data_c30225_5ug3 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID c30225_5ug3 _Entry.Title ; NMR SOLUTION STRUCTURE OF ALPHA-CONOTOXIN GID MUTANT A10V ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2017-01-06 _Entry.Accession_date 2017-01-06 _Entry.Last_release_date 2017-02-03 _Entry.Original_release_date 2017-02-03 _Entry.Origination author _Entry.NMR_STAR_version 3.1.2.6 _Entry.Original_NMR_STAR_version 3.1.2.6 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype SOLUTION _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.ORCID _Entry_author.Entry_ID 1 A. Hussein A. K. . . c30225_5ug3 2 A. Leffler A. E. . . c30225_5ug3 3 H. Zebroski H. A. . . c30225_5ug3 4 S. Powell S. R. . . c30225_5ug3 5 A. Kuryatov A. . . . c30225_5ug3 6 P. Filipenko P. . . . c30225_5ug3 7 J. Gorson J. . . . c30225_5ug3 8 A. Heizmann A. . . . c30225_5ug3 9 S. Lyskov S. . . . c30225_5ug3 10 A. Nicke A. . . . c30225_5ug3 11 J. Lindstrom J. . . . c30225_5ug3 12 B. Rudy B. . . . c30225_5ug3 13 R. Bonneau R. . . . c30225_5ug3 14 M. Holford M. . . . c30225_5ug3 15 S. Poget S. F. . . c30225_5ug3 stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID Neurotoxin . c30225_5ug3 TOXIN . c30225_5ug3 'neuronal nicotinic acetylcholine receptors' . c30225_5ug3 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 c30225_5ug3 spectral_peak_list 2 c30225_5ug3 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 36 c30225_5ug3 '1H chemical shifts' 114 c30225_5ug3 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 1 . . 2017-08-31 . original BMRB . c30225_5ug3 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID BMRB 30226 'NMR SOLUTION STRUCTURE OF THE ALPHA-CONOTOXIN GID MUTANT V13Y' c30225_5ug3 PDB 5UG3 'BMRB Entry Tracking System' c30225_5ug3 stop_ save_ ############### # Citations # ############### save_citation_1 _Citation.Sf_category citations _Citation.Sf_framecode citation_1 _Citation.Entry_ID c30225_5ug3 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID . _Citation.Full_citation . _Citation.Title ; Peptide Ligand Discovery from an Ion Channel Homology Model ; _Citation.Status 'in preparation' _Citation.Type journal _Citation.Journal_abbrev . _Citation.Journal_name_full . _Citation.Journal_volume . _Citation.Journal_issue . _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD 0353 _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first . _Citation.Page_last . _Citation.Year . _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.ORCID _Citation_author.Entry_ID _Citation_author.Citation_ID 1 A. Hussein A. K. . . c30225_5ug3 1 2 A. Leffler A. E. . . c30225_5ug3 1 3 H. Zebroski H. A. . . c30225_5ug3 1 4 S. Powell S. R. . . c30225_5ug3 1 5 A. Kuryatov A. . . . c30225_5ug3 1 6 P. Filipenko P. . . . c30225_5ug3 1 7 J. Gorson J. . . . c30225_5ug3 1 8 A. Heizmann A. . . . c30225_5ug3 1 9 S. Lyskov S. . . . c30225_5ug3 1 10 A. Nicke A. . . . c30225_5ug3 1 11 J. Lindstrom J. . . . c30225_5ug3 1 12 B. Rudy B. . . . c30225_5ug3 1 13 R. Bonneau R. . . . c30225_5ug3 1 14 M. Holford M. . . . c30225_5ug3 1 15 S. Poget S. F. . . c30225_5ug3 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID c30225_5ug3 _Assembly.ID 1 _Assembly.Name 'Alpha-conotoxin GID' _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 . . . . . . c30225_5ug3 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID c30225_5ug3 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name 'Alpha-conotoxin GID' _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 ; IRDECCSNPVCRVNNPHVC ; _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 19 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state . _Entity.Src_method syn _Entity.Parent_entity_ID 1 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 2177.489 _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 1 ILE . c30225_5ug3 1 2 2 ARG . c30225_5ug3 1 3 3 ASP . c30225_5ug3 1 4 4 GLU . c30225_5ug3 1 5 5 CYS . c30225_5ug3 1 6 6 CYS . c30225_5ug3 1 7 7 SER . c30225_5ug3 1 8 8 ASN . c30225_5ug3 1 9 9 PRO . c30225_5ug3 1 10 10 VAL . c30225_5ug3 1 11 11 CYS . c30225_5ug3 1 12 12 ARG . c30225_5ug3 1 13 13 VAL . c30225_5ug3 1 14 14 ASN . c30225_5ug3 1 15 15 ASN . c30225_5ug3 1 16 16 HYP . c30225_5ug3 1 17 17 HIS . c30225_5ug3 1 18 18 VAL . c30225_5ug3 1 19 19 CYS . c30225_5ug3 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 . ILE 1 1 c30225_5ug3 1 . ARG 2 2 c30225_5ug3 1 . ASP 3 3 c30225_5ug3 1 . GLU 4 4 c30225_5ug3 1 . CYS 5 5 c30225_5ug3 1 . CYS 6 6 c30225_5ug3 1 . SER 7 7 c30225_5ug3 1 . ASN 8 8 c30225_5ug3 1 . PRO 9 9 c30225_5ug3 1 . VAL 10 10 c30225_5ug3 1 . CYS 11 11 c30225_5ug3 1 . ARG 12 12 c30225_5ug3 1 . VAL 13 13 c30225_5ug3 1 . ASN 14 14 c30225_5ug3 1 . ASN 15 15 c30225_5ug3 1 . HYP 16 16 c30225_5ug3 1 . HIS 17 17 c30225_5ug3 1 . VAL 18 18 c30225_5ug3 1 . CYS 19 19 c30225_5ug3 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 c30225_5ug3 _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 . 6491 organism . 'Conus geographus' 'Geography cone' . . Eukaryota Metazoa Conus geographus . . . . . . . . . . . . . c30225_5ug3 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 c30225_5ug3 _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' . . . . . . . . . . . . . . . . c30225_5ug3 1 stop_ save_ ################################# # Polymer residues and ligands # ################################# save_chem_comp_HYP _Chem_comp.Sf_category chem_comp _Chem_comp.Sf_framecode chem_comp_HYP _Chem_comp.Entry_ID c30225_5ug3 _Chem_comp.ID HYP _Chem_comp.Provenance PDB _Chem_comp.Name 4-HYDROXYPROLINE _Chem_comp.Type 'L-PEPTIDE LINKING' _Chem_comp.BMRB_code HYP _Chem_comp.PDB_code HYP _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 HYP _Chem_comp.Number_atoms_all 18 _Chem_comp.Number_atoms_nh 9 _Chem_comp.PubChem_code . _Chem_comp.Subcomponent_list . _Chem_comp.InCHi_code InChI=1S/C5H9NO3/c7-3-1-4(5(8)9)6-2-3/h3-4,6-7H,1-2H2,(H,8,9)/t3-,4+/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 PRO _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 HYDROXYPROLINE _Chem_comp.Formal_charge 0 _Chem_comp.Paramagnetic . _Chem_comp.Aromatic no _Chem_comp.Formula 'C5 H9 N O3' _Chem_comp.Formula_weight 131.130 _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 no _Chem_comp.Ideal_coordinates_details Corina _Chem_comp.Ideal_coordinates_missing_flag no _Chem_comp.Model_coordinates_db_code . _Chem_comp.Processing_site PDBJ _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 C1C(CNC1C(=O)O)O SMILES 'OpenEye OEToolkits' 1.5.0 c30225_5ug3 HYP C1[C@H](CN[C@@H]1C(=O)O)O SMILES_CANONICAL 'OpenEye OEToolkits' 1.5.0 c30225_5ug3 HYP InChI=1S/C5H9NO3/c7-3-1-4(5(8)9)6-2-3/h3-4,6-7H,1-2H2,(H,8,9)/t3-,4+/m1/s1 InChI InChI 1.03 c30225_5ug3 HYP O=C(O)C1NCC(O)C1 SMILES ACDLabs 10.04 c30225_5ug3 HYP O[C@H]1CN[C@@H](C1)C(O)=O SMILES_CANONICAL CACTVS 3.341 c30225_5ug3 HYP O[CH]1CN[CH](C1)C(O)=O SMILES CACTVS 3.341 c30225_5ug3 HYP PMMYEEVYMWASQN-DMTCNVIQSA-N InChIKey InChI 1.03 c30225_5ug3 HYP 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,4R)-4-hydroxypyrrolidine-2-carboxylic acid' 'SYSTEMATIC NAME' 'OpenEye OEToolkits' 1.5.0 c30225_5ug3 HYP (4R)-4-hydroxy-L-proline 'SYSTEMATIC NAME' ACDLabs 10.04 c30225_5ug3 HYP 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 . . . . -3.366 . 16.585 . 44.188 . 0.168 1.360 -0.282 1 . c30225_5ug3 HYP CA CA CA CA . C . . S 0 . . . 1 no no . . . . -2.955 . 15.768 . 43.044 . -0.384 -0.003 -0.493 2 . c30225_5ug3 HYP C C C C . C . . N 0 . . . 1 no no . . . . -1.447 . 15.609 . 43.030 . -1.811 -0.072 -0.013 3 . c30225_5ug3 HYP O O O O . O . . N 0 . . . 1 no no . . . . -0.722 . 16.484 . 43.503 . -2.233 0.764 0.750 4 . c30225_5ug3 HYP CB CB CB CB . C . . N 0 . . . 1 no no . . . . -3.408 . 16.578 . 41.829 . 0.515 -0.924 0.359 5 . c30225_5ug3 HYP CG CG CG CG . C . . R 0 . . . 1 no no . . . . -4.437 . 17.482 . 42.330 . 1.847 -0.159 0.505 6 . c30225_5ug3 HYP CD CD CD CD . C . . N 0 . . . 1 no no . . . . -4.068 . 17.803 . 43.753 . 1.640 1.159 -0.271 7 . c30225_5ug3 HYP OD1 OD1 OD1 OD . O . . N 0 . . . 1 no no . . . . -5.693 . 16.815 . 42.294 . 2.917 -0.911 -0.071 8 . c30225_5ug3 HYP OXT OXT OXT OXT . O . . N 0 . . . 1 no yes . . . . -0.976 . 14.502 . 42.469 . -2.614 -1.063 -0.433 9 . c30225_5ug3 HYP H H H H . H . . N 0 . . . 1 no yes . . . . -3.980 . 16.047 . 44.765 . -0.107 1.981 -1.028 10 . c30225_5ug3 HYP HA HA HA HA . H . . N 0 . . . 1 no no . . . . -3.385 . 14.756 . 43.068 . -0.325 -0.278 -1.546 11 . c30225_5ug3 HYP HB2 HB2 HB2 1HB . H . . N 0 . . . 1 no no . . . . -2.567 . 17.141 . 41.398 . 0.066 -1.092 1.337 12 . c30225_5ug3 HYP HB3 HB3 HB3 2HB . H . . N 0 . . . 1 no no . . . . -3.790 . 15.930 . 41.026 . 0.678 -1.873 -0.153 13 . c30225_5ug3 HYP HG HG HG HG . H . . N 0 . . . 1 no no . . . . -4.508 . 18.399 . 41.726 . 2.052 0.048 1.555 14 . c30225_5ug3 HYP HD22 HD22 HD22 1HD . H . . N 0 . . . 0 no no . . . . -4.956 . 18.005 . 44.370 . 2.018 1.065 -1.289 15 . c30225_5ug3 HYP HD23 HD23 HD23 2HD . H . . N 0 . . . 0 no no . . . . -3.457 . 18.713 . 43.848 . 2.132 1.985 0.243 16 . c30225_5ug3 HYP HD1 HD1 HD1 HOD . H . . N 0 . . . 1 no no . . . . -5.999 . 16.666 . 43.181 . 3.780 -0.479 -0.009 17 . c30225_5ug3 HYP HXT HXT HXT HXT . H . . N 0 . . . 1 no yes . . . . -0.027 . 14.511 . 42.499 . -3.520 -1.066 -0.098 18 . c30225_5ug3 HYP 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 . c30225_5ug3 HYP 2 . SING N CD no N 2 . c30225_5ug3 HYP 3 . SING N H no N 3 . c30225_5ug3 HYP 4 . SING CA C no N 4 . c30225_5ug3 HYP 5 . SING CA CB no N 5 . c30225_5ug3 HYP 6 . SING CA HA no N 6 . c30225_5ug3 HYP 7 . DOUB C O no N 7 . c30225_5ug3 HYP 8 . SING C OXT no N 8 . c30225_5ug3 HYP 9 . SING CB CG no N 9 . c30225_5ug3 HYP 10 . SING CB HB2 no N 10 . c30225_5ug3 HYP 11 . SING CB HB3 no N 11 . c30225_5ug3 HYP 12 . SING CG CD no N 12 . c30225_5ug3 HYP 13 . SING CG OD1 no N 13 . c30225_5ug3 HYP 14 . SING CG HG no N 14 . c30225_5ug3 HYP 15 . SING CD HD22 no N 15 . c30225_5ug3 HYP 16 . SING CD HD23 no N 16 . c30225_5ug3 HYP 17 . SING OD1 HD1 no N 17 . c30225_5ug3 HYP 18 . SING OXT HXT no N 18 . c30225_5ug3 HYP stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_3 _Sample.Sf_category sample _Sample.Sf_framecode sample_3 _Sample.Entry_ID c30225_5ug3 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details '1.5 mM A10V design 5 mutant, 100% D2O' _Sample.Aggregate_sample_number . _Sample.Solvent_system '100% 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 'A10V design 5 mutant' none . . 1 $entity_1 . . 1.5 . . mM 0.3 . . . c30225_5ug3 1 2 D2O 'natural abundance' . . . . . . 100 . . % . . . . c30225_5ug3 1 stop_ save_ save_sample_4 _Sample.Sf_category sample _Sample.Sf_framecode sample_4 _Sample.Entry_ID c30225_5ug3 _Sample.ID 2 _Sample.Type solution _Sample.Sub_type . _Sample.Details '1.5 mM A10V design 5 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 'A10V design 5 mutant' none . . 1 $entity_1 . . 1.5 . . mM 0.3 . . . c30225_5ug3 2 2 H2O 'natural abundance' . . . . . . 90 . . % . . . . c30225_5ug3 2 3 D2O 'natural abundance' . . . . . . 10 . . % . . . . c30225_5ug3 2 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_1 _Sample_condition_list.Entry_ID c30225_5ug3 _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' 0 . mM c30225_5ug3 1 pH 3 0.05 pH c30225_5ug3 1 pressure 1 . atm c30225_5ug3 1 temperature 380 . K c30225_5ug3 1 stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Software.Sf_category software _Software.Sf_framecode software_1 _Software.Entry_ID c30225_5ug3 _Software.ID 1 _Software.Name ARIA _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID "Linge, O'Donoghue and Nilges" . . c30225_5ug3 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'structure calculation' c30225_5ug3 1 stop_ save_ save_software_2 _Software.Sf_category software _Software.Sf_framecode software_2 _Software.Entry_ID c30225_5ug3 _Software.ID 2 _Software.Name CNS _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Brunger, Adams, Clore, Gros, Nilges and Read' . . c30225_5ug3 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'structure calculation' c30225_5ug3 2 stop_ save_ save_software_3 _Software.Sf_category software _Software.Sf_framecode software_3 _Software.Entry_ID c30225_5ug3 _Software.ID 3 _Software.Name CcpNMR _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID CCPN . . c30225_5ug3 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' c30225_5ug3 3 stop_ save_ save_software_4 _Software.Sf_category software _Software.Sf_framecode software_4 _Software.Entry_ID c30225_5ug3 _Software.ID 4 _Software.Name NMRPipe _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . c30225_5ug3 4 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing c30225_5ug3 4 stop_ save_ save_software_5 _Software.Sf_category software _Software.Sf_framecode software_5 _Software.Entry_ID c30225_5ug3 _Software.ID 5 _Software.Name TOPSPIN _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Bruker Biospin' . . c30225_5ug3 5 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID collection c30225_5ug3 5 stop_ save_ save_software_6 _Software.Sf_category software _Software.Sf_framecode software_6 _Software.Entry_ID c30225_5ug3 _Software.ID 6 _Software.Name VNMR _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Varian . . c30225_5ug3 6 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID collection c30225_5ug3 6 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 c30225_5ug3 _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_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_2 _NMR_spectrometer.Entry_ID c30225_5ug3 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model UNITYPLUS _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID c30225_5ug3 _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 . . . c30225_5ug3 1 2 NMR_spectrometer_2 Varian UNITYPLUS . 600 . . . c30225_5ug3 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 c30225_5ug3 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-1H TOCSY' no . . . . . . . . . . 2 $sample_4 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . c30225_5ug3 1 2 '2D 1H-1H NOESY' no . . . . . . . . . . 2 $sample_4 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . c30225_5ug3 1 3 '2D DQF-COSY' no . . . . . . . . . . 2 $sample_4 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . c30225_5ug3 1 4 '2D 1H-13C HSQC' no . . . . . . . . . . 1 $sample_3 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . c30225_5ug3 1 5 '2D 1H-1H TOCSY' no . . . . . . . . . . 1 $sample_3 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . c30225_5ug3 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 c30225_5ug3 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl carbons' . . . . ppm 0.000 internal direct 0.25144953 . . . . . c30225_5ug3 1 H 1 DSS 'methyl protons' . . . . ppm 0.000 internal direct 1.0 . . . . . c30225_5ug3 1 stop_ save_ save_chem_shift_reference_2 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chem_shift_reference_2 _Chem_shift_reference.Entry_ID c30225_5ug3 _Chem_shift_reference.ID 2 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.000 internal indirect 0.25144953 . . . . . c30225_5ug3 2 H 1 DSS 'methyl protons' . . . . ppm 0.000 internal direct 1.0 . . . . . c30225_5ug3 2 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 c30225_5ug3 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chem_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-1H TOCSY' . . . c30225_5ug3 1 2 '2D 1H-1H NOESY' . . . c30225_5ug3 1 3 '2D DQF-COSY' . . . c30225_5ug3 1 4 '2D 1H-13C HSQC' . . . c30225_5ug3 1 5 '2D 1H-1H TOCSY' . . . c30225_5ug3 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.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 ILE HA H 1 3.865 0.002 . 1 . 78 . A 1 ILE HA . c30225_5ug3 1 2 . 1 1 1 1 ILE HB H 1 1.967 0.003 . 1 . 80 . A 1 ILE HB . c30225_5ug3 1 3 . 1 1 1 1 ILE HG12 H 1 1.491 0.003 . 2 . 81 . A 1 ILE HG12 . c30225_5ug3 1 4 . 1 1 1 1 ILE HG13 H 1 1.220 0.008 . 2 . 82 . A 1 ILE HG13 . c30225_5ug3 1 5 . 1 1 1 1 ILE HG21 H 1 0.992 0.004 . 1 . 83 . A 1 ILE HG21 . c30225_5ug3 1 6 . 1 1 1 1 ILE HG22 H 1 0.992 0.004 . 1 . 83 . A 1 ILE HG22 . c30225_5ug3 1 7 . 1 1 1 1 ILE HG23 H 1 0.992 0.004 . 1 . 83 . A 1 ILE HG23 . c30225_5ug3 1 8 . 1 1 1 1 ILE HD11 H 1 0.927 0.003 . 1 . 84 . A 1 ILE HD11 . c30225_5ug3 1 9 . 1 1 1 1 ILE HD12 H 1 0.927 0.003 . 1 . 84 . A 1 ILE HD12 . c30225_5ug3 1 10 . 1 1 1 1 ILE HD13 H 1 0.927 0.003 . 1 . 84 . A 1 ILE HD13 . c30225_5ug3 1 11 . 1 1 1 1 ILE CA C 13 60.240 . . 1 . 109 . A 1 ILE CA . c30225_5ug3 1 12 . 1 1 1 1 ILE CB C 13 39.165 . . 1 . 132 . A 1 ILE CB . c30225_5ug3 1 13 . 1 1 2 2 ARG H H 1 8.790 0.005 . 1 . 1 . A 2 ARG H . c30225_5ug3 1 14 . 1 1 2 2 ARG HA H 1 4.348 0.003 . 1 . 2 . A 2 ARG HA . c30225_5ug3 1 15 . 1 1 2 2 ARG HB2 H 1 1.796 0.002 . 2 . 4 . A 2 ARG HB2 . c30225_5ug3 1 16 . 1 1 2 2 ARG HB3 H 1 1.626 0.015 . 2 . 5 . A 2 ARG HB3 . c30225_5ug3 1 17 . 1 1 2 2 ARG HD2 H 1 3.194 0.004 . 1 . 3 . A 2 ARG HD2 . c30225_5ug3 1 18 . 1 1 2 2 ARG HE H 1 7.254 0.002 . 1 . 7 . A 2 ARG HE . c30225_5ug3 1 19 . 1 1 2 2 ARG CA C 13 56.274 . . 1 . 125 . A 2 ARG CA . c30225_5ug3 1 20 . 1 1 2 2 ARG CB C 13 27.162 0.0 . 1 . 148 . A 2 ARG CB . c30225_5ug3 1 21 . 1 1 3 3 ASP H H 1 8.777 0.002 . 1 . 8 . A 3 ASP H . c30225_5ug3 1 22 . 1 1 3 3 ASP HA H 1 4.602 0.004 . 1 . 9 . A 3 ASP HA . c30225_5ug3 1 23 . 1 1 3 3 ASP HB2 H 1 2.912 0.008 . 2 . 10 . A 3 ASP HB2 . c30225_5ug3 1 24 . 1 1 3 3 ASP HB3 H 1 2.849 0.005 . 2 . 12 . A 3 ASP HB3 . c30225_5ug3 1 25 . 1 1 3 3 ASP CA C 13 53.283 . . 1 . 119 . A 3 ASP CA . c30225_5ug3 1 26 . 1 1 3 3 ASP CB C 13 38.524 0.002 . 1 . 146 . A 3 ASP CB . c30225_5ug3 1 27 . 1 1 4 4 GLU H H 1 8.898 0.003 . 1 . 13 . A 4 GLU H . c30225_5ug3 1 28 . 1 1 4 4 GLU HA H 1 4.228 0.008 . 1 . 14 . A 4 GLU HA . c30225_5ug3 1 29 . 1 1 4 4 GLU HB2 H 1 2.177 0.008 . 2 . 16 . A 4 GLU HB2 . c30225_5ug3 1 30 . 1 1 4 4 GLU HB3 H 1 2.050 0.002 . 2 . 17 . A 4 GLU HB3 . c30225_5ug3 1 31 . 1 1 4 4 GLU HG2 H 1 2.499 0.004 . 1 . 15 . A 4 GLU HG2 . c30225_5ug3 1 32 . 1 1 4 4 GLU CA C 13 57.369 . . 1 . 115 . A 4 GLU CA . c30225_5ug3 1 33 . 1 1 4 4 GLU CB C 13 27.767 . . 1 . 147 . A 4 GLU CB . c30225_5ug3 1 34 . 1 1 5 5 CYS H H 1 8.507 0.003 . 1 . 18 . A 5 CYS H . c30225_5ug3 1 35 . 1 1 5 5 CYS HA H 1 4.465 0.004 . 1 . 19 . A 5 CYS HA . c30225_5ug3 1 36 . 1 1 5 5 CYS HB2 H 1 3.296 0.006 . 2 . 20 . A 5 CYS HB2 . c30225_5ug3 1 37 . 1 1 5 5 CYS HB3 H 1 2.765 0.006 . 2 . 21 . A 5 CYS HB3 . c30225_5ug3 1 38 . 1 1 5 5 CYS CA C 13 58.337 . . 1 . 128 . A 5 CYS CA . c30225_5ug3 1 39 . 1 1 6 6 CYS H H 1 8.169 0.001 . 1 . 22 . A 6 CYS H . c30225_5ug3 1 40 . 1 1 6 6 CYS HA H 1 4.367 0.006 . 1 . 23 . A 6 CYS HA . c30225_5ug3 1 41 . 1 1 6 6 CYS HB2 H 1 3.281 0.008 . 2 . 24 . A 6 CYS HB2 . c30225_5ug3 1 42 . 1 1 6 6 CYS HB3 H 1 2.882 0.008 . 2 . 25 . A 6 CYS HB3 . c30225_5ug3 1 43 . 1 1 6 6 CYS CA C 13 56.401 . . 1 . 126 . A 6 CYS CA . c30225_5ug3 1 44 . 1 1 7 7 SER H H 1 7.851 0.005 . 1 . 26 . A 7 SER H . c30225_5ug3 1 45 . 1 1 7 7 SER HA H 1 4.514 0.002 . 1 . 27 . A 7 SER HA . c30225_5ug3 1 46 . 1 1 7 7 SER HB2 H 1 4.017 0.004 . 2 . 28 . A 7 SER HB2 . c30225_5ug3 1 47 . 1 1 7 7 SER HB3 H 1 3.971 0.002 . 2 . 29 . A 7 SER HB3 . c30225_5ug3 1 48 . 1 1 7 7 SER CA C 13 58.772 . . 1 . 112 . A 7 SER CA . c30225_5ug3 1 49 . 1 1 7 7 SER CB C 13 63.652 0.001 . 1 . 108 . A 7 SER CB . c30225_5ug3 1 50 . 1 1 8 8 ASN H H 1 7.967 0.003 . 1 . 30 . A 8 ASN H . c30225_5ug3 1 51 . 1 1 8 8 ASN HA H 1 5.303 0.002 . 1 . 31 . A 8 ASN HA . c30225_5ug3 1 52 . 1 1 8 8 ASN HB2 H 1 3.209 0.003 . 2 . 32 . A 8 ASN HB2 . c30225_5ug3 1 53 . 1 1 8 8 ASN HB3 H 1 2.884 0.008 . 2 . 33 . A 8 ASN HB3 . c30225_5ug3 1 54 . 1 1 8 8 ASN HD21 H 1 8.029 0.001 . 1 . 98 . A 8 ASN HD21 . c30225_5ug3 1 55 . 1 1 8 8 ASN HD22 H 1 7.263 0.003 . 1 . 99 . A 8 ASN HD22 . c30225_5ug3 1 56 . 1 1 8 8 ASN CA C 13 49.948 . . 1 . 106 . A 8 ASN CA . c30225_5ug3 1 57 . 1 1 8 8 ASN CB C 13 40.776 0.003 . 1 . 134 . A 8 ASN CB . c30225_5ug3 1 58 . 1 1 9 9 PRO HA H 1 4.131 0.003 . 1 . 85 . A 9 PRO HA . c30225_5ug3 1 59 . 1 1 9 9 PRO HB2 H 1 2.398 0.002 . 2 . 89 . A 9 PRO HB2 . c30225_5ug3 1 60 . 1 1 9 9 PRO HB3 H 1 2.067 0.015 . 2 . 90 . A 9 PRO HB3 . c30225_5ug3 1 61 . 1 1 9 9 PRO HG2 H 1 2.147 0.002 . 1 . 91 . A 9 PRO HG2 . c30225_5ug3 1 62 . 1 1 9 9 PRO HD2 H 1 4.042 0.002 . 2 . 87 . A 9 PRO HD2 . c30225_5ug3 1 63 . 1 1 9 9 PRO HD3 H 1 3.956 0.003 . 2 . 88 . A 9 PRO HD3 . c30225_5ug3 1 64 . 1 1 9 9 PRO CA C 13 65.808 . . 1 . 111 . A 9 PRO CA . c30225_5ug3 1 65 . 1 1 9 9 PRO CB C 13 32.635 0.019 . 1 . 135 . A 9 PRO CB . c30225_5ug3 1 66 . 1 1 9 9 PRO CD C 13 51.098 0.001 . 1 . 123 . A 9 PRO CD . c30225_5ug3 1 67 . 1 1 10 10 VAL H H 1 7.491 0.001 . 1 . 65 . A 10 VAL H . c30225_5ug3 1 68 . 1 1 10 10 VAL HA H 1 3.746 0.001 . 1 . 66 . A 10 VAL HA . c30225_5ug3 1 69 . 1 1 10 10 VAL HB H 1 2.046 0.002 . 1 . 67 . A 10 VAL HB . c30225_5ug3 1 70 . 1 1 10 10 VAL HG11 H 1 0.998 0.002 . 2 . 68 . A 10 VAL HG11 . c30225_5ug3 1 71 . 1 1 10 10 VAL HG12 H 1 0.998 0.002 . 2 . 68 . A 10 VAL HG12 . c30225_5ug3 1 72 . 1 1 10 10 VAL HG13 H 1 0.998 0.002 . 2 . 68 . A 10 VAL HG13 . c30225_5ug3 1 73 . 1 1 10 10 VAL HG21 H 1 0.884 0.002 . 2 . 69 . A 10 VAL HG21 . c30225_5ug3 1 74 . 1 1 10 10 VAL HG22 H 1 0.884 0.002 . 2 . 69 . A 10 VAL HG22 . c30225_5ug3 1 75 . 1 1 10 10 VAL HG23 H 1 0.884 0.002 . 2 . 69 . A 10 VAL HG23 . c30225_5ug3 1 76 . 1 1 10 10 VAL CA C 13 65.304 . . 1 . 107 . A 10 VAL CA . c30225_5ug3 1 77 . 1 1 10 10 VAL CB C 13 32.126 . . 1 . 141 . A 10 VAL CB . c30225_5ug3 1 78 . 1 1 11 11 CYS H H 1 7.662 0.001 . 1 . 39 . A 11 CYS H . c30225_5ug3 1 79 . 1 1 11 11 CYS HA H 1 4.204 0.004 . 1 . 40 . A 11 CYS HA . c30225_5ug3 1 80 . 1 1 11 11 CYS HB2 H 1 4.133 0.004 . 2 . 41 . A 11 CYS HB2 . c30225_5ug3 1 81 . 1 1 11 11 CYS HB3 H 1 3.307 0.003 . 2 . 42 . A 11 CYS HB3 . c30225_5ug3 1 82 . 1 1 11 11 CYS CA C 13 60.735 . . 1 . 116 . A 11 CYS CA . c30225_5ug3 1 83 . 1 1 12 12 ARG H H 1 8.528 0.004 . 1 . 43 . A 12 ARG H . c30225_5ug3 1 84 . 1 1 12 12 ARG HA H 1 3.950 0.003 . 1 . 44 . A 12 ARG HA . c30225_5ug3 1 85 . 1 1 12 12 ARG HB2 H 1 1.728 0.003 . 2 . 48 . A 12 ARG HB2 . c30225_5ug3 1 86 . 1 1 12 12 ARG HB3 H 1 1.600 0.003 . 2 . 49 . A 12 ARG HB3 . c30225_5ug3 1 87 . 1 1 12 12 ARG HG2 H 1 2.020 0.005 . 2 . 46 . A 12 ARG HG2 . c30225_5ug3 1 88 . 1 1 12 12 ARG HG3 H 1 1.855 0.004 . 2 . 47 . A 12 ARG HG3 . c30225_5ug3 1 89 . 1 1 12 12 ARG HD2 H 1 3.278 0.007 . 1 . 45 . A 12 ARG HD2 . c30225_5ug3 1 90 . 1 1 12 12 ARG HE H 1 7.372 0.008 . 1 . 51 . A 12 ARG HE . c30225_5ug3 1 91 . 1 1 12 12 ARG CA C 13 59.628 . . 1 . 124 . A 12 ARG CA . c30225_5ug3 1 92 . 1 1 12 12 ARG CB C 13 27.604 0.018 . 1 . 130 . A 12 ARG CB . c30225_5ug3 1 93 . 1 1 13 13 VAL H H 1 7.397 0.004 . 1 . 52 . A 13 VAL H . c30225_5ug3 1 94 . 1 1 13 13 VAL HA H 1 3.881 0.002 . 1 . 53 . A 13 VAL HA . c30225_5ug3 1 95 . 1 1 13 13 VAL HB H 1 2.166 0.003 . 1 . 54 . A 13 VAL HB . c30225_5ug3 1 96 . 1 1 13 13 VAL HG11 H 1 1.065 0.003 . 2 . 55 . A 13 VAL HG11 . c30225_5ug3 1 97 . 1 1 13 13 VAL HG12 H 1 1.065 0.003 . 2 . 55 . A 13 VAL HG12 . c30225_5ug3 1 98 . 1 1 13 13 VAL HG13 H 1 1.065 0.003 . 2 . 55 . A 13 VAL HG13 . c30225_5ug3 1 99 . 1 1 13 13 VAL HG21 H 1 0.977 0.006 . 2 . 56 . A 13 VAL HG21 . c30225_5ug3 1 100 . 1 1 13 13 VAL HG22 H 1 0.977 0.006 . 2 . 56 . A 13 VAL HG22 . c30225_5ug3 1 101 . 1 1 13 13 VAL HG23 H 1 0.977 0.006 . 2 . 56 . A 13 VAL HG23 . c30225_5ug3 1 102 . 1 1 13 13 VAL CA C 13 64.522 . . 1 . 110 . A 13 VAL CA . c30225_5ug3 1 103 . 1 1 13 13 VAL CB C 13 31.912 . . 1 . 140 . A 13 VAL CB . c30225_5ug3 1 104 . 1 1 14 14 ASN H H 1 7.617 0.009 . 1 . 57 . A 14 ASN H . c30225_5ug3 1 105 . 1 1 14 14 ASN HA H 1 4.731 0.003 . 1 . 58 . A 14 ASN HA . c30225_5ug3 1 106 . 1 1 14 14 ASN HB2 H 1 2.909 0.009 . 2 . 59 . A 14 ASN HB2 . c30225_5ug3 1 107 . 1 1 14 14 ASN HB3 H 1 2.779 0.007 . 2 . 60 . A 14 ASN HB3 . c30225_5ug3 1 108 . 1 1 14 14 ASN HD21 H 1 7.697 0.002 . 1 . 103 . A 14 ASN HD21 . c30225_5ug3 1 109 . 1 1 14 14 ASN HD22 H 1 7.080 0.002 . 1 . 105 . A 14 ASN HD22 . c30225_5ug3 1 110 . 1 1 14 14 ASN CA C 13 54.032 . . 1 . 118 . A 14 ASN CA . c30225_5ug3 1 111 . 1 1 14 14 ASN CB C 13 39.428 0.003 . 1 . 143 . A 14 ASN CB . c30225_5ug3 1 112 . 1 1 15 15 ASN H H 1 7.636 0.004 . 1 . 61 . A 15 ASN H . c30225_5ug3 1 113 . 1 1 15 15 ASN HA H 1 5.148 0.01 . 1 . 62 . A 15 ASN HA . c30225_5ug3 1 114 . 1 1 15 15 ASN HB2 H 1 2.770 0.005 . 2 . 63 . A 15 ASN HB2 . c30225_5ug3 1 115 . 1 1 15 15 ASN HB3 H 1 2.687 0.005 . 2 . 64 . A 15 ASN HB3 . c30225_5ug3 1 116 . 1 1 15 15 ASN HD21 H 1 7.831 0.004 . 1 . 100 . A 15 ASN HD21 . c30225_5ug3 1 117 . 1 1 15 15 ASN HD22 H 1 7.393 0.003 . 1 . 102 . A 15 ASN HD22 . c30225_5ug3 1 118 . 1 1 15 15 ASN CA C 13 51.589 . . 1 . 117 . A 15 ASN CA . c30225_5ug3 1 119 . 1 1 15 15 ASN CB C 13 40.356 0.006 . 1 . 142 . A 15 ASN CB . c30225_5ug3 1 120 . 1 1 16 16 HYP CA C 13 63.045 . . 1 . 113 . A 16 HYP CA . c30225_5ug3 1 121 . 1 1 16 16 HYP CB C 13 39.066 0.002 . 1 . 131 . A 16 HYP CB . c30225_5ug3 1 122 . 1 1 16 16 HYP CD C 13 56.625 0.003 . 1 . 127 . A 16 HYP CD . c30225_5ug3 1 123 . 1 1 16 16 HYP HA H 1 4.528 0.004 . 1 . 92 . A 16 HYP HA . c30225_5ug3 1 124 . 1 1 16 16 HYP HB2 H 1 2.215 0.005 . 2 . 96 . A 16 HYP HB2 . c30225_5ug3 1 125 . 1 1 16 16 HYP HB3 H 1 1.906 0.003 . 2 . 97 . A 16 HYP HB3 . c30225_5ug3 1 126 . 