 127 102 173 c30497_6e5i 1 30 'spec=NOESY, no=260, id=257, vol=1.840000e+08' 104 127 104 173 c30497_6e5i 1 31 'spec=NOESY, no=274, id=271, vol=1.720000e+08' 107 127 107 173 c30497_6e5i 1 32 'spec=NOESY, no=286, id=283, vol=1.560000e+08' 110 127 110 173 c30497_6e5i 1 33 'spec=NOESY, no=287, id=284, vol=1.550000e+08' 116 127 116 173 c30497_6e5i 1 34 'spec=NOESY, no=293, id=290, vol=1.480000e+08' 118 127 118 173 c30497_6e5i 1 35 'spec=NOESY, no=301, id=298, vol=1.410000e+08' 120 127 120 173 c30497_6e5i 1 36 'spec=NOESY, no=319, id=316, vol=1.250000e+08' 122 127 122 173 c30497_6e5i 1 37 'spec=NOESY, no=321, id=318, vol=1.240000e+08' 125 127 125 173 c30497_6e5i 1 38 'spec=NOESY, no=325, id=322, vol=1.190000e+08' 129 127 129 173 c30497_6e5i 1 39 'spec=NOESY, no=327, id=324, vol=1.160000e+08' 132 127 132 173 c30497_6e5i 1 40 'spec=NOESY, no=336, id=333, vol=1.120000e+08' 134 127 134 173 c30497_6e5i 1 41 'spec=NOESY, no=337, id=334, vol=1.120000e+08' 138 127 138 173 c30497_6e5i 1 42 'spec=NOESY, no=338, id=335, vol=1.110000e+08' 143 127 143 173 c30497_6e5i 1 43 'spec=NOESY, no=343, id=340, vol=1.100000e+08' 145 127 145 173 c30497_6e5i 1 44 'spec=NOESY, no=346, id=343, vol=1.080000e+08' 147 127 147 173 c30497_6e5i 1 45 'spec=NOESY, no=348, id=345, vol=1.080000e+08' 149 127 149 173 c30497_6e5i 1 46 'spec=NOESY, no=364, id=361, vol=1.010000e+08' 155 127 155 173 c30497_6e5i 1 47 'spec=NOESY, no=365, id=362, vol=1.000000e+08' 157 127 157 173 c30497_6e5i 1 48 'spec=NOESY, no=366, id=363, vol=9.990000e+07' 163 127 163 173 c30497_6e5i 1 49 'spec=NOESY, no=371, id=368, vol=9.740000e+07' 169 127 169 173 c30497_6e5i 1 50 'spec=NOESY, no=372, id=369, vol=9.740000e+07' 172 127 172 173 c30497_6e5i 1 51 'spec=NOESY, no=381, id=378, vol=9.360000e+07' 174 127 174 173 c30497_6e5i 1 52 'spec=NOESY, no=385, id=382, vol=9.230000e+07' 177 127 177 173 c30497_6e5i 1 53 'spec=NOESY, no=388, id=385, vol=8.880000e+07' 179 127 179 173 c30497_6e5i 1 54 'spec=NOESY, no=391, id=388, vol=8.790000e+07' 181 127 181 173 c30497_6e5i 1 55 'spec=NOESY, no=395, id=392, vol=8.710000e+07' 187 127 187 173 c30497_6e5i 1 56 'spec=NOESY, no=399, id=396, vol=8.480000e+07' 189 127 189 173 c30497_6e5i 1 57 'spec=NOESY, no=414, id=411, vol=7.740000e+07' 191 127 191 173 c30497_6e5i 1 58 'spec=NOESY, no=418, id=415, vol=7.520000e+07' 193 127 193 173 c30497_6e5i 1 59 'spec=NOESY, no=419, id=416, vol=7.460000e+07' 205 127 205 173 c30497_6e5i 1 60 'spec=NOESY, no=427, id=424, vol=7.120000e+07' 207 127 207 173 c30497_6e5i 1 61 'spec=NOESY, no=431, id=428, vol=6.880000e+07' 210 127 210 173 c30497_6e5i 1 62 'spec=NOESY, no=437, id=434, vol=6.450000e+07' 213 127 213 173 c30497_6e5i 1 63 'spec=NOESY, no=464, id=461, vol=5.530000e+07' 215 127 215 173 c30497_6e5i 1 64 'spec=NOESY, no=467, id=464, vol=5.490000e+07' 224 127 224 173 c30497_6e5i 1 65 'spec=NOESY, no=470, id=467, vol=5.210000e+07' 228 127 228 173 c30497_6e5i 1 66 'spec=NOESY, no=485, id=482, vol=4.490000e+07' 234 127 234 173 c30497_6e5i 1 67 'spec=NOESY, no=488, id=485, vol=4.390000e+07' 236 127 236 173 c30497_6e5i 1 68 'spec=NOESY, no=489, id=486, vol=4.330000e+07' 238 127 238 173 c30497_6e5i 1 69 'spec=NOESY, no=497, id=494, vol=3.930000e+07' 242 127 242 173 c30497_6e5i 1 70 'spec=NOESY, no=503, id=500, vol=3.720000e+07' 248 127 248 173 c30497_6e5i 1 71 'spec=NOESY, no=509, id=506, vol=3.560000e+07' 256 127 256 173 c30497_6e5i 1 72 'spec=NOESY, no=511, id=508, vol=3.520000e+07' 258 127 258 173 c30497_6e5i 1 73 'spec=NOESY, no=515, id=512, vol=3.400000e+07' 267 127 267 173 c30497_6e5i 1 74 'spec=NOESY, no=517, id=514, vol=3.360000e+07' 269 127 269 173 c30497_6e5i 1 75 'spec=NOESY, no=523, id=520, vol=2.740000e+07' 273 127 273 173 c30497_6e5i 1 76 'spec=NOESY, no=527, id=524, vol=2.230000e+07' 277 127 277 173 c30497_6e5i 1 77 'spec=NOESY, no=531, id=528, vol=1.770000e+07' 281 127 281 173 c30497_6e5i 1 78 'spec=NOESY, no=3, id=0, vol=6.080000e+09' 286 127 286 169 c30497_6e5i 1 79 'spec=NOESY, no=4, id=1, vol=4.410000e+09' 287 127 287 169 c30497_6e5i 1 80 'spec=NOESY, no=6, id=3, vol=4.070000e+09' 289 127 289 169 c30497_6e5i 1 81 'spec=NOESY, no=5, id=2, vol=4.330000e+09' 288 127 288 169 c30497_6e5i 1 82 'spec=NOESY, no=7, id=4, vol=4.050000e+09' 293 127 293 169 c30497_6e5i 1 83 'spec=NOESY, no=8, id=5, vol=3.940000e+09' 294 127 294 169 c30497_6e5i 1 84 'spec=NOESY, no=9, id=6, vol=3.930000e+09' 295 127 295 169 c30497_6e5i 1 85 'spec=NOESY, no=10, id=7, vol=3.910000e+09' 296 127 296 170 c30497_6e5i 1 86 'spec=NOESY, no=11, id=8, vol=3.740000e+09' 297 127 297 170 c30497_6e5i 1 87 'spec=NOESY, no=12, id=9, vol=3.520000e+09' 298 127 298 170 c30497_6e5i 1 88 'spec=NOESY, no=13, id=10, vol=3.260000e+09' 299 127 299 171 c30497_6e5i 1 89 'spec=NOESY, no=15, id=12, vol=2.180000e+09' 301 127 301 171 c30497_6e5i 1 90 'spec=NOESY, no=14, id=11, vol=3.130000e+09' 300 127 300 171 c30497_6e5i 1 91 'spec=NOESY, no=16, id=13, vol=1.870000e+09' 305 127 305 171 c30497_6e5i 1 92 'spec=NOESY, no=17, id=14, vol=1.850000e+09' 306 127 306 171 c30497_6e5i 1 93 'spec=NOESY, no=18, id=15, vol=1.810000e+09' 307 127 307 171 c30497_6e5i 1 94 'spec=NOESY, no=19, id=16, vol=1.690000e+09' 308 127 308 171 c30497_6e5i 1 95 'spec=NOESY, no=21, id=18, vol=1.560000e+09' 310 127 310 171 c30497_6e5i 1 96 'spec=NOESY, no=20, id=17, vol=1.640000e+09' 309 127 309 171 c30497_6e5i 1 97 'spec=NOESY, no=22, id=19, vol=1.520000e+09' 319 127 319 171 c30497_6e5i 1 98 'spec=NOESY, no=24, id=21, vol=1.430000e+09' 320 127 320 171 c30497_6e5i 1 99 'spec=NOESY, no=25, id=22, vol=1.420000e+09' 321 127 321 171 c30497_6e5i 1 100 'spec=NOESY, no=26, id=23, vol=1.400000e+09' 322 127 322 171 c30497_6e5i 1 101 'spec=NOESY, no=28, id=25, vol=1.240000e+09' 324 127 324 171 c30497_6e5i 1 102 'spec=NOESY, no=27, id=24, vol=1.370000e+09' 323 127 323 171 c30497_6e5i 1 103 'spec=NOESY, no=31, id=28, vol=1.120000e+09' 327 127 327 171 c30497_6e5i 1 104 'spec=NOESY, no=29, id=26, vol=1.220000e+09' 326 127 326 171 c30497_6e5i 1 105 'spec=NOESY, no=32, id=29, vol=1.110000e+09' 329 127 329 171 c30497_6e5i 1 106 'spec=NOESY, no=34, id=31, vol=1.020000e+09' 331 127 331 171 c30497_6e5i 1 107 'spec=NOESY, no=33, id=30, vol=1.050000e+09' 330 127 330 171 c30497_6e5i 1 108 'spec=NOESY, no=36, id=33, vol=9.360000e+08' 334 127 334 171 c30497_6e5i 1 109 'spec=NOESY, no=35, id=32, vol=9.410000e+08' 333 127 333 171 c30497_6e5i 1 110 'spec=NOESY, no=37, id=34, vol=9.160000e+08' 336 127 336 171 c30497_6e5i 1 111 'spec=NOESY, no=38, id=35, vol=9.160000e+08' 338 127 338 171 c30497_6e5i 1 112 'spec=NOESY, no=39, id=36, vol=9.160000e+08' 339 127 339 171 c30497_6e5i 1 113 'spec=NOESY, no=41, id=38, vol=9.130000e+08' 341 127 341 171 c30497_6e5i 1 114 'spec=NOESY, no=40, id=37, vol=9.140000e+08' 340 127 340 171 c30497_6e5i 1 115 'spec=NOESY, no=43, id=40, vol=9.020000e+08' 343 127 343 171 c30497_6e5i 1 116 'spec=NOESY, no=44, id=41, vol=8.920000e+08' 345 127 345 171 c30497_6e5i 1 117 'spec=NOESY, no=45, id=42, vol=8.850000e+08' 347 127 347 171 c30497_6e5i 1 118 'spec=NOESY, no=50, id=47, vol=8.300000e+08' 350 127 350 171 c30497_6e5i 1 119 'spec=NOESY, no=46, id=43, vol=8.680000e+08' 349 127 349 171 c30497_6e5i 1 120 'spec=NOESY, no=51, id=48, vol=8.200000e+08' 352 127 352 171 c30497_6e5i 1 121 'spec=NOESY, no=52, id=49, vol=8.180000e+08' 361 127 361 171 c30497_6e5i 1 122 'spec=NOESY, no=54, id=51, vol=8.010000e+08' 364 127 364 171 c30497_6e5i 1 123 'spec=NOESY, no=53, id=50, vol=8.120000e+08' 363 127 363 171 c30497_6e5i 1 124 'spec=NOESY, no=56, id=53, vol=7.780000e+08' 367 127 367 171 c30497_6e5i 1 125 'spec=NOESY, no=55, id=52, vol=7.970000e+08' 366 127 366 171 c30497_6e5i 1 126 'spec=NOESY, no=58, id=55, vol=7.550000e+08' 370 127 370 171 