1 1 16 16 HYP HD1 H 1 3.800 0.004 . 1 . 94 . A 16 HYP HD1 . c30225_5ug3 1 127 . 1 1 16 16 HYP HD22 H 1 3.523 0.004 . 1 . 95 . A 16 HYP HD22 . c30225_5ug3 1 128 . 1 1 16 16 HYP HG H 1 4.332 0.005 . 1 . 93 . A 16 HYP HG . c30225_5ug3 1 129 . 1 1 17 17 HIS H H 1 8.796 0.004 . 1 . 70 . A 17 HIS H . c30225_5ug3 1 130 . 1 1 17 17 HIS HA H 1 4.686 0.003 . 1 . 71 . A 17 HIS HA . c30225_5ug3 1 131 . 1 1 17 17 HIS HB2 H 1 3.389 0.002 . 2 . 72 . A 17 HIS HB2 . c30225_5ug3 1 132 . 1 1 17 17 HIS HB3 H 1 3.323 0.006 . 2 . 73 . A 17 HIS HB3 . c30225_5ug3 1 133 . 1 1 17 17 HIS CA C 13 56.221 . . 1 . 122 . A 17 HIS CA . c30225_5ug3 1 134 . 1 1 17 17 HIS CB C 13 28.058 0.001 . 1 . 129 . A 17 HIS CB . c30225_5ug3 1 135 . 1 1 18 18 VAL H H 1 7.630 0.003 . 1 . 34 . A 18 VAL H . c30225_5ug3 1 136 . 1 1 18 18 VAL HA H 1 4.232 0.005 . 1 . 35 . A 18 VAL HA . c30225_5ug3 1 137 . 1 1 18 18 VAL HB H 1 2.193 0.003 . 1 . 36 . A 18 VAL HB . c30225_5ug3 1 138 . 1 1 18 18 VAL HG11 H 1 0.974 0.005 . 2 . 37 . A 18 VAL HG11 . c30225_5ug3 1 139 . 1 1 18 18 VAL HG12 H 1 0.974 0.005 . 2 . 37 . A 18 VAL HG12 . c30225_5ug3 1 140 . 1 1 18 18 VAL HG13 H 1 0.974 0.005 . 2 . 37 . A 18 VAL HG13 . c30225_5ug3 1 141 . 1 1 18 18 VAL HG21 H 1 0.931 0.003 . 2 . 38 . A 18 VAL HG21 . c30225_5ug3 1 142 . 1 1 18 18 VAL HG22 H 1 0.931 0.003 . 2 . 38 . A 18 VAL HG22 . c30225_5ug3 1 143 . 1 1 18 18 VAL HG23 H 1 0.931 0.003 . 2 . 38 . A 18 VAL HG23 . c30225_5ug3 1 144 . 1 1 18 18 VAL CA C 13 62.988 . . 1 . 114 . A 18 VAL CA . c30225_5ug3 1 145 . 1 1 18 18 VAL CB C 13 32.786 . . 1 . 139 . A 18 VAL CB . c30225_5ug3 1 146 . 1 1 19 19 CYS H H 1 7.932 0.002 . 1 . 74 . A 19 CYS H . c30225_5ug3 1 147 . 1 1 19 19 CYS HA H 1 4.839 0.001 . 1 . 75 . A 19 CYS HA . c30225_5ug3 1 148 . 1 1 19 19 CYS HB2 H 1 3.273 0.006 . 2 . 76 . A 19 CYS HB2 . c30225_5ug3 1 149 . 1 1 19 19 CYS HB3 H 1 2.764 0.005 . 2 . 77 . A 19 CYS HB3 . c30225_5ug3 1 150 . 1 1 19 19 CYS CA C 13 53.722 . . 1 . 121 . A 19 CYS CA . c30225_5ug3 1 stop_ save_ ######################### # Spectral peak lists # ######################### save_spectral_peak_list_1 _Spectral_peak_list.Sf_category spectral_peak_list _Spectral_peak_list.Sf_framecode spectral_peak_list_1 _Spectral_peak_list.Entry_ID c30225_5ug3 _Spectral_peak_list.ID 1 _Spectral_peak_list.Sample_ID 2 _Spectral_peak_list.Sample_label $sample_4 _Spectral_peak_list.Sample_condition_list_ID 1 _Spectral_peak_list.Sample_condition_list_label $sample_conditions_1 _Spectral_peak_list.Experiment_ID 2 _Spectral_peak_list.Experiment_name '2D 1H-1H NOESY' _Spectral_peak_list.Number_of_spectral_dimensions 2 _Spectral_peak_list.Details . _Spectral_peak_list.Text_data_format text _Spectral_peak_list.Text_data ; Number,Position F1,Position F2,Assign F1,Assign F2 1,5.29909,49.94829, 8AsnHa, 8AsnCa 2,5.17197,51.58932, 15AsnHa, 15AsnCa 3,4.51884,58.77216, 7SerHa, 7SerCa 4,4.31494,71.71796,None,None 5,3.74577,65.30414, 10ValHa, 10ValCa 6,3.87605,64.52209, 13ValHa, 13ValCa 7,3.96302,63.65353, 7SerHba, 7SerCb 8,4.00762,63.65061, 7SerHbb, 7SerCb 9,3.86653,60.23985, 1IleHa, 1IleCa 10,4.12733,65.8082, 9ProHa, 9ProCa 11,4.21825,62.98809, 18ValHa, 18ValCa 12,4.52217,63.04456, 16HypHa, 16HypCa 13,4.24293,57.36938, 4GluHa, 4GluCa 14,4.20397,60.73532, 11CysHa, 11CysCa 15,3.96237,59.62812, 12ArgHa, 12ArgCa 16,4.90571,53.72211,None, 19CysCa 17,4.73389,54.03152, 14AsnHa, 14AsnCa 18,4.61834,53.28286, 3AspHa, 3AspCa 19,4.67766,56.22104, 17HisHa, 17HisCa 20,3.95313,51.09973, 9ProHda, 9ProCd 21,4.04294,51.09707, 9ProHdb, 9ProCd 22,4.34569,56.27368, 2ArgHa, 2ArgCa 23,4.38691,56.4013, 6CysHa, 6CysCa 24,3.79838,56.62786, 16HypHd1, 16HypCd 25,3.50796,56.62158, 16HypHd2a, 16HypCd 26,3.8463,58.07204,None,None 27,3.71525,61.96862,None,None 28,4.4613,58.33669, 5CysHa, 5CysCa 29,3.27488,43.63967,None,None 30,2.88586,38.52576, 3AspHbb, 3AspCb 31,3.32781,28.05899, 17HisHba, 17HisCb 32,3.38837,28.0571, 17HisHbb, 17HisCb 33,3.21361,40.779, 8AsnHbb, 8AsnCb 34,1.60302,27.16179,None,None 35,1.72176,27.62236, 12ArgHbb, 12ArgCb 36,1.59565,27.58616, 12ArgHba, 12ArgCb 37,1.49799,26.76918,None,None 38,2.7747,39.4241, 14AsnHba, 14AsnCb 39,2.22635,39.06358, 16HypHbb, 16HypCb 40,1.91725,39.06757, 16HypHba, 16HypCb 41,1.97105,39.16521, 1IleHb, 1IleCb 42,2.19668,32.78595, 18ValHb, 18ValCb 43,1.30701,32.65196,None,None 44,2.86697,40.77269, 8AsnHba, 8AsnCb 45,2.39712,32.65365, 9ProHbb, 9ProCb 46,2.02638,32.61587, 9ProHba, 9ProCb 47,4.14384,41.85221, 11CysHbb,None 48,3.30828,37.256,None,None 49,2.86331,37.258,None,None 50,2.17029,31.91152, 13ValHb, 13ValCb 51,2.04684,32.12606, 10ValHb, 10ValCb 52,2.02195,30.74346, 12ArgHgb,None 53,1.86118,30.7444, 12ArgHga,None 54,3.30582,40.21628,None,None 55,2.67196,40.36276, 15AsnHba, 15AsnCb 56,2.69844,40.3498, 15AsnHba, 15AsnCb 57,2.77027,40.22361,None,None 58,2.90984,39.43104, 14AsnHbb, 14AsnCb 59,1.63803,27.16202, 2ArgHba, 2ArgCb 60,2.86313,38.52197, 3AspHba, 3AspCb 61,2.18688,27.76692, 4GluHbb, 4GluCb 62,2.04196,27.76692, 4GluHba, 4GluCb 63,1.79698,27.1624, 2ArgHbb, 2ArgCb 64,-4.28E-05,79.9928,None,None ; loop_ _Spectral_dim.ID _Spectral_dim.Atom_type _Spectral_dim.Atom_isotope_number _Spectral_dim.Spectral_region _Spectral_dim.Magnetization_linkage_ID _Spectral_dim.Under_sampling_type _Spectral_dim.Sweep_width _Spectral_dim.Sweep_width_units _Spectral_dim.Center_frequency_offset _Spectral_dim.Encoding_code _Spectral_dim.Encoded_source_dimension_ID _Spectral_dim.Entry_ID _Spectral_dim.Spectral_peak_list_ID 1 H 1 H . aliased 12.044 ppm 5.028 . . c30225_5ug3 1 2 H 1 H . aliased 12.000 ppm 5.028 . . c30225_5ug3 1 stop_ save_ save_spectral_peak_list_2 _Spectral_peak_list.Sf_category spectral_peak_list _Spectral_peak_list.Sf_framecode spectral_peak_list_2 _Spectral_peak_list.Entry_ID c30225_5ug3 _Spectral_peak_list.ID 2 _Spectral_peak_list.Sample_ID 1 _Spectral_peak_list.Sample_label $sample_3 _Spectral_peak_list.Sample_condition_list_ID 1 _Spectral_peak_list.Sample_condition_list_label $sample_conditions_1 _Spectral_peak_list.Experiment_ID 4 _Spectral_peak_list.Experiment_name '2D 1H-13C HSQC' _Spectral_peak_list.Number_of_spectral_dimensions 2 _Spectral_peak_list.Details . _Spectral_peak_list.Text_data_format text _Spectral_peak_list.Text_data ; Number,#,Position F1,Position F2,Assign F1,Assign F2,Volume 1,1,8.79342,4.34924, 2ArgH, 2ArgHa,1.39E+06 2,2,8.79133,3.19845, 2ArgH, 2ArgHda,4.40E+04 3,3,8.78851,1.79612, 2ArgH, 2ArgHbb,1.01E+06 4,4,8.79115,1.62948, 2ArgH, 2ArgHba,2.81E+05 5,5,4.3472,1.79984, 2ArgHa, 2ArgHbb,9.62E+05 6,6,4.35325,1.60701, 2ArgHa, 2ArgHba,5.26E+05 7,7,1.79247,1.64449, 2ArgHbb, 2ArgHba,8.91E+05 8,8,4.3482,8.7787, 2ArgHa, 2ArgH,2.59E+06 9,9,3.1899,8.79266, 2ArgHda, 2ArgH,9.32E+04 10,10,1.79561,8.78758, 2ArgHbb, 2ArgH,6.92E+05 11,11,1.64331,8.79009, 2ArgHba, 2ArgH,1.95E+05 12,12,1.60472,8.78409, 2ArgHba, 2ArgH,2.01E+05 13,13,1.79635,3.1963, 2ArgHbb, 2ArgHda,4.48E+05 14,14,1.64402,3.19805, 2ArgHba, 2ArgHda,5.25E+05 15,15,1.60491,3.19732, 2ArgHba, 2ArgHda,4.76E+05 16,16,1.64882,1.79359, 2ArgHba, 2ArgHbb,1.15E+06 17,17,1.60454,1.79509, 2ArgHba, 2ArgHbb,1.29E+06 18,18,7.25642,3.19848, 2ArgHe, 2ArgHda,5.01E+05 19,19,7.25469,1.79402, 2ArgHe, 2ArgHbb,1.17E+05 20,20,7.25096,1.62455, 2ArgHe, 2ArgHba,1.45E+05 21,21,1.79858,4.35013, 2ArgHbb, 2ArgHa,6.39E+05 22,22,8.77538,4.60287, 3AspH, 3AspHa,5.03E+05 23,23,8.77534,2.91643, 3AspH, 3AspHbb,7.08E+05 24,24,8.77478,2.84639, 3AspH, 3AspHba,6.83E+05 25,25,4.59896,2.91771, 3AspHa, 3AspHbb,7.92E+05 26,26,4.59779,2.84374, 3AspHa, 3AspHba,1.02E+06 27,27,2.92057,2.77818, 14AsnHbb, 14AsnHba,2.02E+06 28,28,2.9136,2.84704, 3AspHbb, 3AspHba,4.10E+06 29,29,4.59902,8.77648, 3AspHa, 3AspH,4.22E+05 30,30,2.91094,8.77817, 3AspHbb, 3AspH,4.89E+05 31,31,2.854,8.77744, 3AspHba, 3AspH,4.79E+05 32,32,2.91219,4.6018, 3AspHbb, 3AspHa,6.95E+05 33,33,2.855,4.60315, 3AspHba, 3AspHa,7.75E+05 34,34,2.85511,2.91715, 3AspHba, 3AspHbb,6.87E+06 35,35,8.89995,4.232, 4GluH, 4GluHa,4.90E+05 36,36,8.90063,2.49843, 4GluH, 4GluHga,3.80E+05 37,37,8.90006,2.17458, 4GluH, 4GluHbb,4.64E+05 38,38,8.89991,2.05047, 4GluH, 4GluHba,6.94E+05 39,39,4.23061,2.49617, 4GluHa, 4GluHga,4.31E+05 40,40,4.2328,2.19088, 4GluHa, 4GluHbb,1.49E+06 41,41,4.23011,2.04974, 4GluHa, 4GluHba,6.20E+05 42,42,2.50575,2.17932, 4GluHga, 4GluHbb,3.99E+05 43,43,2.50058,2.05311, 4GluHga, 4GluHba,3.57E+05 44,44,2.17456,2.05302, 4GluHbb, 4GluHba,3.43E+06 45,45,4.22983,8.8967, 4GluHa, 4GluH,5.48E+05 46,46,2.50261,8.89997, 4GluHga, 4GluH,1.89E+05 47,47,2.17036,8.89689, 4GluHbb, 4GluH,3.48E+05 48,48,2.05158,8.89702, 4GluHba, 4GluH,4.49E+05 49,49,2.50556,4.23275, 4GluHga, 4GluHa,2.09E+05 50,50,2.19158,4.23175, 4GluHbb, 4GluHa,1.07E+06 51,51,2.05049,4.23094, 4GluHba, 4GluHa,5.20E+05 52,52,2.17219,2.49078, 4GluHbb, 4GluHga,8.49E+05 53,53,2.05178,2.49687, 4GluHba, 4GluHga,8.08E+05 54,54,2.05105,2.16921, 4GluHba, 4GluHbb,4.11E+06 55,55,8.50803,4.46818, 5CysH, 5CysHa,5.66E+05 56,56,8.50806,3.30016, 5CysH, 5CysHbb,1.36E+06 57,57,8.50755,2.762, 5CysH, 5CysHba,1.05E+06 58,58,4.47565,3.30238, 5CysHa, 5CysHbb,2.38E+05 59,59,4.46998,2.76156, 5CysHa, 5CysHba,4.98E+05 60,60,3.28708,2.76446, 5CysHbb, 5CysHba,5.08E+06 61,61,4.46121,8.50479, 5CysHa, 5CysH,6.06E+05 62,62,3.2991,8.51034, 5CysHbb, 5CysH,1.13E+06 63,63,2.75666,8.50149, 5CysHba, 5CysH,6.29E+05 64,64,3.30279,4.46638, 5CysHbb, 5CysHa,8.97E+05 65,65,2.76051,4.46697, 5CysHba, 5CysHa,3.16E+05 66,66,2.76496,3.28834, 5CysHba, 5CysHbb,5.94E+06 67,67,8.16986,4.36785, 6CysH, 6CysHa,4.14E+05 68,68,8.1696,3.28758, 6CysH, 6CysHbb,7.88E+05 69,69,8.16948,2.8775, 6CysH, 6CysHba,9.19E+05 70,70,4.36792,3.27425, 6CysHa, 6CysHbb,7.13E+05 71,71,4.36101,2.87849, 6CysHa, 6CysHba,6.26E+05 72,72,3.26769,2.87792, 6CysHbb, 6CysHba,3.15E+06 73,73,4.36733,8.16932, 6CysHa, 6CysH,4.64E+05 74,74,3.28755,8.16904, 6CysHbb, 6CysH,5.38E+05 75,75,2.87629,8.16905, 6CysHba, 6CysH,5.48E+05 76,76,3.28209,4.37194, 6CysHbb, 6CysHa,6.16E+05 77,77,2.87661,4.36828, 6CysHba, 6CysHa,2.50E+05 78,78,2.87676,3.27882, 6CysHba, 6CysHbb,3.85E+06 79,79,7.84934,4.51323, 7SerH, 7SerHa,4.00E+05 80,80,7.84948,4.01816, 7SerH, 7SerHbb,4.80E+05 81,81,7.8507,3.97251, 7SerH, 7SerHba,5.42E+05 82,82,4.51584,7.85541, 7SerHa, 7SerH,5.21E+05 83,83,4.01289,7.85354, 7SerHbb, 7SerH,3.83E+05 84,84,3.97159,7.8534, 7SerHba, 7SerH,3.41E+05 85,85,4.51279,4.01796, 7SerHa, 7SerHbb,1.11E+06 86,86,4.51392,3.97298, 7SerHa, 7SerHba,1.59E+06 87,87,4.01235,4.51379, 7SerHbb, 7SerHa,4.25E+05 88,88,3.97127,4.51372, 7SerHba, 7SerHa,6.08E+05 89,89,4.01549,3.97392, 7SerHbb, 7SerHba,6.79E+06 90,90,3.97001,4.01977, 7SerHba, 7SerHbb,7.25E+06 91,91,7.96852,5.30493, 8AsnH, 8AsnHa,3.65E+05 92,92,7.96947,3.20878, 8AsnH, 8AsnHbb,6.06E+05 93,93,7.96967,2.88317, 8AsnH, 8AsnHba,5.19E+05 94,94,5.30117,3.20842, 8AsnHa, 8AsnHbb,2.56E+05 95,95,5.30313,2.88435, 8AsnHa, 8AsnHba,4.43E+05 96,96,3.20866,2.87959, 8AsnHbb, 8AsnHba,2.60E+06 97,97,5.30298,7.96538, 8AsnHa, 8AsnH,1.90E+05 98,98,3.20834,7.96188, 8AsnHbb, 8AsnH,4.76E+05 99,99,2.87388,7.95966, 8AsnHba, 8AsnH,4.64E+05 100,100,3.20834,5.30313, 8AsnHbb, 8AsnHa,4.12E+05 101,101,2.87451,5.3002, 8AsnHba, 8AsnHa,7.39E+05 102,102,2.8742,3.20653, 8AsnHba, 8AsnHbb,2.96E+06 103,103,7.62777,4.23132, 18ValH, 18ValHa,4.57E+05 104,104,7.62666,2.19375, 18ValH, 18ValHb,8.09E+05 105,105,7.6278,0.97369, 18ValH, 18ValHgb*,1.07E+06 106,106,7.62993,0.93428, 18ValH, 18ValHga*,2.83E+05 107,107,4.23355,0.96778, 18ValHa, 18ValHgb*,1.21E+06 108,108,4.23447,0.92912, 18ValHa, 18ValHga*,9.26E+05 109,109,4.23416,2.19408, 18ValHa, 18ValHb,1.49E+06 110,110,2.18946,0.97011, 18ValHb, 18ValHgb*,1.64E+06 111,111,2.19108,0.92849, 18ValHb, 18ValHga*,9.62E+05 112,112,0.97637,0.97584, 18ValHgb*, 18ValHgb*,1.38E+08 113,113,0.929,0.92831, 18ValHga*, 18ValHga*,1.23E+08 114,114,4.23419,7.62975, 18ValHa, 18ValH,5.24E+05 115,115,2.19329,7.62942, 18ValHb, 18ValH,5.88E+05 116,116,0.97406,7.63049, 18ValHgb*, 18ValH,8.62E+05 117,117,0.93343,7.62939, 18ValHga*, 18ValH,2.76E+05 118,118,2.18044,4.23253, 18ValHb, 18ValHa,1.00E+06 119,119,0.97531,4.23113, 18ValHgb*, 18ValHa,7.42E+05 120,120,0.93429,4.23225, 18ValHga*, 18ValHa,8.83E+05 121,121,0.97725,2.18935, 18ValHgb*, 18ValHb,1.93E+06 122,122,0.93508,2.19386, 18ValHga*, 18ValHb,1.51E+06 123,123,7.66255,4.2068, 11CysH, 11CysHa,6.74E+05 124,124,7.66344,4.13455, 11CysH, 11CysHbb,7.07E+05 125,125,7.66313,3.30731, 11CysH, 11CysHba,9.65E+05 126,126,4.19939,3.30843, 11CysHa, 11CysHba,1.08E+06 127,127,4.19956,4.13563, 11CysHa, 11CysHbb,1.33E+06 128,128,4.12816,3.30547, 11CysHbb, 11CysHba,1.35E+06 129,129,4.19916,7.65937, 11CysHa, 11CysH,5.16E+05 130,130,4.12808,7.66026, 11CysHbb, 11CysH,4.83E+05 131,131,3.30386,7.66344, 11CysHba, 11CysH,8.67E+05 132,132,4.12836,4.20588, 11CysHbb, 11CysHa,1.21E+06 133,133,3.30556,4.20606, 11CysHba, 11CysHa,1.55E+06 134,134,8.53028,3.95039, 12ArgH, 12ArgHa,5.26E+05 135,135,8.52651,3.29679, 12ArgH, 12ArgHda,5.61E+05 136,136,8.53051,2.02149, 12ArgH, 12ArgHgb,8.48E+05 137,137,8.53028,1.85678, 12ArgH, 12ArgHga,6.55E+05 138,138,8.5299,1.72942, 12ArgH, 12ArgHbb,3.26E+05 139,139,8.53008,1.60141, 12ArgH, 12ArgHba,2.46E+05 140,140,3.95092,3.26986, 12ArgHa, 12ArgHda,2.79E+04 141,141,3.95193,2.02581, 12ArgHa, 12ArgHgb,1.22E+06 142,142,3.95028,1.85751, 12ArgHa, 12ArgHga,6.01E+05 143,143,3.94971,1.72841, 12ArgHa, 12ArgHbb,4.53E+05 144,144,3.95096,1.60308, 12ArgHa, 12ArgHba,3.88E+05 145,145,3.27874,2.01866, 12ArgHda, 12ArgHgb,5.90E+05 146,146,3.27646,1.85593, 12ArgHda, 12ArgHga,6.16E+05 147,147,3.27603,1.72896, 12ArgHda, 12ArgHbb,1.02E+06 148,148,3.27628,1.60169, 12ArgHda, 12ArgHba,9.99E+05 149,149,2.01579,1.85725, 12ArgHgb, 12ArgHga,1.85E+06 150,150,2.01309,1.73068, 12ArgHgb, 12ArgHbb,3.90E+05 151,151,2.00933,1.60408, 12ArgHgb, 12ArgHba,2.77E+05 152,152,1.85023,1.73057, 12ArgHga, 12ArgHbb,6.88E+05 153,153,1.84134,1.60233, 12ArgHga, 12ArgHba,5.10E+05 154,154,1.72673,1.60266, 12ArgHbb, 12ArgHba,1.96E+06 155,155,1.59835,1.72839, 12ArgHba, 12ArgHbb,2.32E+06 156,156,1.73027,1.84968, 12ArgHbb, 12ArgHga,1.06E+06 157,157,1.59877,1.85556, 12ArgHba, 12ArgHga,7.90E+05 158,158,1.85141,2.01907, 12ArgHga, 12ArgHgb,2.04E+06 159,159,1.7323,2.01846, 12ArgHbb, 12ArgHgb,6.48E+05 160,160,1.59804,2.01842, 12ArgHba, 12ArgHgb,4.27E+05 161,161,2.01672,3.27686, 12ArgHgb, 12ArgHda,5.67E+05 162,162,1.85023,3.27595, 12ArgHga, 12ArgHda,5.75E+05 163,163,1.72841,3.2763, 12ArgHbb, 12ArgHda,9.18E+05 164,164,1.59789,3.27565, 12ArgHba, 12ArgHda,9.38E+05 165,165,2.02216,3.9519, 12ArgHgb, 12ArgHa,7.61E+05 166,166,1.85174,3.95063, 12ArgHga, 12ArgHa,3.66E+05 167,167,1.72954,3.95098, 12ArgHbb, 12ArgHa,3.08E+05 168,168,1.59607,3.95029, 12ArgHba, 12ArgHa,2.87E+05 169,169,2.02567,4.13513, (9Pro/12Arg)(Hba/Hgb), 9ProHa,6.85E+05 170,170,3.19364,7.25467, 2ArgHda, 2ArgHe,4.82E+05 171,171,1.79521,7.25593, 2ArgHbb, 2ArgHe,8.24E+04 172,172,1.60892,7.24894, 2ArgHba, 2ArgHe,1.16E+05 173,173,7.36648,3.27505, 12ArgHe, 12ArgHda,9.44E+05 174,174,7.36783,2.02063, 12ArgHe, 12ArgHgb,1.64E+05 175,175,7.36728,1.85739, 12ArgHe, 12ArgHga,1.91E+05 176,176,7.36689,1.72698, 12ArgHe, 12ArgHbb,2.26E+05 177,177,7.36779,1.60307, 12ArgHe, 12ArgHba,2.37E+05 178,178,3.27774,7.37076, 12ArgHda, 12ArgHe,9.94E+05 179,179,1.72964,7.37441, 12ArgHbb, 12ArgHe,2.14E+05 180,180,1.59697,7.37279, 12ArgHba, 12ArgHe,2.31E+05 181,181,7.39994,3.88104, 13ValH, 13ValHa,5.17E+05 182,182,7.40122,2.17157, 13ValH, 13ValHb,1.02E+06 183,183,7.39873,0.9764, 13ValH, 13ValHga*,4.61E+05 184,184,7.40122,1.06793, 13ValH, 13ValHgb*,8.04E+05 185,185,3.88251,2.1659, 13ValHa, 13ValHb,1.21E+06 186,186,3.88263,1.06502, 13ValHa, 13ValHgb*,8.41E+05 187,187,3.86989,0.98602, 1IleHa, 1IleHg2*,1.00E+06 188,188,3.88203,0.97551, 13ValHa, 13ValHga*,9.95E+05 189,189,2.15908,1.06691, 13ValHb, 13ValHgb*,6.62E+05 190,190,2.15908,0.97313, 13ValHb, 13ValHga*,1.18E+06 191,191,1.06036,1.06463, 13ValHgb*, 13ValHgb*,4.39E+07 192,192,0.9658,0.9765, 13ValHga*, 13ValHga*,9.17E+07 193,193,3.88238,7.39726, 13ValHa, 13ValH,8.05E+05 194,194,2.16436,7.39743, 13ValHb, 13ValH,7.68E+05 195,195,1.06102,7.39743, 13ValHgb*, 13ValH,7.00E+05 196,196,0.98171,7.39436, 13ValHga*, 13ValH,3.13E+05 197,197,2.16459,3.88087, 13ValHb, 13ValHa,7.53E+05 198,198,1.0616,3.8799, 13ValHgb*, 13ValHa,6.70E+05 199,199,0.98171,3.8818, 13ValHga*, 13ValHa,8.12E+05 200,200,1.06358,2.16763, 13ValHgb*, 13ValHb,8.93E+05 201,201,0.98646,2.16686, 13ValHga*, 13ValHb,1.70E+06 202,202,0.98143,1.06878, 13ValHga*, 13ValHgb*,2.69E+06 203,203,7.60907,4.73397, 14AsnH, 14AsnHa,4.35E+05 204,204,7.61847,2.90691, 14AsnH, 14AsnHbb,4.01E+05 205,205,7.61397,2.78084, 14AsnH, 14AsnHba,6.17E+05 206,206,4.72908,2.91039, 14AsnHa, 14AsnHbb,5.42E+05 207,207,4.73019,2.79041, 14AsnHa, 14AsnHba,1.90E+05 208,208,2.9375,2.84913, 3AspHbb, 3AspHba,1.65E+06 209,209,4.73315,7.62452, 14AsnHa, 14AsnH,3.66E+05 210,210,2.91448,7.62982, 14AsnHbb, 14AsnH,3.05E+05 211,211,2.75806,7.60896, 14AsnHba, 14AsnH,4.81E+05 212,212,2.90815,4.73118, 14AsnHbb, 14AsnHa,6.10E+05 213,213,2.77947,2.91335, 14AsnHba, 14AsnHbb,3.65E+06 214,214,7.64183,5.15318, 15AsnH, 15AsnHa,4.46E+05 215,215,7.64113,2.77849, 15AsnH, 15AsnHbb,4.63E+05 216,216,7.639,2.6901, 15AsnH, 15AsnHba,1.08E+06 217,217,2.76737,7.63221, 15AsnHbb, 15AsnH,5.47E+05 218,218,2.68119,7.63341, 15AsnHba, 15AsnH,6.00E+05 219,219,2.68209,5.14967, 15AsnHba, 15AsnHa,6.92E+05 220,220,7.48988,3.74674, 10ValH, 10ValHa,5.80E+05 221,221,7.49173,2.04657, 10ValH, 10ValHb,1.68E+06 222,222,7.49123,0.99775, 10ValH, 10ValHgb*,1.07E+06 223,223,7.49092,0.88096, 10ValH, 10ValHga*,2.62E+05 224,224,3.74585,7.48969, 10ValHa, 10ValH,5.83E+05 225,225,2.04476,7.49019, 10ValHb, 10ValH,1.09E+06 226,226,1.00068,7.48998, 10ValHgb*, 10ValH,9.93E+05 227,227,0.8864,7.48779, 10ValHga*, 10ValH,1.77E+05 228,228,3.74562,2.04727, 10ValHa, 10ValHb,6.06E+05 229,229,3.74493,0.99679, 10ValHa, 10ValHgb*,1.34E+06 230,230,3.74542,0.883, 10ValHa, 10ValHga*,8.09E+05 231,231,2.04431,0.99781, 10ValHb, 10ValHgb*,1.14E+06 232,232,2.0452,0.88459, 10ValHb, 10ValHga*,9.73E+05 233,233,0.99397,0.9968, 10ValHgb*, 10ValHgb*,1.45E+08 234,234,1.00337,0.87995, 10ValHgb*, 10ValHga*,3.93E+05 235,235,0.88422,0.88236, 10ValHga*, 10ValHga*,4.20E+07 236,236,2.04641,3.74476, 10ValHb, 10ValHa,4.50E+05 237,237,0.99919,3.74581, 10ValHgb*, 10ValHa,1.10E+06 238,238,0.88455,3.74726, 10ValHga*, 10ValHa,7.39E+05 239,239,1.00138,2.04391, 10ValHgb*, 10ValHb,1.84E+06 240,240,0.88678,2.04847, 10ValHga*, 10ValHb,1.46E+06 241,241,0.88495,0.99663, 10ValHga*, 10ValHgb*,2.46E+06 242,242,8.79429,4.68805, 17HisH, 17HisHa,7.71E+05 243,243,8.79358,3.38919, 17HisH, 17HisHbb,3.34E+05 244,244,8.79174,3.31966, 17HisH, 17HisHba,5.04E+05 245,245,4.68608,3.3899, 17HisHa, 17HisHbb,4.47E+05 246,246,4.68482,3.34462, 17HisHa, 17HisHba,1380.40283 247,247,3.39439,3.31763, 17HisHbb, 17HisHba,2.91E+06 248,248,4.68612,8.80072, 17HisHa, 17HisH,4.88E+05 249,249,3.3857,8.7998, 17HisHbb, 17HisH,2.39E+05 250,250,3.32395,8.79704, 17HisHba, 17HisH,3.43E+05 251,251,3.39057,4.69131, 17HisHbb, 17HisHa,4.41E+05 252,252,3.32124,4.68455, 17HisHba, 17HisHa,4.06E+05 253,253,3.32632,3.38685, 17HisHba, 17HisHbb,4.06E+06 254,254,7.92945,4.83807, 19CysH, 19CysHa,3.15E+05 255,255,7.93061,3.27442, 19CysH, 19CysHbb,2.30E+05 256,256,7.92999,2.76589, 19CysH, 19CysHba,4.67E+05 257,257,3.26312,2.76694, 19CysHbb, 19CysHba,3.27E+06 258,258,3.27719,7.93453, 19CysHbb, 19CysH,3.40E+05 259,259,2.77708,7.93276, 19CysHba, 19CysH,4.08E+05 260,260,3.86355,1.9689, 1IleHa, 1IleHb,5.23E+05 261,261,3.86304,1.4892, 1IleHa, 1IleHg1b,7.16E+04 262,262,3.86445,1.22215, 1IleHa, 1IleHg1a,7.56E+04 263,263,1.96395,1.22725, 1IleHb, 1IleHg1a,1.27E+05 264,264,3.86533,0.9291, 1IleHa, 1IleHd1*,1.42E+05 265,265,1.96554,0.99698, 1IleHb, 1IleHg2*,3.10E+05 266,266,1.96945,0.92558, 1IleHb, 1IleHd1*,7.83E+04 267,267,1.20542,0.93044, 1IleHg1a, 1IleHd1*,2.76E+04 268,268,0.92393,0.92375, 1IleHd1*, 1IleHd1*,1.23E+08 269,269,1.96608,3.86199, 1IleHb, 1IleHa,4.38E+05 270,270,1.4827,3.86165, 1IleHg1b, 1IleHa,6.82E+04 271,271,1.21883,3.86615, 1IleHg1a, 1IleHa,9.95E+04 272,272,0.98996,3.8609, 1IleHg2*, 1IleHa,8.27E+05 273,273,1.49212,1.96845, 1IleHg1b, 1IleHb,2.19E+05 274,274,1.2273,1.96223, 1IleHg1a, 1IleHb,1.63E+05 275,275,0.99477,1.96589, 1IleHg2*, 1IleHb,8.46E+05 276,276,0.92703,1.96141, 1IleHd1*, 1IleHb,3.04E+05 277,277,1.49147,1.22541, 1IleHg1b, 1IleHg1a,1.02E+06 278,278,1.21624,1.48905, 1IleHg1a, 1IleHg1b,9.52E+05 279,279,8.89917,8.50389, 4GluH, 5CysH,4.70E+05 280,280,8.89897,8.17075, 4GluH, 6CysH,2.99E+04 281,281,8.80163,7.9368, 17HisH, 19CysH,3.30E+04 282,282,8.79332,7.62957, 17HisH, 18ValH,5.26E+05 283,283,8.50788,8.1691, 5CysH, 6CysH,5.06E+05 284,284,8.50945,7.84685, 5CysH, 7SerH,5.69E+04 285,285,8.89792,8.78006, 4GluH, 3AspH,4.22E+05 286,286,8.52924,7.96162, 12ArgH, 8AsnH,5.86E+04 287,287,8.52968,7.66181, 12ArgH, 11CysH,7.06E+05 288,288,8.53041,7.4897, 12ArgH, 10ValH,1.01E+05 289,289,8.53027,7.3969, 12ArgH, 13ValH,5.11E+05 290,290,8.17041,7.85242, 6CysH, 7SerH,5.34E+05 291,291,7.96939,7.8539, 8AsnH, 7SerH,7.47E+05 292,292,7.92998,7.6292, 19CysH, 18ValH,6.78E+05 293,293,7.66276,7.49008, 11CysH, 10ValH,1.07E+06 294,294,8.16855,8.50463, 6CysH, 5CysH,5.41E+05 295,295,8.16959,8.89677, 6CysH, 4GluH,6.63E+04 296,296,7.84915,8.16907, 7SerH, 6CysH,5.16E+05 297,297,7.84904,7.96212, 7SerH, 8AsnH,9.28E+05 298,298,7.8497,8.49982, 7SerH, 5CysH,8.87E+04 299,299,7.96472,8.52524, 8AsnH, 12ArgH,1.11E+05 300,300,7.62886,7.93264, 18ValH, 19CysH,7.15E+05 301,301,7.968,8.16665, 8AsnH, 6CysH,1.10E+05 302,302,7.4902,7.66284, 10ValH, 11CysH,9.21E+05 303,303,8.5064,8.89703, 5CysH, 4GluH,5.81E+05 304,304,7.49389,5.30427, 10ValH, 8AsnHa,1.12E+05 305,305,5.30211,4.04319, 8AsnHa, 9ProHdb,1.52E+06 306,306,4.134,4.04567, 9ProHa, 9ProHdb,1.42E+05 307,307,4.12831,2.39876, 9ProHa, 9ProHbb,1.19E+06 308,308,4.12932,2.03185, (9Pro/11Cys)(Ha/Hbb), 12ArgHgb,9.04E+05 309,309,4.12854,2.14602, 9ProHa, 9ProHga,1.62E+05 310,310,4.12774,3.95433, 9ProHa, 9ProHda,1.85E+05 311,311,4.03776,3.95258, 9ProHdb, 9ProHda,3.91E+06 312,312,4.04142,2.39923, 9ProHdb, 9ProHbb,1.58E+05 313,313,4.04055,2.14828, 9ProHdb, 9ProHga,4.62E+05 314,314,4.13191,2.07578, 9ProHa, 9ProHba,5.79E+05 315,315,4.04191,2.06802, 9ProHdb, 9ProHba,5.99E+05 316,316,3.95999,2.39672, 9ProHda, 9ProHbb,1.30E+05 317,317,3.95471,2.14995, 9ProHda, 9ProHga,6.75E+05 318,318,3.95618,2.0729, 9ProHda, 9ProHba,6.91E+05 319,319,2.39762,2.14739, 9ProHbb, 9ProHga,3.92E+05 320,320,2.39762,2.06662, 9ProHbb, 9ProHba,1.44E+06 321,321,2.1386,2.07055, 9ProHga, 9ProHba,2.72E+06 322,322,3.30464,4.13432, 11CysHba, 11CysHbb,2.13E+06 323,323,2.39743,4.13503, 9ProHbb, 9ProHa,1.02E+06 324,324,2.14502,4.13461, 9ProHga, 9ProHa,1.78E+05 325,325,2.07375,4.13563, 9ProHba, 9ProHa,3.67E+05 326,326,2.07877,4.04445, 9ProHba, 9ProHdb,4.41E+05 327,327,2.14764,4.04482, 9ProHga, 9ProHdb,4.65E+05 328,328,2.39042,4.04214, 9ProHbb, 9ProHdb,9.53E+04 329,329,3.95997,4.04044, 9ProHda, 9ProHdb,6.82E+06 330,330,2.39596,3.9546, 9ProHbb, 9ProHda,1.14E+05 331,331,2.14781,3.95407, 9ProHga, 9ProHda,6.51E+05 332,332,2.07542,3.95335, 9ProHba, 9ProHda,4.18E+05 333,333,2.14799,2.40116, 9ProHga, 9ProHbb,6.92E+05 334,334,2.06957,2.40108, 9ProHba, 9ProHbb,8.95E+05 335,335,2.07689,2.14717, 9ProHba, 9ProHga,3.24E+06 336,336,4.52883,3.52283, 16HypHa, 16HypHd2a,8.36E+04 337,337,4.52834,2.21846, 16HypHa, 16HypHbb,1.74E+06 338,338,4.52799,1.90661, 16HypHa, 16HypHba,8.56E+05 339,339,4.33449,3.80432, 16HypHg, 16HypHd1,7.20E+05 340,340,4.3338,3.52458, 16HypHg, 16HypHd2a,5.17E+05 341,341,4.33417,2.21677, 16HypHg, 16HypHbb,4.72E+05 342,342,4.33438,1.90469, 16HypHg, 16HypHba,8.17E+05 343,343,3.79752,3.52438, 16HypHd1, 16HypHd2a,3.56E+06 344,344,3.79923,2.21658, 16HypHd1, 16HypHbb,1.26E+05 345,345,3.79685,1.90577, 16HypHd1, 16HypHba,2.48E+05 346,346,3.52821,2.218, 16HypHd2a, 16HypHbb,1.74E+05 347,347,3.5278,1.90529, 16HypHd2a, 16HypHba,1.52E+05 348,348,2.2175,1.90593, 16HypHbb, 16HypHba,2.90E+06 349,349,1.90467,2.21689, 16HypHba, 16HypHbb,2.85E+06 350,350,1.91221,3.52475, 16HypHba, 16HypHd2a,1.11E+05 351,351,2.21698,3.52525, 16HypHbb, 16HypHd2a,1.82E+05 352,352,1.89781,3.80331, 16HypHba, 16HypHd1,2.19E+05 353,353,2.21695,3.80477, 16HypHbb, 16HypHd1,1.27E+05 354,354,3.52769,3.8046, 16HypHd2a, 16HypHd1,2.78E+06 355,355,3.797,4.32776, 16HypHd1, 16HypHg,4.24E+05 356,356,3.5196,4.32476, 16HypHd2a, 16HypHg,1.75E+05 357,357,2.21689,4.33061, 16HypHbb, 16HypHg,2.93E+05 358,358,1.90061,4.33536, 16HypHba, 16HypHg,5.45E+05 359,359,8.9003,4.60252, 4GluH, 3AspHa,1.59E+06 360,360,8.89451,4.34817, 4GluH, 2ArgHa,4.15E+04 361,361,8.79385,4.5306, 17HisH, 16HypHa,8.68E+05 362,362,8.50844,4.60273, 5CysH, 3AspHa,1.63E+05 363,363,8.16785,4.60547, 6CysH, 3AspHa,8.84E+04 364,364,8.50783,4.23161, 5CysH, 4GluHa,6.63E+05 365,365,8.53038,4.13403, 12ArgH, 11CysHbb,4.85E+05 366,366,8.52981,4.20702, 12ArgH, 11CysHa,3.36E+05 367,367,7.93045,4.23242, 19CysH, 18ValHa,4.78E+05 368,368,7.96868,4.5132, 8AsnH, 7SerHa,2.03E+05 369,369,7.96967,4.02143, 8AsnH, 7SerHbb,1.42E+05 370,370,7.97014,3.97014, 8AsnH, 7SerHba,1.50E+05 371,371,8.79082,3.8629, 2ArgH, 1IleHa,1.46E+06 372,372,7.40064,2.01965, 13ValH, 12ArgHgb,2.78E+05 373,373,7.40072,1.85801, 13ValH, 12ArgHga,4.09E+05 374,374,7.39931,1.72992, 12ArgHe, 12ArgHbb,1.21E+05 375,375,7.39659,1.59815, 13ValH, 12ArgHba,1.45E+05 376,376,7.66287,2.04737, 11CysH, 10ValHb,8.13E+05 377,377,7.49003,2.15104, 10ValH, 9ProHga,2.52E+05 378,378,7.92766,2.19592, 19CysH, 18ValHb,2.47E+05 379,379,8.79373,2.21214, 17HisH, 