c30497_6e5i 1 127 'spec=NOESY, no=59, id=56, vol=7.450000e+08' 372 127 372 171 c30497_6e5i 1 128 'spec=NOESY, no=61, id=58, vol=7.390000e+08' 374 127 374 171 c30497_6e5i 1 129 'spec=NOESY, no=62, id=59, vol=7.090000e+08' 377 127 377 171 c30497_6e5i 1 130 'spec=NOESY, no=63, id=60, vol=7.090000e+08' 378 127 378 171 c30497_6e5i 1 131 'spec=NOESY, no=65, id=62, vol=6.800000e+08' 380 127 380 171 c30497_6e5i 1 132 'spec=NOESY, no=64, id=61, vol=7.050000e+08' 379 127 379 171 c30497_6e5i 1 133 'spec=NOESY, no=66, id=63, vol=6.750000e+08' 382 127 382 171 c30497_6e5i 1 134 'spec=NOESY, no=68, id=65, vol=6.630000e+08' 384 127 384 171 c30497_6e5i 1 135 'spec=NOESY, no=67, id=64, vol=6.660000e+08' 383 127 383 171 c30497_6e5i 1 136 'spec=NOESY, no=69, id=66, vol=6.510000e+08' 386 127 386 171 c30497_6e5i 1 137 'spec=NOESY, no=70, id=67, vol=6.470000e+08' 387 127 387 171 c30497_6e5i 1 138 'spec=NOESY, no=71, id=68, vol=6.430000e+08' 388 127 388 171 c30497_6e5i 1 139 'spec=NOESY, no=72, id=69, vol=6.390000e+08' 389 127 389 171 c30497_6e5i 1 140 'spec=NOESY, no=73, id=70, vol=6.330000e+08' 390 127 390 171 c30497_6e5i 1 141 'spec=NOESY, no=74, id=71, vol=6.300000e+08' 391 127 391 171 c30497_6e5i 1 142 'spec=NOESY, no=78, id=75, vol=6.150000e+08' 393 127 393 171 c30497_6e5i 1 143 'spec=NOESY, no=77, id=74, vol=6.180000e+08' 392 127 392 171 c30497_6e5i 1 144 'spec=NOESY, no=79, id=76, vol=6.140000e+08' 396 127 396 171 c30497_6e5i 1 145 'spec=NOESY, no=80, id=77, vol=6.040000e+08' 397 127 397 171 c30497_6e5i 1 146 'spec=NOESY, no=82, id=79, vol=5.980000e+08' 398 127 398 171 c30497_6e5i 1 147 'spec=NOESY, no=84, id=81, vol=5.870000e+08' 400 127 400 171 c30497_6e5i 1 148 'spec=NOESY, no=83, id=80, vol=5.970000e+08' 399 127 399 171 c30497_6e5i 1 149 'spec=NOESY, no=86, id=83, vol=5.790000e+08' 403 127 403 171 c30497_6e5i 1 150 'spec=NOESY, no=87, id=84, vol=5.750000e+08' 404 127 404 171 c30497_6e5i 1 151 'spec=NOESY, no=88, id=85, vol=5.700000e+08' 405 127 405 171 c30497_6e5i 1 152 'spec=NOESY, no=90, id=87, vol=5.680000e+08' 407 127 407 171 c30497_6e5i 1 153 'spec=NOESY, no=89, id=86, vol=5.680000e+08' 406 127 406 171 c30497_6e5i 1 154 'spec=NOESY, no=92, id=89, vol=5.620000e+08' 409 127 409 171 c30497_6e5i 1 155 'spec=NOESY, no=94, id=91, vol=5.410000e+08' 411 127 411 171 c30497_6e5i 1 156 'spec=NOESY, no=93, id=90, vol=5.610000e+08' 410 127 410 171 c30497_6e5i 1 157 'spec=NOESY, no=95, id=92, vol=5.370000e+08' 414 127 414 171 c30497_6e5i 1 158 'spec=NOESY, no=96, id=93, vol=5.290000e+08' 415 127 415 171 c30497_6e5i 1 159 'spec=NOESY, no=98, id=95, vol=5.140000e+08' 417 127 417 171 c30497_6e5i 1 160 'spec=NOESY, no=97, id=94, vol=5.140000e+08' 416 127 416 171 c30497_6e5i 1 161 'spec=NOESY, no=99, id=96, vol=5.130000e+08' 420 127 420 171 c30497_6e5i 1 162 'spec=NOESY, no=100, id=97, vol=5.110000e+08' 423 127 423 172 c30497_6e5i 1 163 'spec=NOESY, no=101, id=98, vol=5.090000e+08' 426 127 426 172 c30497_6e5i 1 164 'spec=NOESY, no=103, id=100, vol=4.950000e+08' 428 127 428 173 c30497_6e5i 1 165 'spec=NOESY, no=102, id=99, vol=5.010000e+08' 427 127 427 172 c30497_6e5i 1 166 'spec=NOESY, no=104, id=101, vol=4.940000e+08' 431 127 431 173 c30497_6e5i 1 167 'spec=NOESY, no=106, id=103, vol=4.910000e+08' 438 127 438 173 c30497_6e5i 1 168 'spec=NOESY, no=105, id=102, vol=4.940000e+08' 437 127 437 173 c30497_6e5i 1 169 'spec=NOESY, no=107, id=104, vol=4.780000e+08' 440 127 440 173 c30497_6e5i 1 170 'spec=NOESY, no=108, id=105, vol=4.770000e+08' 441 127 441 173 c30497_6e5i 1 171 'spec=NOESY, no=109, id=106, vol=4.720000e+08' 442 127 442 173 c30497_6e5i 1 172 'spec=NOESY, no=112, id=109, vol=4.680000e+08' 444 127 444 173 c30497_6e5i 1 173 'spec=NOESY, no=110, id=107, vol=4.700000e+08' 443 127 443 173 c30497_6e5i 1 174 'spec=NOESY, no=114, id=111, vol=4.600000e+08' 448 127 448 173 c30497_6e5i 1 175 'spec=NOESY, no=113, id=110, vol=4.670000e+08' 447 127 447 173 c30497_6e5i 1 176 'spec=NOESY, no=116, id=113, vol=4.580000e+08' 451 127 451 173 c30497_6e5i 1 177 'spec=NOESY, no=115, id=112, vol=4.580000e+08' 450 127 450 173 c30497_6e5i 1 178 'spec=NOESY, no=119, id=116, vol=4.370000e+08' 454 127 454 173 c30497_6e5i 1 179 'spec=NOESY, no=117, id=114, vol=4.480000e+08' 453 127 453 173 c30497_6e5i 1 180 'spec=NOESY, no=120, id=117, vol=4.340000e+08' 457 127 457 173 c30497_6e5i 1 181 'spec=NOESY, no=122, id=119, vol=4.240000e+08' 467 127 467 173 c30497_6e5i 1 182 'spec=NOESY, no=121, id=118, vol=4.260000e+08' 466 127 466 173 c30497_6e5i 1 183 'spec=NOESY, no=123, id=120, vol=4.230000e+08' 469 127 469 173 c30497_6e5i 1 184 'spec=NOESY, no=125, id=122, vol=4.190000e+08' 479 127 479 173 c30497_6e5i 1 185 'spec=NOESY, no=124, id=121, vol=4.200000e+08' 478 127 478 173 c30497_6e5i 1 186 'spec=NOESY, no=127, id=124, vol=4.150000e+08' 482 127 482 173 c30497_6e5i 1 187 'spec=NOESY, no=128, id=125, vol=4.140000e+08' 483 127 483 173 c30497_6e5i 1 188 'spec=NOESY, no=129, id=126, vol=4.130000e+08' 484 127 484 173 c30497_6e5i 1 189 'spec=NOESY, no=130, id=127, vol=4.110000e+08' 485 127 485 173 c30497_6e5i 1 190 'spec=NOESY, no=131, id=128, vol=4.090000e+08' 486 127 486 173 c30497_6e5i 1 191 'spec=NOESY, no=133, id=130, vol=4.070000e+08' 488 127 488 173 c30497_6e5i 1 192 'spec=NOESY, no=132, id=129, vol=4.070000e+08' 487 127 487 173 c30497_6e5i 1 193 'spec=NOESY, no=135, id=132, vol=4.020000e+08' 492 127 492 173 c30497_6e5i 1 194 'spec=NOESY, no=134, id=131, vol=4.050000e+08' 491 127 491 173 c30497_6e5i 1 195 'spec=NOESY, no=136, id=133, vol=4.000000e+08' 494 127 494 173 c30497_6e5i 1 196 'spec=NOESY, no=137, id=134, vol=3.970000e+08' 496 127 496 173 c30497_6e5i 1 197 'spec=NOESY, no=139, id=136, vol=3.920000e+08' 497 127 497 173 c30497_6e5i 1 198 'spec=NOESY, no=140, id=137, vol=3.890000e+08' 498 127 498 173 c30497_6e5i 1 199 'spec=NOESY, no=142, id=139, vol=3.880000e+08' 500 127 500 173 c30497_6e5i 1 200 'spec=NOESY, no=141, id=138, vol=3.890000e+08' 499 127 499 173 c30497_6e5i 1 201 'spec=NOESY, no=144, id=141, vol=3.840000e+08' 503 127 503 173 c30497_6e5i 1 202 'spec=NOESY, no=146, id=143, vol=3.750000e+08' 506 127 506 173 c30497_6e5i 1 203 'spec=NOESY, no=145, id=142, vol=3.820000e+08' 505 127 505 173 c30497_6e5i 1 204 'spec=NOESY, no=147, id=144, vol=3.730000e+08' 509 127 509 173 c30497_6e5i 1 205 'spec=NOESY, no=148, id=145, vol=3.720000e+08' 510 127 510 173 c30497_6e5i 1 206 'spec=NOESY, no=149, id=146, vol=3.710000e+08' 511 127 511 173 c30497_6e5i 1 207 'spec=NOESY, no=151, id=148, vol=3.640000e+08' 512 127 512 173 c30497_6e5i 1 208 'spec=NOESY, no=154, id=151, vol=3.580000e+08' 513 127 513 173 c30497_6e5i 1 209 'spec=NOESY, no=155, id=152, vol=3.570000e+08' 514 127 514 173 c30497_6e5i 1 210 'spec=NOESY, no=156, id=153, vol=3.570000e+08' 515 127 515 173 c30497_6e5i 1 211 'spec=NOESY, no=157, id=154, vol=3.560000e+08' 516 127 516 173 c30497_6e5i 1 212 'spec=NOESY, no=159, id=156, vol=3.550000e+08' 518 127 518 173 c30497_6e5i 1 213 'spec=NOESY, no=158, id=155, vol=3.550000e+08' 517 127 517 173 c30497_6e5i 1 214 'spec=NOESY, no=160, id=157, vol=3.550000e+08' 521 127 521 173 c30497_6e5i 1 215 'spec=NOESY, no=161, id=158, vol=3.520000e+08' 522 127 522 173 c30497_6e5i 1 216 'spec=NOESY, no=163, id=160, vol=3.500000e+08' 524 127 524 173 c30497_6e5i 1 217 'spec=NOESY, no=162, id=159, vol=3.500000e+08' 523 127 523 173 c30497_6e5i 1 218 'spec=NOESY, no=164, id=161, vol=3.420000e+08' 527 127 527 173 c30497_6e5i 1 219 'spec=NOESY, no=165, id=162, vol=3.390000e+08' 528 127 528 173 c30497_6e5i 1 220 'spec=NOESY, no=166, id=163, vol=3.350000e+08' 529 127 529 173 c30497_6e5i 1 221 'spec=NOESY, no=167, id=164, vol=3.340000e+08' 530 127 530 173 c30497_6e5i 1 222 'spec=NOESY, no=169, id=166, vol=3.320000e+08' 532 127 532 173 c30497_6e5i 1 223 'spec=NOESY, no=168, id=165, vol=3.330000e+08' 531 127 531 173 c30497_6e5i 1 224 'spec=NOESY, no=171, id=168, vol=3.300000e+08' 537 127 537 173 c30497_6e5i 1 225 'spec=NOESY, no=170, id=167, vol=3.310000e+08' 536 127 536 173 c30497_6e5i 1 226 'spec=NOESY, no=172, id=169, vol=3.250000e+08' 539 127 539 173 c30497_6e5i 1 227 'spec=NOESY, no=173, id=170, vol=3.250000e+08' 542 127 542 173 c30497_6e5i 1 228 'spec=NOESY, no=176, id=173, vol=3.200000e+08' 544 127 544 173 c30497_6e5i 1 229 'spec=NOESY, no=174, id=171, vol=3.220000e+08' 543 127 543 173 c30497_6e5i 1 230 'spec=NOESY, no=178, id=175, vol=3.190000e+08' 547 127 547 173 c30497_6e5i 1 231 'spec=NOESY, no=177, id=174, vol=3.190000e+08' 546 127 546 173 c30497_6e5i 1 232 'spec=NOESY, no=179, id=176, vol=3.130000e+08' 549 127 549 173 c30497_6e5i 1 233 'spec=NOESY, no=180, id=177, vol=3.060000e+08' 551 127 551 173 c30497_6e5i 1 234 'spec=NOESY, no=181, id=178, vol=3.040000e+08' 553 127 553 173 c30497_6e5i 1 235 'spec=NOESY, no=182, id=179, vol=3.030000e+08' 555 127 555 173 c30497_6e5i 1 236 'spec=NOESY, no=184, id=181, vol=3.010000e+08' 557 127 557 173 c30497_6e5i 1 237 'spec=NOESY, no=183, id=180, vol=3.020000e+08' 556 127 556 173 c30497_6e5i 1 238 'spec=NOESY, no=186, id=183, vol=2.930000e+08' 559 127 559 173 c30497_6e5i 1 239 'spec=NOESY, no=187, id=184, vol=2.930000e+08' 560 127 560 173 c30497_6e5i 1 240 'spec=NOESY, no=189, id=186, vol=2.890000e+08' 562 127 562 173 c30497_6e5i 1 241 'spec=NOESY, no=188, id=185, vol=2.900000e+08' 561 127 561 173 c30497_6e5i 1 242 'spec=NOESY, no=192, id=189, vol=2.830000e+08' 565 127 565 173 c30497_6e5i 1 243 'spec=NOESY, no=190, id=187, vol=2.870000e+08' 564 127 564 173 c30497_6e5i 1 244 'spec=NOESY, no=193, id=190, vol=2.810000e+08' 571 127 571 173 c30497_6e5i 1 245 'spec=NOESY, no=194, id=191, vol=2.800000e+08' 572 127 572 173 c30497_6e5i 1 246 'spec=NOESY, no=195, id=192, vol=2.780000e+08' 573 127 573 173 c30497_6e5i 1 247 'spec=NOESY, no=196, id=193, vol=2.770000e+08' 574 127 574 173 c30497_6e5i 1 248 'spec=NOESY, no=198, id=195, vol=2.720000e+08' 575 127 575 173 c30497_6e5i 1 249 'spec=NOESY, no=199, id=196, vol=2.720000e+08' 576 127 576 173 c30497_6e5i 1 250 'spec=NOESY, no=201, id=198, vol=2.670000e+08' 578 127 578 173 c30497_6e5i 1 251 'spec=NOESY, no=200, id=197, vol=2.670000e+08' 577 127 577 173 c30497_6e5i 1 252 'spec=NOESY, no=203, id=200, vol=2.630000e+08' 584 127 584 173 c30497_6e5i 1 253 'spec=NOESY, no=205, id=202, vol=2.600000e+08' 588 127 588 173 c30497_6e5i 1 254 'spec=NOESY, no=204, id=201, vol=2.600000e+08' 587 127 587 173 c30497_6e5i 1 255 'spec=NOESY, no=206, id=203, vol=2.600000e+08' 597 127 597 173 c30497_6e5i 1 256 'spec=NOESY, no=207, id=204, vol=2.590000e+08' 598 127 598 173 c30497_6e5i 1 257 'spec=NOESY, no=209, id=206, vol=2.540000e+08' 600 127 600 173 c30497_6e5i 1 258 'spec=NOESY, no=208, id=205, vol=2.590000e+08' 599 127 599 173 c30497_6e5i 1 259 'spec=NOESY, no=210, id=207, vol=2.530000e+08' 602 127 602 173 c30497_6e5i 1 260 'spec=NOESY, no=211, id=208, vol=2.480000e+08' 603 127 603 173 c30497_6e5i 1 261 'spec=NOESY, no=212, id=209, vol=2.470000e+08' 604 127 604 173 c30497_6e5i 1 262 'spec=NOESY, no=213, id=210, vol=2.460000e+08' 605 127 605 173 c30497_6e5i 1 263 'spec=NOESY, no=214, id=211, vol=2.450000e+08' 606 127 606 173 c30497_6e5i 1 264 'spec=NOESY, no=215, id=212, vol=2.420000e+08' 607 127 607 173 c30497_6e5i 1 265 'spec=NOESY, no=216, id=213, vol=2.390000e+08' 608 127 608 173 c30497_6e5i 1 266 'spec=NOESY, no=219, id=216, vol=2.340000e+08' 610 127 610 173 c30497_6e5i 1 267 'spec=NOESY, no=217, id=214, vol=2.380000e+08' 609 127 609 173 c30497_6e5i 1 268 'spec=NOESY, no=222, id=219, vol=2.320000e+08' 617 127 617 173 c30497_6e5i 1 269 'spec=NOESY, no=220, id=217, vol=2.340000e+08' 616 127 616 173 c30497_6e5i 1 270 'spec=NOESY, no=223, id=220, vol=2.280000e+08' 623 127 623 173 c30497_6e5i 1 271 'spec=NOESY, no=225, id=222, vol=2.260000e+08' 625 127 625 173 c30497_6e5i 1 272 'spec=NOESY, no=224, id=221, vol=2.270000e+08' 624 127 624 173 c30497_6e5i 1 273 'spec=NOESY, no=226, id=223, vol=2.260000e+08' 628 127 628 173 c30497_6e5i 1 274 'spec=NOESY, no=227, id=224, vol=2.250000e+08' 629 127 629 173 c30497_6e5i 1 275 'spec=NOESY, no=229, id=226, vol=2.210000e+08' 630 127 630 173 c30497_6e5i 1 276 'spec=NOESY, no=231, id=228, vol=2.190000e+08' 632 127 632 173 c30497_6e5i 1 277 'spec=NOESY, no=230, id=227, vol=2.200000e+08' 631 127 631 173 c30497_6e5i 1 278 'spec=NOESY, no=232, id=229, vol=2.170000e+08' 634 127 634 173 c30497_6e5i 1 279 'spec=NOESY, no=234, id=231, vol=2.130000e+08' 637 127 637 173 c30497_6e5i 1 280 'spec=NOESY, no=233, id=230, vol=2.160000e+08' 636 127 636 173 c30497_6e5i 1 281 'spec=NOESY, no=235, id=232, vol=2.100000e+08' 646 127 646 173 c30497_6e5i 1 282 'spec=NOESY, no=240, id=237, vol=2.030000e+08' 656 127 656 173 c30497_6e5i 1 283 'spec=NOESY, no=237, id=234, vol=2.060000e+08' 655 127 655 173 c30497_6e5i 1 284 'spec=NOESY, no=241, id=238, vol=2.030000e+08' 658 127 658 173 c30497_6e5i 1 285 'spec=NOESY, no=243, id=240, vol=2.000000e+08' 659 127 659 173 c30497_6e5i 1 286 'spec=NOESY, no=245, id=242, vol=1.990000e+08' 661 127 661 173 c30497_6e5i 1 287 'spec=NOESY, no=244, id=241, vol=1.990000e+08' 660 127 660 173 c30497_6e5i 1 288 'spec=NOESY, no=247, id=244, vol=1.970000e+08' 664 127 664 173 c30497_6e5i 1 289 'spec=NOESY, no=246, id=243, vol=1.980000e+08' 663 127 663 173 c30497_6e5i 1 290 'spec=NOESY, no=248, id=245, vol=1.950000e+08' 667 127 667 173 c30497_6e5i 1 291 'spec=NOESY, no=250, id=247, vol=1.920000e+08' 670 127 670 173 c30497_6e5i 1 292 'spec=NOESY, no=249, id=246, vol=1.940000e+08' 669 127 669 173 c30497_6e5i 1 293 'spec=NOESY, no=253, id=250, vol=1.900000e+08' 672 127 672 173 c30497_6e5i 1 294 'spec=NOESY, no=254, id=251, vol=1.900000e+08' 673 127 673 173 c30497_6e5i 1 295 'spec=NOESY, no=257, id=254, vol=1.850000e+08' 675 127 675 173 c30497_6e5i 1 296 'spec=NOESY, no=255, id=252, vol=1.870000e+08' 674 127 674 173 c30497_6e5i 1 297 'spec=NOESY, no=261, id=258, vol=1.830000e+08' 678 127 678 173 c30497_6e5i 1 298 'spec=NOESY, no=258, id=255, vol=1.840000e+08' 677 127 677 173 c30497_6e5i 1 299 'spec=NOESY, no=262, id=259, vol=1.820000e+08' 684 127 684 173 c30497_6e5i 1 300 'spec=NOESY, no=263, id=260, vol=1.820000e+08' 690 127 690 173 c30497_6e5i 1 301 'spec=NOESY, no=265, id=262, vol=1.820000e+08' 692 127 692 173 c30497_6e5i 1 302 'spec=NOESY, no=264, id=261, vol=1.820000e+08' 691 127 691 173 c30497_6e5i 1 303 'spec=NOESY, no=268, id=265, vol=1.810000e+08' 699 127 699 173 c30497_6e5i 1 304 'spec=NOESY, no=267, id=264, vol=1.810000e+08' 698 127 698 173 c30497_6e5i 1 305 'spec=NOESY, no=269, id=266, vol=1.790000e+08' 702 127 702 173 c30497_6e5i 1 306 'spec=NOESY, no=271, id=268, vol=1.760000e+08' 712 127 712 173 c30497_6e5i 1 307 'spec=NOESY, no=270, id=267, vol=1.770000e+08' 711 127 711 173 c30497_6e5i 1 308 'spec=NOESY, no=272, id=269, vol=1.750000e+08' 718 127 718 173 c30497_6e5i 1 309 'spec=NOESY, no=273, id=270, vol=1.740000e+08' 721 127 721 173 c30497_6e5i 1 310 'spec=NOESY, no=275, id=272, vol=1.710000e+08' 722 127 722 173 c30497_6e5i 1 311 'spec=NOESY, no=276, id=273, vol=1.700000e+08' 723 127 723 173 c30497_6e5i 1 312 'spec=NOESY, no=277, id=274, vol=1.670000e+08' 724 127 724 173 c30497_6e5i 1 313 'spec=NOESY, no=278, id=275, vol=1.670000e+08' 725 127 725 173 c30497_6e5i 1 314 'spec=NOESY, no=280, id=277, vol=1.650000e+08' 727 127 727 173 c30497_6e5i 1 315 'spec=NOESY, no=279, id=276, vol=1.660000e+08' 726 127 726 173 c30497_6e5i 1 316 'spec=NOESY, no=282, id=279, vol=1.610000e+08' 731 127 731 173 c30497_6e5i 1 317 'spec=NOESY, no=281, id=278, vol=1.650000e+08' 