16HypHbb,2.11E+05 380,380,8.79287,1.97177, 2ArgH, 1IleHb,3.32E+05 381,381,8.79784,1.9057, 17HisH, 16HypHba,1.94E+05 382,382,7.9308,0.97098, 19CysH, 18ValHgb*,2.52E+05 383,383,7.83042,0.97357, 15AsnHd2b, 18ValHgb*,1.04E+05 384,384,7.93213,8.79603, 19CysH, 17HisH,5.41E+04 385,385,7.62936,8.79801, 18ValH, 17HisH,5.02E+05 386,386,7.6624,8.52734, 11CysH, 12ArgH,7.29E+05 387,387,7.48743,8.52536, 10ValH, 12ArgH,7.83E+04 388,388,7.39893,8.5278, 13ValH, 12ArgH,4.22E+05 389,389,8.79981,5.15106, 17HisH, 15AsnHa,6.58E+04 390,390,7.4905,3.95372, 10ValH, 9ProHda,2.88E+05 391,391,7.49033,4.04322, 10ValH, 9ProHdb,7.64E+04 392,392,7.4923,4.13603, 10ValH, 11CysHbb,1.53E+05 393,393,4.47009,3.21258, 5CysHa, 8AsnHbb,1.81E+05 394,394,4.13125,1.85589, 9ProHa, 12ArgHga,4.14E+05 395,395,4.12903,1.72838, 9ProHa, 12ArgHbb,1.37E+05 396,396,4.12904,1.60374, 9ProHa, 12ArgHba,1.42E+05 397,397,3.74655,2.16407, 10ValHa, 13ValHb,1.97E+05 398,398,3.52297,2.6892, 16HypHd2a, 15AsnHba,1.14E+05 399,399,3.79673,2.68888, 16HypHd1, 15AsnHba,1.36E+05 400,400,3.94995,2.69471, 12ArgHa, 15AsnHba,1.69E+05 401,401,4.36843,2.01657, 6CysHa, 12ArgHgb,4.03E+05 402,402,2.19365,2.68595, 18ValHb, 15AsnHba,3.88E+05 403,403,2.68126,2.19802, 15AsnHba, 18ValHb,2.13E+05 404,404,1.96791,1.49516, 1IleHb, 1IleHg1b,1.86E+05 405,405,4.36838,3.9486, 6CysHa, 12ArgHa,9.23E+04 406,406,7.66331,3.20831, 11CysH, 8AsnHbb,2.86E+05 407,407,7.84859,3.27679, 7SerH, 12ArgHda,1.35E+05 408,408,7.66168,3.74704, 11CysH, 10ValHa,2.19E+05 409,409,7.39993,3.74754, 13ValH, 10ValHa,1.03E+05 410,410,7.61265,3.8816, 14AsnH, 13ValHa,2.52E+05 411,411,8.7773,4.34763, 3AspH, 2ArgHa,2.34E+06 412,412,7.6324,3.523, 15AsnH, 16HypHd2a,2.17E+05 413,413,7.40086,3.94999, 13ValH, 12ArgHa,2.14E+05 414,414,8.7896,3.79882, 17HisH, 16HypHd1,7.95E+04 415,415,8.90106,2.91519, 4GluH, 3AspHbb,2.45E+05 416,416,8.89955,2.84478, 4GluH, 3AspHba,3.26E+05 417,417,8.16931,2.76105, 6CysH, (5Cys/19Cys)Hba,5.60E+05 418,418,8.02834,2.88245, 8AsnHd2b, 8AsnHba,4.82E+05 419,419,2.85061,8.89463, 3AspHba, 4GluH,2.39E+05 420,420,2.91128,8.89882, 3AspHbb, 4GluH,1.79E+05 421,421,3.86578,8.79686, 1IleHa, 2ArgH,1.81E+06 422,422,4.59805,8.89686, 3AspHa, 4GluH,1.78E+06 423,423,4.52859,8.79836, 16HypHa, 17HisH,9.78E+05 424,424,4.46404,8.8981, 5CysHa, 4GluH,9.55E+04 425,425,4.22968,8.50582, 4GluHa, 5CysH,5.11E+05 426,426,1.85549,4.13592, 12ArgHga, 9ProHa,4.42E+05 427,427,1.72798,4.13588, 12ArgHbb, 11CysHbb,2.05E+05 428,428,1.59722,4.13614, 12ArgHba, 9ProHa,2.37E+05 429,429,2.01588,4.36951, 12ArgHgb, 6CysHa,3.27E+05 430,430,2.16264,3.7467, 13ValHb, 10ValHa,1.59E+05 431,431,1.05985,3.74578, 13ValHgb*, 10ValHa,3.35E+05 432,432,4.19784,3.21189, 11CysHa, 8AsnHbb,1.34E+05 433,433,4.12857,3.21244, 11CysHbb, 8AsnHbb,2.40E+05 434,434,8.7879,3.52531, 17HisH, 16HypHd2a,5.84E+04 435,435,8.51026,2.04842, 5CysH, 4GluHba,3.47E+05 436,436,8.50807,2.17919, 5CysH, 4GluHbb,2.44E+05 437,437,8.50939,2.50337, 5CysH, 4GluHga,9.59E+04 438,438,8.50587,2.90778, (5Cys/12Arg)H, 8AsnHba,1.49E+05 439,439,8.16715,4.46936, 6CysH, 5CysHa,1.42E+05 440,440,8.02862,3.20815, 8AsnHd2b, 8AsnHbb,2.75E+05 441,441,8.02585,7.25988, 8AsnHd2b, 8AsnHd2a,4.25E+06 442,442,8.02944,5.30337, 8AsnHd2b, 8AsnHa,1.41E+05 443,443,8.02898,3.31047, 8AsnHd2b, 11CysHba,2.50E+04 444,444,7.63228,4.53251, (15Asn/18Val)H, 16HypHa,1.14E+05 445,445,7.63068,4.683, 18ValH, 17HisHa,3.69E+05 446,446,7.82973,7.39321, 15AsnHd2b, 15AsnHd2a,3.81E+06 447,447,7.82997,2.69223, 15AsnHd2b, 15AsnHba,9.16E+05 448,448,7.82939,2.77287, 15AsnHd2b, 15AsnHbb,2.64E+05 449,449,7.85178,2.88687, 7SerH, 8AsnHba,3.19E+05 450,450,7.69657,7.08143, 14AsnHd2b, 14AsnHd2a,5.30E+06 451,451,7.82887,7.63542, 15AsnHd2b, 18ValH,3.43E+05 452,452,7.49189,2.39894, 10ValH, 9ProHbb,1.22E+05 453,453,3.19035,1.79595, 2ArgHda, 2ArgHbb,5.71E+05 454,454,3.19076,1.62892, 2ArgHda, 2ArgHba,7.84E+05 455,455,8.789,0.99503, (2Arg/17His)H, (18Val/1Ile)(Hgb*/Hg2*),1.93E+05 456,456,3.74585,1.06489, 10ValHa, 13ValHgb*,3.75E+05 457,457,3.94692,0.9788, 12ArgHa, 13ValHga*,3.29E+05 458,458,7.38831,7.83288, 15AsnHd2a, 15AsnHd2b,3.68E+06 459,459,7.26582,8.02819, 8AsnHd2a, 8AsnHd2b,4.69E+06 460,460,7.07929,7.69884, 14AsnHd2a, 14AsnHd2b,5.50E+06 461,461,7.07999,2.90096, 14AsnHd2a, 14AsnHbb,1.53E+05 462,462,7.07713,2.77513, 14AsnHd2a, 14AsnHba,2.43E+05 463,463,7.39151,2.77674, (13Val/15Asn)H, (15Asn/14Asn)Hb*,2.28E+05 464,464,7.39075,2.6914, 15AsnHd2a, 15AsnHba,3.59E+05 465,465,8.53241,2.87845, 12ArgH, 8AsnHba,1.15E+05 466,466,7.39008,2.89794, (13Val/12Arg)H, {*}Hb*,1.50E+05 467,467,4.20532,2.77666, 11CysHa, 5CysHba,2.15E+05 468,468,4.20185,2.8984, (11Cys/4Glu)Ha, {*}Hb*,1.56E+05 469,469,5.30211,3.95839, 8AsnHa, 9ProHda,1.09E+06 470,470,4.04192,5.30343, 9ProHdb, 8AsnHa,1.50E+06 471,471,3.95692,5.30388, 9ProHda, 8AsnHa,1.41E+06 472,472,3.79748,5.14978, 16HypHd1, 15AsnHa,9.99E+05 473,473,3.51551,5.15024, 16HypHd2a, 15AsnHa,6.29E+05 474,474,3.27556,4.83936, 19CysHbb, 19CysHa,7.50E+05 475,475,2.91347,5.12525, 14AsnHbb, 15AsnHa,1.56E+05 476,476,2.21765,4.53029, 16HypHbb, 16HypHa,1.06E+06 477,477,1.90534,4.53018, 16HypHba, 16HypHa,5.45E+05 478,478,2.75687,1.72125, {*}Hb*, 12ArgHbb,9.16E+04 479,479,2.76608,1.60092, {*}Hb*, 12ArgHba,7.73E+04 480,480,2.68247,0.97235, 15AsnHba, 18ValHgb*,5.41E+05 481,481,4.12848,2.88569, 9ProHa, 8AsnHba,1.34E+05 482,482,7.66227,0.8821, 11CysH, 10ValHga*,2.19E+05 483,483,7.69451,0.88522, 14AsnHd2b, 10ValHga*,2.58E+05 484,484,7.6132,1.06574, 14AsnH, 13ValHgb*,1.39E+05 485,485,7.69634,1.06266, 14AsnHd2b, 13ValHgb*,5.81E+04 486,486,7.83468,5.14948, 15AsnHd2b, 15AsnHa,7.90E+04 487,487,4.12784,8.52663, 9ProHa, 12ArgH,3.46E+05 488,488,3.79528,8.79976, 16HypHd1, 17HisH,8.30E+04 489,489,2.21524,8.79625, 16HypHbb, 17HisH,1.31E+05 490,490,1.97028,8.79542, 1IleHb, 2ArgH,2.84E+05 491,491,1.91162,8.79755, 16HypHba, 17HisH,1.09E+05 492,492,1.59555,8.52499, 12ArgHba, 12ArgH,1.57E+05 493,493,1.72723,8.52807, 12ArgHbb, 12ArgH,1.93E+05 494,494,1.85103,8.52706, 12ArgHga, 12ArgH,3.57E+05 495,495,2.01686,8.52706, 12ArgHgb, 12ArgH,4.75E+05 496,496,2.19325,7.93354, 18ValHb, 19CysH,2.21E+05 497,497,2.17838,8.51466, 4GluHbb, 5CysH,1.49E+05 498,498,2.49344,8.49956, 4GluHga, 5CysH,5.47E+04 499,499,4.46151,8.16961, 5CysHa, 6CysH,1.85E+05 500,500,4.22842,8.16988, 4GluHa, 6CysH,8.12E+04 501,501,2.76044,8.16869, 19CysHba, 6CysH,3.65E+05 502,502,3.29599,8.03092, 6CysHbb, 8AsnHd2b,1.13E+05 503,503,2.88595,8.02763, 8AsnHba, 8AsnHd2b,3.80E+05 504,504,3.20887,8.02798, 8AsnHbb, 8AsnHd2b,2.44E+05 505,505,4.51324,7.96183, 7SerHa, 8AsnH,2.81E+05 506,506,4.23384,7.93289, 18ValHa, 19CysH,5.72E+05 507,507,4.35711,7.85006, 6CysHa, 7SerH,1.27E+05 508,508,4.21538,7.83721, (18Val/4Glu)Ha, (7Ser/15Asn)H,2.31E+05 509,509,3.27845,7.86032, 6CysHbb, 7SerH,1.91E+05 510,510,2.88684,7.84889, (6Cys/8Asn)Hba, 7SerH,2.89E+05 511,511,2.68758,7.82889, 15AsnHba, 15AsnHd2b,5.92E+05 512,512,2.04432,7.66054, 10ValHb, 11CysH,4.82E+05 513,513,2.77001,7.69847, 15AsnHbb, 14AsnHd2b,3.53E+05 514,514,3.51567,7.6344, 16HypHd2a, 15AsnH,1.96E+05 515,515,3.74565,7.66173, 10ValHa, 11CysH,2.39E+05 516,516,3.94825,7.64007, 12ArgHa, (14Asn/15Asn)H,2.75E+05 517,517,4.52551,7.62957, 16HypHa, 18ValH,1.49E+05 518,518,4.68791,7.62899, 17HisHa, 18ValH,3.34E+05 519,519,3.95635,7.48992, 9ProHda, 10ValH,2.39E+05 520,520,4.04029,7.49045, 9ProHdb, 10ValH,1.18E+05 521,521,4.1287,7.49041, 9ProHa, 10ValH,1.87E+05 522,522,4.12981,7.38612, 9ProHa, 13ValH,2.64E+05 523,523,2.68658,7.39342, 15AsnHba, 15AsnHd2a,2.67E+05 524,524,3.74595,7.39675, 10ValHa, 13ValH,1.88E+05 525,525,2.14751,5.30526, 9ProHga, 8AsnHa,9.49E+04 526,526,2.06541,5.29949, 9ProHba, 8AsnHa,9.47E+04 527,527,7.62763,3.32013, 18ValH, 17HisHba,1.33E+05 528,528,7.62904,3.38883, 18ValH, 17HisHbb,1.43E+05 529,529,7.84916,4.36836, 7SerH, 6CysHa,8.14E+04 530,530,2.76889,4.21023, 5CysHba, 11CysHa,1.82E+05 531,531,7.69554,2.90074, 14AsnHd2b, 14AsnHbb,3.15E+05 532,532,7.69521,2.77627, 14AsnHd2b, 14AsnHba,5.14E+05 533,533,2.6843,3.94919, 15AsnHba, 12ArgHa,8.92E+04 534,534,2.67939,3.80539, 15AsnHba, 16HypHd1,8.14E+04 535,535,7.49091,8.02664, 10ValH, 8AsnHd2b,6.61E+04 536,536,2.68442,3.52024, 15AsnHba, 16HypHd2a,1.23E+05 537,537,7.39911,7.61557, (15Asn/13Val)(Hd2a/H), (14Asn/18Val)H,6.29E+05 ; loop_ _Spectral_dim.ID _Spectral_dim.Atom_type _Spectral_dim.Atom_isotope_number _Spectral_dim.Spectral_region _Spectral_dim.Magnetization_linkage_ID _Spectral_dim.Under_sampling_type _Spectral_dim.Sweep_width _Spectral_dim.Sweep_width_units _Spectral_dim.Center_frequency_offset _Spectral_dim.Encoding_code _Spectral_dim.Encoded_source_dimension_ID _Spectral_dim.Entry_ID _Spectral_dim.Spectral_peak_list_ID 1 H 1 H . aliased 7.503 ppm 3.294 . . c30225_5ug3 2 2 C 13 C . aliased 79.993 ppm 42.025 . . c30225_5ug3 2 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 c30225_5ug3 _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 20 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 c30225_5ug3 _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 . . . c30225_5ug3 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 . . . . c30225_5ug3 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 ILE C C -9.810 -4.148 -1.039 . . . 1.0 . . . . . . . . . . . . A . 1 ILE C . . . . . . . . . c30225_5ug3 1 . 1 . 2 . 1 1 1 ILE CA C -9.517 -5.359 -1.915 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CA . . . . . . . . . c30225_5ug3 1 . 1 . 3 . 1 1 1 ILE CB C -10.640 -5.528 -2.955 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CB . . . . . . . . . c30225_5ug3 1 . 1 . 4 . 1 1 1 ILE CD1 C -11.502 -7.077 -4.791 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CD1 . . . . . . . . . c30225_5ug3 1 . 1 . 5 . 1 1 1 ILE CG1 C -10.418 -6.807 -3.773 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CG1 . . . . . . . . . c30225_5ug3 1 . 1 . 6 . 1 1 1 ILE CG2 C -10.703 -4.313 -3.875 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CG2 . . . . . . . . . c30225_5ug3 1 . 1 . 7 . 1 1 1 ILE H1 H -9.140 -7.392 -1.657 . . . 1.0 . . . . . . . . . . . . A . 1 ILE H1 . . . . . . . . . c30225_5ug3 1 . 1 . 8 . 1 1 1 ILE H2 H -10.243 -6.753 -0.550 . . . 1.0 . . . . . . . . . . . . A . 1 ILE H2 . . . . . . . . . c30225_5ug3 1 . 1 . 9 . 1 1 1 ILE H3 H -8.594 -6.424 -0.384 . . . 1.0 . . . . . . . . . . . . A . 1 ILE H3 . . . . . . . . . c30225_5ug3 1 . 1 . 10 . 1 1 1 ILE HA H -8.589 -5.191 -2.440 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HA . . . . . . . . . c30225_5ug3 1 . 1 . 11 . 1 1 1 ILE HB H -11.572 -5.599 -2.425 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HB . . . . . . . . . c30225_5ug3 1 . 1 . 12 . 1 1 1 ILE HD11 H -11.274 -7.985 -5.329 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HD11 . . . . . . . . . c30225_5ug3 1 . 1 . 13 . 1 1 1 ILE HD12 H -11.557 -6.251 -5.485 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HD12 . . . . . . . . . c30225_5ug3 1 . 1 . 14 . 1 1 1 ILE HD13 H -12.450 -7.186 -4.287 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HD13 . . . . . . . . . c30225_5ug3 1 . 1 . 15 . 1 1 1 ILE HG12 H -9.482 -6.726 -4.304 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG12 . . . . . . . . . c30225_5ug3 1 . 1 . 16 . 1 1 1 ILE HG13 H -10.373 -7.653 -3.103 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG13 . . . . . . . . . c30225_5ug3 1 . 1 . 17 . 1 1 1 ILE HG21 H -10.899 -3.427 -3.290 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG21 . . . . . . . . . c30225_5ug3 1 . 1 . 18 . 1 1 1 ILE HG22 H -11.496 -4.449 -4.597 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG22 . . . . . . . . . c30225_5ug3 1 . 1 . 19 . 1 1 1 ILE HG23 H -9.763 -4.204 -4.393 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG23 . . . . . . . . . c30225_5ug3 1 . 1 . 20 . 1 1 1 ILE N N -9.364 -6.566 -1.070 . . . 1.0 . . . . . . . . . . . . A . 1 ILE N . . . . . . . . . c30225_5ug3 1 . 1 . 21 . 1 1 1 ILE O O -10.966 -3.806 -0.778 . . . 1.0 . . . . . . . . . . . . A . 1 ILE O . . . . . . . . . c30225_5ug3 1 . 1 . 22 . 1 1 2 ARG C C -7.390 -1.822 0.486 . . . 1.0 . . . . . . . . . . . . A . 2 ARG C . . . . . . . . . c30225_5ug3 1 . 1 . 23 . 1 1 2 ARG CA C -8.802 -2.375 0.303 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CA . . . . . . . . . c30225_5ug3 1 . 1 . 24 . 1 1 2 ARG CB C -9.401 -2.775 1.659 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CB . . . . . . . . . c30225_5ug3 1 . 1 . 25 . 1 1 2 ARG CD C -11.013 -0.855 1.961 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CD . . . . . . . . . c30225_5ug3 1 . 1 . 26 . 1 1 2 ARG CG C -9.825 -1.608 2.542 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CG . . . . . . . . . c30225_5ug3 1 . 1 . 27 . 1 1 2 ARG CZ C -11.468 0.493 -0.057 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CZ . . . . . . . . . c30225_5ug3 1 . 1 . 28 . 1 1 2 ARG H H -7.862 -3.864 -0.849 . . . 1.0 . . . . . . . . . . . . A . 2 ARG H . . . . . . . . . c30225_5ug3 1 . 1 . 29 . 1 1 2 ARG HA H -9.422 -1.628 -0.163 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HA . . . . . . . . . c30225_5ug3 1 . 1 . 30 . 1 1 2 ARG HB2 H -10.269 -3.392 1.482 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB2 . . . . . . . . . c30225_5ug3 1 . 1 . 31 . 1 1 2 ARG HB3 H -8.668 -3.355 2.199 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB3 . . . . . . . . . c30225_5ug3 1 . 1 . 32 . 1 1 2 ARG HD2 H -11.720 -1.573 1.572 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD2 . . . . . . . . . c30225_5ug3 1 . 1 . 33 . 1 1 2 ARG HD3 H -11.482 -0.288 2.751 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD3 . . . . . . . . . c30225_5ug3 1 . 1 . 34 . 1 1 2 ARG HE H -9.703 0.390 0.877 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HE . . . . . . . . . c30225_5ug3 1 . 1 . 35 . 1 1 2 ARG HG2 H -10.095 -1.988 3.514 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG2 . . . . . . . . . c30225_5ug3 1 . 1 . 36 . 1 1 2 ARG HG3 H -8.993 -0.925 2.640 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG3 . . . . . . . . . c30225_5ug3 1 . 1 . 37 . 1 1 2 ARG HH11 H -13.049 -0.611 0.571 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH11 . . . . . . . . . c30225_5ug3 1 . 1 . 38 . 1 1 2 ARG HH12 H -13.349 0.392 -0.811 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH12 . . . . . . . . . c30225_5ug3 1 . 1 . 39 . 1 1 2 ARG HH21 H -10.091 1.711 -0.907 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH21 . . . . . . . . . c30225_5ug3 1 . 1 . 40 . 1 1 2 ARG HH22 H -11.657 1.706 -1.669 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH22 . . . . . . . . . c30225_5ug3 1 . 1 . 41 . 1 1 2 ARG N N -8.738 -3.531 -0.578 . . . 1.0 . . . . . . . . . . . . A . 2 ARG N . . . . . . . . . c30225_5ug3 1 . 1 . 42 . 1 1 2 ARG NE N -10.633 0.058 0.885 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NE . . . . . . . . . c30225_5ug3 1 . 1 . 43 . 1 1 2 ARG NH1 N -12.721 0.053 -0.103 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH1 . . . . . . . . . c30225_5ug3 1 . 1 . 44 . 1 1 2 ARG NH2 N -11.041 1.374 -0.949 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH2 . . . . . . . . . c30225_5ug3 1 . 1 . 45 . 1 1 2 ARG O O -6.941 -1.558 1.605 . . . 1.0 . . . . . . . . . . . . A . 2 ARG O . . . . . . . . . c30225_5ug3 1 . 1 . 46 . 1 1 3 ASP C C -5.150 0.242 -0.451 . . . 1.0 . . . . . . . . . . . . A . 3 ASP C . . . . . . . . . c30225_5ug3 1 . 1 . 47 . 1 1 3 ASP CA C -5.284 -1.265 -0.612 . . . 1.0 . . . . . . . . . . . . A . 3 ASP CA . . . . . . . . . c30225_5ug3 1 . 1 . 48 . 1 1 3 ASP CB C -4.580 -1.705 -1.900 . . . 1.0 . . . . . . . . . . . . A . 3 ASP CB . . . . . . . . . c30225_5ug3 1 . 1 . 49 . 1 1 3 ASP CG C -4.676 -3.197 -2.146 . . . 1.0 . . . . . . . . . . . . A . 3 ASP CG . . . . . . . . . c30225_5ug3 1 . 1 . 50 . 1 1 3 ASP H H -7.133 -1.799 -1.494 . . . 1.0 . . . . . . . . . . . . A . 3 ASP H . . . . . . . . . c30225_5ug3 1 . 1 . 51 . 1 1 3 ASP HA H -4.813 -1.749 0.230 . . . 1.0 . . . . . . . . . . . . A . 3 ASP HA . . . . . . . . . c30225_5ug3 1 . 1 . 52 . 1 1 3 ASP HB2 H -5.025 -1.194 -2.739 . . . 1.0 . . . . . . . . . . . . A . 3 ASP HB2 . . . . . . . . . c30225_5ug3 1 . 1 . 53 . 1 1 3 ASP HB3 H -3.536 -1.437 -1.835 . . . 1.0 . . . . . . . . . . . . A . 3 ASP HB3 . . . . . . . . . c30225_5ug3 1 . 1 . 54 . 1 1 3 ASP N N -6.689 -1.661 -0.630 . . . 1.0 . . . . . . . . . . . . A . 3 ASP N . . . . . . . . . c30225_5ug3 1 . 1 . 55 . 1 1 3 ASP O O -4.693 0.937 -1.358 . . . 1.0 . . . . . . . . . . . . A . 3 ASP O . . . . . . . . . c30225_5ug3 1 . 1 . 56 . 1 1 3 ASP OD1 O -5.669 -3.639 -2.763 . . . 1.0 . . . . . . . . . . . . A . 3 ASP OD1 . . . . . . . . . c30225_5ug3 1 . 1 . 57 . 1 1 3 ASP OD2 O -3.768 -3.938 -1.727 . . . 1.0 . . . . . . . . . . . . A . 3 ASP OD2 . . . . . . . . . c30225_5ug3 1 . 1 . 58 . 1 1 4 GLU C C -4.044 2.654 1.036 . . . 1.0 . . . . . . . . . . . . A . 4 GLU C . . . . . . . . . c30225_5ug3 1 . 1 . 59 . 1 1 4 GLU CA C -5.487 2.168 0.983 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CA . . . . . . . . . c30225_5ug3 1 . 1 . 60 . 1 1 4 GLU CB C -6.195 2.485 2.301 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CB . . . . . . . . . c30225_5ug3 1 . 1 . 61 . 1 1 4 GLU CD C -8.461 2.536 1.193 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CD . . . . . . . . . c30225_5ug3 1 . 1 . 62 . 1 1 4 GLU CG C -7.636 2.005 2.345 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CG . . . . . . . . . c30225_5ug3 1 . 1 . 63 . 1 1 4 GLU H H -5.853 0.126 1.408 . . . 1.0 . . . . . . . . . . . . A . 4 GLU H . . . . . . . . . c30225_5ug3 1 . 1 . 64 . 1 1 4 GLU HA H -5.997 2.676 0.178 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HA . . . . . . . . . c30225_5ug3 1 . 1 . 65 . 1 1 4 GLU HB2 H -5.656 2.012 3.109 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HB2 . . . . . . . . . c30225_5ug3 1 . 1 . 66 . 1 1 4 GLU HB3 H -6.189 3.554 2.452 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HB3 . . . . . . . . . c30225_5ug3 1 . 1 . 67 . 1 1 4 GLU HG2 H -7.645 0.926 2.306 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HG2 . . . . . . . . . c30225_5ug3 1 . 1 . 68 . 1 1 4 GLU HG3 H -8.084 2.335 3.271 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HG3 . . . . . . . . . c30225_5ug3 1 . 1 . 69 . 1 1 4 GLU N N -5.533 0.739 0.711 . . . 1.0 . . . . . . . . . . . . A . 4 GLU N . . . . . . . . . c30225_5ug3 1 . 1 . 70 . 1 1 4 GLU O O -3.728 3.760 0.598 . . . 1.0 . . . . . . . . . . . . A . 4 GLU O . . . . . . . . . c30225_5ug3 1 . 1 . 71 . 1 1 4 GLU OE1 O -9.002 3.654 1.304 . . . 1.0 . . . . . . . . . . . . A . 4 GLU OE1 . . . . . . . . . c30225_5ug3 1 . 1 . 72 . 1 1 4 GLU OE2 O -8.581 1.832 0.171 . . . 1.0 . . . . . . . . . . . . A . 4 GLU OE2 . . . . . . . . . c30225_5ug3 1 . 1 . 73 . 1 1 5 CYS C C -1.051 2.218 0.332 . . . 1.0 . . . . . . . . . . . . A . 5 CYS C . . . . . . . . . c30225_5ug3 1 . 1 . 74 . 1 1 5 CYS CA C -1.758 2.133 1.686 . . . 1.0 . . . . . . . . . . . . A . 5 CYS CA . . . . . . . . . c30225_5ug3 1 . 1 . 75 . 1 1 5 CYS CB C -1.062 1.114 2.586 . . . 1.0 . . . . . . . . . . . . A . 5 CYS CB . . . . . . . . . c30225_5ug3 1 . 1 . 76 . 1 1 5 CYS H H -3.477 0.911 1.827 . . . 1.0 . . . . . . . . . . . . A . 5 CYS H . . . . . . . . . c30225_5ug3 1 . 1 . 77 . 1 1 5 CYS HA H -1.705 3.102 2.160 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HA . . . . . . . . . c30225_5ug3 1 . 1 . 78 . 1 1 5 CYS HB2 H -1.711 0.262 2.720 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HB2 . . . . . . . . . c30225_5ug3 1 . 1 . 79 . 1 1 5 CYS HB3 H -0.152 0.791 2.108 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HB3 . . . . . . . . . c30225_5ug3 1 . 1 . 80 . 1 1 5 CYS N N -3.167 1.797 1.540 . . . 1.0 . . . . . . . . . . . . A . 5 CYS N . . . . . . . . . c30225_5ug3 1 . 1 . 81 . 1 1 5 CYS O O 0.093 2.660 0.252 . . . 1.0 . . . . . . . . . . . . A . 5 CYS O . . . . . . . . . c30225_5ug3 1 . 1 . 82 . 1 1 5 CYS SG S -0.632 1.746 4.244 . . . 1.0 . . . . . . . . . . . . A . 5 CYS SG . . . . . . . . . c30225_5ug3 1 . 1 . 83 . 1 1 6 CYS C C -1.010 3.398 -2.451 . . . 1.0 . . . . . . . . . . . . A . 6 CYS C . . . . . . . . . c30225_5ug3 1 . 1 . 84 . 1 1 6 CYS CA C -1.184 1.930 -2.076 . . . 1.0 . . . . . . . . . . . . A . 6 CYS CA . . . . . . . . . c30225_5ug3 1 . 1 . 85 . 1 1 6 CYS CB C -2.102 1.244 -3.085 . . . 1.0 . . . . . . . . . . . . A . 6 CYS CB . . . . . . . . . c30225_5ug3 1 . 1 . 86 . 1 1 6 CYS H H -2.616 1.401 -0.610 . . . 1.0 . . . . . . . . . . . . A . 6 CYS H . . . . . . . . . c30225_5ug3 1 . 1 . 87 . 1 1 6 CYS HA H -0.215 1.450 -2.090 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HA . . . . . . . . . c30225_5ug3 1 . 1 . 88 . 1 1 6 CYS HB2 H -2.193 0.200 -2.827 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HB2 . . . . . . . . . c30225_5ug3 1 . 1 . 89 . 1 1 6 CYS HB3 H -3.077 1.707 -3.037 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HB3 . . . . . . . . . c30225_5ug3 1 . 1 . 90 . 1 1 6 CYS N N -1.730 1.808 -0.730 . . . 1.0 . . . . . . . . . . . . A . 6 CYS N . . . . . . . . . c30225_5ug3 1 . 1 . 91 . 1 1 6 CYS O O -0.085 3.756 -3.174 . . . 1.0 . . . . . . . . . . . . A . 6 CYS O . . . . . . . . . c30225_5ug3 1 . 1 . 92 . 1 1 6 CYS SG S -1.523 1.343 -4.810 . . . 1.0 . . . . . . . . . . . . A . 6 CYS SG . . . . . . . . . c30225_5ug3 1 . 1 . 93 . 1 1 7 SER C C -0.879 6.371 -1.243 . . . 1.0 . . . . . . . . . . . . A . 7 SER C . . . . . . . . . c30225_5ug3 1 . 1 . 94 . 1 1 7 SER CA C -1.831 5.678 -2.219 . . . 1.0 . . . . . . . . . . . . A . 7 SER CA . . . . . . . . . c30225_5ug3 1 . 1 . 95 . 1 1 7 SER CB C -3.240 6.280 -2.132 . . . 1.0 . . . . . . . . . . . . A . 7 SER CB . . . . . . . . . c30225_5ug3 1 . 1 . 96 . 1 1 7 SER H H -2.575 3.915 -1.318 . . . 1.0 . . . . . . . . . . . . A . 7 SER H . . . . . . . . . c30225_5ug3 1 . 1 . 97 . 1 1 7 SER HA H -1.452 5.800 -3.223 . . . 1.0 . . . . . . . . . . . . A . 7 SER HA . . . . . . . . . c30225_5ug3 1 . 1 . 98 . 1 1 7 SER HB2 H -3.918 5.687 -2.728 . . . 1.0 . . . . . . . . . . . . A . 7 SER HB2 . . . . . . . . . c30225_5ug3 1 . 1 . 99 . 1 1 7 SER HB3 H -3.568 6.270 -1.103 . . . 1.0 . . . . . . . . . . . . A . 7 SER HB3 . . . . . . . . . c30225_5ug3 1 . 1 . 100 . 1 1 7 SER HG H -3.065 8.218 -1.880 . . . 1.0 . . . . . . . . . . . . A . 7 SER HG . . . . . . . . . c30225_5ug3 1 . 1 . 101 . 1 1 7 SER N N -1.882 4.251 -1.925 . . . 1.0 . . . . . . . . . . . . A . 7 SER N . . . . . . . . . c30225_5ug3 1 . 1 . 102 . 1 1 7 SER O O -0.938 7.584 -1.035 . . . 1.0 . . . . . . . . . . . . A . 7 SER O . . . . . . . . . c30225_5ug3 1 . 1 . 103 . 1 1 7 SER OG O -3.272 7.617 -2.609 . . . 1.0 . . . . . . . . . . . . A . 7 SER OG . . . . . . . . . c30225_5ug3 1 . 1 . 104 . 1 1 8 ASN C C 2.333 5.523 0.006 . . . 1.0 . . . . . . . . . . . . A . 8 ASN C . . . . . . . . . c30225_5ug3 1 . 1 . 105 . 1 1 8 ASN CA C 0.952 6.050 0.338 . . . 1.0 . . . . . . . . . . . . A . 8 ASN CA . . . . . . . . . c30225_5ug3 1 . 1 . 106 . 1 1 8 ASN CB C 0.572 5.546 1.720 . . . 1.0 . . . . . . . . . . . . A . 8 ASN CB . . . . . . . . . c30225_5ug3 1 . 1 . 107 . 1 1 8 ASN CG C -0.747 6.101 2.223 . . . 1.0 . . . . . . . . . . . . A . 8 ASN CG . . . . . . . . . c30225_5ug3 1 . 1 . 108 . 1 1 8 ASN H H 0.018 4.626 -0.897 . . . 1.0 . . . . . . . . . . . . A . 8 ASN H . . . . . . . . . c30225_5ug3 1 . 1 . 109 . 1 1 8 ASN HA H 0.957 7.128 0.329 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HA . . . . . . . . . c30225_5ug3 1 . 1 . 110 . 1 1 8 ASN HB2 H 0.500 4.471 1.677 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HB2 . . . . . . . . . c30225_5ug3 1 . 1 . 111 . 1 1 8 ASN HB3 H 1.347 5.818 2.419 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HB3 . . . . . . . . . c30225_5ug3 1 . 1 . 112 . 1 1 8 ASN HD21 H -1.750 4.665 1.287 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HD21 . . . . . . . . . c30225_5ug3 1 . 1 . 113 . 1 1 8 ASN HD22 H -2.707 5.785 2.188 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HD22 . . . . . . . . . c30225_5ug3 1 . 1 . 114 . 1 1 8 ASN N N 0.001 5.574 -0.651 . . . 1.0 . . . . . . . . . . . . A . 8 ASN N . . . . . . . . . c30225_5ug3 1 . 1 . 115 . 1 1 8 ASN ND2 N -1.842 5.455 1.860 . . . 1.0 . . . . . . . . . . . . A . 8 ASN ND2 . . . . . . . . . c30225_5ug3 1 . 1 . 116 . 1 1 8 ASN O O 2.587 4.324 0.135 . . . 1.0 . . . . . . . . . . . . A . 8 ASN O . . . . . . . . . c30225_5ug3 1 . 1 . 117 . 1 1 8 ASN OD1 O -0.781 7.111 2.925 . . . 1.0 . . . . . . . . . . . . A . 8 ASN OD1 . . . . . . . . . c30225_5ug3 1 . 1 . 118 . 1 1 9 PRO C C 5.395 5.374 0.329 . . . 1.0 . . . . . . . . . . . . A . 9 PRO C . . . . . . . . . c30225_5ug3 1 . 1 . 119 . 1 1 9 PRO CA C 4.590 5.975 -0.816 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CA . . . . . . . . . c30225_5ug3 1 . 1 . 120 . 1 1 9 PRO CB C 5.231 7.274 -1.312 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CB . . . . . . . . . c30225_5ug3 1 . 1 . 121 . 1 1 9 PRO CD C 3.085 7.855 -0.488 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CD . . . . . . . . . c30225_5ug3 1 . 1 . 122 . 1 1 9 PRO CG C 4.498 8.347 -0.594 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CG . . . . . . . . . c30225_5ug3 1 . 1 . 123 . 1 1 9 PRO HA H 4.534 5.258 -1.623 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HA . . . . . . . . . c30225_5ug3 1 . 1 . 124 . 1 1 9 PRO HB2 H 6.283 7.278 -1.069 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HB2 . . . . . . . . . c30225_5ug3 1 . 1 . 125 . 