730 127 730 173 c30497_6e5i 1 318 'spec=NOESY, no=283, id=280, vol=1.580000e+08' 733 127 733 173 c30497_6e5i 1 319 'spec=NOESY, no=284, id=281, vol=1.570000e+08' 735 127 735 173 c30497_6e5i 1 320 'spec=NOESY, no=285, id=282, vol=1.570000e+08' 736 127 736 173 c30497_6e5i 1 321 'spec=NOESY, no=288, id=285, vol=1.520000e+08' 737 127 737 173 c30497_6e5i 1 322 'spec=NOESY, no=289, id=286, vol=1.510000e+08' 738 127 738 173 c30497_6e5i 1 323 'spec=NOESY, no=290, id=287, vol=1.500000e+08' 739 127 739 173 c30497_6e5i 1 324 'spec=NOESY, no=291, id=288, vol=1.500000e+08' 740 127 740 173 c30497_6e5i 1 325 'spec=NOESY, no=292, id=289, vol=1.490000e+08' 741 127 741 173 c30497_6e5i 1 326 'spec=NOESY, no=295, id=292, vol=1.460000e+08' 743 127 743 173 c30497_6e5i 1 327 'spec=NOESY, no=294, id=291, vol=1.470000e+08' 742 127 742 173 c30497_6e5i 1 328 'spec=NOESY, no=296, id=293, vol=1.450000e+08' 745 127 745 173 c30497_6e5i 1 329 'spec=NOESY, no=299, id=296, vol=1.430000e+08' 748 127 748 173 c30497_6e5i 1 330 'spec=NOESY, no=297, id=294, vol=1.440000e+08' 747 127 747 173 c30497_6e5i 1 331 'spec=NOESY, no=300, id=297, vol=1.430000e+08' 750 127 750 173 c30497_6e5i 1 332 'spec=NOESY, no=302, id=299, vol=1.390000e+08' 753 127 753 173 c30497_6e5i 1 333 'spec=NOESY, no=303, id=300, vol=1.390000e+08' 755 127 755 173 c30497_6e5i 1 334 'spec=NOESY, no=304, id=301, vol=1.380000e+08' 756 127 756 173 c30497_6e5i 1 335 'spec=NOESY, no=306, id=303, vol=1.370000e+08' 758 127 758 173 c30497_6e5i 1 336 'spec=NOESY, no=305, id=302, vol=1.370000e+08' 757 127 757 173 c30497_6e5i 1 337 'spec=NOESY, no=308, id=305, vol=1.360000e+08' 760 127 760 173 c30497_6e5i 1 338 'spec=NOESY, no=310, id=307, vol=1.340000e+08' 762 127 762 173 c30497_6e5i 1 339 'spec=NOESY, no=309, id=306, vol=1.350000e+08' 761 127 761 173 c30497_6e5i 1 340 'spec=NOESY, no=312, id=309, vol=1.340000e+08' 769 127 769 173 c30497_6e5i 1 341 'spec=NOESY, no=311, id=308, vol=1.340000e+08' 768 127 768 173 c30497_6e5i 1 342 'spec=NOESY, no=314, id=311, vol=1.310000e+08' 773 127 773 173 c30497_6e5i 1 343 'spec=NOESY, no=313, id=310, vol=1.330000e+08' 772 127 772 173 c30497_6e5i 1 344 'spec=NOESY, no=315, id=312, vol=1.300000e+08' 775 127 775 173 c30497_6e5i 1 345 'spec=NOESY, no=316, id=313, vol=1.290000e+08' 777 127 777 173 c30497_6e5i 1 346 'spec=NOESY, no=317, id=314, vol=1.290000e+08' 778 127 778 173 c30497_6e5i 1 347 'spec=NOESY, no=320, id=317, vol=1.250000e+08' 780 127 780 173 c30497_6e5i 1 348 'spec=NOESY, no=318, id=315, vol=1.280000e+08' 779 127 779 173 c30497_6e5i 1 349 'spec=NOESY, no=322, id=319, vol=1.240000e+08' 782 127 782 173 c30497_6e5i 1 350 'spec=NOESY, no=324, id=321, vol=1.200000e+08' 784 127 784 173 c30497_6e5i 1 351 'spec=NOESY, no=323, id=320, vol=1.220000e+08' 783 127 783 173 c30497_6e5i 1 352 'spec=NOESY, no=326, id=323, vol=1.160000e+08' 787 127 787 173 c30497_6e5i 1 353 'spec=NOESY, no=328, id=325, vol=1.160000e+08' 790 127 790 173 c30497_6e5i 1 354 'spec=NOESY, no=329, id=326, vol=1.160000e+08' 791 127 791 173 c30497_6e5i 1 355 'spec=NOESY, no=330, id=327, vol=1.160000e+08' 792 127 792 173 c30497_6e5i 1 356 'spec=NOESY, no=331, id=328, vol=1.150000e+08' 793 127 793 173 c30497_6e5i 1 357 'spec=NOESY, no=333, id=330, vol=1.130000e+08' 795 127 795 173 c30497_6e5i 1 358 'spec=NOESY, no=332, id=329, vol=1.140000e+08' 794 127 794 173 c30497_6e5i 1 359 'spec=NOESY, no=334, id=331, vol=1.130000e+08' 798 127 798 173 c30497_6e5i 1 360 'spec=NOESY, no=335, id=332, vol=1.120000e+08' 800 127 800 173 c30497_6e5i 1 361 'spec=NOESY, no=339, id=336, vol=1.110000e+08' 802 127 802 173 c30497_6e5i 1 362 'spec=NOESY, no=340, id=337, vol=1.110000e+08' 805 127 805 173 c30497_6e5i 1 363 'spec=NOESY, no=342, id=339, vol=1.100000e+08' 807 127 807 173 c30497_6e5i 1 364 'spec=NOESY, no=341, id=338, vol=1.100000e+08' 806 127 806 173 c30497_6e5i 1 365 'spec=NOESY, no=345, id=342, vol=1.090000e+08' 809 127 809 173 c30497_6e5i 1 366 'spec=NOESY, no=347, id=344, vol=1.080000e+08' 811 127 811 173 c30497_6e5i 1 367 'spec=NOESY, no=350, id=347, vol=1.070000e+08' 815 127 815 173 c30497_6e5i 1 368 'spec=NOESY, no=349, id=346, vol=1.070000e+08' 814 127 814 173 c30497_6e5i 1 369 'spec=NOESY, no=351, id=348, vol=1.070000e+08' 818 127 818 173 c30497_6e5i 1 370 'spec=NOESY, no=352, id=349, vol=1.060000e+08' 821 127 821 173 c30497_6e5i 1 371 'spec=NOESY, no=354, id=351, vol=1.060000e+08' 825 127 825 173 c30497_6e5i 1 372 'spec=NOESY, no=353, id=350, vol=1.060000e+08' 824 127 824 173 c30497_6e5i 1 373 'spec=NOESY, no=355, id=352, vol=1.050000e+08' 827 127 827 173 c30497_6e5i 1 374 'spec=NOESY, no=357, id=354, vol=1.050000e+08' 829 127 829 173 c30497_6e5i 1 375 'spec=NOESY, no=356, id=353, vol=1.050000e+08' 828 127 828 173 c30497_6e5i 1 376 'spec=NOESY, no=360, id=357, vol=1.040000e+08' 834 127 834 173 c30497_6e5i 1 377 'spec=NOESY, no=359, id=356, vol=1.040000e+08' 833 127 833 173 c30497_6e5i 1 378 'spec=NOESY, no=362, id=359, vol=1.030000e+08' 836 127 836 173 c30497_6e5i 1 379 'spec=NOESY, no=363, id=360, vol=1.020000e+08' 838 127 838 173 c30497_6e5i 1 380 'spec=NOESY, no=367, id=364, vol=9.950000e+07' 839 127 839 173 c30497_6e5i 1 381 'spec=NOESY, no=368, id=365, vol=9.940000e+07' 840 127 840 173 c30497_6e5i 1 382 'spec=NOESY, no=370, id=367, vol=9.860000e+07' 842 127 842 173 c30497_6e5i 1 383 'spec=NOESY, no=369, id=366, vol=9.930000e+07' 841 127 841 173 c30497_6e5i 1 384 'spec=NOESY, no=374, id=371, vol=9.730000e+07' 845 127 845 173 c30497_6e5i 1 385 'spec=NOESY, no=373, id=370, vol=9.730000e+07' 844 127 844 173 c30497_6e5i 1 386 'spec=NOESY, no=375, id=372, vol=9.720000e+07' 847 127 847 173 c30497_6e5i 1 387 'spec=NOESY, no=376, id=373, vol=9.620000e+07' 848 127 848 173 c30497_6e5i 1 388 'spec=NOESY, no=378, id=375, vol=9.470000e+07' 850 127 850 173 c30497_6e5i 1 389 'spec=NOESY, no=377, id=374, vol=9.530000e+07' 849 127 849 173 c30497_6e5i 1 390 'spec=NOESY, no=380, id=377, vol=9.360000e+07' 854 127 854 173 c30497_6e5i 1 391 'spec=NOESY, no=379, id=376, vol=9.400000e+07' 853 127 853 173 c30497_6e5i 1 392 'spec=NOESY, no=382, id=379, vol=9.360000e+07' 860 127 860 173 c30497_6e5i 1 393 'spec=NOESY, no=386, id=383, vol=9.140000e+07' 863 127 863 173 c30497_6e5i 1 394 'spec=NOESY, no=387, id=384, vol=9.030000e+07' 865 127 865 173 c30497_6e5i 1 395 'spec=NOESY, no=389, id=386, vol=8.860000e+07' 867 127 867 173 c30497_6e5i 1 396 'spec=NOESY, no=390, id=387, vol=8.800000e+07' 869 127 869 173 c30497_6e5i 1 397 'spec=NOESY, no=393, id=390, vol=8.750000e+07' 871 127 871 173 c30497_6e5i 1 398 'spec=NOESY, no=392, id=389, vol=8.750000e+07' 870 127 870 173 c30497_6e5i 1 399 'spec=NOESY, no=396, id=393, vol=8.540000e+07' 876 127 876 173 c30497_6e5i 1 400 'spec=NOESY, no=394, id=391, vol=8.710000e+07' 875 127 875 173 c30497_6e5i 1 401 'spec=NOESY, no=397, id=394, vol=8.540000e+07' 878 127 878 173 c30497_6e5i 1 402 'spec=NOESY, no=398, id=395, vol=8.500000e+07' 879 127 879 173 c30497_6e5i 1 403 'spec=NOESY, no=401, id=398, vol=8.360000e+07' 881 127 881 173 c30497_6e5i 1 404 'spec=NOESY, no=400, id=397, vol=8.450000e+07' 880 127 880 173 c30497_6e5i 1 405 'spec=NOESY, no=403, id=400, vol=8.260000e+07' 884 127 884 173 c30497_6e5i 1 406 'spec=NOESY, no=402, id=399, vol=8.300000e+07' 883 127 883 173 c30497_6e5i 1 407 'spec=NOESY, no=404, id=401, vol=8.140000e+07' 886 127 886 173 c30497_6e5i 1 408 'spec=NOESY, no=405, id=402, vol=8.120000e+07' 892 127 892 173 c30497_6e5i 1 409 'spec=NOESY, no=406, id=403, vol=8.100000e+07' 894 127 894 173 c30497_6e5i 1 410 'spec=NOESY, no=407, id=404, vol=8.050000e+07' 900 127 900 173 c30497_6e5i 1 411 'spec=NOESY, no=408, id=405, vol=8.020000e+07' 903 127 903 173 c30497_6e5i 1 412 'spec=NOESY, no=409, id=406, vol=7.980000e+07' 