1 1 9 PRO HB3 H 5.098 7.358 -2.377 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HB3 . . . . . . . . . c30225_5ug3 1 . 1 . 126 . 1 1 9 PRO HD2 H 2.619 8.246 0.398 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HD2 . . . . . . . . . c30225_5ug3 1 . 1 . 127 . 1 1 9 PRO HD3 H 2.521 8.126 -1.368 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HD3 . . . . . . . . . c30225_5ug3 1 . 1 . 128 . 1 1 9 PRO HG2 H 4.922 8.491 0.388 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HG2 . . . . . . . . . c30225_5ug3 1 . 1 . 129 . 1 1 9 PRO HG3 H 4.535 9.265 -1.161 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HG3 . . . . . . . . . c30225_5ug3 1 . 1 . 130 . 1 1 9 PRO N N 3.254 6.394 -0.400 . . . 1.0 . . . . . . . . . . . . A . 9 PRO N . . . . . . . . . c30225_5ug3 1 . 1 . 131 . 1 1 9 PRO O O 6.420 4.741 0.107 . . . 1.0 . . . . . . . . . . . . A . 9 PRO O . . . . . . . . . c30225_5ug3 1 . 1 . 132 . 1 1 10 VAL C C 5.141 3.577 2.960 . . . 1.0 . . . . . . . . . . . . A . 10 VAL C . . . . . . . . . c30225_5ug3 1 . 1 . 133 . 1 1 10 VAL CA C 5.572 5.026 2.729 . . . 1.0 . . . . . . . . . . . . A . 10 VAL CA . . . . . . . . . c30225_5ug3 1 . 1 . 134 . 1 1 10 VAL CB C 5.254 5.869 3.981 . . . 1.0 . . . . . . . . . . . . A . 10 VAL CB . . . . . . . . . c30225_5ug3 1 . 1 . 135 . 1 1 10 VAL CG1 C 6.077 5.407 5.172 . . . 1.0 . . . . . . . . . . . . A . 10 VAL CG1 . . . . . . . . . c30225_5ug3 1 . 1 . 136 . 1 1 10 VAL CG2 C 5.492 7.346 3.703 . . . 1.0 . . . . . . . . . . . . A . 10 VAL CG2 . . . . . . . . . c30225_5ug3 1 . 1 . 137 . 1 1 10 VAL H H 4.088 6.085 1.654 . . . 1.0 . . . . . . . . . . . . A . 10 VAL H . . . . . . . . . c30225_5ug3 1 . 1 . 138 . 1 1 10 VAL HA H 6.643 5.049 2.559 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HA . . . . . . . . . c30225_5ug3 1 . 1 . 139 . 1 1 10 VAL HB H 4.210 5.736 4.222 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HB . . . . . . . . . c30225_5ug3 1 . 1 . 140 . 1 1 10 VAL HG11 H 7.128 5.509 4.945 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HG11 . . . . . . . . . c30225_5ug3 1 . 1 . 141 . 1 1 10 VAL HG12 H 5.854 4.371 5.382 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HG12 . . . . . . . . . c30225_5ug3 1 . 1 . 142 . 1 1 10 VAL HG13 H 5.834 6.010 6.034 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HG13 . . . . . . . . . c30225_5ug3 1 . 1 . 143 . 1 1 10 VAL HG21 H 6.530 7.503 3.457 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HG21 . . . . . . . . . c30225_5ug3 1 . 1 . 144 . 1 1 10 VAL HG22 H 5.238 7.922 4.578 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HG22 . . . . . . . . . c30225_5ug3 1 . 1 . 145 . 1 1 10 VAL HG23 H 4.874 7.661 2.875 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HG23 . . . . . . . . . c30225_5ug3 1 . 1 . 146 . 1 1 10 VAL N N 4.914 5.567 1.548 . . . 1.0 . . . . . . . . . . . . A . 10 VAL N . . . . . . . . . c30225_5ug3 1 . 1 . 147 . 1 1 10 VAL O O 5.912 2.747 3.445 . . . 1.0 . . . . . . . . . . . . A . 10 VAL O . . . . . . . . . c30225_5ug3 1 . 1 . 148 . 1 1 11 CYS C C 4.016 1.049 1.589 . . . 1.0 . . . . . . . . . . . . A . 11 CYS C . . . . . . . . . c30225_5ug3 1 . 1 . 149 . 1 1 11 CYS CA C 3.438 1.906 2.707 . . . 1.0 . . . . . . . . . . . . A . 11 CYS CA . . . . . . . . . c30225_5ug3 1 . 1 . 150 . 1 1 11 CYS CB C 1.921 1.869 2.638 . . . 1.0 . . . . . . . . . . . . A . 11 CYS CB . . . . . . . . . c30225_5ug3 1 . 1 . 151 . 1 1 11 CYS H H 3.316 3.948 2.245 . . . 1.0 . . . . . . . . . . . . A . 11 CYS H . . . . . . . . . c30225_5ug3 1 . 1 . 152 . 1 1 11 CYS HA H 3.762 1.513 3.658 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HA . . . . . . . . . c30225_5ug3 1 . 1 . 153 . 1 1 11 CYS HB2 H 1.605 2.260 1.683 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HB2 . . . . . . . . . c30225_5ug3 1 . 1 . 154 . 1 1 11 CYS HB3 H 1.605 0.851 2.719 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HB3 . . . . . . . . . c30225_5ug3 1 . 1 . 155 . 1 1 11 CYS N N 3.914 3.262 2.593 . . . 1.0 . . . . . . . . . . . . A . 11 CYS N . . . . . . . . . c30225_5ug3 1 . 1 . 156 . 1 1 11 CYS O O 4.583 -0.014 1.836 . . . 1.0 . . . . . . . . . . . . A . 11 CYS O . . . . . . . . . c30225_5ug3 1 . 1 . 157 . 1 1 11 CYS SG S 1.063 2.821 3.931 . . . 1.0 . . . . . . . . . . . . A . 11 CYS SG . . . . . . . . . c30225_5ug3 1 . 1 . 158 . 1 1 12 ARG C C 5.779 0.561 -0.929 . . . 1.0 . . . . . . . . . . . . A . 12 ARG C . . . . . . . . . c30225_5ug3 1 . 1 . 159 . 1 1 12 ARG CA C 4.278 0.736 -0.802 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CA . . . . . . . . . c30225_5ug3 1 . 1 . 160 . 1 1 12 ARG CB C 3.680 1.290 -2.089 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CB . . . . . . . . . c30225_5ug3 1 . 1 . 161 . 1 1 12 ARG CD C 3.120 3.312 -3.437 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CD . . . . . . . . . c30225_5ug3 1 . 1 . 162 . 1 1 12 ARG CG C 3.851 2.771 -2.223 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CG . . . . . . . . . c30225_5ug3 1 . 1 . 163 . 1 1 12 ARG CZ C 2.753 5.540 -4.440 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CZ . . . . . . . . . c30225_5ug3 1 . 1 . 164 . 1 1 12 ARG H H 3.534 2.437 0.222 . . . 1.0 . . . . . . . . . . . . A . 12 ARG H . . . . . . . . . c30225_5ug3 1 . 1 . 165 . 1 1 12 ARG HA H 3.866 -0.219 -0.634 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HA . . . . . . . . . c30225_5ug3 1 . 1 . 166 . 1 1 12 ARG HB2 H 4.165 0.821 -2.929 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HB2 . . . . . . . . . c30225_5ug3 1 . 1 . 167 . 1 1 12 ARG HB3 H 2.625 1.062 -2.116 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HB3 . . . . . . . . . c30225_5ug3 1 . 1 . 168 . 1 1 12 ARG HD2 H 3.350 2.691 -4.290 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HD2 . . . . . . . . . c30225_5ug3 1 . 1 . 169 . 1 1 12 ARG HD3 H 2.059 3.275 -3.240 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HD3 . . . . . . . . . c30225_5ug3 1 . 1 . 170 . 1 1 12 ARG HE H 4.374 4.995 -3.405 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HE . . . . . . . . . c30225_5ug3 1 . 1 . 171 . 1 1 12 ARG HG2 H 3.446 3.223 -1.336 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HG2 . . . . . . . . . c30225_5ug3 1 . 1 . 172 . 1 1 12 ARG HG3 H 4.902 3.000 -2.306 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HG3 . . . . . . . . . c30225_5ug3 1 . 1 . 173 . 1 1 12 ARG HH11 H 1.208 4.251 -4.693 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH11 . . . . . . . . . c30225_5ug3 1 . 1 . 174 . 1 1 12 ARG HH12 H 1.003 5.813 -5.418 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH12 . . . . . . . . . c30225_5ug3 1 . 1 . 175 . 1 1 12 ARG HH21 H 4.105 7.047 -4.360 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH21 . . . . . . . . . c30225_5ug3 1 . 1 . 176 . 1 1 12 ARG HH22 H 2.645 7.404 -5.226 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH22 . . . . . . . . . c30225_5ug3 1 . 1 . 177 . 1 1 12 ARG N N 3.895 1.532 0.356 . . . 1.0 . . . . . . . . . . . . A . 12 ARG N . . . . . . . . . c30225_5ug3 1 . 1 . 178 . 1 1 12 ARG NE N 3.499 4.691 -3.735 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NE . . . . . . . . . c30225_5ug3 1 . 1 . 179 . 1 1 12 ARG NH1 N 1.561 5.172 -4.886 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NH1 . . . . . . . . . c30225_5ug3 1 . 1 . 180 . 1 1 12 ARG NH2 N 3.203 6.760 -4.695 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NH2 . . . . . . . . . c30225_5ug3 1 . 1 . 181 . 1 1 12 ARG O O 6.243 -0.313 -1.656 . . . 1.0 . . . . . . . . . . . . A . 12 ARG O . . . . . . . . . c30225_5ug3 1 . 1 . 182 . 1 1 13 VAL C C 8.383 0.055 0.643 . . . 1.0 . . . . . . . . . . . . A . 13 VAL C . . . . . . . . . c30225_5ug3 1 . 1 . 183 . 1 1 13 VAL CA C 7.972 1.253 -0.218 . . . 1.0 . . . . . . . . . . . . A . 13 VAL CA . . . . . . . . . c30225_5ug3 1 . 1 . 184 . 1 1 13 VAL CB C 8.624 2.537 0.315 . . . 1.0 . . . . . . . . . . . . A . 13 VAL CB . . . . . . . . . c30225_5ug3 1 . 1 . 185 . 1 1 13 VAL CG1 C 8.129 2.825 1.708 . . . 1.0 . . . . . . . . . . . . A . 13 VAL CG1 . . . . . . . . . c30225_5ug3 1 . 1 . 186 . 1 1 13 VAL CG2 C 10.126 2.434 0.306 . . . 1.0 . . . . . . . . . . . . A . 13 VAL CG2 . . . . . . . . . c30225_5ug3 1 . 1 . 187 . 1 1 13 VAL H H 6.121 2.114 0.264 . . . 1.0 . . . . . . . . . . . . A . 13 VAL H . . . . . . . . . c30225_5ug3 1 . 1 . 188 . 1 1 13 VAL HA H 8.309 1.091 -1.231 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HA . . . . . . . . . c30225_5ug3 1 . 1 . 189 . 1 1 13 VAL HB H 8.333 3.358 -0.325 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HB . . . . . . . . . c30225_5ug3 1 . 1 . 190 . 1 1 13 VAL HG11 H 8.561 2.115 2.395 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HG11 . . . . . . . . . c30225_5ug3 1 . 1 . 191 . 1 1 13 VAL HG12 H 7.046 2.720 1.722 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HG12 . . . . . . . . . c30225_5ug3 1 . 1 . 192 . 1 1 13 VAL HG13 H 8.402 3.828 1.994 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HG13 . . . . . . . . . c30225_5ug3 1 . 1 . 193 . 1 1 13 VAL HG21 H 10.424 1.600 0.922 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HG21 . . . . . . . . . c30225_5ug3 1 . 1 . 194 . 1 1 13 VAL HG22 H 10.543 3.346 0.702 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HG22 . . . . . . . . . c30225_5ug3 1 . 1 . 195 . 1 1 13 VAL HG23 H 10.469 2.281 -0.704 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HG23 . . . . . . . . . c30225_5ug3 1 . 1 . 196 . 1 1 13 VAL N N 6.535 1.390 -0.239 . . . 1.0 . . . . . . . . . . . . A . 13 VAL N . . . . . . . . . c30225_5ug3 1 . 1 . 197 . 1 1 13 VAL O O 9.309 -0.679 0.292 . . . 1.0 . . . . . . . . . . . . A . 13 VAL O . . . . . . . . . c30225_5ug3 1 . 1 . 198 . 1 1 14 ASN C C 7.333 -2.550 2.252 . . . 1.0 . . . . . . . . . . . . A . 14 ASN C . . . . . . . . . c30225_5ug3 1 . 1 . 199 . 1 1 14 ASN CA C 8.042 -1.260 2.653 . . . 1.0 . . . . . . . . . . . . A . 14 ASN CA . . . . . . . . . c30225_5ug3 1 . 1 . 200 . 1 1 14 ASN CB C 7.756 -0.932 4.127 . . . 1.0 . . . . . . . . . . . . A . 14 ASN CB . . . . . . . . . c30225_5ug3 1 . 1 . 201 . 1 1 14 ASN CG C 6.280 -0.921 4.487 . . . 1.0 . . . . . . . . . . . . A . 14 ASN CG . . . . . . . . . c30225_5ug3 1 . 1 . 202 . 1 1 14 ASN H H 6.946 0.449 2.005 . . . 1.0 . . . . . . . . . . . . A . 14 ASN H . . . . . . . . . c30225_5ug3 1 . 1 . 203 . 1 1 14 ASN HA H 9.106 -1.421 2.543 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HA . . . . . . . . . c30225_5ug3 1 . 1 . 204 . 1 1 14 ASN HB2 H 8.244 -1.665 4.747 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HB2 . . . . . . . . . c30225_5ug3 1 . 1 . 205 . 1 1 14 ASN HB3 H 8.165 0.042 4.351 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HB3 . . . . . . . . . c30225_5ug3 1 . 1 . 206 . 1 1 14 ASN HD21 H 6.231 1.059 4.338 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HD21 . . . . . . . . . c30225_5ug3 1 . 1 . 207 . 1 1 14 ASN HD22 H 4.745 0.294 4.776 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HD22 . . . . . . . . . c30225_5ug3 1 . 1 . 208 . 1 1 14 ASN N N 7.689 -0.157 1.765 . . . 1.0 . . . . . . . . . . . . A . 14 ASN N . . . . . . . . . c30225_5ug3 1 . 1 . 209 . 1 1 14 ASN ND2 N 5.692 0.259 4.536 . . . 1.0 . . . . . . . . . . . . A . 14 ASN ND2 . . . . . . . . . c30225_5ug3 1 . 1 . 210 . 1 1 14 ASN O O 7.895 -3.635 2.397 . . . 1.0 . . . . . . . . . . . . A . 14 ASN O . . . . . . . . . c30225_5ug3 1 . 1 . 211 . 1 1 14 ASN OD1 O 5.681 -1.965 4.755 . . . 1.0 . . . . . . . . . . . . A . 14 ASN OD1 . . . . . . . . . c30225_5ug3 1 . 1 . 212 . 1 1 15 ASN C C 5.806 -4.019 -0.068 . . . 1.0 . . . . . . . . . . . . A . 15 ASN C . . . . . . . . . c30225_5ug3 1 . 1 . 213 . 1 1 15 ASN CA C 5.367 -3.604 1.331 . . . 1.0 . . . . . . . . . . . . A . 15 ASN CA . . . . . . . . . c30225_5ug3 1 . 1 . 214 . 1 1 15 ASN CB C 3.851 -3.338 1.433 . . . 1.0 . . . . . . . . . . . . A . 15 ASN CB . . . . . . . . . c30225_5ug3 1 . 1 . 215 . 1 1 15 ASN CG C 3.226 -2.490 0.322 . . . 1.0 . . . . . . . . . . . . A . 15 ASN CG . . . . . . . . . c30225_5ug3 1 . 1 . 216 . 1 1 15 ASN H H 5.671 -1.579 1.694 . . . 1.0 . . . . . . . . . . . . A . 15 ASN H . . . . . . . . . c30225_5ug3 1 . 1 . 217 . 1 1 15 ASN HA H 5.621 -4.415 2.009 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HA . . . . . . . . . c30225_5ug3 1 . 1 . 218 . 1 1 15 ASN HB2 H 3.350 -4.278 1.440 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HB2 . . . . . . . . . c30225_5ug3 1 . 1 . 219 . 1 1 15 ASN HB3 H 3.657 -2.843 2.374 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HB3 . . . . . . . . . c30225_5ug3 1 . 1 . 220 . 1 1 15 ASN HD21 H 1.959 -1.700 1.632 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HD21 . . . . . . . . . c30225_5ug3 1 . 1 . 221 . 1 1 15 ASN HD22 H 1.800 -1.149 0.001 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HD22 . . . . . . . . . c30225_5ug3 1 . 1 . 222 . 1 1 15 ASN N N 6.103 -2.446 1.757 . . . 1.0 . . . . . . . . . . . . A . 15 ASN N . . . . . . . . . c30225_5ug3 1 . 1 . 223 . 1 1 15 ASN ND2 N 2.231 -1.697 0.687 . . . 1.0 . . . . . . . . . . . . A . 15 ASN ND2 . . . . . . . . . c30225_5ug3 1 . 1 . 224 . 1 1 15 ASN O O 6.124 -3.193 -0.923 . . . 1.0 . . . . . . . . . . . . A . 15 ASN O . . . . . . . . . c30225_5ug3 1 . 1 . 225 . 1 1 15 ASN OD1 O 3.599 -2.555 -0.846 . . . 1.0 . . . . . . . . . . . . A . 15 ASN OD1 . . . . . . . . . c30225_5ug3 1 . 1 . 226 . 1 1 16 HYP C C 5.476 -5.692 -2.710 . . . 1.0 . . . . . . . . . . . . A . 16 HYP C . . . . . . . . . c30225_5ug3 1 . 1 . 227 . 1 1 16 HYP CA C 6.381 -5.935 -1.511 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CA . . . . . . . . . c30225_5ug3 1 . 1 . 228 . 1 1 16 HYP CB C 6.428 -7.402 -1.150 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CB . . . . . . . . . c30225_5ug3 1 . 1 . 229 . 1 1 16 HYP CD C 5.544 -6.319 0.794 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CD . . . . . . . . . c30225_5ug3 1 . 1 . 230 . 1 1 16 HYP CG C 5.805 -7.663 0.198 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CG . . . . . . . . . c30225_5ug3 1 . 1 . 231 . 1 1 16 HYP HA H 7.363 -5.590 -1.746 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HA . . . . . . . . . c30225_5ug3 1 . 1 . 232 . 1 1 16 HYP HB2 H 7.456 -7.728 -1.126 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HB2 . . . . . . . . . c30225_5ug3 1 . 1 . 233 . 1 1 16 HYP HB3 H 5.894 -7.964 -1.902 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HB3 . . . . . . . . . c30225_5ug3 1 . 1 . 234 . 1 1 16 HYP HD1 H 6.713 -7.822 1.902 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HD1 . . . . . . . . . c30225_5ug3 1 . 1 . 235 . 1 1 16 HYP HD22 H 4.519 -6.225 1.082 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HD22 . . . . . . . . . c30225_5ug3 1 . 1 . 236 . 1 1 16 HYP HD23 H 6.178 -6.179 1.656 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HD23 . . . . . . . . . c30225_5ug3 1 . 1 . 237 . 1 1 16 HYP HG H 4.897 -8.240 0.091 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HG . . . . . . . . . c30225_5ug3 1 . 1 . 238 . 1 1 16 HYP N N 5.889 -5.330 -0.261 . . . 1.0 . . . . . . . . . . . . A . 16 HYP N . . . . . . . . . c30225_5ug3 1 . 1 . 239 . 1 1 16 HYP O O 5.951 -5.339 -3.788 . . . 1.0 . . . . . . . . . . . . A . 16 HYP O . . . . . . . . . c30225_5ug3 1 . 1 . 240 . 1 1 16 HYP OD1 O 6.703 -8.324 1.071 . . . 1.0 . . . . . . . . . . . . A . 16 HYP OD1 . . . . . . . . . c30225_5ug3 1 . 1 . 241 . 1 1 17 HIS C C 1.793 -5.584 -3.065 . . . 1.0 . . . . . . . . . . . . A . 17 HIS C . . . . . . . . . c30225_5ug3 1 . 1 . 242 . 1 1 17 HIS CA C 3.219 -5.676 -3.606 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CA . . . . . . . . . c30225_5ug3 1 . 1 . 243 . 1 1 17 HIS CB C 3.324 -6.783 -4.678 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CB . . . . . . . . . c30225_5ug3 1 . 1 . 244 . 1 1 17 HIS CD2 C 3.814 -9.062 -3.520 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CD2 . . . . . . . . . c30225_5ug3 1 . 1 . 245 . 1 1 17 HIS CE1 C 1.877 -10.021 -3.865 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CE1 . . . . . . . . . c30225_5ug3 1 . 1 . 246 . 1 1 17 HIS CG C 3.038 -8.178 -4.190 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CG . . . . . . . . . c30225_5ug3 1 . 1 . 247 . 1 1 17 HIS H H 3.868 -6.191 -1.649 . . . 1.0 . . . . . . . . . . . . A . 17 HIS H . . . . . . . . . c30225_5ug3 1 . 1 . 248 . 1 1 17 HIS HA H 3.463 -4.731 -4.067 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HA . . . . . . . . . c30225_5ug3 1 . 1 . 249 . 1 1 17 HIS HB2 H 2.625 -6.567 -5.470 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HB2 . . . . . . . . . c30225_5ug3 1 . 1 . 250 . 1 1 17 HIS HB3 H 4.325 -6.776 -5.085 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HB3 . . . . . . . . . c30225_5ug3 1 . 1 . 251 . 1 1 17 HIS HD1 H 1.053 -8.431 -4.858 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HD1 . . . . . . . . . c30225_5ug3 1 . 1 . 252 . 1 1 17 HIS HD2 H 4.833 -8.905 -3.199 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HD2 . . . . . . . . . c30225_5ug3 1 . 1 . 253 . 1 1 17 HIS HE1 H 1.074 -10.743 -3.869 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HE1 . . . . . . . . . c30225_5ug3 1 . 1 . 254 . 1 1 17 HIS HE2 H 3.308 -10.935 -2.719 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HE2 . . . . . . . . . c30225_5ug3 1 . 1 . 255 . 1 1 17 HIS N N 4.183 -5.892 -2.528 . . . 1.0 . . . . . . . . . . . . A . 17 HIS N . . . . . . . . . c30225_5ug3 1 . 1 . 256 . 1 1 17 HIS ND1 N 1.831 -8.813 -4.392 . . . 1.0 . . . . . . . . . . . . A . 17 HIS ND1 . . . . . . . . . c30225_5ug3 1 . 1 . 257 . 1 1 17 HIS NE2 N 3.070 -10.198 -3.328 . . . 1.0 . . . . . . . . . . . . A . 17 HIS NE2 . . . . . . . . . c30225_5ug3 1 . 1 . 258 . 1 1 17 HIS O O 0.867 -6.177 -3.612 . . . 1.0 . . . . . . . . . . . . A . 17 HIS O . . . . . . . . . c30225_5ug3 1 . 1 . 259 . 1 1 18 VAL C C -0.458 -3.538 -2.156 . . . 1.0 . . . . . . . . . . . . A . 18 VAL C . . . . . . . . . c30225_5ug3 1 . 1 . 260 . 1 1 18 VAL CA C 0.285 -4.650 -1.419 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CA . . . . . . . . . c30225_5ug3 1 . 1 . 261 . 1 1 18 VAL CB C 0.327 -4.348 0.096 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CB . . . . . . . . . c30225_5ug3 1 . 1 . 262 . 1 1 18 VAL CG1 C -1.082 -4.265 0.670 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CG1 . . . . . . . . . c30225_5ug3 1 . 1 . 263 . 1 1 18 VAL CG2 C 1.130 -5.410 0.828 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CG2 . . . . . . . . . c30225_5ug3 1 . 1 . 264 . 1 1 18 VAL H H 2.385 -4.378 -1.585 . . . 1.0 . . . . . . . . . . . . A . 18 VAL H . . . . . . . . . c30225_5ug3 1 . 1 . 265 . 1 1 18 VAL HA H -0.256 -5.575 -1.563 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HA . . . . . . . . . c30225_5ug3 1 . 1 . 266 . 1 1 18 VAL HB H 0.811 -3.393 0.242 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HB . . . . . . . . . c30225_5ug3 1 . 1 . 267 . 1 1 18 VAL HG11 H -1.583 -5.211 0.531 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG11 . . . . . . . . . c30225_5ug3 1 . 1 . 268 . 1 1 18 VAL HG12 H -1.633 -3.487 0.161 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG12 . . . . . . . . . c30225_5ug3 1 . 1 . 269 . 1 1 18 VAL HG13 H -1.028 -4.038 1.723 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG13 . . . . . . . . . c30225_5ug3 1 . 1 . 270 . 1 1 18 VAL HG21 H 0.635 -6.364 0.736 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG21 . . . . . . . . . c30225_5ug3 1 . 1 . 271 . 1 1 18 VAL HG22 H 1.209 -5.145 1.873 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG22 . . . . . . . . . c30225_5ug3 1 . 1 . 272 . 1 1 18 VAL HG23 H 2.116 -5.474 0.398 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG23 . . . . . . . . . c30225_5ug3 1 . 1 . 273 . 1 1 18 VAL N N 1.615 -4.829 -1.991 . . . 1.0 . . . . . . . . . . . . A . 18 VAL N . . . . . . . . . c30225_5ug3 1 . 1 . 274 . 1 1 18 VAL O O -0.632 -2.426 -1.648 . . . 1.0 . . . . . . . . . . . . A . 18 VAL O . . . . . . . . . c30225_5ug3 1 . 1 . 275 . 1 1 19 CYS C C -1.921 -3.656 -5.553 . . . 1.0 . . . . . . . . . . . . A . 19 CYS C . . . . . . . . . c30225_5ug3 1 . 1 . 276 . 1 1 19 CYS CA C -1.650 -2.976 -4.218 . . . 1.0 . . . . . . . . . . . . A . 19 CYS CA . . . . . . . . . c30225_5ug3 1 . 1 . 277 . 1 1 19 CYS CB C -0.969 -1.621 -4.445 . . . 1.0 . . . . . . . . . . . . A . 19 CYS CB . . . . . . . . . c30225_5ug3 1 . 1 . 278 . 1 1 19 CYS H H -0.552 -4.716 -3.755 . . . 1.0 . . . . . . . . . . . . A . 19 CYS H . . . . . . . . . c30225_5ug3 1 . 1 . 279 . 1 1 19 CYS HA H -2.592 -2.818 -3.713 . . . 1.0 . . . . . . . . . . . . A . 19 CYS HA . . . . . . . . . c30225_5ug3 1 . 1 . 280 . 1 1 19 CYS HB2 H -0.858 -1.119 -3.494 . . . 1.0 . . . . . . . . . . . . A . 19 CYS HB2 . . . . . . . . . c30225_5ug3 1 . 1 . 281 . 1 1 19 CYS HB3 H 0.008 -1.785 -4.876 . . . 1.0 . . . . . . . . . . . . A . 19 CYS HB3 . . . . . . . . . c30225_5ug3 1 . 1 . 282 . 1 1 19 CYS N N -0.840 -3.852 -3.386 . . . 1.0 . . . . . . . . . . . . A . 19 CYS N . . . . . . . . . c30225_5ug3 1 . 1 . 283 . 1 1 19 CYS O O -1.027 -3.644 -6.425 . . . 1.0 . . . . . . . . . . . . A . 19 CYS O . . . . . . . . . c30225_5ug3 1 . 1 . 284 . 1 1 19 CYS OXT O -3.019 -4.227 -5.720 . . . 1.0 . . . . . . . . . . . . A . 19 CYS OXT . . . . . . . . . c30225_5ug3 1 . 1 . 285 . 1 1 19 CYS SG S -1.892 -0.506 -5.556 . . . 1.0 . . . . . . . . . . . . A . 19 CYS SG . . . . . . . . . c30225_5ug3 1 . 2 . 286 . 1 1 1 ILE C C -9.126 -5.464 0.682 . . . 1.0 . . . . . . . . . . . . A . 1 ILE C . . . . . . . . . c30225_5ug3 1 . 2 . 287 . 1 1 1 ILE CA C -9.475 -6.391 1.844 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CA . . . . . . . . . c30225_5ug3 1 . 2 . 288 . 1 1 1 ILE CB C -8.296 -7.359 2.128 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CB . . . . . . . . . c30225_5ug3 1 . 2 . 289 . 1 1 1 ILE CD1 C -7.173 -5.842 3.840 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CD1 . . . . . . . . . c30225_5ug3 1 . 2 . 290 . 1 1 1 ILE CG1 C -7.038 -6.584 2.527 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CG1 . . . . . . . . . c30225_5ug3 1 . 2 . 291 . 1 1 1 ILE CG2 C -8.015 -8.249 0.925 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CG2 . . . . . . . . . c30225_5ug3 1 . 2 . 292 . 1 1 1 ILE H1 H -11.505 -6.466 1.404 . . . 1.0 . . . . . . . . . . . . A . 1 ILE H1 . . . . . . . . . c30225_5ug3 1 . 2 . 293 . 1 1 1 ILE H2 H -10.959 -7.759 2.348 . . . 1.0 . . . . . . . . . . . . A . 1 ILE H2 . . . . . . . . . c30225_5ug3 1 . 2 . 294 . 1 1 1 ILE H3 H -10.602 -7.706 0.697 . . . 1.0 . . . . . . . . . . . . A . 1 ILE H3 . . . . . . . . . c30225_5ug3 1 . 2 . 295 . 1 1 1 ILE HA H -9.640 -5.790 2.726 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HA . . . . . . . . . c30225_5ug3 1 . 2 . 296 . 1 1 1 ILE HB H -8.585 -7.998 2.949 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HB . . . . . . . . . c30225_5ug3 1 . 2 . 297 . 1 1 1 ILE HD11 H -7.380 -6.545 4.633 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HD11 . . . . . . . . . c30225_5ug3 1 . 2 . 298 . 1 1 1 ILE HD12 H -7.981 -5.131 3.769 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HD12 . . . . . . . . . c30225_5ug3 1 . 2 . 299 . 1 1 1 ILE HD13 H -6.254 -5.321 4.054 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HD13 . . . . . . . . . c30225_5ug3 1 . 2 . 300 . 1 1 1 ILE HG12 H -6.213 -7.275 2.622 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG12 . . . . . . . . . c30225_5ug3 1 . 2 . 301 . 1 1 1 ILE HG13 H -6.810 -5.860 1.759 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG13 . . . . . . . . . c30225_5ug3 1 . 2 . 302 . 1 1 1 ILE HG21 H -7.756 -7.634 0.076 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG21 . . . . . . . . . c30225_5ug3 1 . 2 . 303 . 1 1 1 ILE HG22 H -8.894 -8.831 0.692 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG22 . . . . . . . . . c30225_5ug3 1 . 2 . 304 . 1 1 1 ILE HG23 H -7.194 -8.912 1.152 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG23 . . . . . . . . . c30225_5ug3 1 . 2 . 305 . 1 1 1 ILE N N -10.720 -7.131 1.554 . . . 1.0 . . . . . . . . . . . . A . 1 ILE N . . . . . . . . . c30225_5ug3 1 . 2 . 306 . 1 1 1 ILE O O -9.309 -5.818 -0.483 . . . 1.0 . . . . . . . . . . . . A . 1 ILE O . . . . . . . . . c30225_5ug3 1 . 2 . 307 . 1 1 2 ARG C C -6.995 -2.592 0.372 . . . 1.0 . . . . . . . . . . . . A . 2 ARG C . . . . . . . . . c30225_5ug3 1 . 2 . 308 . 1 1 2 ARG CA C -8.296 -3.289 -0.006 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CA . . . . . . . . . c30225_5ug3 1 . 2 . 309 . 1 1 2 ARG CB C -9.429 -2.268 -0.148 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CB . . . . . . . . . c30225_5ug3 1 . 2 . 310 . 1 1 2 ARG CD C -9.256 -1.951 -2.649 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CD . . . . . . . . . c30225_5ug3 1 . 2 . 311 . 1 1 2 ARG CG C -9.255 -1.270 -1.288 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CG . . . . . . . . . c30225_5ug3 1 . 2 . 312 . 1 1 2 ARG CZ C -7.621 -3.593 -3.531 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CZ . . . . . . . . . c30225_5ug3 1 . 2 . 313 . 1 1 2 ARG H H -8.517 -4.042 1.941 . . . 1.0 . . . . . . . . . . . . A . 2 ARG H . . . . . . . . . c30225_5ug3 1 . 2 . 314 . 1 1 2 ARG HA H -8.162 -3.806 -0.936 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HA . . . . . . . . . c30225_5ug3 1 . 2 . 315 . 1 1 2 ARG HB2 H -10.354 -2.800 -0.309 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB2 . . . . . . . . . c30225_5ug3 1 . 