909 127 909 173 c30497_6e5i 1 413 'spec=NOESY, no=411, id=408, vol=7.910000e+07' 911 127 911 173 c30497_6e5i 1 414 'spec=NOESY, no=410, id=407, vol=7.920000e+07' 910 127 910 173 c30497_6e5i 1 415 'spec=NOESY, no=412, id=409, vol=7.860000e+07' 913 127 913 173 c30497_6e5i 1 416 'spec=NOESY, no=415, id=412, vol=7.720000e+07' 915 127 915 173 c30497_6e5i 1 417 'spec=NOESY, no=413, id=410, vol=7.750000e+07' 914 127 914 173 c30497_6e5i 1 418 'spec=NOESY, no=416, id=413, vol=7.630000e+07' 918 127 918 173 c30497_6e5i 1 419 'spec=NOESY, no=420, id=417, vol=7.440000e+07' 922 127 922 173 c30497_6e5i 1 420 'spec=NOESY, no=417, id=414, vol=7.610000e+07' 921 127 921 173 c30497_6e5i 1 421 'spec=NOESY, no=421, id=418, vol=7.440000e+07' 925 127 925 173 c30497_6e5i 1 422 'spec=NOESY, no=423, id=420, vol=7.260000e+07' 929 127 929 173 c30497_6e5i 1 423 'spec=NOESY, no=422, id=419, vol=7.430000e+07' 928 127 928 173 c30497_6e5i 1 424 'spec=NOESY, no=424, id=421, vol=7.220000e+07' 931 127 931 173 c30497_6e5i 1 425 'spec=NOESY, no=426, id=423, vol=7.170000e+07' 933 127 933 173 c30497_6e5i 1 426 'spec=NOESY, no=425, id=422, vol=7.220000e+07' 932 127 932 173 c30497_6e5i 1 427 'spec=NOESY, no=428, id=425, vol=7.110000e+07' 935 127 935 173 c30497_6e5i 1 428 'spec=NOESY, no=430, id=427, vol=6.930000e+07' 937 127 937 173 c30497_6e5i 1 429 'spec=NOESY, no=429, id=426, vol=6.970000e+07' 936 127 936 173 c30497_6e5i 1 430 'spec=NOESY, no=432, id=429, vol=6.730000e+07' 940 127 940 173 c30497_6e5i 1 431 'spec=NOESY, no=434, id=431, vol=6.700000e+07' 943 127 943 173 c30497_6e5i 1 432 'spec=NOESY, no=433, id=430, vol=6.720000e+07' 942 127 942 173 c30497_6e5i 1 433 'spec=NOESY, no=435, id=432, vol=6.530000e+07' 946 127 946 173 c30497_6e5i 1 434 'spec=NOESY, no=436, id=433, vol=6.450000e+07' 948 127 948 173 c30497_6e5i 1 435 'spec=NOESY, no=438, id=435, vol=6.380000e+07' 949 127 949 173 c30497_6e5i 1 436 'spec=NOESY, no=439, id=436, vol=6.310000e+07' 950 127 950 173 c30497_6e5i 1 437 'spec=NOESY, no=441, id=438, vol=6.290000e+07' 952 127 952 173 c30497_6e5i 1 438 'spec=NOESY, no=440, id=437, vol=6.290000e+07' 951 127 951 173 c30497_6e5i 1 439 'spec=NOESY, no=442, id=439, vol=6.190000e+07' 954 127 954 173 c30497_6e5i 1 440 'spec=NOESY, no=444, id=441, vol=6.140000e+07' 957 127 957 173 c30497_6e5i 1 441 'spec=NOESY, no=443, id=440, vol=6.190000e+07' 956 127 956 173 c30497_6e5i 1 442 'spec=NOESY, no=446, id=443, vol=6.050000e+07' 960 127 960 173 c30497_6e5i 1 443 'spec=NOESY, no=445, id=442, vol=6.140000e+07' 959 127 959 173 c30497_6e5i 1 444 'spec=NOESY, no=447, id=444, vol=5.970000e+07' 962 127 962 173 c30497_6e5i 1 445 'spec=NOESY, no=449, id=446, vol=5.960000e+07' 964 127 964 173 c30497_6e5i 1 446 'spec=NOESY, no=448, id=445, vol=5.960000e+07' 963 127 963 173 c30497_6e5i 1 447 'spec=NOESY, no=450, id=447, vol=5.920000e+07' 966 127 966 173 c30497_6e5i 1 448 'spec=NOESY, no=451, id=448, vol=5.900000e+07' 970 127 970 173 c30497_6e5i 1 449 'spec=NOESY, no=452, id=449, vol=5.780000e+07' 971 127 971 173 c30497_6e5i 1 450 'spec=NOESY, no=453, id=450, vol=5.760000e+07' 972 127 972 173 c30497_6e5i 1 451 'spec=NOESY, no=455, id=452, vol=5.700000e+07' 974 127 974 173 c30497_6e5i 1 452 'spec=NOESY, no=454, id=451, vol=5.700000e+07' 973 127 973 173 c30497_6e5i 1 453 'spec=NOESY, no=457, id=454, vol=5.690000e+07' 978 127 978 173 c30497_6e5i 1 454 'spec=NOESY, no=456, id=453, vol=5.690000e+07' 977 127 977 173 c30497_6e5i 1 455 'spec=NOESY, no=458, id=455, vol=5.660000e+07' 980 127 980 173 c30497_6e5i 1 456 'spec=NOESY, no=459, id=456, vol=5.640000e+07' 982 127 982 173 c30497_6e5i 1 457 'spec=NOESY, no=460, id=457, vol=5.610000e+07' 985 127 985 173 c30497_6e5i 1 458 'spec=NOESY, no=461, id=458, vol=5.580000e+07' 986 127 986 173 c30497_6e5i 1 459 'spec=NOESY, no=463, id=460, vol=5.540000e+07' 987 127 987 173 c30497_6e5i 1 460 'spec=NOESY, no=465, id=462, vol=5.520000e+07' 988 127 988 173 c30497_6e5i 1 461 'spec=NOESY, no=466, id=463, vol=5.500000e+07' 989 127 989 173 c30497_6e5i 1 462 'spec=NOESY, no=469, id=466, vol=5.340000e+07' 991 127 991 173 c30497_6e5i 1 463 'spec=NOESY, no=468, id=465, vol=5.390000e+07' 990 127 990 173 c30497_6e5i 1 464 'spec=NOESY, no=472, id=469, vol=5.010000e+07' 994 127 994 173 c30497_6e5i 1 465 'spec=NOESY, no=471, id=468, vol=5.150000e+07' 993 127 993 173 c30497_6e5i 1 466 'spec=NOESY, no=473, id=470, vol=4.990000e+07' 997 127 997 173 c30497_6e5i 1 467 'spec=NOESY, no=475, id=472, vol=4.950000e+07' 1001 127 1001 173 c30497_6e5i 1 468 'spec=NOESY, no=474, id=471, vol=4.970000e+07' 1000 127 1000 173 c30497_6e5i 1 469 'spec=NOESY, no=476, id=473, vol=4.830000e+07' 1003 127 1003 173 c30497_6e5i 1 470 'spec=NOESY, no=477, id=474, vol=4.790000e+07' 1006 127 1006 173 c30497_6e5i 1 471 'spec=NOESY, no=478, id=475, vol=4.770000e+07' 1012 127 1012 173 c30497_6e5i 1 472 'spec=NOESY, no=479, id=476, vol=4.750000e+07' 1016 127 1016 173 c30497_6e5i 1 473 'spec=NOESY, no=481, id=478, vol=4.600000e+07' 1018 127 1018 173 c30497_6e5i 1 474 'spec=NOESY, no=480, id=477, vol=4.630000e+07' 1017 127 1017 173 c30497_6e5i 1 475 'spec=NOESY, no=483, id=480, vol=4.500000e+07' 1021 127 1021 173 c30497_6e5i 1 476 'spec=NOESY, no=482, id=479, vol=4.570000e+07' 1020 127 1020 173 c30497_6e5i 1 477 'spec=NOESY, no=486, id=483, vol=4.480000e+07' 1025 127 1025 173 c30497_6e5i 1 478 'spec=NOESY, no=484, id=481, vol=4.490000e+07' 1024 127 1024 173 c30497_6e5i 1 479 'spec=NOESY, no=487, id=484, vol=4.440000e+07' 1028 127 1028 173 c30497_6e5i 1 480 'spec=NOESY, no=490, id=487, vol=4.250000e+07' 1029 127 1029 173 c30497_6e5i 1 481 'spec=NOESY, no=491, id=488, vol=4.150000e+07' 1030 127 1030 173 c30497_6e5i 1 482 'spec=NOESY, no=493, id=490, vol=4.100000e+07' 1032 127 1032 173 c30497_6e5i 1 483 'spec=NOESY, no=492, id=489, vol=4.120000e+07' 1031 127 1031 173 c30497_6e5i 1 484 'spec=NOESY, no=494, id=491, vol=4.050000e+07' 1035 127 1035 173 c30497_6e5i 1 485 'spec=NOESY, no=496, id=493, vol=3.950000e+07' 1037 127 1037 173 c30497_6e5i 1 486 'spec=NOESY, no=499, id=496, vol=3.890000e+07' 1040 127 1040 173 c30497_6e5i 1 487 'spec=NOESY, no=498, id=495, vol=3.890000e+07' 1039 127 1039 173 c30497_6e5i 1 488 'spec=NOESY, no=500, id=497, vol=3.830000e+07' 1042 127 1042 173 c30497_6e5i 1 489 'spec=NOESY, no=501, id=498, vol=3.770000e+07' 1045 127 1045 173 c30497_6e5i 1 490 'spec=NOESY, no=502, id=499, vol=3.760000e+07' 1047 127 1047 173 c30497_6e5i 1 491 'spec=NOESY, no=504, id=501, vol=3.710000e+07' 1050 127 1050 173 c30497_6e5i 1 492 'spec=NOESY, no=505, id=502, vol=3.680000e+07' 1052 127 1052 173 c30497_6e5i 1 493 'spec=NOESY, no=506, id=503, vol=3.650000e+07' 1058 127 1058 173 c30497_6e5i 1 494 'spec=NOESY, no=507, id=504, vol=3.600000e+07' 1060 127 1060 173 c30497_6e5i 1 495 'spec=NOESY, no=508, id=505, vol=3.590000e+07' 1061 127 1061 173 c30497_6e5i 1 496 'spec=NOESY, no=510, id=507, vol=3.530000e+07' 1062 127 1062 173 c30497_6e5i 1 497 'spec=NOESY, no=513, id=510, vol=3.500000e+07' 1063 127 1063 173 c30497_6e5i 1 498 'spec=NOESY, no=514, id=511, vol=3.420000e+07' 1064 127 1064 173 c30497_6e5i 1 499 'spec=NOESY, no=518, id=515, vol=3.260000e+07' 1066 127 1066 173 c30497_6e5i 1 500 'spec=NOESY, no=516, id=513, vol=3.400000e+07' 1065 127 1065 173 c30497_6e5i 1 501 'spec=NOESY, no=519, id=516, vol=3.180000e+07' 1068 127 1068 173 c30497_6e5i 1 502 'spec=NOESY, no=520, id=517, vol=3.120000e+07' 1070 127 1070 173 c30497_6e5i 1 503 'spec=NOESY, no=522, id=519, vol=2.790000e+07' 1073 127 1073 173 c30497_6e5i 1 504 'spec=NOESY, no=521, id=518, vol=3.080000e+07' 1072 127 1072 173 c30497_6e5i 1 505 'spec=NOESY, no=524, id=521, vol=2.660000e+07' 1079 127 1079 173 c30497_6e5i 1 506 'spec=NOESY, no=526, id=523, vol=2.460000e+07' 1082 127 1082 173 c30497_6e5i 1 507 'spec=NOESY, no=525, id=522, vol=2.470000e+07' 1081 127 1081 173 c30497_6e5i 1 508 'spec=NOESY, no=529, id=526, vol=1.940000e+07' 1085 127 1085 173 c30497_6e5i 1 509 'spec=NOESY, no=528, id=525, vol=2.060000e+07' 1084 127 1084 173 c30497_6e5i 1 510 'spec=NOESY, no=530, id=527, vol=1.770000e+07' 1087 127 1087 173 c30497_6e5i 1 511 'spec=NOESY, no=532, id=529, vol=7.510000e+06' 1090 127 1090 173 c30497_6e5i 1 stop_ loop_ _Gen_dist_constraint_conv_err.ID _Gen_dist_constraint_conv_err.Gen_dist_constraint_parse_file_ID _Gen_dist_constraint_conv_err.Parse_file_constraint_ID _Gen_dist_constraint_conv_err.Conv_error_type _Gen_dist_constraint_conv_err.Conv_error_note _Gen_dist_constraint_conv_err.Entry_ID _Gen_dist_constraint_conv_err.Gen_dist_constraint_list_ID 1 2 24 1 "Not handling restraint 24, item 3, resonance(s) ' .27.HN1' (nmrStar names) not linked" c30497_6e5i 1 2 2 44 1 "Not handling restraint 44, item 2, resonance(s) ' .12.HE' (nmrStar names) not linked" c30497_6e5i 1 3 2 44 1 "Not handling restraint 44, item 3, resonance(s) ' .12.HE' (nmrStar names) not linked" c30497_6e5i 1 4 2 53 1 "Not handling restraint 53, item 2, resonance(s) ' .12.HE' (nmrStar names) not linked" c30497_6e5i 1 5 2 53 1 "Not handling restraint 53, item 3, resonance(s) ' .12.HE' (nmrStar names) not linked" c30497_6e5i 1 6 2 62 1 "Not handling restraint 62, item 3, resonance(s) ' .27.HN1' (nmrStar names) not linked" c30497_6e5i 1 7 2 75 1 "Not handling restraint 75, item 4, resonance(s) ' .27.HN1' (nmrStar names) not linked" c30497_6e5i 1 8 2 75 1 "Not handling restraint 75, item 5, resonance(s) ' .27.HN1' (nmrStar names) not linked" c30497_6e5i 1 9 2 80 1 "Not handling restraint 80, item 1, resonance(s) ' .27.HN1' (nmrStar names),' .27.HN2' (nmrStar names) not linked" c30497_6e5i 1 10 2 113 1 "Not handling restraint 113, item 1, resonance(s) ' .12.HE' (nmrStar names) not linked" c30497_6e5i 1 11 2 181 1 "Not handling restraint 181, item 1, resonance(s) ' .12.HE' (nmrStar names) not linked" c30497_6e5i 1 12 2 188 1 "Not handling restraint 188, item 1, resonance(s) ' .12.HE' (nmrStar names) not linked" c30497_6e5i 1 13 2 209 1 "Not handling restraint 209, item 1, resonance(s) ' .12.HE' (nmrStar names) not linked" c30497_6e5i 1 14 2 214 1 "Not handling restraint 214, item 1, resonance(s) ' .12.HE' (nmrStar names) not linked" c30497_6e5i 1 15 2 247 1 "Not handling restraint 247, item 1, resonance(s) ' .27.HN2' (nmrStar names) not linked" c30497_6e5i 1 16 2 259 1 "Not handling restraint 259, item 1, resonance(s) ' .12.HE' (nmrStar names) not linked" c30497_6e5i 1 17 2 338 1 "Not handling restraint 338, item 1, resonance(s) ' .27.HN1' (nmrStar names) not linked" c30497_6e5i 1 18 2 380 1 "Not handling restraint 380, item 1, resonance(s) ' .12.HE' (nmrStar names) not linked" c30497_6e5i 1 19 2 401 1 "Not handling restraint 401, item 1, resonance(s) ' .12.HE' (nmrStar names) not linked" c30497_6e5i 1 20 2 424 1 "Not handling restraint 424, item 1, resonance(s) ' .12.HE' (nmrStar names) not linked" c30497_6e5i 1 21 2 449 1 "Not handling restraint 449, item 1, resonance(s) ' .27.HN2' (nmrStar names) not linked" c30497_6e5i 1 22 2 480 1 "Not handling restraint 480, item 1, resonance(s) ' .27.HN2' (nmrStar names) not linked" c30497_6e5i 1 23 2 497 1 "Not handling restraint 497, item 1, resonance(s) ' .12.HE' (nmrStar names) not linked" c30497_6e5i 1 stop_ save_ save_CNS/XPLOR_distance_constraints_3 _Gen_dist_constraint_list.Sf_category general_distance_constraints _Gen_dist_constraint_list.Sf_framecode CNS/XPLOR_distance_constraints_3 _Gen_dist_constraint_list.Entry_ID c30497_6e5i _Gen_dist_constraint_list.ID 2 _Gen_dist_constraint_list.Constraint_type 'hydrogen bond' _Gen_dist_constraint_list.Details 'Generated by Wattos' _Gen_dist_constraint_list.Constraint_file_ID 1 _Gen_dist_constraint_list.Block_ID 3 loop_ _Gen_dist_constraint_software.Software_ID _Gen_dist_constraint_software.Software_label _Gen_dist_constraint_software.Method_ID _Gen_dist_constraint_software.Method_label _Gen_dist_constraint_software.Entry_ID _Gen_dist_constraint_software.Gen_dist_constraint_list_ID . . . . c30497_6e5i 2 stop_ loop_ _Gen_dist_constraint.ID _Gen_dist_constraint.Member_ID _Gen_dist_constraint.Member_logic_code _Gen_dist_constraint.Assembly_atom_ID_1 _Gen_dist_constraint.Entity_assembly_ID_1 _Gen_dist_constraint.Entity_ID_1 _Gen_dist_constraint.Comp_index_ID_1 _Gen_dist_constraint.Seq_ID_1 _Gen_dist_constraint.Comp_ID_1 _Gen_dist_constraint.Atom_ID_1 _Gen_dist_constraint.Atom_type_1 _Gen_dist_constraint.Atom_isotope_number_1 _Gen_dist_constraint.Resonance_ID_1 _Gen_dist_constraint.Assembly_atom_ID_2 _Gen_dist_constraint.Entity_assembly_ID_2 _Gen_dist_constraint.Entity_ID_2 _Gen_dist_constraint.Comp_index_ID_2 _Gen_dist_constraint.Seq_ID_2 _Gen_dist_constraint.Comp_ID_2 _Gen_dist_constraint.Atom_ID_2 _Gen_dist_constraint.Atom_type_2 _Gen_dist_constraint.Atom_isotope_number_2 _Gen_dist_constraint.Resonance_ID_2 _Gen_dist_constraint.Intensity_val _Gen_dist_constraint.Intensity_lower_val_err _Gen_dist_constraint.Intensity_upper_val_err _Gen_dist_constraint.Distance_val _Gen_dist_constraint.Distance_lower_bound_val _Gen_dist_constraint.Distance_upper_bound_val _Gen_dist_constraint.Contribution_fractional_val _Gen_dist_constraint.Spectral_peak_ID _Gen_dist_constraint.Spectral_peak_list_ID _Gen_dist_constraint.PDB_record_ID_1 _Gen_dist_constraint.PDB_model_num_1 _Gen_dist_constraint.PDB_strand_ID_1 _Gen_dist_constraint.PDB_ins_code_1 _Gen_dist_constraint.PDB_residue_no_1 _Gen_dist_constraint.PDB_residue_name_1 _Gen_dist_constraint.PDB_atom_name_1 _Gen_dist_constraint.PDB_record_ID_2 _Gen_dist_constraint.PDB_model_num_2 _Gen_dist_constraint.PDB_strand_ID_2 _Gen_dist_constraint.PDB_ins_code_2 _Gen_dist_constraint.PDB_residue_no_2 _Gen_dist_constraint.PDB_residue_name_2 _Gen_dist_constraint.PDB_atom_name_2 _Gen_dist_constraint.Auth_entity_assembly_ID_1 _Gen_dist_constraint.Auth_asym_ID_1 _Gen_dist_constraint.Auth_chain_ID_1 _Gen_dist_constraint.Auth_seq_ID_1 _Gen_dist_constraint.Auth_comp_ID_1 _Gen_dist_constraint.Auth_atom_ID_1 _Gen_dist_constraint.Auth_alt_ID_1 _Gen_dist_constraint.Auth_atom_name_1 _Gen_dist_constraint.Auth_entity_assembly_ID_2 _Gen_dist_constraint.Auth_asym_ID_2 _Gen_dist_constraint.Auth_chain_ID_2 _Gen_dist_constraint.Auth_seq_ID_2 _Gen_dist_constraint.Auth_comp_ID_2 _Gen_dist_constraint.Auth_atom_ID_2 _Gen_dist_constraint.Auth_alt_ID_2 _Gen_dist_constraint.Auth_atom_name_2 _Gen_dist_constraint.Entry_ID _Gen_dist_constraint.Gen_dist_constraint_list_ID 1 1 . . 1 1 6 6 GLU H H . . . 1 1 2 2 ASP O O . . . . . 1.9 1.8 2.0 . . . . . A . 6 GLU H . . A . 2 ASP O . . . 6 . HN . . . . . 2 . O . . c30497_6e5i 2 2 1 . . 1 1 2 2 ASP O O . . . 1 1 6 6 GLU N N . . . . . 2.9 2.7 3.1 . . . . . A . 2 ASP O . . A . 6 GLU N . . . 2 . O . . . . . 6 . N . . c30497_6e5i 2 3 1 . . 1 1 7 7 LEU H H . . . 1 1 3 3 LYS O O . . . . . 1.9 1.8 2.0 . . . . . A . 7 LEU H . . A . 3 LYS O . . . 7 . HN . . . . . 3 . O . . c30497_6e5i 2 4 1 . . 1 1 3 3 LYS O O . . . 1 1 7 7 LEU N N . . . . . 2.9 2.7 3.1 . . . . . A . 3 LYS O . . A . 7 LEU N . . . 3 . O . . . . . 7 . N . . c30497_6e5i 2 5 1 . . 1 1 8 8 LYS H H . . . 1 1 4 4 CYS O O . . . . . 1.9 1.8 2.0 . . . . . A . 8 LYS H . . A . 4 CYS O . . . 8 . HN . . . . . 4 . O . . c30497_6e5i 2 6 1 . . 1 1 4 4 CYS O O . . . 1 1 8 8 LYS N N . . . . . 2.9 2.7 3.1 . . . . . A . 4 CYS O . . A . 8 LYS N . . . 4 . O . . . . . 8 . N . . c30497_6e5i 2 7 1 . . 1 1 9 9 LYS H H . . . 1 1 5 5 LYS O O . . . . . 1.9 1.8 2.0 . . . . . A . 9 LYS H . . A . 5 LYS O . . . 9 . HN . . . . . 5 . O . . c30497_6e5i 2 8 1 . . 1 1 5 5 LYS O O . . . 