2 . 316 . 1 1 2 ARG HB3 H -9.507 -1.713 0.775 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB3 . . . . . . . . . c30225_5ug3 1 . 2 . 317 . 1 1 2 ARG HD2 H -9.902 -2.815 -2.603 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD2 . . . . . . . . . c30225_5ug3 1 . 2 . 318 . 1 1 2 ARG HD3 H -9.638 -1.256 -3.383 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD3 . . . . . . . . . c30225_5ug3 1 . 2 . 319 . 1 1 2 ARG HE H -7.195 -1.712 -2.986 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HE . . . . . . . . . c30225_5ug3 1 . 2 . 320 . 1 1 2 ARG HG2 H -10.065 -0.558 -1.254 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG2 . . . . . . . . . c30225_5ug3 1 . 2 . 321 . 1 1 2 ARG HG3 H -8.314 -0.753 -1.156 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG3 . . . . . . . . . c30225_5ug3 1 . 2 . 322 . 1 1 2 ARG HH11 H -9.505 -4.321 -3.370 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH11 . . . . . . . . . c30225_5ug3 1 . 2 . 323 . 1 1 2 ARG HH12 H -8.330 -5.432 -3.996 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH12 . . . . . . . . . c30225_5ug3 1 . 2 . 324 . 1 1 2 ARG HH21 H -5.659 -3.174 -3.831 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH21 . . . . . . . . . c30225_5ug3 1 . 2 . 325 . 1 1 2 ARG HH22 H -6.149 -4.784 -4.258 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH22 . . . . . . . . . c30225_5ug3 1 . 2 . 326 . 1 1 2 ARG N N -8.643 -4.271 1.001 . . . 1.0 . . . . . . . . . . . . A . 2 ARG N . . . . . . . . . c30225_5ug3 1 . 2 . 327 . 1 1 2 ARG NE N -7.916 -2.380 -3.055 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NE . . . . . . . . . c30225_5ug3 1 . 2 . 328 . 1 1 2 ARG NH1 N -8.560 -4.519 -3.640 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH1 . . . . . . . . . c30225_5ug3 1 . 2 . 329 . 1 1 2 ARG NH2 N -6.379 -3.872 -3.903 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH2 . . . . . . . . . c30225_5ug3 1 . 2 . 330 . 1 1 2 ARG O O -6.854 -2.103 1.494 . . . 1.0 . . . . . . . . . . . . A . 2 ARG O . . . . . . . . . c30225_5ug3 1 . 2 . 331 . 1 1 3 ASP C C -4.913 -0.391 -0.442 . . . 1.0 . . . . . . . . . . . . A . 3 ASP C . . . . . . . . . c30225_5ug3 1 . 2 . 332 . 1 1 3 ASP CA C -4.761 -1.903 -0.326 . . . 1.0 . . . . . . . . . . . . A . 3 ASP CA . . . . . . . . . c30225_5ug3 1 . 2 . 333 . 1 1 3 ASP CB C -3.699 -2.394 -1.318 . . . 1.0 . . . . . . . . . . . . A . 3 ASP CB . . . . . . . . . c30225_5ug3 1 . 2 . 334 . 1 1 3 ASP CG C -3.399 -3.872 -1.180 . . . 1.0 . . . . . . . . . . . . A . 3 ASP CG . . . . . . . . . c30225_5ug3 1 . 2 . 335 . 1 1 3 ASP H H -6.202 -3.015 -1.413 . . . 1.0 . . . . . . . . . . . . A . 3 ASP H . . . . . . . . . c30225_5ug3 1 . 2 . 336 . 1 1 3 ASP HA H -4.442 -2.142 0.676 . . . 1.0 . . . . . . . . . . . . A . 3 ASP HA . . . . . . . . . c30225_5ug3 1 . 2 . 337 . 1 1 3 ASP HB2 H -4.045 -2.211 -2.324 . . . 1.0 . . . . . . . . . . . . A . 3 ASP HB2 . . . . . . . . . c30225_5ug3 1 . 2 . 338 . 1 1 3 ASP HB3 H -2.783 -1.843 -1.154 . . . 1.0 . . . . . . . . . . . . A . 3 ASP HB3 . . . . . . . . . c30225_5ug3 1 . 2 . 339 . 1 1 3 ASP N N -6.044 -2.567 -0.555 . . . 1.0 . . . . . . . . . . . . A . 3 ASP N . . . . . . . . . c30225_5ug3 1 . 2 . 340 . 1 1 3 ASP O O -4.533 0.211 -1.447 . . . 1.0 . . . . . . . . . . . . A . 3 ASP O . . . . . . . . . c30225_5ug3 1 . 2 . 341 . 1 1 3 ASP OD1 O -4.009 -4.683 -1.910 . . . 1.0 . . . . . . . . . . . . A . 3 ASP OD1 . . . . . . . . . c30225_5ug3 1 . 2 . 342 . 1 1 3 ASP OD2 O -2.551 -4.233 -0.339 . . . 1.0 . . . . . . . . . . . . A . 3 ASP OD2 . . . . . . . . . c30225_5ug3 1 . 2 . 343 . 1 1 4 GLU C C -4.412 2.421 0.785 . . . 1.0 . . . . . . . . . . . . A . 4 GLU C . . . . . . . . . c30225_5ug3 1 . 2 . 344 . 1 1 4 GLU CA C -5.716 1.653 0.614 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CA . . . . . . . . . c30225_5ug3 1 . 2 . 345 . 1 1 4 GLU CB C -6.679 1.999 1.746 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CB . . . . . . . . . c30225_5ug3 1 . 2 . 346 . 1 1 4 GLU CD C -8.886 1.529 2.860 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CD . . . . . . . . . c30225_5ug3 1 . 2 . 347 . 1 1 4 GLU CG C -7.965 1.193 1.711 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CG . . . . . . . . . c30225_5ug3 1 . 2 . 348 . 1 1 4 GLU H H -5.706 -0.318 1.383 . . . 1.0 . . . . . . . . . . . . A . 4 GLU H . . . . . . . . . c30225_5ug3 1 . 2 . 349 . 1 1 4 GLU HA H -6.164 1.926 -0.330 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HA . . . . . . . . . c30225_5ug3 1 . 2 . 350 . 1 1 4 GLU HB2 H -6.188 1.814 2.691 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HB2 . . . . . . . . . c30225_5ug3 1 . 2 . 351 . 1 1 4 GLU HB3 H -6.933 3.047 1.680 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HB3 . . . . . . . . . c30225_5ug3 1 . 2 . 352 . 1 1 4 GLU HG2 H -8.480 1.399 0.784 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HG2 . . . . . . . . . c30225_5ug3 1 . 2 . 353 . 1 1 4 GLU HG3 H -7.719 0.144 1.761 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HG3 . . . . . . . . . c30225_5ug3 1 . 2 . 354 . 1 1 4 GLU N N -5.463 0.217 0.597 . . . 1.0 . . . . . . . . . . . . A . 4 GLU N . . . . . . . . . c30225_5ug3 1 . 2 . 355 . 1 1 4 GLU O O -4.298 3.584 0.395 . . . 1.0 . . . . . . . . . . . . A . 4 GLU O . . . . . . . . . c30225_5ug3 1 . 2 . 356 . 1 1 4 GLU OE1 O -9.736 2.431 2.704 . . . 1.0 . . . . . . . . . . . . A . 4 GLU OE1 . . . . . . . . . c30225_5ug3 1 . 2 . 357 . 1 1 4 GLU OE2 O -8.768 0.887 3.926 . . . 1.0 . . . . . . . . . . . . A . 4 GLU OE2 . . . . . . . . . c30225_5ug3 1 . 2 . 358 . 1 1 5 CYS C C -1.371 2.520 0.252 . . . 1.0 . . . . . . . . . . . . A . 5 CYS C . . . . . . . . . c30225_5ug3 1 . 2 . 359 . 1 1 5 CYS CA C -2.119 2.333 1.574 . . . 1.0 . . . . . . . . . . . . A . 5 CYS CA . . . . . . . . . c30225_5ug3 1 . 2 . 360 . 1 1 5 CYS CB C -1.317 1.453 2.521 . . . 1.0 . . . . . . . . . . . . A . 5 CYS CB . . . . . . . . . c30225_5ug3 1 . 2 . 361 . 1 1 5 CYS H H -3.579 0.834 1.661 . . . 1.0 . . . . . . . . . . . . A . 5 CYS H . . . . . . . . . c30225_5ug3 1 . 2 . 362 . 1 1 5 CYS HA H -2.264 3.299 2.033 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HA . . . . . . . . . c30225_5ug3 1 . 2 . 363 . 1 1 5 CYS HB2 H -0.530 2.036 2.952 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HB2 . . . . . . . . . c30225_5ug3 1 . 2 . 364 . 1 1 5 CYS HB3 H -1.966 1.101 3.308 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HB3 . . . . . . . . . c30225_5ug3 1 . 2 . 365 . 1 1 5 CYS N N -3.423 1.750 1.354 . . . 1.0 . . . . . . . . . . . . A . 5 CYS N . . . . . . . . . c30225_5ug3 1 . 2 . 366 . 1 1 5 CYS O O -0.278 3.071 0.221 . . . 1.0 . . . . . . . . . . . . A . 5 CYS O . . . . . . . . . c30225_5ug3 1 . 2 . 367 . 1 1 5 CYS SG S -0.563 -0.003 1.733 . . . 1.0 . . . . . . . . . . . . A . 5 CYS SG . . . . . . . . . c30225_5ug3 1 . 2 . 368 . 1 1 6 CYS C C -1.206 3.673 -2.521 . . . 1.0 . . . . . . . . . . . . A . 6 CYS C . . . . . . . . . c30225_5ug3 1 . 2 . 369 . 1 1 6 CYS CA C -1.404 2.193 -2.175 . . . 1.0 . . . . . . . . . . . . A . 6 CYS CA . . . . . . . . . c30225_5ug3 1 . 2 . 370 . 1 1 6 CYS CB C -2.346 1.526 -3.181 . . . 1.0 . . . . . . . . . . . . A . 6 CYS CB . . . . . . . . . c30225_5ug3 1 . 2 . 371 . 1 1 6 CYS H H -2.810 1.552 -0.731 . . . 1.0 . . . . . . . . . . . . A . 6 CYS H . . . . . . . . . c30225_5ug3 1 . 2 . 372 . 1 1 6 CYS HA H -0.442 1.696 -2.202 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HA . . . . . . . . . c30225_5ug3 1 . 2 . 373 . 1 1 6 CYS HB2 H -2.402 0.472 -2.961 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HB2 . . . . . . . . . c30225_5ug3 1 . 2 . 374 . 1 1 6 CYS HB3 H -3.329 1.960 -3.068 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HB3 . . . . . . . . . c30225_5ug3 1 . 2 . 375 . 1 1 6 CYS N N -1.962 2.035 -0.833 . . . 1.0 . . . . . . . . . . . . A . 6 CYS N . . . . . . . . . c30225_5ug3 1 . 2 . 376 . 1 1 6 CYS O O -0.318 4.029 -3.295 . . . 1.0 . . . . . . . . . . . . A . 6 CYS O . . . . . . . . . c30225_5ug3 1 . 2 . 377 . 1 1 6 CYS SG S -1.868 1.689 -4.933 . . . 1.0 . . . . . . . . . . . . A . 6 CYS SG . . . . . . . . . c30225_5ug3 1 . 2 . 378 . 1 1 7 SER C C -0.943 6.583 -1.123 . . . 1.0 . . . . . . . . . . . . A . 7 SER C . . . . . . . . . c30225_5ug3 1 . 2 . 379 . 1 1 7 SER CA C -1.914 5.973 -2.131 . . . 1.0 . . . . . . . . . . . . A . 7 SER CA . . . . . . . . . c30225_5ug3 1 . 2 . 380 . 1 1 7 SER CB C -3.295 6.614 -2.000 . . . 1.0 . . . . . . . . . . . . A . 7 SER CB . . . . . . . . . c30225_5ug3 1 . 2 . 381 . 1 1 7 SER H H -2.688 4.193 -1.295 . . . 1.0 . . . . . . . . . . . . A . 7 SER H . . . . . . . . . c30225_5ug3 1 . 2 . 382 . 1 1 7 SER HA H -1.535 6.136 -3.130 . . . 1.0 . . . . . . . . . . . . A . 7 SER HA . . . . . . . . . c30225_5ug3 1 . 2 . 383 . 1 1 7 SER HB2 H -3.639 6.521 -0.981 . . . 1.0 . . . . . . . . . . . . A . 7 SER HB2 . . . . . . . . . c30225_5ug3 1 . 2 . 384 . 1 1 7 SER HB3 H -3.234 7.658 -2.268 . . . 1.0 . . . . . . . . . . . . A . 7 SER HB3 . . . . . . . . . c30225_5ug3 1 . 2 . 385 . 1 1 7 SER HG H -3.972 6.133 -3.778 . . . 1.0 . . . . . . . . . . . . A . 7 SER HG . . . . . . . . . c30225_5ug3 1 . 2 . 386 . 1 1 7 SER N N -2.013 4.533 -1.914 . . . 1.0 . . . . . . . . . . . . A . 7 SER N . . . . . . . . . c30225_5ug3 1 . 2 . 387 . 1 1 7 SER O O -0.931 7.790 -0.889 . . . 1.0 . . . . . . . . . . . . A . 7 SER O . . . . . . . . . c30225_5ug3 1 . 2 . 388 . 1 1 7 SER OG O -4.226 5.976 -2.859 . . . 1.0 . . . . . . . . . . . . A . 7 SER OG . . . . . . . . . c30225_5ug3 1 . 2 . 389 . 1 1 8 ASN C C 2.169 5.483 0.093 . . . 1.0 . . . . . . . . . . . . A . 8 ASN C . . . . . . . . . c30225_5ug3 1 . 2 . 390 . 1 1 8 ASN CA C 0.840 6.097 0.468 . . . 1.0 . . . . . . . . . . . . A . 8 ASN CA . . . . . . . . . c30225_5ug3 1 . 2 . 391 . 1 1 8 ASN CB C 0.432 5.571 1.840 . . . 1.0 . . . . . . . . . . . . A . 8 ASN CB . . . . . . . . . c30225_5ug3 1 . 2 . 392 . 1 1 8 ASN CG C -0.875 6.158 2.335 . . . 1.0 . . . . . . . . . . . . A . 8 ASN CG . . . . . . . . . c30225_5ug3 1 . 2 . 393 . 1 1 8 ASN H H -0.216 4.769 -0.766 . . . 1.0 . . . . . . . . . . . . A . 8 ASN H . . . . . . . . . c30225_5ug3 1 . 2 . 394 . 1 1 8 ASN HA H 0.922 7.172 0.493 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HA . . . . . . . . . c30225_5ug3 1 . 2 . 395 . 1 1 8 ASN HB2 H 0.323 4.499 1.772 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HB2 . . . . . . . . . c30225_5ug3 1 . 2 . 396 . 1 1 8 ASN HB3 H 1.209 5.800 2.553 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HB3 . . . . . . . . . c30225_5ug3 1 . 2 . 397 . 1 1 8 ASN HD21 H -1.891 4.814 1.295 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HD21 . . . . . . . . . c30225_5ug3 1 . 2 . 398 . 1 1 8 ASN HD22 H -2.844 5.926 2.213 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HD22 . . . . . . . . . c30225_5ug3 1 . 2 . 399 . 1 1 8 ASN N N -0.145 5.717 -0.525 . . . 1.0 . . . . . . . . . . . . A . 8 ASN N . . . . . . . . . c30225_5ug3 1 . 2 . 400 . 1 1 8 ASN ND2 N -1.980 5.574 1.903 . . . 1.0 . . . . . . . . . . . . A . 8 ASN ND2 . . . . . . . . . c30225_5ug3 1 . 2 . 401 . 1 1 8 ASN O O 2.380 4.287 0.304 . . . 1.0 . . . . . . . . . . . . A . 8 ASN O . . . . . . . . . c30225_5ug3 1 . 2 . 402 . 1 1 8 ASN OD1 O -0.890 7.138 3.077 . . . 1.0 . . . . . . . . . . . . A . 8 ASN OD1 . . . . . . . . . c30225_5ug3 1 . 2 . 403 . 1 1 9 PRO C C 5.143 5.084 0.217 . . . 1.0 . . . . . . . . . . . . A . 9 PRO C . . . . . . . . . c30225_5ug3 1 . 2 . 404 . 1 1 9 PRO CA C 4.375 5.761 -0.914 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CA . . . . . . . . . c30225_5ug3 1 . 2 . 405 . 1 1 9 PRO CB C 5.108 7.017 -1.398 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CB . . . . . . . . . c30225_5ug3 1 . 2 . 406 . 1 1 9 PRO CD C 2.926 7.707 -0.760 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CD . . . . . . . . . c30225_5ug3 1 . 2 . 407 . 1 1 9 PRO CG C 4.029 7.980 -1.738 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CG . . . . . . . . . c30225_5ug3 1 . 2 . 408 . 1 1 9 PRO HA H 4.259 5.064 -1.729 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HA . . . . . . . . . c30225_5ug3 1 . 2 . 409 . 1 1 9 PRO HB2 H 5.731 7.396 -0.606 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HB2 . . . . . . . . . c30225_5ug3 1 . 2 . 410 . 1 1 9 PRO HB3 H 5.712 6.780 -2.260 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HB3 . . . . . . . . . c30225_5ug3 1 . 2 . 411 . 1 1 9 PRO HD2 H 3.060 8.295 0.136 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HD2 . . . . . . . . . c30225_5ug3 1 . 2 . 412 . 1 1 9 PRO HD3 H 1.970 7.910 -1.207 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HD3 . . . . . . . . . c30225_5ug3 1 . 2 . 413 . 1 1 9 PRO HG2 H 4.389 8.993 -1.627 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HG2 . . . . . . . . . c30225_5ug3 1 . 2 . 414 . 1 1 9 PRO HG3 H 3.685 7.810 -2.747 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HG3 . . . . . . . . . c30225_5ug3 1 . 2 . 415 . 1 1 9 PRO N N 3.080 6.269 -0.477 . . . 1.0 . . . . . . . . . . . . A . 9 PRO N . . . . . . . . . c30225_5ug3 1 . 2 . 416 . 1 1 9 PRO O O 5.989 4.232 -0.029 . . . 1.0 . . . . . . . . . . . . A . 9 PRO O . . . . . . . . . c30225_5ug3 1 . 2 . 417 . 1 1 10 VAL C C 5.110 3.433 2.837 . . . 1.0 . . . . . . . . . . . . A . 10 VAL C . . . . . . . . . c30225_5ug3 1 . 2 . 418 . 1 1 10 VAL CA C 5.487 4.891 2.624 . . . 1.0 . . . . . . . . . . . . A . 10 VAL CA . . . . . . . . . c30225_5ug3 1 . 2 . 419 . 1 1 10 VAL CB C 5.151 5.707 3.891 . . . 1.0 . . . . . . . . . . . . A . 10 VAL CB . . . . . . . . . c30225_5ug3 1 . 2 . 420 . 1 1 10 VAL CG1 C 3.834 5.271 4.519 . . . 1.0 . . . . . . . . . . . . A . 10 VAL CG1 . . . . . . . . . c30225_5ug3 1 . 2 . 421 . 1 1 10 VAL CG2 C 6.288 5.638 4.900 . . . 1.0 . . . . . . . . . . . . A . 10 VAL CG2 . . . . . . . . . c30225_5ug3 1 . 2 . 422 . 1 1 10 VAL H H 4.051 6.055 1.584 . . . 1.0 . . . . . . . . . . . . A . 10 VAL H . . . . . . . . . c30225_5ug3 1 . 2 . 423 . 1 1 10 VAL HA H 6.551 4.955 2.445 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HA . . . . . . . . . c30225_5ug3 1 . 2 . 424 . 1 1 10 VAL HB H 5.035 6.728 3.587 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HB . . . . . . . . . c30225_5ug3 1 . 2 . 425 . 1 1 10 VAL HG11 H 3.895 4.228 4.792 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HG11 . . . . . . . . . c30225_5ug3 1 . 2 . 426 . 1 1 10 VAL HG12 H 3.035 5.409 3.807 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HG12 . . . . . . . . . c30225_5ug3 1 . 2 . 427 . 1 1 10 VAL HG13 H 3.640 5.863 5.399 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HG13 . . . . . . . . . c30225_5ug3 1 . 2 . 428 . 1 1 10 VAL HG21 H 7.193 6.020 4.451 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HG21 . . . . . . . . . c30225_5ug3 1 . 2 . 429 . 1 1 10 VAL HG22 H 6.440 4.612 5.201 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HG22 . . . . . . . . . c30225_5ug3 1 . 2 . 430 . 1 1 10 VAL HG23 H 6.036 6.233 5.766 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HG23 . . . . . . . . . c30225_5ug3 1 . 2 . 431 . 1 1 10 VAL N N 4.800 5.428 1.455 . . . 1.0 . . . . . . . . . . . . A . 10 VAL N . . . . . . . . . c30225_5ug3 1 . 2 . 432 . 1 1 10 VAL O O 5.888 2.633 3.360 . . . 1.0 . . . . . . . . . . . . A . 10 VAL O . . . . . . . . . c30225_5ug3 1 . 2 . 433 . 1 1 11 CYS C C 4.074 0.854 1.455 . . . 1.0 . . . . . . . . . . . . A . 11 CYS C . . . . . . . . . c30225_5ug3 1 . 2 . 434 . 1 1 11 CYS CA C 3.444 1.720 2.531 . . . 1.0 . . . . . . . . . . . . A . 11 CYS CA . . . . . . . . . c30225_5ug3 1 . 2 . 435 . 1 1 11 CYS CB C 1.919 1.628 2.436 . . . 1.0 . . . . . . . . . . . . A . 11 CYS CB . . . . . . . . . c30225_5ug3 1 . 2 . 436 . 1 1 11 CYS H H 3.322 3.783 2.044 . . . 1.0 . . . . . . . . . . . . A . 11 CYS H . . . . . . . . . c30225_5ug3 1 . 2 . 437 . 1 1 11 CYS HA H 3.754 1.354 3.496 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HA . . . . . . . . . c30225_5ug3 1 . 2 . 438 . 1 1 11 CYS HB2 H 1.479 2.211 3.230 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HB2 . . . . . . . . . c30225_5ug3 1 . 2 . 439 . 1 1 11 CYS HB3 H 1.599 2.025 1.484 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HB3 . . . . . . . . . c30225_5ug3 1 . 2 . 440 . 1 1 11 CYS N N 3.909 3.090 2.419 . . . 1.0 . . . . . . . . . . . . A . 11 CYS N . . . . . . . . . c30225_5ug3 1 . 2 . 441 . 1 1 11 CYS O O 4.543 -0.243 1.728 . . . 1.0 . . . . . . . . . . . . A . 11 CYS O . . . . . . . . . c30225_5ug3 1 . 2 . 442 . 1 1 11 CYS SG S 1.280 -0.079 2.575 . . . 1.0 . . . . . . . . . . . . A . 11 CYS SG . . . . . . . . . c30225_5ug3 1 . 2 . 443 . 1 1 12 ARG C C 6.062 0.397 -0.985 . . . 1.0 . . . . . . . . . . . . A . 12 ARG C . . . . . . . . . c30225_5ug3 1 . 2 . 444 . 1 1 12 ARG CA C 4.548 0.548 -0.890 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CA . . . . . . . . . c30225_5ug3 1 . 2 . 445 . 1 1 12 ARG CB C 3.930 1.033 -2.199 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CB . . . . . . . . . c30225_5ug3 1 . 2 . 446 . 1 1 12 ARG CD C 3.046 2.961 -3.513 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CD . . . . . . . . . c30225_5ug3 1 . 2 . 447 . 1 1 12 ARG CG C 3.893 2.526 -2.331 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CG . . . . . . . . . c30225_5ug3 1 . 2 . 448 . 1 1 12 ARG CZ C 3.413 2.488 -5.918 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CZ . . . . . . . . . c30225_5ug3 1 . 2 . 449 . 1 1 12 ARG H H 3.877 2.301 0.093 . . . 1.0 . . . . . . . . . . . . A . 12 ARG H . . . . . . . . . c30225_5ug3 1 . 2 . 450 . 1 1 12 ARG HA H 4.161 -0.412 -0.691 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HA . . . . . . . . . c30225_5ug3 1 . 2 . 451 . 1 1 12 ARG HB2 H 4.502 0.642 -3.023 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HB2 . . . . . . . . . c30225_5ug3 1 . 2 . 452 . 1 1 12 ARG HB3 H 2.919 0.660 -2.266 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HB3 . . . . . . . . . c30225_5ug3 1 . 2 . 453 . 1 1 12 ARG HD2 H 2.009 2.960 -3.206 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HD2 . . . . . . . . . c30225_5ug3 1 . 2 . 454 . 1 1 12 ARG HD3 H 3.335 3.962 -3.796 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HD3 . . . . . . . . . c30225_5ug3 1 . 2 . 455 . 1 1 12 ARG HE H 3.108 1.108 -4.509 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HE . . . . . . . . . c30225_5ug3 1 . 2 . 456 . 1 1 12 ARG HG2 H 3.458 2.923 -1.430 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HG2 . . . . . . . . . c30225_5ug3 1 . 2 . 457 . 1 1 12 ARG HG3 H 4.899 2.895 -2.451 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HG3 . . . . . . . . . c30225_5ug3 1 . 2 . 458 . 1 1 12 ARG HH11 H 3.518 4.457 -5.449 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH11 . . . . . . . . . c30225_5ug3 1 . 2 . 459 . 1 1 12 ARG HH12 H 3.727 4.085 -7.126 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH12 . . . . . . . . . c30225_5ug3 1 . 2 . 460 . 1 1 12 ARG HH21 H 3.338 0.616 -6.704 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH21 . . . . . . . . . c30225_5ug3 1 . 2 . 461 . 1 1 12 ARG HH22 H 3.642 1.899 -7.844 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH22 . . . . . . . . . c30225_5ug3 1 . 2 . 462 . 1 1 12 ARG N N 4.125 1.364 0.236 . . . 1.0 . . . . . . . . . . . . A . 12 ARG N . . . . . . . . . c30225_5ug3 1 . 2 . 463 . 1 1 12 ARG NE N 3.200 2.074 -4.669 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NE . . . . . . . . . c30225_5ug3 1 . 2 . 464 . 1 1 12 ARG NH1 N 3.563 3.780 -6.186 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NH1 . . . . . . . . . c30225_5ug3 1 . 2 . 465 . 1 1 12 ARG NH2 N 3.468 1.600 -6.903 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NH2 . . . . . . . . . c30225_5ug3 1 . 2 . 466 . 1 1 12 ARG O O 6.561 -0.476 -1.694 . . . 1.0 . . . . . . . . . . . . A . 12 ARG O . . . . . . . . . c30225_5ug3 1 . 2 . 467 . 1 1 13 VAL C C 8.590 -0.049 0.781 . . . 1.0 . . . . . . . . . . . . A . 13 VAL C . . . . . . . . . c30225_5ug3 1 . 2 . 468 . 1 1 13 VAL CA C 8.228 1.084 -0.183 . . . 1.0 . . . . . . . . . . . . A . 13 VAL CA . . . . . . . . . c30225_5ug3 1 . 2 . 469 . 1 1 13 VAL CB C 8.899 2.383 0.280 . . . 1.0 . . . . . . . . . . . . A . 13 VAL CB . . . . . . . . . c30225_5ug3 1 . 2 . 470 . 1 1 13 VAL CG1 C 8.889 3.420 -0.828 . . . 1.0 . . . . . . . . . . . . A . 13 VAL CG1 . . . . . . . . . c30225_5ug3 1 . 2 . 471 . 1 1 13 VAL CG2 C 8.221 2.915 1.527 . . . 1.0 . . . . . . . . . . . . A . 13 VAL CG2 . . . . . . . . . c30225_5ug3 1 . 2 . 472 . 1 1 13 VAL H H 6.368 2.009 0.137 . . . 1.0 . . . . . . . . . . . . A . 13 VAL H . . . . . . . . . c30225_5ug3 1 . 2 . 473 . 1 1 13 VAL HA H 8.607 0.840 -1.164 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HA . . . . . . . . . c30225_5ug3 1 . 2 . 474 . 1 1 13 VAL HB H 9.913 2.162 0.525 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HB . . . . . . . . . c30225_5ug3 1 . 2 . 475 . 1 1 13 VAL HG11 H 7.869 3.642 -1.106 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HG11 . . . . . . . . . c30225_5ug3 1 . 2 . 476 . 1 1 13 VAL HG12 H 9.419 3.034 -1.685 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HG12 . . . . . . . . . c30225_5ug3 1 . 2 . 477 . 1 1 13 VAL HG13 H 9.372 4.322 -0.482 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HG13 . . . . . . . . . c30225_5ug3 1 . 2 . 478 . 1 1 13 VAL HG21 H 8.412 2.246 2.351 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HG21 . . . . . . . . . c30225_5ug3 1 . 2 . 479 . 1 1 13 VAL HG22 H 7.152 2.970 1.356 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HG22 . . . . . . . . . c30225_5ug3 1 . 2 . 480 . 1 1 13 VAL HG23 H 8.602 3.896 1.758 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HG23 . . . . . . . . . c30225_5ug3 1 . 2 . 481 . 1 1 13 VAL N N 6.793 1.246 -0.291 . . . 1.0 . . . . . . . . . . . . A . 13 VAL N . . . . . . . . . c30225_5ug3 1 . 2 . 482 . 1 1 13 VAL O O 9.467 -0.862 0.491 . . . 1.0 . . . . . . . . . . . . A . 13 VAL O . . . . . . . . . c30225_5ug3 1 . 2 . 483 . 1 1 14 ASN C C 7.514 -2.453 2.512 . . . 1.0 . . . . . . . . . . . . A . 14 ASN C . . . . . . . . . c30225_5ug3 1 . 2 . 484 . 1 1 14 ASN CA C 8.204 -1.154 2.911 . . . 1.0 . . . . . . . . . . . . A . 14 ASN CA . . . . . . . . . c30225_5ug3 1 . 2 . 485 . 1 1 14 ASN CB C 7.796 -0.729 4.335 . . . 1.0 . . . . . . . . . . . . A . 14 ASN CB . . . . . . . . . c30225_5ug3 1 . 2 . 486 . 1 1 14 ASN CG C 6.326 -0.950 4.657 . . . 1.0 . . . . . . . . . . . . A . 14 ASN CG . . . . . . . . . c30225_5ug3 1 . 2 . 487 . 1 1 14 ASN H H 7.215 0.554 2.118 . . . 1.0 . . . . . . . . . . . . A . 14 ASN H . . . . . . . . . c30225_5ug3 1 . 2 . 488 . 1 1 14 ASN HA H 9.271 -1.319 2.892 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HA . . . . . . . . . c30225_5ug3 1 . 2 . 489 . 1 1 14 ASN HB2 H 8.379 -1.292 5.043 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HB2 . . . . . . . . . c30225_5ug3 1 . 2 . 490 . 1 1 14 ASN HB3 H 8.016 0.323 4.462 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HB3 . . . . . . . . . c30225_5ug3 1 . 2 . 491 . 1 1 14 ASN HD21 H 5.881 0.902 4.097 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HD21 . . . . . . . . . c30225_5ug3 1 . 2 . 492 . 1 1 14 ASN HD22 H 4.554 -0.056 4.659 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HD22 . . . . . . . . . c30225_5ug3 1 . 2 . 493 . 1 1 14 ASN N N 7.912 -0.112 1.929 . . . 1.0 . . . . . . . . . . . . A . 14 ASN N . . . . . . . . . c30225_5ug3 1 . 2 . 494 . 1 1 14 ASN ND2 N 5.507 0.065 4.447 . . . 1.0 . . . . . . . . . . . . A . 14 ASN ND2 . . . . . . . . . c30225_5ug3 1 . 2 . 495 . 1 1 14 ASN O O 8.067 -3.541 2.676 . . . 1.0 . . . . . . . . . . . . A . 14 ASN O . . . . . . . . . c30225_5ug3 1 . 2 . 496 . 1 1 14 ASN OD1 O 5.932 -2.026 5.110 . . . 1.0 . . . . . . . . . . . . A . 14 ASN OD1 . . . . . . . . . c30225_5ug3 1 . 2 . 497 . 1 1 15 ASN C C 5.829 -3.552 -0.030 . . . 1.0 . . . . . . . . . . . . A . 15 ASN C . . . . . . . . . c30225_5ug3 1 . 2 . 498 . 1 1 15 ASN CA C 5.569 -3.441 1.458 . . . 1.0 . . . . . . . . . . . . A . 15 ASN CA . . . . . . . . . c30225_5ug3 1 . 2 . 499 . 1 1 15 ASN CB C 4.090 -3.262 1.684 . . . 1.0 . . . . . . . . . . . . A . 15 ASN CB . . . . . . . . . c30225_5ug3 1 . 2 . 500 . 1 1 15 ASN CG C 3.495 -4.314 2.595 . . . 1.0 . . . . . . . . . . . . A . 15 ASN CG . . . . . . . . . c30225_5ug3 1 . 2 . 501 . 1 1 15 ASN H H 5.917 -1.446 1.905 . . . 1.0 . . . . . . . . . . . . A . 15 ASN H . . . . . . . . . c30225_5ug3 1 . 2 . 502 . 1 1 15 ASN HA H 5.902 -4.334 1.958 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HA . . . . . . . . . c30225_5ug3 1 . 2 . 503 . 1 1 15 ASN HB2 H 3.908 -2.286 2.114 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HB2 . . . . . . . . . c30225_5ug3 1 . 2 . 504 . 1 1 15 ASN HB3 H 3.612 -3.332 0.727 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HB3 . . . . . . . . . c30225_5ug3 1 . 2 . 505 . 1 1 15 ASN HD21 H 1.796 -4.222 1.581 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HD21 . . . . . . . . . c30225_5ug3 1 . 2 . 506 . 1 1 15 ASN HD22 H 1.824 -5.339 2.905 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HD22 . . . . . . . . . c30225_5ug3 1 . 2 . 507 . 1 1 15 ASN N N 6.312 -2.324 1.973 . . . 1.0 . . . . . . . . . . . . A . 15 ASN N . . . . . . . . . c30225_5ug3 1 . 2 . 508 . 1 1 15 ASN ND2 N 2.249 -4.661 2.337 . . . 1.0 . . . . . . . . . . . . A . 15 ASN ND2 . . . . . . . . . c30225_5ug3 1 . 