1 1 9 9 LYS N N . . . . . 2.9 2.7 3.1 . . . . . A . 5 LYS O . . A . 9 LYS N . . . 5 . O . . . . . 9 . N . . c30497_6e5i 2 9 1 . . 1 1 10 10 ARG H H . . . 1 1 6 6 GLU O O . . . . . 1.9 1.8 2.0 . . . . . A . 10 ARG H . . A . 6 GLU O . . . 10 . HN . . . . . 6 . O . . c30497_6e5i 2 10 1 . . 1 1 6 6 GLU O O . . . 1 1 10 10 ARG N N . . . . . 2.9 2.7 3.1 . . . . . A . 6 GLU O . . A . 10 ARG N . . . 6 . O . . . . . 10 . N . . c30497_6e5i 2 11 1 . . 1 1 13 13 CYS H H . . . 1 1 11 11 TYR O O . . . . . 1.9 1.8 2.0 . . . . . A . 13 CYS H . . A . 11 TYR O . . . 13 . HN . . . . . 11 . O . . c30497_6e5i 2 12 1 . . 1 1 11 11 TYR O O . . . 1 1 13 13 CYS N N . . . . . 2.9 2.7 3.1 . . . . . A . 11 TYR O . . A . 13 CYS N . . . 11 . O . . . . . 13 . N . . c30497_6e5i 2 13 1 . . 1 1 21 21 ARG H H . . . 1 1 18 18 ASP O O . . . . . 1.9 1.8 2.0 . . . . . A . 21 ARG H . . A . 18 ASP O . . . 21 . HN . . . . . 18 . O . . c30497_6e5i 2 14 1 . . 1 1 18 18 ASP O O . . . 1 1 21 21 ARG N N . . . . . 2.9 2.7 3.1 . . . . . A . 18 ASP O . . A . 21 ARG N . . . 18 . O . . . . . 21 . N . . c30497_6e5i 2 15 1 . . 1 1 18 18 ASP H H . . . 1 1 21 21 ARG O O . . . . . 1.9 1.8 2.0 . . . . . A . 18 ASP H . . A . 21 ARG O . . . 18 . HN . . . . . 21 . O . . c30497_6e5i 2 16 1 . . 1 1 21 21 ARG O O . . . 1 1 18 18 ASP N N . . . . . 2.9 2.7 3.1 . . . . . A . 21 ARG O . . A . 18 ASP N . . . 21 . O . . . . . 18 . N . . c30497_6e5i 2 17 1 . . 1 1 23 23 GLU H H . . . 1 1 16 16 ARG O O . . . . . 1.9 1.8 2.0 . . . . . A . 23 GLU H . . A . 16 ARG O . . . 23 . HN . . . . . 16 . O . . c30497_6e5i 2 18 1 . . 1 1 16 16 ARG O O . . . 1 1 23 23 GLU N N . . . . . 2.9 2.7 3.1 . . . . . A . 16 ARG O . . A . 23 GLU N . . . 16 . O . . . . . 23 . N . . c30497_6e5i 2 19 1 . . 1 1 16 16 ARG H H . . . 1 1 23 23 GLU O O . . . . . 1.9 1.8 2.0 . . . . . A . 16 ARG H . . A . 23 GLU O . . . 16 . HN . . . . . 23 . O . . c30497_6e5i 2 20 1 . . 1 1 23 23 GLU O O . . . 1 1 16 16 ARG N N . . . . . 2.9 2.7 3.1 . . . . . A . 23 GLU O . . A . 16 ARG N . . . 23 . O . . . . . 16 . N . . c30497_6e5i 2 21 1 . . 1 1 25 25 HIS H H . . . 1 1 14 14 GLU O O . . . . . 1.9 1.8 2.0 . . . . . A . 25 HIS H . . A . 14 GLU O . . . 25 . HN . . . . . 14 . O . . c30497_6e5i 2 22 1 . . 1 1 14 14 GLU O O . . . 1 1 25 25 HIS N N . . . . . 2.9 2.7 3.1 . . . . . A . 14 GLU O . . A . 25 HIS N . . . 14 . O . . . . . 25 . N . . c30497_6e5i 2 23 1 . . 1 1 14 14 GLU H H . . . 1 1 25 25 HIS O O . . . . . 1.9 1.8 2.0 . . . . . A . 14 GLU H . . A . 25 HIS O . . . 14 . HN . . . . . 25 . O . . c30497_6e5i 2 24 1 . . 1 1 25 25 HIS O O . . . 1 1 14 14 GLU N N . . . . . 2.9 2.7 3.1 . . . . . A . 25 HIS O . . A . 14 GLU N . . . 25 . O . . . . . 14 . N . . c30497_6e5i 2 stop_ loop_ _Gen_dist_constraint_comment_org.ID _Gen_dist_constraint_comment_org.Comment_text _Gen_dist_constraint_comment_org.Comment_begin_line _Gen_dist_constraint_comment_org.Comment_begin_column _Gen_dist_constraint_comment_org.Comment_end_line _Gen_dist_constraint_comment_org.Comment_end_column _Gen_dist_constraint_comment_org.Entry_ID _Gen_dist_constraint_comment_org.Gen_dist_constraint_list_ID 1 helix 2 1 2 7 c30497_6e5i 2 2 turn 13 1 13 6 c30497_6e5i 2 3 hairpin 16 1 16 9 c30497_6e5i 2 stop_ loop_ _Gen_dist_constraint_parse_err.ID _Gen_dist_constraint_parse_err.Content _Gen_dist_constraint_parse_err.Begin_line _Gen_dist_constraint_parse_err.Begin_column _Gen_dist_constraint_parse_err.End_line _Gen_dist_constraint_parse_err.End_column _Gen_dist_constraint_parse_err.Entry_ID _Gen_dist_constraint_parse_err.Gen_dist_constraint_list_ID 1 '# Restraints file 3: wsh2005_hbonds_v2.tbl' 1 1 1 42 c30497_6e5i 2 stop_ save_ save_CNS/XPLOR_dihedral_4 _Torsion_angle_constraint_list.Sf_category torsion_angle_constraints _Torsion_angle_constraint_list.Sf_framecode CNS/XPLOR_dihedral_4 _Torsion_angle_constraint_list.Entry_ID c30497_6e5i _Torsion_angle_constraint_list.ID 1 _Torsion_angle_constraint_list.Details 'Generated by Wattos' _Torsion_angle_constraint_list.Constraint_file_ID 1 _Torsion_angle_constraint_list.Block_ID 4 loop_ _Torsion_angle_constraint_software.Software_ID _Torsion_angle_constraint_software.Software_label _Torsion_angle_constraint_software.Method_ID _Torsion_angle_constraint_software.Method_label _Torsion_angle_constraint_software.Entry_ID _Torsion_angle_constraint_software.Torsion_angle_constraint_list_ID . . . . c30497_6e5i 1 stop_ loop_ _Torsion_angle_constraint.ID _Torsion_angle_constraint.Torsion_angle_name _Torsion_angle_constraint.Assembly_atom_ID_1 _Torsion_angle_constraint.Entity_assembly_ID_1 _Torsion_angle_constraint.Entity_ID_1 _Torsion_angle_constraint.Comp_index_ID_1 _Torsion_angle_constraint.Seq_ID_1 _Torsion_angle_constraint.Comp_ID_1 _Torsion_angle_constraint.Atom_ID_1 _Torsion_angle_constraint.Atom_type_1 _Torsion_angle_constraint.Resonance_ID_1 _Torsion_angle_constraint.Assembly_atom_ID_2 _Torsion_angle_constraint.Entity_assembly_ID_2 _Torsion_angle_constraint.Entity_ID_2 _Torsion_angle_constraint.Comp_index_ID_2 _Torsion_angle_constraint.Seq_ID_2 _Torsion_angle_constraint.Comp_ID_2 _Torsion_angle_constraint.Atom_ID_2 _Torsion_angle_constraint.Atom_type_2 _Torsion_angle_constraint.Resonance_ID_2 _Torsion_angle_constraint.Assembly_atom_ID_3 _Torsion_angle_constraint.Entity_assembly_ID_3 _Torsion_angle_constraint.Entity_ID_3 _Torsion_angle_constraint.Comp_index_ID_3 _Torsion_angle_constraint.Seq_ID_3 _Torsion_angle_constraint.Comp_ID_3 _Torsion_angle_constraint.Atom_ID_3 _Torsion_angle_constraint.Atom_type_3 _Torsion_angle_constraint.Resonance_ID_3 _Torsion_angle_constraint.Assembly_atom_ID_4 _Torsion_angle_constraint.Entity_assembly_ID_4 _Torsion_angle_constraint.Entity_ID_4 _Torsion_angle_constraint.Comp_index_ID_4 _Torsion_angle_constraint.Seq_ID_4 _Torsion_angle_constraint.Comp_ID_4 _Torsion_angle_constraint.Atom_ID_4 _Torsion_angle_constraint.Atom_type_4 _Torsion_angle_constraint.Resonance_ID_4 _Torsion_angle_constraint.Angle_lower_bound_val _Torsion_angle_constraint.Angle_upper_bound_val _Torsion_angle_constraint.Source_experiment_ID _Torsion_angle_constraint.PDB_record_ID_1 _Torsion_angle_constraint.PDB_model_num_1 _Torsion_angle_constraint.PDB_strand_ID_1 _Torsion_angle_constraint.PDB_ins_code_1 _Torsion_angle_constraint.PDB_residue_no_1 _Torsion_angle_constraint.PDB_residue_name_1 _Torsion_angle_constraint.PDB_atom_name_1 _Torsion_angle_constraint.PDB_record_ID_2 _Torsion_angle_constraint.PDB_model_num_2 _Torsion_angle_constraint.PDB_strand_ID_2 _Torsion_angle_constraint.PDB_ins_code_2 _Torsion_angle_constraint.PDB_residue_no_2 _Torsion_angle_constraint.PDB_residue_name_2 _Torsion_angle_constraint.PDB_atom_name_2 _Torsion_angle_constraint.PDB_record_ID_3 _Torsion_angle_constraint.PDB_model_num_3 _Torsion_angle_constraint.PDB_strand_ID_3 _Torsion_angle_constraint.PDB_ins_code_3 _Torsion_angle_constraint.PDB_residue_no_3 _Torsion_angle_constraint.PDB_residue_name_3 _Torsion_angle_constraint.PDB_atom_name_3 _Torsion_angle_constraint.PDB_record_ID_4 _Torsion_angle_constraint.PDB_model_num_4 _Torsion_angle_constraint.PDB_strand_ID_4 _Torsion_angle_constraint.PDB_ins_code_4 _Torsion_angle_constraint.PDB_residue_no_4 _Torsion_angle_constraint.PDB_residue_name_4 _Torsion_angle_constraint.PDB_atom_name_4 _Torsion_angle_constraint.Auth_entity_assembly_ID_1 _Torsion_angle_constraint.Auth_asym_ID_1 _Torsion_angle_constraint.Auth_chain_ID_1 _Torsion_angle_constraint.Auth_seq_ID_1 _Torsion_angle_constraint.Auth_comp_ID_1 _Torsion_angle_constraint.Auth_atom_ID_1 _Torsion_angle_constraint.Auth_alt_ID_1 _Torsion_angle_constraint.Auth_atom_name_1 _Torsion_angle_constraint.Auth_entity_assembly_ID_2 _Torsion_angle_constraint.Auth_asym_ID_2 _Torsion_angle_constraint.Auth_chain_ID_2 _Torsion_angle_constraint.Auth_seq_ID_2 _Torsion_angle_constraint.Auth_comp_ID_2 _Torsion_angle_constraint.Auth_atom_ID_2 _Torsion_angle_constraint.Auth_alt_ID_2 _Torsion_angle_constraint.Auth_atom_name_2 _Torsion_angle_constraint.Auth_entity_assembly_ID_3 _Torsion_angle_constraint.Auth_asym_ID_3 _Torsion_angle_constraint.Auth_chain_ID_3 _Torsion_angle_constraint.Auth_seq_ID_3 _Torsion_angle_constraint.Auth_comp_ID_3 _Torsion_angle_constraint.Auth_atom_ID_3 _Torsion_angle_constraint.Auth_alt_ID_3 _Torsion_angle_constraint.Auth_atom_name_3 _Torsion_angle_constraint.Auth_entity_assembly_ID_4 _Torsion_angle_constraint.Auth_asym_ID_4 _Torsion_angle_constraint.Auth_chain_ID_4 _Torsion_angle_constraint.Auth_seq_ID_4 _Torsion_angle_constraint.Auth_comp_ID_4 _Torsion_angle_constraint.Auth_atom_ID_4 _Torsion_angle_constraint.Auth_alt_ID_4 _Torsion_angle_constraint.Auth_atom_name_4 _Torsion_angle_constraint.Entry_ID _Torsion_angle_constraint.Torsion_angle_constraint_list_ID 1 . . 