2 . 509 . 1 1 15 ASN O O 5.270 -2.806 -0.833 . . . 1.0 . . . . . . . . . . . . A . 15 ASN O . . . . . . . . . c30225_5ug3 1 . 2 . 510 . 1 1 15 ASN OD1 O 4.155 -4.826 3.502 . . . 1.0 . . . . . . . . . . . . A . 15 ASN OD1 . . . . . . . . . c30225_5ug3 1 . 2 . 511 . 1 1 16 HYP C C 6.193 -4.828 -2.848 . . . 1.0 . . . . . . . . . . . . A . 16 HYP C . . . . . . . . . c30225_5ug3 1 . 2 . 512 . 1 1 16 HYP CA C 7.229 -4.632 -1.747 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CA . . . . . . . . . c30225_5ug3 1 . 2 . 513 . 1 1 16 HYP CB C 8.114 -5.843 -1.579 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CB . . . . . . . . . c30225_5ug3 1 . 2 . 514 . 1 1 16 HYP CD C 7.078 -5.586 0.528 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CD . . . . . . . . . c30225_5ug3 1 . 2 . 515 . 1 1 16 HYP CG C 8.276 -6.168 -0.119 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CG . . . . . . . . . c30225_5ug3 1 . 2 . 516 . 1 1 16 HYP HA H 7.840 -3.775 -1.989 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HA . . . . . . . . . c30225_5ug3 1 . 2 . 517 . 1 1 16 HYP HB2 H 9.085 -5.640 -2.002 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HB2 . . . . . . . . . c30225_5ug3 1 . 2 . 518 . 1 1 16 HYP HB3 H 7.664 -6.685 -2.089 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HB3 . . . . . . . . . c30225_5ug3 1 . 2 . 519 . 1 1 16 HYP HD1 H 8.928 -4.788 1.022 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HD1 . . . . . . . . . c30225_5ug3 1 . 2 . 520 . 1 1 16 HYP HD22 H 6.319 -6.297 0.655 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HD22 . . . . . . . . . c30225_5ug3 1 . 2 . 521 . 1 1 16 HYP HD23 H 7.355 -5.171 1.484 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HD23 . . . . . . . . . c30225_5ug3 1 . 2 . 522 . 1 1 16 HYP HG H 8.373 -7.228 0.055 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HG . . . . . . . . . c30225_5ug3 1 . 2 . 523 . 1 1 16 HYP N N 6.655 -4.509 -0.390 . . . 1.0 . . . . . . . . . . . . A . 16 HYP N . . . . . . . . . c30225_5ug3 1 . 2 . 524 . 1 1 16 HYP O O 5.767 -5.948 -3.138 . . . 1.0 . . . . . . . . . . . . A . 16 HYP O . . . . . . . . . c30225_5ug3 1 . 2 . 525 . 1 1 16 HYP OD1 O 9.344 -5.456 0.446 . . . 1.0 . . . . . . . . . . . . A . 16 HYP OD1 . . . . . . . . . c30225_5ug3 1 . 2 . 526 . 1 1 17 HIS C C 3.577 -4.350 -4.344 . . . 1.0 . . . . . . . . . . . . A . 17 HIS C . . . . . . . . . c30225_5ug3 1 . 2 . 527 . 1 1 17 HIS CA C 4.926 -3.676 -4.608 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CA . . . . . . . . . c30225_5ug3 1 . 2 . 528 . 1 1 17 HIS CB C 5.637 -4.328 -5.804 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CB . . . . . . . . . c30225_5ug3 1 . 2 . 529 . 1 1 17 HIS CD2 C 4.671 -2.828 -7.694 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CD2 . . . . . . . . . c30225_5ug3 1 . 2 . 530 . 1 1 17 HIS CE1 C 4.203 -4.401 -9.143 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CE1 . . . . . . . . . c30225_5ug3 1 . 2 . 531 . 1 1 17 HIS CG C 5.018 -4.012 -7.135 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CG . . . . . . . . . c30225_5ug3 1 . 2 . 532 . 1 1 17 HIS H H 6.081 -2.848 -3.048 . . . 1.0 . . . . . . . . . . . . A . 17 HIS H . . . . . . . . . c30225_5ug3 1 . 2 . 533 . 1 1 17 HIS HA H 4.742 -2.640 -4.846 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HA . . . . . . . . . c30225_5ug3 1 . 2 . 534 . 1 1 17 HIS HB2 H 6.661 -3.990 -5.830 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HB2 . . . . . . . . . c30225_5ug3 1 . 2 . 535 . 1 1 17 HIS HB3 H 5.622 -5.401 -5.679 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HB3 . . . . . . . . . c30225_5ug3 1 . 2 . 536 . 1 1 17 HIS HD1 H 4.843 -5.946 -7.962 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HD1 . . . . . . . . . c30225_5ug3 1 . 2 . 537 . 1 1 17 HIS HD2 H 4.773 -1.851 -7.242 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HD2 . . . . . . . . . c30225_5ug3 1 . 2 . 538 . 1 1 17 HIS HE1 H 3.871 -4.910 -10.035 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HE1 . . . . . . . . . c30225_5ug3 1 . 2 . 539 . 1 1 17 HIS HE2 H 3.742 -2.444 -9.539 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HE2 . . . . . . . . . c30225_5ug3 1 . 2 . 540 . 1 1 17 HIS N N 5.787 -3.704 -3.433 . . . 1.0 . . . . . . . . . . . . A . 17 HIS N . . . . . . . . . c30225_5ug3 1 . 2 . 541 . 1 1 17 HIS ND1 N 4.710 -4.977 -8.070 . . . 1.0 . . . . . . . . . . . . A . 17 HIS ND1 . . . . . . . . . c30225_5ug3 1 . 2 . 542 . 1 1 17 HIS NE2 N 4.169 -3.100 -8.941 . . . 1.0 . . . . . . . . . . . . A . 17 HIS NE2 . . . . . . . . . c30225_5ug3 1 . 2 . 543 . 1 1 17 HIS O O 3.065 -5.086 -5.186 . . . 1.0 . . . . . . . . . . . . A . 17 HIS O . . . . . . . . . c30225_5ug3 1 . 2 . 544 . 1 1 18 VAL C C 0.674 -3.553 -3.604 . . . 1.0 . . . . . . . . . . . . A . 18 VAL C . . . . . . . . . c30225_5ug3 1 . 2 . 545 . 1 1 18 VAL CA C 1.629 -4.519 -2.911 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CA . . . . . . . . . c30225_5ug3 1 . 2 . 546 . 1 1 18 VAL CB C 1.337 -4.564 -1.405 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CB . . . . . . . . . c30225_5ug3 1 . 2 . 547 . 1 1 18 VAL CG1 C 2.228 -5.597 -0.732 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CG1 . . . . . . . . . c30225_5ug3 1 . 2 . 548 . 1 1 18 VAL CG2 C 1.522 -3.187 -0.780 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CG2 . . . . . . . . . c30225_5ug3 1 . 2 . 549 . 1 1 18 VAL H H 3.508 -3.677 -2.446 . . . 1.0 . . . . . . . . . . . . A . 18 VAL H . . . . . . . . . c30225_5ug3 1 . 2 . 550 . 1 1 18 VAL HA H 1.492 -5.509 -3.321 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HA . . . . . . . . . c30225_5ug3 1 . 2 . 551 . 1 1 18 VAL HB H 0.315 -4.862 -1.266 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HB . . . . . . . . . c30225_5ug3 1 . 2 . 552 . 1 1 18 VAL HG11 H 2.126 -6.544 -1.240 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG11 . . . . . . . . . c30225_5ug3 1 . 2 . 553 . 1 1 18 VAL HG12 H 1.933 -5.713 0.299 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG12 . . . . . . . . . c30225_5ug3 1 . 2 . 554 . 1 1 18 VAL HG13 H 3.257 -5.273 -0.778 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG13 . . . . . . . . . c30225_5ug3 1 . 2 . 555 . 1 1 18 VAL HG21 H 2.539 -2.856 -0.932 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG21 . . . . . . . . . c30225_5ug3 1 . 2 . 556 . 1 1 18 VAL HG22 H 1.315 -3.239 0.278 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG22 . . . . . . . . . c30225_5ug3 1 . 2 . 557 . 1 1 18 VAL HG23 H 0.844 -2.487 -1.246 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG23 . . . . . . . . . c30225_5ug3 1 . 2 . 558 . 1 1 18 VAL N N 3.000 -4.110 -3.168 . . . 1.0 . . . . . . . . . . . . A . 18 VAL N . . . . . . . . . c30225_5ug3 1 . 2 . 559 . 1 1 18 VAL O O -0.529 -3.797 -3.710 . . . 1.0 . . . . . . . . . . . . A . 18 VAL O . . . . . . . . . c30225_5ug3 1 . 2 . 560 . 1 1 19 CYS C C 1.325 -1.147 -6.100 . . . 1.0 . . . . . . . . . . . . A . 19 CYS C . . . . . . . . . c30225_5ug3 1 . 2 . 561 . 1 1 19 CYS CA C 0.541 -1.451 -4.833 . . . 1.0 . . . . . . . . . . . . A . 19 CYS CA . . . . . . . . . c30225_5ug3 1 . 2 . 562 . 1 1 19 CYS CB C 0.358 -0.186 -3.988 . . . 1.0 . . . . . . . . . . . . A . 19 CYS CB . . . . . . . . . c30225_5ug3 1 . 2 . 563 . 1 1 19 CYS H H 2.204 -2.335 -3.920 . . . 1.0 . . . . . . . . . . . . A . 19 CYS H . . . . . . . . . c30225_5ug3 1 . 2 . 564 . 1 1 19 CYS HA H -0.428 -1.846 -5.103 . . . 1.0 . . . . . . . . . . . . A . 19 CYS HA . . . . . . . . . c30225_5ug3 1 . 2 . 565 . 1 1 19 CYS HB2 H -0.510 -0.308 -3.359 . . . 1.0 . . . . . . . . . . . . A . 19 CYS HB2 . . . . . . . . . c30225_5ug3 1 . 2 . 566 . 1 1 19 CYS HB3 H 1.229 -0.054 -3.363 . . . 1.0 . . . . . . . . . . . . A . 19 CYS HB3 . . . . . . . . . c30225_5ug3 1 . 2 . 567 . 1 1 19 CYS N N 1.248 -2.461 -4.077 . . . 1.0 . . . . . . . . . . . . A . 19 CYS N . . . . . . . . . c30225_5ug3 1 . 2 . 568 . 1 1 19 CYS O O 2.486 -0.702 -5.983 . . . 1.0 . . . . . . . . . . . . A . 19 CYS O . . . . . . . . . c30225_5ug3 1 . 2 . 569 . 1 1 19 CYS OXT O 0.792 -1.382 -7.203 . . . 1.0 . . . . . . . . . . . . A . 19 CYS OXT . . . . . . . . . c30225_5ug3 1 . 2 . 570 . 1 1 19 CYS SG S 0.130 1.348 -4.952 . . . 1.0 . . . . . . . . . . . . A . 19 CYS SG . . . . . . . . . c30225_5ug3 1 . 3 . 571 . 1 1 1 ILE C C -9.606 -3.406 3.295 . . . 1.0 . . . . . . . . . . . . A . 1 ILE C . . . . . . . . . c30225_5ug3 1 . 3 . 572 . 1 1 1 ILE CA C -10.327 -3.882 4.549 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CA . . . . . . . . . c30225_5ug3 1 . 3 . 573 . 1 1 1 ILE CB C -9.448 -3.560 5.778 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CB . . . . . . . . . c30225_5ug3 1 . 3 . 574 . 1 1 1 ILE CD1 C -7.147 -3.938 6.805 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CD1 . . . . . . . . . c30225_5ug3 1 . 3 . 575 . 1 1 1 ILE CG1 C -8.133 -4.345 5.732 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CG1 . . . . . . . . . c30225_5ug3 1 . 3 . 576 . 1 1 1 ILE CG2 C -10.204 -3.860 7.062 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CG2 . . . . . . . . . c30225_5ug3 1 . 3 . 577 . 1 1 1 ILE H1 H -9.769 -5.876 4.355 . . . 1.0 . . . . . . . . . . . . A . 1 ILE H1 . . . . . . . . . c30225_5ug3 1 . 3 . 578 . 1 1 1 ILE H2 H -11.246 -5.505 3.629 . . . 1.0 . . . . . . . . . . . . A . 1 ILE H2 . . . . . . . . . c30225_5ug3 1 . 3 . 579 . 1 1 1 ILE H3 H -11.143 -5.641 5.310 . . . 1.0 . . . . . . . . . . . . A . 1 ILE H3 . . . . . . . . . c30225_5ug3 1 . 3 . 580 . 1 1 1 ILE HA H -11.254 -3.339 4.643 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HA . . . . . . . . . c30225_5ug3 1 . 3 . 581 . 1 1 1 ILE HB H -9.227 -2.502 5.764 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HB . . . . . . . . . c30225_5ug3 1 . 3 . 582 . 1 1 1 ILE HD11 H -7.603 -4.058 7.776 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HD11 . . . . . . . . . c30225_5ug3 1 . 3 . 583 . 1 1 1 ILE HD12 H -6.866 -2.906 6.664 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HD12 . . . . . . . . . c30225_5ug3 1 . 3 . 584 . 1 1 1 ILE HD13 H -6.269 -4.562 6.741 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HD13 . . . . . . . . . c30225_5ug3 1 . 3 . 585 . 1 1 1 ILE HG12 H -8.346 -5.395 5.858 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG12 . . . . . . . . . c30225_5ug3 1 . 3 . 586 . 1 1 1 ILE HG13 H -7.664 -4.189 4.771 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG13 . . . . . . . . . c30225_5ug3 1 . 3 . 587 . 1 1 1 ILE HG21 H -10.469 -4.907 7.087 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG21 . . . . . . . . . c30225_5ug3 1 . 3 . 588 . 1 1 1 ILE HG22 H -11.101 -3.261 7.100 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG22 . . . . . . . . . c30225_5ug3 1 . 3 . 589 . 1 1 1 ILE HG23 H -9.578 -3.627 7.910 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG23 . . . . . . . . . c30225_5ug3 1 . 3 . 590 . 1 1 1 ILE N N -10.642 -5.324 4.455 . . . 1.0 . . . . . . . . . . . . A . 1 ILE N . . . . . . . . . c30225_5ug3 1 . 3 . 591 . 1 1 1 ILE O O -8.781 -4.128 2.727 . . . 1.0 . . . . . . . . . . . . A . 1 ILE O . . . . . . . . . c30225_5ug3 1 . 3 . 592 . 1 1 2 ARG C C -7.971 -0.936 2.175 . . . 1.0 . . . . . . . . . . . . A . 2 ARG C . . . . . . . . . c30225_5ug3 1 . 3 . 593 . 1 1 2 ARG CA C -9.261 -1.597 1.723 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CA . . . . . . . . . c30225_5ug3 1 . 3 . 594 . 1 1 2 ARG CB C -10.171 -0.582 1.027 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CB . . . . . . . . . c30225_5ug3 1 . 3 . 595 . 1 1 2 ARG CD C -11.020 -2.134 -0.787 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CD . . . . . . . . . c30225_5ug3 1 . 3 . 596 . 1 1 2 ARG CG C -11.396 -1.200 0.360 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CG . . . . . . . . . c30225_5ug3 1 . 3 . 597 . 1 1 2 ARG CZ C -9.258 -3.874 -0.813 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CZ . . . . . . . . . c30225_5ug3 1 . 3 . 598 . 1 1 2 ARG H H -10.642 -1.699 3.309 . . . 1.0 . . . . . . . . . . . . A . 2 ARG H . . . . . . . . . c30225_5ug3 1 . 3 . 599 . 1 1 2 ARG HA H -9.024 -2.387 1.032 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HA . . . . . . . . . c30225_5ug3 1 . 3 . 600 . 1 1 2 ARG HB2 H -10.511 0.137 1.757 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB2 . . . . . . . . . c30225_5ug3 1 . 3 . 601 . 1 1 2 ARG HB3 H -9.599 -0.067 0.269 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB3 . . . . . . . . . c30225_5ug3 1 . 3 . 602 . 1 1 2 ARG HD2 H -11.915 -2.385 -1.335 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD2 . . . . . . . . . c30225_5ug3 1 . 3 . 603 . 1 1 2 ARG HD3 H -10.334 -1.618 -1.441 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD3 . . . . . . . . . c30225_5ug3 1 . 3 . 604 . 1 1 2 ARG HE H -10.849 -3.861 0.402 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HE . . . . . . . . . c30225_5ug3 1 . 3 . 605 . 1 1 2 ARG HG2 H -11.946 -1.763 1.099 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG2 . . . . . . . . . c30225_5ug3 1 . 3 . 606 . 1 1 2 ARG HG3 H -12.019 -0.405 -0.024 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG3 . . . . . . . . . c30225_5ug3 1 . 3 . 607 . 1 1 2 ARG HH11 H -8.953 -2.376 -2.148 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH11 . . . . . . . . . c30225_5ug3 1 . 3 . 608 . 1 1 2 ARG HH12 H -7.750 -3.626 -2.147 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH12 . . . . . . . . . c30225_5ug3 1 . 3 . 609 . 1 1 2 ARG HH21 H -9.262 -5.486 0.416 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH21 . . . . . . . . . c30225_5ug3 1 . 3 . 610 . 1 1 2 ARG HH22 H -7.925 -5.396 -0.689 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH22 . . . . . . . . . c30225_5ug3 1 . 3 . 611 . 1 1 2 ARG N N -9.931 -2.199 2.858 . . . 1.0 . . . . . . . . . . . . A . 2 ARG N . . . . . . . . . c30225_5ug3 1 . 3 . 612 . 1 1 2 ARG NE N -10.391 -3.372 -0.321 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NE . . . . . . . . . c30225_5ug3 1 . 3 . 613 . 1 1 2 ARG NH1 N -8.602 -3.242 -1.780 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH1 . . . . . . . . . c30225_5ug3 1 . 3 . 614 . 1 1 2 ARG NH2 N -8.777 -5.010 -0.322 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH2 . . . . . . . . . c30225_5ug3 1 . 3 . 615 . 1 1 2 ARG O O -7.923 -0.323 3.243 . . . 1.0 . . . . . . . . . . . . A . 2 ARG O . . . . . . . . . c30225_5ug3 1 . 3 . 616 . 1 1 3 ASP C C -5.337 0.775 1.109 . . . 1.0 . . . . . . . . . . . . A . 3 ASP C . . . . . . . . . c30225_5ug3 1 . 3 . 617 . 1 1 3 ASP CA C -5.618 -0.571 1.749 . . . 1.0 . . . . . . . . . . . . A . 3 ASP CA . . . . . . . . . c30225_5ug3 1 . 3 . 618 . 1 1 3 ASP CB C -4.520 -1.565 1.361 . . . 1.0 . . . . . . . . . . . . A . 3 ASP CB . . . . . . . . . c30225_5ug3 1 . 3 . 619 . 1 1 3 ASP CG C -4.608 -2.866 2.129 . . . 1.0 . . . . . . . . . . . . A . 3 ASP CG . . . . . . . . . c30225_5ug3 1 . 3 . 620 . 1 1 3 ASP H H -7.042 -1.491 0.498 . . . 1.0 . . . . . . . . . . . . A . 3 ASP H . . . . . . . . . c30225_5ug3 1 . 3 . 621 . 1 1 3 ASP HA H -5.611 -0.449 2.821 . . . 1.0 . . . . . . . . . . . . A . 3 ASP HA . . . . . . . . . c30225_5ug3 1 . 3 . 622 . 1 1 3 ASP HB2 H -4.599 -1.787 0.308 . . . 1.0 . . . . . . . . . . . . A . 3 ASP HB2 . . . . . . . . . c30225_5ug3 1 . 3 . 623 . 1 1 3 ASP HB3 H -3.558 -1.118 1.556 . . . 1.0 . . . . . . . . . . . . A . 3 ASP HB3 . . . . . . . . . c30225_5ug3 1 . 3 . 624 . 1 1 3 ASP N N -6.929 -1.065 1.372 . . . 1.0 . . . . . . . . . . . . A . 3 ASP N . . . . . . . . . c30225_5ug3 1 . 3 . 625 . 1 1 3 ASP O O -4.958 0.855 -0.061 . . . 1.0 . . . . . . . . . . . . A . 3 ASP O . . . . . . . . . c30225_5ug3 1 . 3 . 626 . 1 1 3 ASP OD1 O -4.341 -2.862 3.349 . . . 1.0 . . . . . . . . . . . . A . 3 ASP OD1 . . . . . . . . . c30225_5ug3 1 . 3 . 627 . 1 1 3 ASP OD2 O -4.938 -3.901 1.513 . . . 1.0 . . . . . . . . . . . . A . 3 ASP OD2 . . . . . . . . . c30225_5ug3 1 . 3 . 628 . 1 1 4 GLU C C -3.663 3.272 1.189 . . . 1.0 . . . . . . . . . . . . A . 4 GLU C . . . . . . . . . c30225_5ug3 1 . 3 . 629 . 1 1 4 GLU CA C -5.160 3.182 1.482 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CA . . . . . . . . . c30225_5ug3 1 . 3 . 630 . 1 1 4 GLU CB C -5.516 4.165 2.593 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CB . . . . . . . . . c30225_5ug3 1 . 3 . 631 . 1 1 4 GLU CD C -5.464 6.585 3.284 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CD . . . . . . . . . c30225_5ug3 1 . 3 . 632 . 1 1 4 GLU CG C -5.549 5.604 2.135 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CG . . . . . . . . . c30225_5ug3 1 . 3 . 633 . 1 1 4 GLU H H -5.935 1.707 2.767 . . . 1.0 . . . . . . . . . . . . A . 4 GLU H . . . . . . . . . c30225_5ug3 1 . 3 . 634 . 1 1 4 GLU HA H -5.717 3.429 0.591 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HA . . . . . . . . . c30225_5ug3 1 . 3 . 635 . 1 1 4 GLU HB2 H -6.489 3.910 2.984 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HB2 . . . . . . . . . c30225_5ug3 1 . 3 . 636 . 1 1 4 GLU HB3 H -4.785 4.076 3.384 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HB3 . . . . . . . . . c30225_5ug3 1 . 3 . 637 . 1 1 4 GLU HG2 H -4.718 5.779 1.469 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HG2 . . . . . . . . . c30225_5ug3 1 . 3 . 638 . 1 1 4 GLU HG3 H -6.475 5.767 1.608 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HG3 . . . . . . . . . c30225_5ug3 1 . 3 . 639 . 1 1 4 GLU N N -5.519 1.833 1.893 . . . 1.0 . . . . . . . . . . . . A . 4 GLU N . . . . . . . . . c30225_5ug3 1 . 3 . 640 . 1 1 4 GLU O O -3.179 4.244 0.610 . . . 1.0 . . . . . . . . . . . . A . 4 GLU O . . . . . . . . . c30225_5ug3 1 . 3 . 641 . 1 1 4 GLU OE1 O -6.445 6.706 4.045 . . . 1.0 . . . . . . . . . . . . A . 4 GLU OE1 . . . . . . . . . c30225_5ug3 1 . 3 . 642 . 1 1 4 GLU OE2 O -4.409 7.240 3.431 . . . 1.0 . . . . . . . . . . . . A . 4 GLU OE2 . . . . . . . . . c30225_5ug3 1 . 3 . 643 . 1 1 5 CYS C C -1.059 2.276 -0.026 . . . 1.0 . . . . . . . . . . . . A . 5 CYS C . . . . . . . . . c30225_5ug3 1 . 3 . 644 . 1 1 5 CYS CA C -1.497 2.176 1.437 . . . 1.0 . . . . . . . . . . . . A . 5 CYS CA . . . . . . . . . c30225_5ug3 1 . 3 . 645 . 1 1 5 CYS CB C -0.988 0.889 2.068 . . . 1.0 . . . . . . . . . . . . A . 5 CYS CB . . . . . . . . . c30225_5ug3 1 . 3 . 646 . 1 1 5 CYS H H -3.388 1.486 2.024 . . . 1.0 . . . . . . . . . . . . A . 5 CYS H . . . . . . . . . c30225_5ug3 1 . 3 . 647 . 1 1 5 CYS HA H -1.075 3.008 1.977 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HA . . . . . . . . . c30225_5ug3 1 . 3 . 648 . 1 1 5 CYS HB2 H -1.738 0.119 1.954 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HB2 . . . . . . . . . c30225_5ug3 1 . 3 . 649 . 1 1 5 CYS HB3 H -0.090 0.584 1.569 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HB3 . . . . . . . . . c30225_5ug3 1 . 3 . 650 . 1 1 5 CYS N N -2.935 2.241 1.597 . . . 1.0 . . . . . . . . . . . . A . 5 CYS N . . . . . . . . . c30225_5ug3 1 . 3 . 651 . 1 1 5 CYS O O 0.122 2.455 -0.312 . . . 1.0 . . . . . . . . . . . . A . 5 CYS O . . . . . . . . . c30225_5ug3 1 . 3 . 652 . 1 1 5 CYS SG S -0.624 1.049 3.846 . . . 1.0 . . . . . . . . . . . . A . 5 CYS SG . . . . . . . . . c30225_5ug3 1 . 3 . 653 . 1 1 6 CYS C C -1.312 3.824 -2.624 . . . 1.0 . . . . . . . . . . . . A . 6 CYS C . . . . . . . . . c30225_5ug3 1 . 3 . 654 . 1 1 6 CYS CA C -1.746 2.383 -2.354 . . . 1.0 . . . . . . . . . . . . A . 6 CYS CA . . . . . . . . . c30225_5ug3 1 . 3 . 655 . 1 1 6 CYS CB C -3.010 2.086 -3.147 . . . 1.0 . . . . . . . . . . . . A . 6 CYS CB . . . . . . . . . c30225_5ug3 1 . 3 . 656 . 1 1 6 CYS H H -2.913 1.908 -0.671 . . . 1.0 . . . . . . . . . . . . A . 6 CYS H . . . . . . . . . c30225_5ug3 1 . 3 . 657 . 1 1 6 CYS HA H -0.958 1.707 -2.661 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HA . . . . . . . . . c30225_5ug3 1 . 3 . 658 . 1 1 6 CYS HB2 H -3.802 2.724 -2.783 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HB2 . . . . . . . . . c30225_5ug3 1 . 3 . 659 . 1 1 6 CYS HB3 H -2.831 2.302 -4.185 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HB3 . . . . . . . . . c30225_5ug3 1 . 3 . 660 . 1 1 6 CYS N N -2.008 2.164 -0.944 . . . 1.0 . . . . . . . . . . . . A . 6 CYS N . . . . . . . . . c30225_5ug3 1 . 3 . 661 . 1 1 6 CYS O O -0.409 4.069 -3.421 . . . 1.0 . . . . . . . . . . . . A . 6 CYS O . . . . . . . . . c30225_5ug3 1 . 3 . 662 . 1 1 6 CYS SG S -3.588 0.365 -3.023 . . . 1.0 . . . . . . . . . . . . A . 6 CYS SG . . . . . . . . . c30225_5ug3 1 . 3 . 663 . 1 1 7 SER C C -0.613 6.675 -1.196 . . . 1.0 . . . . . . . . . . . . A . 7 SER C . . . . . . . . . c30225_5ug3 1 . 3 . 664 . 1 1 7 SER CA C -1.673 6.187 -2.173 . . . 1.0 . . . . . . . . . . . . A . 7 SER CA . . . . . . . . . c30225_5ug3 1 . 3 . 665 . 1 1 7 SER CB C -2.949 7.012 -2.022 . . . 1.0 . . . . . . . . . . . . A . 7 SER CB . . . . . . . . . c30225_5ug3 1 . 3 . 666 . 1 1 7 SER H H -2.648 4.523 -1.302 . . . 1.0 . . . . . . . . . . . . A . 7 SER H . . . . . . . . . c30225_5ug3 1 . 3 . 667 . 1 1 7 SER HA H -1.297 6.300 -3.179 . . . 1.0 . . . . . . . . . . . . A . 7 SER HA . . . . . . . . . c30225_5ug3 1 . 3 . 668 . 1 1 7 SER HB2 H -2.704 8.061 -2.079 . . . 1.0 . . . . . . . . . . . . A . 7 SER HB2 . . . . . . . . . c30225_5ug3 1 . 3 . 669 . 1 1 7 SER HB3 H -3.635 6.758 -2.815 . . . 1.0 . . . . . . . . . . . . A . 7 SER HB3 . . . . . . . . . c30225_5ug3 1 . 3 . 670 . 1 1 7 SER HG H -3.510 7.543 -0.218 . . . 1.0 . . . . . . . . . . . . A . 7 SER HG . . . . . . . . . c30225_5ug3 1 . 3 . 671 . 1 1 7 SER N N -1.961 4.775 -1.958 . . . 1.0 . . . . . . . . . . . . A . 7 SER N . . . . . . . . . c30225_5ug3 1 . 3 . 672 . 1 1 7 SER O O -0.124 7.798 -1.295 . . . 1.0 . . . . . . . . . . . . A . 7 SER O . . . . . . . . . c30225_5ug3 1 . 3 . 673 . 1 1 7 SER OG O -3.574 6.756 -0.775 . . . 1.0 . . . . . . . . . . . . A . 7 SER OG . . . . . . . . . c30225_5ug3 1 . 3 . 674 . 1 1 8 ASN C C 2.055 5.478 0.267 . . . 1.0 . . . . . . . . . . . . A . 8 ASN C . . . . . . . . . c30225_5ug3 1 . 3 . 675 . 1 1 8 ASN CA C 0.768 6.113 0.723 . . . 1.0 . . . . . . . . . . . . A . 8 ASN CA . . . . . . . . . c30225_5ug3 1 . 3 . 676 . 1 1 8 ASN CB C 0.408 5.549 2.090 . . . 1.0 . . . . . . . . . . . . A . 8 ASN CB . . . . . . . . . c30225_5ug3 1 . 3 . 677 . 1 1 8 ASN CG C -0.741 6.286 2.748 . . . 1.0 . . . . . . . . . . . . A . 8 ASN CG . . . . . . . . . c30225_5ug3 1 . 3 . 678 . 1 1 8 ASN H H -0.736 4.958 -0.204 . . . 1.0 . . . . . . . . . . . . A . 8 ASN H . . . . . . . . . c30225_5ug3 1 . 3 . 679 . 1 1 8 ASN HA H 0.890 7.182 0.790 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HA . . . . . . . . . c30225_5ug3 1 . 3 . 680 . 1 1 8 ASN HB2 H 0.132 4.516 1.965 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HB2 . . . . . . . . . c30225_5ug3 1 . 3 . 681 . 1 1 8 ASN HB3 H 1.273 5.607 2.737 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HB3 . . . . . . . . . c30225_5ug3 1 . 3 . 682 . 1 1 8 ASN HD21 H -2.047 5.212 1.711 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HD21 . . . . . . . . . c30225_5ug3 1 . 3 . 683 . 1 1 8 ASN HD22 H -2.727 6.391 2.790 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HD22 . . . . . . . . . c30225_5ug3 1 . 3 . 684 . 1 1 8 ASN N N -0.277 5.821 -0.246 . . . 1.0 . . . . . . . . . . . . A . 8 ASN N . . . . . . . . . c30225_5ug3 1 . 3 . 685 . 1 1 8 ASN ND2 N -1.957 5.926 2.383 . . . 1.0 . . . . . . . . . . . . A . 8 ASN ND2 . . . . . . . . . c30225_5ug3 1 . 3 . 686 . 1 1 8 ASN O O 2.247 4.274 0.449 . . . 1.0 . . . . . . . . . . . . A . 8 ASN O . . . . . . . . . c30225_5ug3 1 . 3 . 687 . 1 1 8 ASN OD1 O -0.534 7.188 3.559 . . . 1.0 . . . . . . . . . . . . A . 8 ASN OD1 . . . . . . . . . c30225_5ug3 1 . 3 . 688 . 1 1 9 PRO C C 5.009 4.956 0.153 . . . 1.0 . . . . . . . . . . . . A . 9 PRO C . . . . . . . . . c30225_5ug3 1 . 3 . 689 . 1 1 9 PRO CA C 4.189 5.720 -0.880 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CA . . . . . . . . . c30225_5ug3 1 . 3 . 690 . 1 1 9 PRO CB C 4.945 6.957 -1.383 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CB . . . . . . . . . c30225_5ug3 1 . 3 . 691 . 1 1 9 PRO CD C 2.869 7.714 -0.518 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CD . . . . . . . . . c30225_5ug3 1 . 3 . 692 . 1 1 9 PRO CG C 4.303 8.109 -0.694 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CG . . . . . . . . . c30225_5ug3 1 . 3 . 693 . 1 1 9 PRO HA H 3.972 5.068 -1.705 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HA . . . . . . . . . c30225_5ug3 1 . 3 . 694 . 1 1 9 PRO HB2 H 5.990 6.875 -1.129 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HB2 . . . . . . . . . c30225_5ug3 1 . 3 . 695 . 1 1 9 PRO HB3 H 4.832 7.035 -2.451 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HB3 . . . . . . . . . c30225_5ug3 1 . 3 . 696 . 1 1 9 PRO HD2 H 2.455 8.194 0.347 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HD2 . . . . . . . . . c30225_5ug3 1 . 3 . 697 . 1 1 9 PRO HD3 H 2.296 7.955 -1.400 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HD3 . . . . . . . . . c30225_5ug3 1 . 3 . 698 . 1 1 9 PRO HG2 H 4.771 8.273 0.266 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HG2 . . . . . . . . . c30225_5ug3 1 . 3 . 699 . 1 1 9 PRO HG3 H 4.376 8.994 -1.308 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HG3 . . . . . . . . . c30225_5ug3 1 . 3 . 700 . 1 1 9 PRO N N 2.960 6.257 -0.328 . . . 1.0 . . . . . . . . . . . . A . 9 PRO N . . . . . . . . . c30225_5ug3 1 . 3 . 701 . 1 1 9 PRO O O 5.769 4.063 -0.199 . . . 1.0 . . . . . . . . . . . . A . 9 PRO O . . . . . . . . . c30225_5ug3 1 . 3 . 702 . 1 1 10 VAL C C 5.243 3.171 2.622 . . . 1.0 . . . . . . . . . . . . A . 10 VAL C . . . . . . . . . c30225_5ug3 1 . 3 . 703 . 1 1 10 VAL CA C 5.592 4.645 2.488 . . . 1.0 . . . . . . . . . . . . A . 10 VAL CA . . . . . . . . . c30225_5ug3 1 . 3 . 704 . 1 1 10 VAL CB C 5.384 5.359 3.841 . . . 1.0 . . . . . . . . . . . . A . 10 VAL CB . . . . . . . . . c30225_5ug3 1 . 3 . 705 . 1 1 10 VAL CG1 C 3.998 5.102 4.417 . . . 1.0 . . . . . . . . . . . . A . 10 VAL CG1 . . . . . . . . . c30225_5ug3 1 . 3 . 706 . 1 1 10 VAL CG2 C 6.470 4.962 4.829 . . . 1.0 . . . . . . . . . . . . A . 10 VAL CG2 . . . . . . . . . c30225_5ug3 1 . 3 . 707 . 1 1 10 VAL H H 4.080 5.893 1.663 . . . 1.0 . . . . . . . . . . . . A . 10 VAL H . . . . . . . . . c30225_5ug3 1 . 3 . 708 . 1 1 10 VAL HA H 6.636 4.728 2.214 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HA . . . . . . . . . c30225_5ug3 1 . 3 . 709 . 1 1 10 VAL HB H 5.462 6.412 3.660 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HB . . . . . . . . . c30225_5ug3 1 . 3 . 710 . 1 1 10 VAL HG11 H 3.868 4.043 4.578 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HG11 . . . . . . . . . c30225_5ug3 1 . 3 . 711 . 1 1 10 VAL HG12 H 3.251 5.453 3.724 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HG12 . . . . . . . . . c30225_5ug3 1 . 3 . 712 . 1 1 10 VAL HG13 H 3.895 5.626 5.355 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HG13 . . . . . . . . . c30225_5ug3 1 . 3 . 713 . 1 1 10 VAL HG21 H 7.431 5.289 4.460 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HG21 . . . . . . . . . c30225_5ug3 1 . 3 . 714 . 1 1 10 VAL HG22 H 6.474 3.889 4.945 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HG22 . . . . . . . . . c30225_5ug3 1 . 3 . 715 . 1 1 10 VAL HG23 H 6.273 5.426 5.784 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HG23 . . . . . . . . . c30225_5ug3 1 . 3 . 716 . 1 1 10 VAL N N 4.800 5.260 1.430 . . . 1.0 . . . . . . . . . . . . A . 10 VAL N . . . . . . . . . c30225_5ug3 1 . 3 . 717 . 1 1 10 VAL O O 6.108 2.323 2.841 . . . 1.0 . . . . . . . . . . . . A . 10 VAL O . . . . . . . . . c30225_5ug3 1 . 3 . 718 . 1 1 11 CYS C C 4.083 0.682 1.405 . . . 1.0 . . . . . . . . . . . . A . 11 CYS C . . . . . . . . . c30225_5ug3 1 . 3 . 719 . 1 1 11 CYS CA C 3.491 1.517 2.528 . . . 1.0 . . . . . . . . . . . . A . 11 CYS CA . . . . . . . . . c30225_5ug3 1 . 3 . 720 . 1 1 11 CYS CB C 1.978 1.489 2.419 . . . 1.0 . . . . . . . . . . . . A . 11 CYS CB . . . . . . . . . c30225_5ug3 1 . 3 . 721 . 1 1 11 CYS H H 3.335 3.606 2.314 . . . 1.0 . . . . . . . . . . . . A . 11 CYS H . . . . . . . . . c30225_5ug3 1 . 3 . 722 . 1 1 11 CYS HA H 3.785 1.103 3.478 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HA . . . . . . . . . c30225_5ug3 1 . 3 . 723 . 1 1 11 CYS HB2 H 1.679 2.067 1.557 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HB2 . . . . . . . . . c30225_5ug3 1 . 3 . 724 . 1 1 11 CYS HB3 H 1.667 0.473 2.281 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HB3 . . . . . . . . . c30225_5ug3 1 . 3 . 725 . 1 1 11 CYS N N 3.971 2.878 2.465 . . . 1.0 . . . . . . . . . . . . A . 11 CYS N . . . . . . . . . c30225_5ug3 1 . 3 . 726 . 1 1 11 CYS O O 4.597 -0.410 1.634 . . . 1.0 . . . . . . . . . . . . A . 11 CYS O . . . . . . . . . c30225_5ug3 1 . 3 . 727 . 1 1 11 CYS SG S 1.080 2.152 3.858 . . . 1.0 . . . . . . . . . . . . A . 11 CYS SG . . . . . . . . . c30225_5ug3 1 . 3 . 728 . 1 1 12 ARG C C 5.931 0.251 -1.056 . . . 1.0 . . . . . . . . . . . . A . 12 ARG C . . . . . . . . . c30225_5ug3 1 . 3 . 729 . 1 1 12 ARG CA C 4.425 0.467 -0.989 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CA . . . . . . . . . c30225_5ug3 1 . 3 . 730 . 1 1 12 ARG CB C 3.884 1.125 -2.263 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CB . . . . . . . . . c30225_5ug3 1 . 3 . 731 . 1 1 12 ARG CD C 2.458 2.985 -3.180 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CD . . . . . . . . . c30225_5ug3 1 . 3 . 732 . 1 1 12 ARG CG C 3.344 2.524 -2.043 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CG . . . . . . . . . c30225_5ug3 1 . 3 . 733 . 1 1 12 ARG CZ C 2.506 3.216 -5.631 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CZ . . . . . . . . . c30225_5ug3 1 . 3 . 734 . 1 1 12 ARG H H 3.739 2.147 0.096 . . . 1.0 . . . . . . . . . . . . A . 12 ARG H . . . . . . . . . c30225_5ug3 1 . 3 . 735 . 1 1 12 ARG HA H 3.969 -0.489 -0.903 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HA . . . . . . . . . c30225_5ug3 1 . 3 . 736 . 1 1 12 ARG HB2 H 4.678 1.181 -2.994 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HB2 . . . . . . . . . c30225_5ug3 1 . 3 . 737 . 1 1 12 ARG HB3 H 3.086 0.514 -2.658 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HB3 . . . . . . . . . c30225_5ug3 1 . 3 . 738 . 1 1 12 ARG HD2 H 1.587 2.355 -3.197 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HD2 . . . . . . . . . c30225_5ug3 1 . 3 . 739 . 1 1 12 ARG HD3 H 2.156 4.005 -2.989 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HD3 . . . . . . . . . c30225_5ug3 1 . 3 . 740 . 1 1 12 ARG HE H 4.057 2.642 -4.499 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HE . . . . . . . . . c30225_5ug3 1 . 3 . 741 . 1 1 12 ARG HG2 H 2.754 2.529 -1.142 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HG2 . . . . . . . . . c30225_5ug3 1 . 3 . 742 . 1 1 12 ARG HG3 H 4.173 3.201 -1.938 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HG3 . . . . . . . . . c30225_5ug3 1 . 3 . 743 . 1 1 12 ARG HH11 H 0.739 3.731 -4.771 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH11 . . . . . . . . . c30225_5ug3 1 . 3 . 744 . 1 1 12 ARG HH12 H 0.791 3.864 -6.502 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH12 . . . . . . . . . c30225_5ug3 1 . 3 . 745 . 1 1 12 ARG HH21 H 4.126 2.810 -6.777 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH21 . . . . . . . . . c30225_5ug3 1 . 3 . 746 . 1 1 12 ARG HH22 H 2.716 3.327 -7.643 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH22 . . . . . . . . . c30225_5ug3 1 . 3 . 747 . 1 1 12 ARG N N 4.035 1.219 0.194 . . . 1.0 . . . . . . . . . . . . A . 12 ARG N . . . . . . . . . c30225_5ug3 1 . 3 . 748 . 1 1 12 ARG NE N 3.114 2.922 -4.481 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NE . . . . . . . . . c30225_5ug3 1 . 3 . 749 . 1 1 12 ARG NH1 N 1.245 3.635 -5.636 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NH1 . . . . . . . . . c30225_5ug3 1 . 3 . 750 . 1 1 12 ARG NH2 N 3.169 3.110 -6.775 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NH2 . . . . . . . . . c30225_5ug3 1 . 3 . 751 . 1 1 12 ARG O O 6.398 -0.704 -1.670 . . . 1.0 . . . . . . . . . . . . A . 12 ARG O . . . . . . . . . c30225_5ug3 1 . 3 . 752 . 1 1 13 VAL C C 8.605 0.144 0.790 . . . 1.0 . . . . . . . . . . . . A . 13 VAL C . . . . . . . . . c30225_5ug3 1 . 3 . 753 . 1 1 13 VAL CA C 8.131 0.992 -0.392 . . . 1.0 . . . . . . . . . . . . A . 13 VAL CA . . . . . . . . . c30225_5ug3 1 . 3 . 754 . 1 1 13 VAL CB C 8.780 2.375 -0.368 . . . 1.0 . . . . . . . . . . . . A . 13 VAL CB . . . . . . . . . c30225_5ug3 1 . 3 . 755 . 1 1 13 VAL CG1 C 8.281 3.165 -1.559 . . . 1.0 . . . . . . . . . . . . A . 13 VAL CG1 . . . . . . . . . c30225_5ug3 1 . 3 . 756 . 1 1 13 VAL CG2 C 8.499 3.105 0.935 . . . 1.0 . . . . . . . . . . . . A . 13 VAL CG2 . . . . . . . . . c30225_5ug3 1 . 3 . 757 . 1 1 13 VAL H H 6.286 1.905 0.008 . . . 1.0 . . . . . . . . . . . . A . 13 VAL H . . . . . . . . . c30225_5ug3 1 . 3 . 758 . 1 1 13 VAL HA H 8.431 0.501 -1.306 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HA . . . . . . . . . c30225_5ug3 1 . 3 . 759 . 1 1 13 VAL HB H 9.834 2.252 -0.463 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HB . . . . . . . . . c30225_5ug3 1 . 3 . 760 . 1 1 13 VAL HG11 H 8.726 2.777 -2.462 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HG11 . . . . . . . . . c30225_5ug3 1 . 3 . 761 . 1 1 13 VAL HG12 H 8.540 4.205 -1.441 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HG12 . . . . . . . . . c30225_5ug3 1 . 3 . 762 . 1 1 13 VAL HG13 H 7.200 3.060 -1.620 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HG13 . . . . . . . . . c30225_5ug3 1 . 3 . 763 . 1 1 13 VAL HG21 H 8.961 4.081 0.909 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HG21 . . . . . . . . . c30225_5ug3 1 . 3 . 764 . 1 1 13 VAL HG22 H 8.902 2.538 1.761 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HG22 . . . . . . . . . c30225_5ug3 1 . 3 . 765 . 1 1 13 VAL HG23 H 7.432 3.216 1.061 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HG23 . . . . . . . . . c30225_5ug3 1 . 3 . 766 . 1 1 13 VAL N N 6.692 1.128 -0.424 . . . 1.0 . . . . . . . . . . . . A . 13 VAL N . . . . . . . . . c30225_5ug3 1 . 3 . 767 . 1 1 13 VAL O O 9.672 -0.466 0.737 . . . 1.0 . . . . . . . . . . . . A . 13 VAL O . . . . . . . . . c30225_5ug3 1 . 3 . 768 . 1 1 14 ASN C C 7.655 -2.146 2.800 . . . 1.0 . . . . . . . . . . . . A . 14 ASN C . . . . . . . . . c30225_5ug3 1 . 3 . 769 . 1 1 14 ASN CA C 8.145 -0.719 3.016 . . . 1.0 . . . . . . . . . . . . A . 14 ASN CA . . . . . . . . . c30225_5ug3 1 . 3 . 770 . 1 1 14 ASN CB C 7.510 -0.140 4.283 . . . 1.0 . . . . . . . . . . . . A . 14 ASN CB . . . . . . . . . c30225_5ug3 1 . 3 . 771 . 1 1 14 ASN CG C 7.941 -0.875 5.539 . . . 1.0 . . . . . . . . . . . . A . 14 ASN CG . . . . . . . . . c30225_5ug3 1 . 3 . 772 . 1 1 14 ASN H H 6.992 0.643 1.866 . . . 1.0 . . . . . . . . . . . . A . 14 ASN H . . . . . . . . . c30225_5ug3 1 . 3 . 773 . 1 1 14 ASN HA H 9.218 -0.728 3.126 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HA . . . . . . . . . c30225_5ug3 1 . 3 . 774 . 1 1 14 ASN HB2 H 7.797 0.897 4.381 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HB2 . . . . . . . . . c30225_5ug3 1 . 3 . 775 . 1 1 14 ASN HB3 H 6.435 -0.204 4.201 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HB3 . . . . . . . . . c30225_5ug3 1 . 3 . 776 . 1 1 14 ASN HD21 H 6.156 -0.578 6.358 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HD21 . . . . . . . . . c30225_5ug3 1 . 3 . 777 . 1 1 14 ASN HD22 H 7.297 -1.445 7.326 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HD22 . . . . . . . . . c30225_5ug3 1 . 3 . 778 . 1 1 14 ASN N N 7.812 0.102 1.853 . . . 1.0 . . . . . . . . . . . . A . 14 ASN N . . . . . . . . . c30225_5ug3 1 . 3 . 779 . 1 1 14 ASN ND2 N 7.043 -0.976 6.504 . . . 1.0 . . . . . . . . . . . . A . 14 ASN ND2 . . . . . . . . . c30225_5ug3 1 . 3 . 780 . 1 1 14 ASN O O 8.310 -3.118 3.184 . . . 1.0 . . . . . . . . . . . . A . 14 ASN O . . . . . . . . . c30225_5ug3 1 . 3 . 781 . 1 1 14 ASN OD1 O 9.071 -1.353 5.636 . . . 1.0 . . . . . . . . . . . . A . 14 ASN OD1 . . . . . . . . . c30225_5ug3 1 . 3 . 782 . 1 1 15 ASN C C 5.282 -3.507 0.489 . . . 1.0 . . . . . . . . . . . . A . 15 ASN C . . . . . . . . . c30225_5ug3 1 . 3 . 783 . 1 1 15 ASN CA C 5.875 -3.527 1.889 . . . 1.0 . . . . . . . . . . . . A . 15 ASN CA . . . . . . . . . c30225_5ug3 1 . 3 . 784 . 1 1 15 ASN CB C 4.782 -3.794 2.912 . . . 1.0 . . . . . . . . . . . . A . 15 ASN CB . . . . . . . . . c30225_5ug3 1 . 3 . 785 . 1 1 15 ASN CG C 4.126 -5.149 2.723 . . . 1.0 . . . . . . . . . . . . A . 15 ASN CG . . . . . . . . . c30225_5ug3 1 . 3 . 786 . 1 1 15 ASN H H 6.067 -1.438 1.835 . . . 1.0 . . . . . . . . . . . . A . 15 ASN H . . . . . . . . . c30225_5ug3 1 . 3 . 787 . 1 1 15 ASN HA H 6.624 -4.301 1.950 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HA . . . . . . . . . c30225_5ug3 1 . 3 . 788 . 1 1 15 ASN HB2 H 5.204 -3.748 3.905 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HB2 . . . . . . . . . c30225_5ug3 1 . 3 . 789 . 1 1 15 ASN HB3 H 4.031 -3.030 2.806 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HB3 . . . . . . . . . c30225_5ug3 1 . 3 . 790 . 1 1 15 ASN HD21 H 2.423 -4.471 3.491 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HD21 . . . . . . . . . c30225_5ug3 1 . 3 . 791 . 1 1 15 ASN HD22 H 2.427 -6.134 3.012 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HD22 . . . . . . . . . c30225_5ug3 1 . 3 . 792 . 1 1 15 ASN N N 6.508 -2.252 2.155 . . . 1.0 . . . . . . . . . . . . A . 15 ASN N . . . . . . . . . c30225_5ug3 1 . 3 . 793 . 1 1 15 ASN ND2 N 2.866 -5.262 3.109 . . . 1.0 . . . . . . . . . . . . A . 15 ASN ND2 . . . . . . . . . c30225_5ug3 1 . 3 . 794 . 1 1 15 ASN O O 4.120 -3.153 0.293 . . . 1.0 . . . . . . . . . . . . A . 15 ASN O . . . . . . . . . c30225_5ug3 1 . 3 . 795 . 1 1 15 ASN OD1 O 4.749 -6.087 2.233 . . . 1.0 . . . . . . . . . . . . A . 15 ASN OD1 . . . . . . . . . c30225_5ug3 1 . 3 . 796 . 1 1 16 HYP C C 4.746 -4.863 -2.385 . . . 1.0 . . . . . . . . . . . . A . 16 HYP C . . . . . . . . . c30225_5ug3 1 . 3 . 797 . 1 1 16 HYP CA C 5.715 -3.776 -1.924 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CA . . . . . . . . . c30225_5ug3 1 . 3 . 798 . 1 1 16 HYP CB C 7.077 -3.914 -2.576 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CB . . . . . . . . . c30225_5ug3 1 . 3 . 799 . 1 1 16 HYP CD C 7.443 -4.442 -0.304 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CD . . . . . . . . . c30225_5ug3 1 . 3 . 800 . 1 1 16 HYP CG C 8.161 -3.996 -1.527 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CG . . . . . . . . . c30225_5ug3 1 . 3 . 801 . 1 1 16 HYP HA H 5.301 -2.805 -2.153 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HA . . . . . . . . . c30225_5ug3 1 . 3 . 802 . 1 1 16 HYP HB2 H 7.263 -3.056 -3.202 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HB2 . . . . . . . . . c30225_5ug3 1 . 3 . 803 . 1 1 16 HYP HB3 H 7.091 -4.811 -3.180 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HB3 . . . . . . . . . c30225_5ug3 1 . 3 . 804 . 1 1 16 HYP HD1 H 8.294 -2.472 -0.362 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HD1 . . . . . . . . . c30225_5ug3 1 . 3 . 805 . 1 1 16 HYP HD22 H 7.422 -5.495 -0.245 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HD22 . . . . . . . . . c30225_5ug3 1 . 3 . 806 . 1 1 16 HYP HD23 H 7.905 -4.022 0.575 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HD23 . . . . . . . . . c30225_5ug3 1 . 3 . 807 . 1 1 16 HYP HG H 8.949 -4.674 -1.820 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HG . . . . . . . . . c30225_5ug3 1 . 3 . 808 . 1 1 16 HYP N N 6.084 -3.882 -0.498 . . . 1.0 . . . . . . . . . . . . A . 16 HYP N . . . . . . . . . c30225_5ug3 1 . 3 . 809 . 1 1 16 HYP O O 4.955 -5.507 -3.415 . . . 1.0 . . . . . . . . . . . . A . 16 HYP O . . . . . . . . . c30225_5ug3 1 . 3 . 810 . 1 1 16 HYP OD1 O 8.673 -2.718 -1.221 . . . 1.0 . . . . . . . . . . . . A . 16 HYP OD1 . . . . . . . . . c30225_5ug3 1 . 3 . 811 . 1 1 17 HIS C C 1.385 -5.717 -1.066 . . . 1.0 . . . . . . . . . . . . A . 17 HIS C . . . . . . . . . c30225_5ug3 1 . 3 . 812 . 1 1 17 HIS CA C 2.595 -5.948 -1.973 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CA . . . . . . . . . c30225_5ug3 1 . 3 . 813 . 1 1 17 HIS CB C 3.019 -7.432 -1.965 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CB . . . . . . . . . c30225_5ug3 1 . 3 . 814 . 1 1 17 HIS CD2 C 2.910 -8.250 0.502 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CD2 . . . . . . . . . c30225_5ug3 1 . 3 . 815 . 1 1 17 HIS CE1 C 5.025 -8.757 0.765 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CE1 . . . . . . . . . c30225_5ug3 1 . 3 . 816 . 1 1 17 HIS CG C 3.544 -7.955 -0.657 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CG . . . . . . . . . c30225_5ug3 1 . 3 . 817 . 1 1 17 HIS H H 3.655 -4.597 -0.734 . . . 1.0 . . . . . . . . . . . . A . 17 HIS H . . . . . . . . . c30225_5ug3 1 . 3 . 818 . 1 1 17 HIS HA H 2.308 -5.681 -2.980 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HA . . . . . . . . . c30225_5ug3 1 . 3 . 819 . 1 1 17 HIS HB2 H 2.167 -8.035 -2.233 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HB2 . . . . . . . . . c30225_5ug3 1 . 3 . 820 . 1 1 17 HIS HB3 H 3.791 -7.574 -2.709 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HB3 . . . . . . . . . c30225_5ug3 1 . 3 . 821 . 1 1 17 HIS HD1 H 5.590 -8.192 -1.120 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HD1 . . . . . . . . . c30225_5ug3 1 . 3 . 822 . 1 1 17 HIS HD2 H 1.858 -8.116 0.708 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HD2 . . . . . . . . . c30225_5ug3 1 . 3 . 823 . 1 1 17 HIS HE1 H 5.955 -9.094 1.199 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HE1 . . . . . . . . . c30225_5ug3 1 . 3 . 824 . 1 1 17 HIS HE2 H 3.668 -9.131 2.252 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HE2 . . . . . . . . . c30225_5ug3 1 . 3 . 825 . 1 1 17 HIS N N 3.693 -5.065 -1.599 . . . 1.0 . . . . . . . . . . . . A . 17 HIS N . . . . . . . . . c30225_5ug3 1 . 3 . 826 . 1 1 17 HIS ND1 N 4.869 -8.282 -0.457 . . . 1.0 . . . . . . . . . . . . A . 17 HIS ND1 . . . . . . . . . c30225_5ug3 1 . 3 . 827 . 1 1 17 HIS NE2 N 3.852 -8.747 1.366 . . . 1.0 . . . . . . . . . . . . A . 17 HIS NE2 . . . . . . . . . c30225_5ug3 1 . 3 . 828 . 1 1 17 HIS O O 0.589 -6.626 -0.829 . . . 1.0 . . . . . . . . . . . . A . 17 HIS O . . . . . . . . . c30225_5ug3 1 . 3 . 829 . 1 1 18 VAL C C -0.727 -3.048 -0.485 . . . 1.0 . . . . . . . . . . . . A . 18 VAL C . . . . . . . . . c30225_5ug3 1 . 3 . 830 . 1 1 18 VAL CA C 0.088 -4.126 0.240 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CA . . . . . . . . . c30225_5ug3 1 . 3 . 831 . 1 1 18 VAL CB C 0.468 -3.673 1.673 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CB . . . . . . . . . c30225_5ug3 1 . 3 . 832 . 1 1 18 VAL CG1 C 1.435 -2.494 1.663 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CG1 . . . . . . . . . c30225_5ug3 1 . 3 . 833 . 1 1 18 VAL CG2 C -0.776 -3.346 2.486 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CG2 . . . . . . . . . c30225_5ug3 1 . 3 . 834 . 1 1 18 VAL H H 1.965 -3.836 -0.691 . . . 1.0 . . . . . . . . . . . . A . 18 VAL H . . . . . . . . . c30225_5ug3 1 . 3 . 835 . 1 1 18 VAL HA H -0.530 -5.011 0.325 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HA . . . . . . . . . c30225_5ug3 1 . 3 . 836 . 1 1 18 VAL HB H 0.965 -4.501 2.153 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HB . . . . . . . . . c30225_5ug3 1 . 3 . 837 . 1 1 18 VAL HG11 H 2.345 -2.779 1.157 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG11 . . . . . . . . . c30225_5ug3 1 . 3 . 838 . 1 1 18 VAL HG12 H 1.662 -2.208 2.679 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG12 . . . . . . . . . c30225_5ug3 1 . 3 . 839 . 1 1 18 VAL HG13 H 0.981 -1.662 1.148 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG13 . . . . . . . . . c30225_5ug3 1 . 3 . 840 . 1 1 18 VAL HG21 H -1.316 -2.541 2.010 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG21 . . . . . . . . . c30225_5ug3 1 . 3 . 841 . 1 1 18 VAL HG22 H -0.486 -3.046 3.481 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG22 . . . . . . . . . c30225_5ug3 1 . 3 . 842 . 1 1 18 VAL HG23 H -1.410 -4.219 2.544 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG23 . . . . . . . . . c30225_5ug3 1 . 3 . 843 . 1 1 18 VAL N N 1.259 -4.499 -0.546 . . . 1.0 . . . . . . . . . . . . A . 18 VAL N . . . . . . . . . c30225_5ug3 1 . 3 . 844 . 1 1 18 VAL O O -0.679 -1.858 -0.163 . . . 1.0 . . . . . . . . . . . . A . 18 VAL O . . . . . . . . . c30225_5ug3 1 . 3 . 845 . 1 1 19 CYS C C -3.323 -3.387 -3.066 . . . 1.0 . . . . . . . . . . . . A . 19 CYS C . . . . . . . . . c30225_5ug3 1 . 3 . 846 . 1 1 19 CYS CA C -2.294 -2.588 -2.275 . . . 1.0 . . . . . . . . . . . . A . 19 CYS CA . . . . . . . . . c30225_5ug3 1 . 3 . 847 . 1 1 19 CYS CB C -1.426 -1.741 -3.215 . . . 1.0 . . . . . . . . . . . . A . 19 CYS CB . . . . . . . . . c30225_5ug3 1 . 3 . 848 . 1 1 19 CYS H H -1.458 -4.440 -1.703 . . . 1.0 . . . . . . . . . . . . A . 19 CYS H . . . . . . . . . c30225_5ug3 1 . 3 . 849 . 1 1 19 CYS HA H -2.814 -1.934 -1.593 . . . 1.0 . . . . . . . . . . . . A . 19 CYS HA . . . . . . . . . c30225_5ug3 1 . 3 . 850 . 1 1 19 CYS HB2 H -0.765 -1.126 -2.621 . . . 1.0 . . . . . . . . . . . . A . 19 CYS HB2 . . . . . . . . . c30225_5ug3 1 . 3 . 851 . 1 1 19 CYS HB3 H -0.836 -2.396 -3.840 . . . 1.0 . . . . . . . . . . . . A . 19 CYS HB3 . . . . . . . . . c30225_5ug3 1 . 3 . 852 . 1 1 19 CYS N N -1.466 -3.483 -1.487 . . . 1.0 . . . . . . . . . . . . A . 19 CYS N . . . . . . . . . c30225_5ug3 1 . 3 . 853 . 1 1 19 CYS O O -4.483 -3.470 -2.612 . . . 1.0 . . . . . . . . . . . . A . 19 CYS O . . . . . . . . . c30225_5ug3 1 . 3 . 854 . 1 1 19 CYS OXT O -2.964 -3.956 -4.120 . . . 1.0 . . . . . . . . . . . . A . 19 CYS OXT . . . . . . . . . c30225_5ug3 1 . 3 . 855 . 1 1 19 CYS SG S -2.373 -0.631 -4.303 . . . 1.0 . . . . . . . . . . . . A . 19 CYS SG . . . . . . . . . c30225_5ug3 1 . 4 . 856 . 1 1 1 ILE C C -9.717 -2.846 4.474 . . . 1.0 . . . . . . . . . . . . A . 1 ILE C . . . . . . . . . c30225_5ug3 1 . 4 . 857 . 1 1 1 ILE CA C -9.809 -2.951 5.992 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CA . . . . . . . . . c30225_5ug3 1 . 4 . 858 . 1 1 1 ILE CB C -8.744 -3.948 6.523 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CB . . . . . . . . . c30225_5ug3 1 . 4 . 859 . 1 1 1 ILE CD1 C -6.231 -4.344 6.743 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CD1 . . . . . . . . . c30225_5ug3 1 . 4 . 860 . 1 1 1 ILE CG1 C -7.329 -3.452 6.201 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CG1 . . . . . . . . . c30225_5ug3 1 . 4 . 861 . 1 1 1 ILE CG2 C -8.964 -5.342 5.945 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CG2 . . . . . . . . . c30225_5ug3 1 . 4 . 862 . 1 1 1 ILE H1 H -11.243 -3.444 7.415 . . . 1.0 . . . . . . . . . . . . A . 1 ILE H1 . . . . . . . . . c30225_5ug3 1 . 4 . 863 . 1 1 1 ILE H2 H -11.413 -4.269 5.950 . . . 1.0 . . . . . . . . . . . . A . 1 ILE H2 . . . . . . . . . c30225_5ug3 1 . 4 . 864 . 1 1 1 ILE H3 H -11.861 -2.644 6.060 . . . 1.0 . . . . . . . . . . . . A . 1 ILE H3 . . . . . . . . . c30225_5ug3 1 . 4 . 865 . 1 1 1 ILE HA H -9.610 -1.979 6.421 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HA . . . . . . . . . c30225_5ug3 1 . 4 . 866 . 1 1 1 ILE HB H -8.854 -4.014 7.595 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HB . . . . . . . . . c30225_5ug3 1 . 4 . 867 . 1 1 1 ILE HD11 H -6.331 -5.333 6.322 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HD11 . . . . . . . . . c30225_5ug3 1 . 4 . 868 . 1 1 1 ILE HD12 H -6.311 -4.400 7.818 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HD12 . . . . . . . . . c30225_5ug3 1 . 4 . 869 . 1 1 1 ILE HD13 H -5.269 -3.933 6.474 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HD13 . . . . . . . . . c30225_5ug3 1 . 4 . 870 . 1 1 1 ILE HG12 H -7.210 -3.395 5.129 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG12 . . . . . . . . . c30225_5ug3 1 . 4 . 871 . 1 1 1 ILE HG13 H -7.195 -2.468 6.623 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG13 . . . . . . . . . c30225_5ug3 1 . 4 . 872 . 1 1 1 ILE HG21 H -8.896 -5.300 4.869 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG21 . . . . . . . . . c30225_5ug3 1 . 4 . 873 . 1 1 1 ILE HG22 H -9.940 -5.701 6.231 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG22 . . . . . . . . . c30225_5ug3 1 . 4 . 874 . 1 1 1 ILE HG23 H -8.208 -6.013 6.328 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG23 . . . . . . . . . c30225_5ug3 1 . 4 . 875 . 1 1 1 ILE N N -11.174 -3.356 6.383 . . . 1.0 . . . . . . . . . . . . A . 1 ILE N . . . . . . . . . c30225_5ug3 1 . 4 . 876 . 1 1 1 ILE O O -10.296 -3.656 3.749 . . . 1.0 . . . . . . . . . . . . A . 1 ILE O . . . . . . . . . c30225_5ug3 1 . 4 . 877 . 1 1 2 ARG C C -7.351 -1.462 2.276 . . . 1.0 . . . . . . . . . . . . A . 2 ARG C . . . . . . . . . c30225_5ug3 1 . 4 . 878 . 1 1 2 ARG CA C -8.832 -1.624 2.580 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CA . . . . . . . . . c30225_5ug3 1 . 4 . 879 . 1 1 2 ARG CB C -9.608 -0.387 2.121 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CB . . . . . . . . . c30225_5ug3 1 . 4 . 880 . 1 1 2 ARG CD C -10.149 1.204 0.252 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CD . . . . . . . . . c30225_5ug3 1 . 4 . 881 . 1 1 2 ARG CG C -9.529 -0.133 0.623 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CG . . . . . . . . . c30225_5ug3 1 . 4 . 882 . 1 1 2 ARG CZ C -12.143 2.329 1.184 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CZ . . . . . . . . . c30225_5ug3 1 . 4 . 883 . 1 1 2 ARG H H -8.595 -1.210 4.623 . . . 1.0 . . . . . . . . . . . . A . 2 ARG H . . . . . . . . . c30225_5ug3 1 . 4 . 884 . 1 1 2 ARG HA H -9.205 -2.490 2.070 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HA . . . . . . . . . c30225_5ug3 1 . 4 . 885 . 1 1 2 ARG HB2 H -10.647 -0.507 2.390 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB2 . . . . . . . . . c30225_5ug3 1 . 4 . 886 . 1 1 2 ARG HB3 H -9.213 0.479 2.632 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB3 . . . . . . . . . c30225_5ug3 1 . 4 . 887 . 1 1 2 ARG HD2 H -9.619 1.987 0.770 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD2 . . . . . . . . . c30225_5ug3 1 . 4 . 888 . 1 1 2 ARG HD3 H -10.049 1.348 -0.814 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD3 . . . . . . . . . c30225_5ug3 1 . 4 . 889 . 1 1 2 ARG HE H -12.118 0.492 0.389 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HE . . . . . . . . . c30225_5ug3 1 . 4 . 890 . 1 1 2 ARG HG2 H -8.492 -0.135 0.322 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG2 . . . . . . . . . c30225_5ug3 1 . 4 . 891 . 