1 1 1 1 ASN C C . . 1 1 2 2 ASP N N . . 1 1 2 2 ASP CA C . . 1 1 2 2 ASP C C . -90.0 -40.0 . . . A . 1 ASN C . . A . 2 ASP N . . A . 2 ASP CA . . A . 2 ASP C . . . 1 . C . . . . . 2 . N . . . . . 2 . CA . . . . . 2 . C . . c30497_6e5i 1 2 . . 1 1 2 2 ASP C C . . 1 1 3 3 LYS N N . . 1 1 3 3 LYS CA C . . 1 1 3 3 LYS C C . -90.0 -40.0 . . . A . 2 ASP C . . A . 3 LYS N . . A . 3 LYS CA . . A . 3 LYS C . . . 2 . C . . . . . 3 . N . . . . . 3 . CA . . . . . 3 . C . . c30497_6e5i 1 3 . . 1 1 3 3 LYS C C . . 1 1 4 4 CYS N N . . 1 1 4 4 CYS CA C . . 1 1 4 4 CYS C C . -90.0 -40.0 . . . A . 3 LYS C . . A . 4 CYS N . . A . 4 CYS CA . . A . 4 CYS C . . . 3 . C . . . . . 4 . N . . . . . 4 . CA . . . . . 4 . C . . c30497_6e5i 1 4 . . 1 1 4 4 CYS C C . . 1 1 5 5 LYS N N . . 1 1 5 5 LYS CA C . . 1 1 5 5 LYS C C . -90.0 -40.0 . . . A . 4 CYS C . . A . 5 LYS N . . A . 5 LYS CA . . A . 5 LYS C . . . 4 . C . . . . . 5 . N . . . . . 5 . CA . . . . . 5 . C . . c30497_6e5i 1 5 . . 1 1 5 5 LYS C C . . 1 1 6 6 GLU N N . . 1 1 6 6 GLU CA C . . 1 1 6 6 GLU C C . -90.0 -40.0 . . . A . 5 LYS C . . A . 6 GLU N . . A . 6 GLU CA . . A . 6 GLU C . . . 5 . C . . . . . 6 . N . . . . . 6 . CA . . . . . 6 . C . . c30497_6e5i 1 6 . . 1 1 6 6 GLU C C . . 1 1 7 7 LEU N N . . 1 1 7 7 LEU CA C . . 1 1 7 7 LEU C C . -90.0 -40.0 . . . A . 6 GLU C . . A . 7 LEU N . . A . 7 LEU CA . . A . 7 LEU C . . . 6 . C . . . . . 7 . N . . . . . 7 . CA . . . . . 7 . C . . c30497_6e5i 1 7 . . 1 1 7 7 LEU C C . . 1 1 8 8 LYS N N . . 1 1 8 8 LYS CA C . . 1 1 8 8 LYS C C . -90.0 -40.0 . . . A . 7 LEU C . . A . 8 LYS N . . A . 8 LYS CA . . A . 8 LYS C . . . 7 . C . . . . . 8 . N . . . . . 8 . CA . . . . . 8 . C . . c30497_6e5i 1 8 . . 1 1 13 13 CYS C C . . 1 1 14 14 GLU N N . . 1 1 14 14 GLU CA C . . 1 1 14 14 GLU C C . -160.0 -80.0 . . . A . 13 CYS C . . A . 14 GLU N . . A . 14 GLU CA . . A . 14 GLU C . . . 13 . C . . . . . 14 . N . . . . . 14 . CA . . . . . 14 . C . . c30497_6e5i 1 9 . . 1 1 14 14 GLU C C . . 1 1 15 15 VAL N N . . 1 1 15 15 VAL CA C . . 1 1 15 15 VAL C C . -160.0 -80.0 . . . A . 14 GLU C . . A . 15 VAL N . . A . 15 VAL CA . . A . 15 VAL C . . . 14 . C . . . . . 15 . N . . . . . 15 . CA . . . . . 15 . C . . c30497_6e5i 1 10 . . 1 1 15 15 VAL C C . . 1 1 16 16 ARG N N . . 1 1 16 16 ARG CA C . . 1 1 16 16 ARG C C . -160.0 -80.0 . . . A . 15 VAL C . . A . 16 ARG N . . A . 16 ARG CA . . A . 16 ARG C . . . 15 . C . . . . . 16 . N . . . . . 16 . CA . . . . . 16 . C . . c30497_6e5i 1 11 . . 1 1 16 16 ARG C C . . 1 1 17 17 CYS N N . . 1 1 17 17 CYS CA C . . 1 1 17 17 CYS C C . -160.0 -80.0 . . . A . 16 ARG C . . A . 17 CYS N . . A . 17 CYS CA . . A . 17 CYS C . . . 16 . C . . . . . 17 . N . . . . . 17 . CA . . . . . 17 . C . . c30497_6e5i 1 12 . . 1 1 17 17 CYS C C . . 1 1 18 18 ASP N N . . 1 1 18 18 ASP CA C . . 1 1 18 18 ASP C C . -160.0 -80.0 . . . A . 17 CYS C . . A . 18 ASP N . . A . 18 ASP CA . . A . 18 ASP C . . . 17 . C . . . . . 18 . N . . . . . 18 . CA . . . . . 18 . C . . c30497_6e5i 1 13 . . 1 1 21 21 ARG C C . . 1 1 22 22 TYR N N . . 1 1 22 22 TYR CA C . . 1 1 22 22 TYR C C . -160.0 -80.0 . . . A . 21 ARG C . . A . 22 TYR N . . A . 22 TYR CA . . A . 22 TYR C . . . 21 . C . . . . . 22 . N . . . . . 22 . CA . . . . . 22 . C . . c30497_6e5i 1 14 . . 1 1 22 22 TYR C C . . 1 1 23 23 GLU N N . . 1 1 23 23 GLU CA C . . 1 1 23 23 GLU C C . -160.0 -80.0 . . . A . 22 TYR C . . A . 23 GLU N . . A . 23 GLU CA . . A . 23 GLU C . . . 22 . C . . . . . 23 . N . . . . . 23 . CA . . . . . 23 . C . . c30497_6e5i 1 15 . . 1 1 23 23 GLU C C . . 1 1 24 24 VAL N N . . 1 1 24 24 VAL CA C . . 1 1 24 24 VAL C C . -160.0 -80.0 . . . A . 23 GLU C . . A . 24 VAL N . . A . 24 VAL CA . . A . 24 VAL C . . . 23 . C . . . . . 24 . N . . . . . 24 . CA . . . . . 24 . C . . c30497_6e5i 1 16 . . 1 1 25 25 HIS C C . . 1 1 26 26 CYS N N . . 1 1 26 26 CYS CA C . . 1 1 26 26 CYS C C . -160.0 -80.0 . . . A . 25 HIS C . . A . 26 CYS N . . A . 26 CYS CA . . A . 26 CYS C . . . 25 . C . . . . . 26 . N . . . . . 26 . CA . . . . . 26 . C . . c30497_6e5i 1 stop_ loop_ _TA_constraint_parse_err.ID _TA_constraint_parse_err.Content _TA_constraint_parse_err.Begin_line _TA_constraint_parse_err.Begin_column _TA_constraint_parse_err.End_line _TA_constraint_parse_err.End_column _TA_constraint_parse_err.Entry_ID _TA_constraint_parse_err.Torsion_angle_constraint_list_ID 1 '# Restraints file 4: wsh2005_dihedrals.tbl' 1 1 1 42 c30497_6e5i 1 stop_ loop_ _TA_constraint_comment_org.ID _TA_constraint_comment_org.Comment_text _TA_constraint_comment_org.Comment_begin_line _TA_constraint_comment_org.Comment_begin_column _TA_constraint_comment_org.Comment_end_line _TA_constraint_comment_org.Comment_end_column _TA_constraint_comment_org.Entry_ID _TA_constraint_comment_org.Torsion_angle_constraint_list_ID 1 ; Phi angle constraints D2 ; 2 1 3 4 c30497_6e5i 1 2 K3 6 1 6 4 c30497_6e5i 1 3 C4 9 1 9 4 c30497_6e5i 1 4 K5 12 1 12 4 c30497_6e5i 1 5 E6 15 1 15 4 c30497_6e5i 1 6 L7 18 1 18 4 c30497_6e5i 1 7 K8 21 1 21 4 c30497_6e5i 1 8 C14 25 1 25 5 c30497_6e5i 1 9 E15 28 1 28 5 c30497_6e5i 1 10 V16 31 1 31 5 c30497_6e5i 1 11 R17 34 1 34 5 c30497_6e5i 1 12 C18 37 1 37 5 c30497_6e5i 1 13 R22 40 1 40 5 c30497_6e5i 1 14 Y23 43 1 43 5 c30497_6e5i 1 15 E24 46 1 46 5 c30497_6e5i 1 16 H26 49 1 49 5 c30497_6e5i 1 17 C27 52 1 52 5 c30497_6e5i 1 stop_ loop_ _TA_constraint_conv_err.ID _TA_constraint_conv_err.Parse_file_ID _TA_constraint_conv_err.Parse_file_constraint_ID _TA_constraint_conv_err.Conv_error_type _TA_constraint_conv_err.Conv_error_note _TA_constraint_conv_err.Entry_ID _TA_constraint_conv_err.Torsion_angle_constraint_list_ID 1 4 17 1 "Not handling restraint 17, resonance(s) ' .27.CA' (nmrStar names),' .27.C' (nmrStar names) not linked" c30497_6e5i 1 stop_ save_ save_MR_file_comment_1 _Org_constr_file_comment.Sf_framecode MR_file_comment_1 _Org_constr_file_comment.Sf_category org_constr_file_comment _Org_constr_file_comment.Entry_ID c30497_6e5i _Org_constr_file_comment.ID 1 _Org_constr_file_comment.Constraint_file_ID 1 _Org_constr_file_comment.Block_ID 1 _Org_constr_file_comment.Details 'Generated by Wattos' _Org_constr_file_comment.Comment '*HEADER DE NOVO PROTEIN 20-JUL-18 6E5I *TITLE HETEROGENEOUS-BACKBONE MIMICS OF A DESIGNED DISULFIDE-RICH PROTEIN: *TITLE 2 ORN TURN *COMPND MOL_ID: 1; *COMPND 2 MOLECULE: DESIGNED PEPTIDE NC_HEE_D1: ORN TURN MUTANT; *COMPND 3 CHAIN: A; *COMPND 4 ENGINEERED: YES *SOURCE MOL_ID: 1; *SOURCE 2 SYNTHETIC: YES; *SOURCE 3 ORGANISM_SCIENTIFIC: SYNTHETIC CONSTRUCT; *SOURCE 4 ORGANISM_TAXID: 32630 *KEYWDS HETEROGENEOUS BACKBONE FOLDAMER, DE NOVO PROTEIN *EXPDTA SOLUTION NMR *NUMMDL 10 *AUTHOR C.C.CABALTEJA,D.S.MIHALKO,W.S.HORNE *REVDAT 1 21-NOV-18 6E5I 0' save_