1 1 2 ARG HG3 H -10.057 -0.922 0.108 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG3 . . . . . . . . . c30225_5ug3 1 . 4 . 892 . 1 1 2 ARG HH11 H -10.429 3.414 1.361 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH11 . . . . . . . . . c30225_5ug3 1 . 4 . 893 . 1 1 2 ARG HH12 H -11.870 4.181 1.956 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH12 . . . . . . . . . c30225_5ug3 1 . 4 . 894 . 1 1 2 ARG HH21 H -13.993 1.510 1.181 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH21 . . . . . . . . . c30225_5ug3 1 . 4 . 895 . 1 1 2 ARG HH22 H -13.886 3.101 1.863 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH22 . . . . . . . . . c30225_5ug3 1 . 4 . 896 . 1 1 2 ARG N N -9.013 -1.833 3.999 . . . 1.0 . . . . . . . . . . . . A . 2 ARG N . . . . . . . . . c30225_5ug3 1 . 4 . 897 . 1 1 2 ARG NE N -11.564 1.274 0.608 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NE . . . . . . . . . c30225_5ug3 1 . 4 . 898 . 1 1 2 ARG NH1 N -11.424 3.391 1.528 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH1 . . . . . . . . . c30225_5ug3 1 . 4 . 899 . 1 1 2 ARG NH2 N -13.444 2.311 1.428 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH2 . . . . . . . . . c30225_5ug3 1 . 4 . 900 . 1 1 2 ARG O O -6.625 -0.828 3.043 . . . 1.0 . . . . . . . . . . . . A . 2 ARG O . . . . . . . . . c30225_5ug3 1 . 4 . 901 . 1 1 3 ASP C C -5.224 -0.603 0.141 . . . 1.0 . . . . . . . . . . . . A . 3 ASP C . . . . . . . . . c30225_5ug3 1 . 4 . 902 . 1 1 3 ASP CA C -5.506 -1.958 0.775 . . . 1.0 . . . . . . . . . . . . A . 3 ASP CA . . . . . . . . . c30225_5ug3 1 . 4 . 903 . 1 1 3 ASP CB C -5.144 -3.093 -0.189 . . . 1.0 . . . . . . . . . . . . A . 3 ASP CB . . . . . . . . . c30225_5ug3 1 . 4 . 904 . 1 1 3 ASP CG C -5.349 -4.465 0.422 . . . 1.0 . . . . . . . . . . . . A . 3 ASP CG . . . . . . . . . c30225_5ug3 1 . 4 . 905 . 1 1 3 ASP H H -7.536 -2.528 0.597 . . . 1.0 . . . . . . . . . . . . A . 3 ASP H . . . . . . . . . c30225_5ug3 1 . 4 . 906 . 1 1 3 ASP HA H -4.908 -2.052 1.666 . . . 1.0 . . . . . . . . . . . . A . 3 ASP HA . . . . . . . . . c30225_5ug3 1 . 4 . 907 . 1 1 3 ASP HB2 H -5.761 -3.017 -1.073 . . . 1.0 . . . . . . . . . . . . A . 3 ASP HB2 . . . . . . . . . c30225_5ug3 1 . 4 . 908 . 1 1 3 ASP HB3 H -4.107 -2.997 -0.470 . . . 1.0 . . . . . . . . . . . . A . 3 ASP HB3 . . . . . . . . . c30225_5ug3 1 . 4 . 909 . 1 1 3 ASP N N -6.906 -2.040 1.170 . . . 1.0 . . . . . . . . . . . . A . 3 ASP N . . . . . . . . . c30225_5ug3 1 . 4 . 910 . 1 1 3 ASP O O -5.244 -0.450 -1.081 . . . 1.0 . . . . . . . . . . . . A . 3 ASP O . . . . . . . . . c30225_5ug3 1 . 4 . 911 . 1 1 3 ASP OD1 O -6.280 -5.181 -0.001 . . . 1.0 . . . . . . . . . . . . A . 3 ASP OD1 . . . . . . . . . c30225_5ug3 1 . 4 . 912 . 1 1 3 ASP OD2 O -4.579 -4.842 1.336 . . . 1.0 . . . . . . . . . . . . A . 3 ASP OD2 . . . . . . . . . c30225_5ug3 1 . 4 . 913 . 1 1 4 GLU C C -3.354 2.195 0.567 . . . 1.0 . . . . . . . . . . . . A . 4 GLU C . . . . . . . . . c30225_5ug3 1 . 4 . 914 . 1 1 4 GLU CA C -4.808 1.758 0.540 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CA . . . . . . . . . c30225_5ug3 1 . 4 . 915 . 1 1 4 GLU CB C -5.646 2.687 1.413 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CB . . . . . . . . . c30225_5ug3 1 . 4 . 916 . 1 1 4 GLU CD C -7.921 3.165 2.381 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CD . . . . . . . . . c30225_5ug3 1 . 4 . 917 . 1 1 4 GLU CG C -7.104 2.283 1.473 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CG . . . . . . . . . c30225_5ug3 1 . 4 . 918 . 1 1 4 GLU H H -4.871 0.176 1.945 . . . 1.0 . . . . . . . . . . . . A . 4 GLU H . . . . . . . . . c30225_5ug3 1 . 4 . 919 . 1 1 4 GLU HA H -5.169 1.815 -0.474 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HA . . . . . . . . . c30225_5ug3 1 . 4 . 920 . 1 1 4 GLU HB2 H -5.247 2.678 2.417 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HB2 . . . . . . . . . c30225_5ug3 1 . 4 . 921 . 1 1 4 GLU HB3 H -5.586 3.688 1.016 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HB3 . . . . . . . . . c30225_5ug3 1 . 4 . 922 . 1 1 4 GLU HG2 H -7.520 2.337 0.478 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HG2 . . . . . . . . . c30225_5ug3 1 . 4 . 923 . 1 1 4 GLU HG3 H -7.167 1.266 1.832 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HG3 . . . . . . . . . c30225_5ug3 1 . 4 . 924 . 1 1 4 GLU N N -4.961 0.381 0.987 . . . 1.0 . . . . . . . . . . . . A . 4 GLU N . . . . . . . . . c30225_5ug3 1 . 4 . 925 . 1 1 4 GLU O O -3.049 3.372 0.380 . . . 1.0 . . . . . . . . . . . . A . 4 GLU O . . . . . . . . . c30225_5ug3 1 . 4 . 926 . 1 1 4 GLU OE1 O -8.768 3.925 1.870 . . . 1.0 . . . . . . . . . . . . A . 4 GLU OE1 . . . . . . . . . c30225_5ug3 1 . 4 . 927 . 1 1 4 GLU OE2 O -7.724 3.100 3.611 . . . 1.0 . . . . . . . . . . . . A . 4 GLU OE2 . . . . . . . . . c30225_5ug3 1 . 4 . 928 . 1 1 5 CYS C C -0.539 2.079 -0.532 . . . 1.0 . . . . . . . . . . . . A . 5 CYS C . . . . . . . . . c30225_5ug3 1 . 4 . 929 . 1 1 5 CYS CA C -1.030 1.530 0.806 . . . 1.0 . . . . . . . . . . . . A . 5 CYS CA . . . . . . . . . c30225_5ug3 1 . 4 . 930 . 1 1 5 CYS CB C -0.273 0.266 1.174 . . . 1.0 . . . . . . . . . . . . A . 5 CYS CB . . . . . . . . . c30225_5ug3 1 . 4 . 931 . 1 1 5 CYS H H -2.750 0.330 0.945 . . . 1.0 . . . . . . . . . . . . A . 5 CYS H . . . . . . . . . c30225_5ug3 1 . 4 . 932 . 1 1 5 CYS HA H -0.856 2.273 1.568 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HA . . . . . . . . . c30225_5ug3 1 . 4 . 933 . 1 1 5 CYS HB2 H -0.641 -0.551 0.572 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HB2 . . . . . . . . . c30225_5ug3 1 . 4 . 934 . 1 1 5 CYS HB3 H 0.769 0.410 0.975 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HB3 . . . . . . . . . c30225_5ug3 1 . 4 . 935 . 1 1 5 CYS N N -2.454 1.248 0.782 . . . 1.0 . . . . . . . . . . . . A . 5 CYS N . . . . . . . . . c30225_5ug3 1 . 4 . 936 . 1 1 5 CYS O O 0.568 2.599 -0.629 . . . 1.0 . . . . . . . . . . . . A . 5 CYS O . . . . . . . . . c30225_5ug3 1 . 4 . 937 . 1 1 5 CYS SG S -0.451 -0.207 2.923 . . . 1.0 . . . . . . . . . . . . A . 5 CYS SG . . . . . . . . . c30225_5ug3 1 . 4 . 938 . 1 1 6 CYS C C -1.053 4.064 -2.776 . . . 1.0 . . . . . . . . . . . . A . 6 CYS C . . . . . . . . . c30225_5ug3 1 . 4 . 939 . 1 1 6 CYS CA C -1.081 2.538 -2.852 . . . 1.0 . . . . . . . . . . . . A . 6 CYS CA . . . . . . . . . c30225_5ug3 1 . 4 . 940 . 1 1 6 CYS CB C -2.136 2.084 -3.854 . . . 1.0 . . . . . . . . . . . . A . 6 CYS CB . . . . . . . . . c30225_5ug3 1 . 4 . 941 . 1 1 6 CYS H H -2.217 1.493 -1.429 . . . 1.0 . . . . . . . . . . . . A . 6 CYS H . . . . . . . . . c30225_5ug3 1 . 4 . 942 . 1 1 6 CYS HA H -0.110 2.182 -3.165 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HA . . . . . . . . . c30225_5ug3 1 . 4 . 943 . 1 1 6 CYS HB2 H -3.103 2.164 -3.384 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HB2 . . . . . . . . . c30225_5ug3 1 . 4 . 944 . 1 1 6 CYS HB3 H -2.106 2.735 -4.710 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HB3 . . . . . . . . . c30225_5ug3 1 . 4 . 945 . 1 1 6 CYS N N -1.374 1.973 -1.551 . . . 1.0 . . . . . . . . . . . . A . 6 CYS N . . . . . . . . . c30225_5ug3 1 . 4 . 946 . 1 1 6 CYS O O -0.277 4.715 -3.473 . . . 1.0 . . . . . . . . . . . . A . 6 CYS O . . . . . . . . . c30225_5ug3 1 . 4 . 947 . 1 1 6 CYS SG S -1.957 0.363 -4.452 . . . 1.0 . . . . . . . . . . . . A . 6 CYS SG . . . . . . . . . c30225_5ug3 1 . 4 . 948 . 1 1 7 SER C C -0.944 6.508 -0.653 . . . 1.0 . . . . . . . . . . . . A . 7 SER C . . . . . . . . . c30225_5ug3 1 . 4 . 949 . 1 1 7 SER CA C -1.944 6.068 -1.717 . . . 1.0 . . . . . . . . . . . . A . 7 SER CA . . . . . . . . . c30225_5ug3 1 . 4 . 950 . 1 1 7 SER CB C -3.358 6.480 -1.305 . . . 1.0 . . . . . . . . . . . . A . 7 SER CB . . . . . . . . . c30225_5ug3 1 . 4 . 951 . 1 1 7 SER H H -2.470 4.049 -1.362 . . . 1.0 . . . . . . . . . . . . A . 7 SER H . . . . . . . . . c30225_5ug3 1 . 4 . 952 . 1 1 7 SER HA H -1.694 6.538 -2.655 . . . 1.0 . . . . . . . . . . . . A . 7 SER HA . . . . . . . . . c30225_5ug3 1 . 4 . 953 . 1 1 7 SER HB2 H -3.579 6.074 -0.329 . . . 1.0 . . . . . . . . . . . . A . 7 SER HB2 . . . . . . . . . c30225_5ug3 1 . 4 . 954 . 1 1 7 SER HB3 H -3.420 7.556 -1.270 . . . 1.0 . . . . . . . . . . . . A . 7 SER HB3 . . . . . . . . . c30225_5ug3 1 . 4 . 955 . 1 1 7 SER HG H -4.233 6.481 -3.058 . . . 1.0 . . . . . . . . . . . . A . 7 SER HG . . . . . . . . . c30225_5ug3 1 . 4 . 956 . 1 1 7 SER N N -1.882 4.623 -1.902 . . . 1.0 . . . . . . . . . . . . A . 7 SER N . . . . . . . . . c30225_5ug3 1 . 4 . 957 . 1 1 7 SER O O -0.974 7.641 -0.176 . . . 1.0 . . . . . . . . . . . . A . 7 SER O . . . . . . . . . c30225_5ug3 1 . 4 . 958 . 1 1 7 SER OG O -4.317 5.995 -2.229 . . . 1.0 . . . . . . . . . . . . A . 7 SER OG . . . . . . . . . c30225_5ug3 1 . 4 . 959 . 1 1 8 ASN C C 2.266 5.331 0.305 . . . 1.0 . . . . . . . . . . . . A . 8 ASN C . . . . . . . . . c30225_5ug3 1 . 4 . 960 . 1 1 8 ASN CA C 0.919 5.838 0.755 . . . 1.0 . . . . . . . . . . . . A . 8 ASN CA . . . . . . . . . c30225_5ug3 1 . 4 . 961 . 1 1 8 ASN CB C 0.528 5.114 2.032 . . . 1.0 . . . . . . . . . . . . A . 8 ASN CB . . . . . . . . . c30225_5ug3 1 . 4 . 962 . 1 1 8 ASN CG C -0.779 5.612 2.607 . . . 1.0 . . . . . . . . . . . . A . 8 ASN CG . . . . . . . . . c30225_5ug3 1 . 4 . 963 . 1 1 8 ASN H H -0.071 4.720 -0.725 . . . 1.0 . . . . . . . . . . . . A . 8 ASN H . . . . . . . . . c30225_5ug3 1 . 4 . 964 . 1 1 8 ASN HA H 0.972 6.899 0.939 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HA . . . . . . . . . c30225_5ug3 1 . 4 . 965 . 1 1 8 ASN HB2 H 0.431 4.063 1.810 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HB2 . . . . . . . . . c30225_5ug3 1 . 4 . 966 . 1 1 8 ASN HB3 H 1.303 5.252 2.767 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HB3 . . . . . . . . . c30225_5ug3 1 . 4 . 967 . 1 1 8 ASN HD21 H -1.788 4.344 1.456 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HD21 . . . . . . . . . c30225_5ug3 1 . 4 . 968 . 1 1 8 ASN HD22 H -2.742 5.348 2.500 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HD22 . . . . . . . . . c30225_5ug3 1 . 4 . 969 . 1 1 8 ASN N N -0.065 5.592 -0.282 . . . 1.0 . . . . . . . . . . . . A . 8 ASN N . . . . . . . . . c30225_5ug3 1 . 4 . 970 . 1 1 8 ASN ND2 N -1.878 5.045 2.143 . . . 1.0 . . . . . . . . . . . . A . 8 ASN ND2 . . . . . . . . . c30225_5ug3 1 . 4 . 971 . 1 1 8 ASN O O 2.555 4.139 0.430 . . . 1.0 . . . . . . . . . . . . A . 8 ASN O . . . . . . . . . c30225_5ug3 1 . 4 . 972 . 1 1 8 ASN OD1 O -0.802 6.513 3.443 . . . 1.0 . . . . . . . . . . . . A . 8 ASN OD1 . . . . . . . . . c30225_5ug3 1 . 4 . 973 . 1 1 9 PRO C C 5.278 5.100 0.287 . . . 1.0 . . . . . . . . . . . . A . 9 PRO C . . . . . . . . . c30225_5ug3 1 . 4 . 974 . 1 1 9 PRO CA C 4.420 5.832 -0.740 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CA . . . . . . . . . c30225_5ug3 1 . 4 . 975 . 1 1 9 PRO CB C 5.061 7.167 -1.125 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CB . . . . . . . . . c30225_5ug3 1 . 4 . 976 . 1 1 9 PRO CD C 2.864 7.661 -0.373 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CD . . . . . . . . . c30225_5ug3 1 . 4 . 977 . 1 1 9 PRO CG C 3.917 8.085 -1.352 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CG . . . . . . . . . c30225_5ug3 1 . 4 . 978 . 1 1 9 PRO HA H 4.314 5.209 -1.614 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HA . . . . . . . . . c30225_5ug3 1 . 4 . 979 . 1 1 9 PRO HB2 H 5.683 7.512 -0.317 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HB2 . . . . . . . . . c30225_5ug3 1 . 4 . 980 . 1 1 9 PRO HB3 H 5.653 7.044 -2.020 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HB3 . . . . . . . . . c30225_5ug3 1 . 4 . 981 . 1 1 9 PRO HD2 H 2.991 8.178 0.567 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HD2 . . . . . . . . . c30225_5ug3 1 . 4 . 982 . 1 1 9 PRO HD3 H 1.883 7.843 -0.774 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HD3 . . . . . . . . . c30225_5ug3 1 . 4 . 983 . 1 1 9 PRO HG2 H 4.219 9.105 -1.161 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HG2 . . . . . . . . . c30225_5ug3 1 . 4 . 984 . 1 1 9 PRO HG3 H 3.552 7.982 -2.362 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HG3 . . . . . . . . . c30225_5ug3 1 . 4 . 985 . 1 1 9 PRO N N 3.112 6.215 -0.221 . . . 1.0 . . . . . . . . . . . . A . 9 PRO N . . . . . . . . . c30225_5ug3 1 . 4 . 986 . 1 1 9 PRO O O 6.220 4.410 -0.074 . . . 1.0 . . . . . . . . . . . . A . 9 PRO O . . . . . . . . . c30225_5ug3 1 . 4 . 987 . 1 1 10 VAL C C 5.337 3.081 2.648 . . . 1.0 . . . . . . . . . . . . A . 10 VAL C . . . . . . . . . c30225_5ug3 1 . 4 . 988 . 1 1 10 VAL CA C 5.713 4.551 2.594 . . . 1.0 . . . . . . . . . . . . A . 10 VAL CA . . . . . . . . . c30225_5ug3 1 . 4 . 989 . 1 1 10 VAL CB C 5.514 5.198 3.986 . . . 1.0 . . . . . . . . . . . . A . 10 VAL CB . . . . . . . . . c30225_5ug3 1 . 4 . 990 . 1 1 10 VAL CG1 C 4.137 4.910 4.568 . . . 1.0 . . . . . . . . . . . . A . 10 VAL CG1 . . . . . . . . . c30225_5ug3 1 . 4 . 991 . 1 1 10 VAL CG2 C 6.607 4.755 4.946 . . . 1.0 . . . . . . . . . . . . A . 10 VAL CG2 . . . . . . . . . c30225_5ug3 1 . 4 . 992 . 1 1 10 VAL H H 4.163 5.776 1.809 . . . 1.0 . . . . . . . . . . . . A . 10 VAL H . . . . . . . . . c30225_5ug3 1 . 4 . 993 . 1 1 10 VAL HA H 6.759 4.627 2.330 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HA . . . . . . . . . c30225_5ug3 1 . 4 . 994 . 1 1 10 VAL HB H 5.590 6.258 3.858 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HB . . . . . . . . . c30225_5ug3 1 . 4 . 995 . 1 1 10 VAL HG11 H 4.040 3.851 4.751 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HG11 . . . . . . . . . c30225_5ug3 1 . 4 . 996 . 1 1 10 VAL HG12 H 3.379 5.223 3.869 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HG12 . . . . . . . . . c30225_5ug3 1 . 4 . 997 . 1 1 10 VAL HG13 H 4.018 5.448 5.495 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HG13 . . . . . . . . . c30225_5ug3 1 . 4 . 998 . 1 1 10 VAL HG21 H 6.582 3.680 5.048 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HG21 . . . . . . . . . c30225_5ug3 1 . 4 . 999 . 1 1 10 VAL HG22 H 6.444 5.213 5.910 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HG22 . . . . . . . . . c30225_5ug3 1 . 4 . 1000 . 1 1 10 VAL HG23 H 7.569 5.058 4.562 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HG23 . . . . . . . . . c30225_5ug3 1 . 4 . 1001 . 1 1 10 VAL N N 4.945 5.228 1.562 . . . 1.0 . . . . . . . . . . . . A . 10 VAL N . . . . . . . . . c30225_5ug3 1 . 4 . 1002 . 1 1 10 VAL O O 6.197 2.208 2.730 . . . 1.0 . . . . . . . . . . . . A . 10 VAL O . . . . . . . . . c30225_5ug3 1 . 4 . 1003 . 1 1 11 CYS C C 3.727 0.657 1.416 . . . 1.0 . . . . . . . . . . . . A . 11 CYS C . . . . . . . . . c30225_5ug3 1 . 4 . 1004 . 1 1 11 CYS CA C 3.546 1.464 2.698 . . . 1.0 . . . . . . . . . . . . A . 11 CYS CA . . . . . . . . . c30225_5ug3 1 . 4 . 1005 . 1 1 11 CYS CB C 2.077 1.471 3.125 . . . 1.0 . . . . . . . . . . . . A . 11 CYS CB . . . . . . . . . c30225_5ug3 1 . 4 . 1006 . 1 1 11 CYS H H 3.429 3.559 2.402 . . . 1.0 . . . . . . . . . . . . A . 11 CYS H . . . . . . . . . c30225_5ug3 1 . 4 . 1007 . 1 1 11 CYS HA H 4.123 0.992 3.476 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HA . . . . . . . . . c30225_5ug3 1 . 4 . 1008 . 1 1 11 CYS HB2 H 1.957 2.139 3.965 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HB2 . . . . . . . . . c30225_5ug3 1 . 4 . 1009 . 1 1 11 CYS HB3 H 1.471 1.820 2.302 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HB3 . . . . . . . . . c30225_5ug3 1 . 4 . 1010 . 1 1 11 CYS N N 4.051 2.816 2.553 . . . 1.0 . . . . . . . . . . . . A . 11 CYS N . . . . . . . . . c30225_5ug3 1 . 4 . 1011 . 1 1 11 CYS O O 3.999 -0.535 1.473 . . . 1.0 . . . . . . . . . . . . A . 11 CYS O . . . . . . . . . c30225_5ug3 1 . 4 . 1012 . 1 1 11 CYS SG S 1.451 -0.167 3.624 . . . 1.0 . . . . . . . . . . . . A . 11 CYS SG . . . . . . . . . c30225_5ug3 1 . 4 . 1013 . 1 1 12 ARG C C 5.242 0.212 -1.212 . . . 1.0 . . . . . . . . . . . . A . 12 ARG C . . . . . . . . . c30225_5ug3 1 . 4 . 1014 . 1 1 12 ARG CA C 3.784 0.573 -0.999 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CA . . . . . . . . . c30225_5ug3 1 . 4 . 1015 . 1 1 12 ARG CB C 3.241 1.356 -2.185 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CB . . . . . . . . . c30225_5ug3 1 . 4 . 1016 . 1 1 12 ARG CD C 3.006 3.548 -3.326 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CD . . . . . . . . . c30225_5ug3 1 . 4 . 1017 . 1 1 12 ARG CG C 3.669 2.791 -2.193 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CG . . . . . . . . . c30225_5ug3 1 . 4 . 1018 . 1 1 12 ARG CZ C 2.307 2.836 -5.587 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CZ . . . . . . . . . c30225_5ug3 1 . 4 . 1019 . 1 1 12 ARG H H 3.344 2.245 0.237 . . . 1.0 . . . . . . . . . . . . A . 12 ARG H . . . . . . . . . c30225_5ug3 1 . 4 . 1020 . 1 1 12 ARG HA H 3.236 -0.323 -0.923 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HA . . . . . . . . . c30225_5ug3 1 . 4 . 1021 . 1 1 12 ARG HB2 H 3.589 0.897 -3.096 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HB2 . . . . . . . . . c30225_5ug3 1 . 4 . 1022 . 1 1 12 ARG HB3 H 2.161 1.323 -2.163 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HB3 . . . . . . . . . c30225_5ug3 1 . 4 . 1023 . 1 1 12 ARG HD2 H 1.948 3.611 -3.120 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HD2 . . . . . . . . . c30225_5ug3 1 . 4 . 1024 . 1 1 12 ARG HD3 H 3.426 4.542 -3.378 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HD3 . . . . . . . . . c30225_5ug3 1 . 4 . 1025 . 1 1 12 ARG HE H 4.061 2.395 -4.733 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HE . . . . . . . . . c30225_5ug3 1 . 4 . 1026 . 1 1 12 ARG HG2 H 3.378 3.220 -1.254 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HG2 . . . . . . . . . c30225_5ug3 1 . 4 . 1027 . 1 1 12 ARG HG3 H 4.741 2.840 -2.307 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HG3 . . . . . . . . . c30225_5ug3 1 . 4 . 1028 . 1 1 12 ARG HH11 H 0.983 4.071 -4.666 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH11 . . . . . . . . . c30225_5ug3 1 . 4 . 1029 . 1 1 12 ARG HH12 H 0.493 3.478 -6.222 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH12 . . . . . . . . . c30225_5ug3 1 . 4 . 1030 . 1 1 12 ARG HH21 H 3.419 1.629 -6.773 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH21 . . . . . . . . . c30225_5ug3 1 . 4 . 1031 . 1 1 12 ARG HH22 H 1.875 2.086 -7.420 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH22 . . . . . . . . . c30225_5ug3 1 . 4 . 1032 . 1 1 12 ARG N N 3.590 1.292 0.254 . . . 1.0 . . . . . . . . . . . . A . 12 ARG N . . . . . . . . . c30225_5ug3 1 . 4 . 1033 . 1 1 12 ARG NE N 3.208 2.874 -4.608 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NE . . . . . . . . . c30225_5ug3 1 . 4 . 1034 . 1 1 12 ARG NH1 N 1.172 3.515 -5.484 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NH1 . . . . . . . . . c30225_5ug3 1 . 4 . 1035 . 1 1 12 ARG NH2 N 2.554 2.130 -6.682 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NH2 . . . . . . . . . c30225_5ug3 1 . 4 . 1036 . 1 1 12 ARG O O 5.562 -0.747 -1.914 . . . 1.0 . . . . . . . . . . . . A . 12 ARG O . . . . . . . . . c30225_5ug3 1 . 4 . 1037 . 1 1 13 VAL C C 8.102 -0.101 0.360 . . . 1.0 . . . . . . . . . . . . A . 13 VAL C . . . . . . . . . c30225_5ug3 1 . 4 . 1038 . 1 1 13 VAL CA C 7.541 0.798 -0.740 . . . 1.0 . . . . . . . . . . . . A . 13 VAL CA . . . . . . . . . c30225_5ug3 1 . 4 . 1039 . 1 1 13 VAL CB C 8.226 2.162 -0.756 . . . 1.0 . . . . . . . . . . . . A . 13 VAL CB . . . . . . . . . c30225_5ug3 1 . 4 . 1040 . 1 1 13 VAL CG1 C 9.730 2.034 -0.656 . . . 1.0 . . . . . . . . . . . . A . 13 VAL CG1 . . . . . . . . . c30225_5ug3 1 . 4 . 1041 . 1 1 13 VAL CG2 C 7.810 2.881 -2.023 . . . 1.0 . . . . . . . . . . . . A . 13 VAL CG2 . . . . . . . . . c30225_5ug3 1 . 4 . 1042 . 1 1 13 VAL H H 5.797 1.743 -0.075 . . . 1.0 . . . . . . . . . . . . A . 13 VAL H . . . . . . . . . c30225_5ug3 1 . 4 . 1043 . 1 1 13 VAL HA H 7.723 0.327 -1.693 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HA . . . . . . . . . c30225_5ug3 1 . 4 . 1044 . 1 1 13 VAL HB H 7.874 2.735 0.088 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HB . . . . . . . . . c30225_5ug3 1 . 4 . 1045 . 1 1 13 VAL HG11 H 10.102 1.480 -1.502 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HG11 . . . . . . . . . c30225_5ug3 1 . 4 . 1046 . 1 1 13 VAL HG12 H 9.978 1.515 0.256 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HG12 . . . . . . . . . c30225_5ug3 1 . 4 . 1047 . 1 1 13 VAL HG13 H 10.171 3.018 -0.643 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HG13 . . . . . . . . . c30225_5ug3 1 . 4 . 1048 . 1 1 13 VAL HG21 H 8.309 2.438 -2.870 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HG21 . . . . . . . . . c30225_5ug3 1 . 4 . 1049 . 1 1 13 VAL HG22 H 8.068 3.926 -1.951 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HG22 . . . . . . . . . c30225_5ug3 1 . 4 . 1050 . 1 1 13 VAL HG23 H 6.736 2.775 -2.145 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HG23 . . . . . . . . . c30225_5ug3 1 . 4 . 1051 . 1 1 13 VAL N N 6.118 0.998 -0.619 . . . 1.0 . . . . . . . . . . . . A . 13 VAL N . . . . . . . . . c30225_5ug3 1 . 4 . 1052 . 1 1 13 VAL O O 8.681 -1.146 0.073 . . . 1.0 . . . . . . . . . . . . A . 13 VAL O . . . . . . . . . c30225_5ug3 1 . 4 . 1053 . 1 1 14 ASN C C 7.827 -1.815 2.853 . . . 1.0 . . . . . . . . . . . . A . 14 ASN C . . . . . . . . . c30225_5ug3 1 . 4 . 1054 . 1 1 14 ASN CA C 8.479 -0.440 2.745 . . . 1.0 . . . . . . . . . . . . A . 14 ASN CA . . . . . . . . . c30225_5ug3 1 . 4 . 1055 . 1 1 14 ASN CB C 8.303 0.350 4.047 . . . 1.0 . . . . . . . . . . . . A . 14 ASN CB . . . . . . . . . c30225_5ug3 1 . 4 . 1056 . 1 1 14 ASN CG C 8.814 -0.400 5.262 . . . 1.0 . . . . . . . . . . . . A . 14 ASN CG . . . . . . . . . c30225_5ug3 1 . 4 . 1057 . 1 1 14 ASN H H 7.404 1.119 1.789 . . . 1.0 . . . . . . . . . . . . A . 14 ASN H . . . . . . . . . c30225_5ug3 1 . 4 . 1058 . 1 1 14 ASN HA H 9.534 -0.576 2.560 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HA . . . . . . . . . c30225_5ug3 1 . 4 . 1059 . 1 1 14 ASN HB2 H 8.843 1.281 3.970 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HB2 . . . . . . . . . c30225_5ug3 1 . 4 . 1060 . 1 1 14 ASN HB3 H 7.253 0.559 4.192 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HB3 . . . . . . . . . c30225_5ug3 1 . 4 . 1061 . 1 1 14 ASN HD21 H 6.973 -1.011 5.680 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HD21 . . . . . . . . . c30225_5ug3 1 . 4 . 1062 . 1 1 14 ASN HD22 H 8.213 -1.548 6.762 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HD22 . . . . . . . . . c30225_5ug3 1 . 4 . 1063 . 1 1 14 ASN N N 7.925 0.305 1.615 . . . 1.0 . . . . . . . . . . . . A . 14 ASN N . . . . . . . . . c30225_5ug3 1 . 4 . 1064 . 1 1 14 ASN ND2 N 7.911 -1.052 5.972 . . . 1.0 . . . . . . . . . . . . A . 14 ASN ND2 . . . . . . . . . c30225_5ug3 1 . 4 . 1065 . 1 1 14 ASN O O 8.504 -2.822 3.055 . . . 1.0 . . . . . . . . . . . . A . 14 ASN O . . . . . . . . . c30225_5ug3 1 . 4 . 1066 . 1 1 14 ASN OD1 O 10.004 -0.363 5.578 . . . 1.0 . . . . . . . . . . . . A . 14 ASN OD1 . . . . . . . . . c30225_5ug3 1 . 4 . 1067 . 1 1 15 ASN C C 5.715 -3.531 1.175 . . . 1.0 . . . . . . . . . . . . A . 15 ASN C . . . . . . . . . c30225_5ug3 1 . 4 . 1068 . 1 1 15 ASN CA C 5.779 -3.091 2.629 . . . 1.0 . . . . . . . . . . . . A . 15 ASN CA . . . . . . . . . c30225_5ug3 1 . 4 . 1069 . 1 1 15 ASN CB C 4.363 -2.905 3.192 . . . 1.0 . . . . . . . . . . . . A . 15 ASN CB . . . . . . . . . c30225_5ug3 1 . 4 . 1070 . 1 1 15 ASN CG C 4.123 -3.676 4.476 . . . 1.0 . . . . . . . . . . . . A . 15 ASN CG . . . . . . . . . c30225_5ug3 1 . 4 . 1071 . 1 1 15 ASN H H 6.017 -1.013 2.646 . . . 1.0 . . . . . . . . . . . . A . 15 ASN H . . . . . . . . . c30225_5ug3 1 . 4 . 1072 . 1 1 15 ASN HA H 6.303 -3.846 3.204 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HA . . . . . . . . . c30225_5ug3 1 . 4 . 1073 . 1 1 15 ASN HB2 H 4.198 -1.856 3.391 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HB2 . . . . . . . . . c30225_5ug3 1 . 4 . 1074 . 1 1 15 ASN HB3 H 3.650 -3.242 2.455 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HB3 . . . . . . . . . c30225_5ug3 1 . 4 . 1075 . 1 1 15 ASN HD21 H 3.146 -5.097 3.475 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HD21 . . . . . . . . . c30225_5ug3 1 . 4 . 1076 . 1 1 15 ASN HD22 H 3.288 -5.336 5.187 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HD22 . . . . . . . . . c30225_5ug3 1 . 4 . 1077 . 1 1 15 ASN N N 6.512 -1.849 2.711 . . . 1.0 . . . . . . . . . . . . A . 15 ASN N . . . . . . . . . c30225_5ug3 1 . 4 . 1078 . 1 1 15 ASN ND2 N 3.452 -4.817 4.368 . . . 1.0 . . . . . . . . . . . . A . 15 ASN ND2 . . . . . . . . . c30225_5ug3 1 . 4 . 1079 . 1 1 15 ASN O O 5.874 -2.722 0.262 . . . 1.0 . . . . . . . . . . . . A . 15 ASN O . . . . . . . . . c30225_5ug3 1 . 4 . 1080 . 1 1 15 ASN OD1 O 4.495 -3.232 5.561 . . . 1.0 . . . . . . . . . . . . A . 15 ASN OD1 . . . . . . . . . c30225_5ug3 1 . 4 . 1081 . 1 1 16 HYP C C 4.125 -5.008 -1.108 . . . 1.0 . . . . . . . . . . . . A . 16 HYP C . . . . . . . . . c30225_5ug3 1 . 4 . 1082 . 1 1 16 HYP CA C 5.404 -5.419 -0.388 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CA . . . . . . . . . c30225_5ug3 1 . 4 . 1083 . 1 1 16 HYP CB C 5.393 -6.896 -0.079 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CB . . . . . . . . . c30225_5ug3 1 . 4 . 1084 . 1 1 16 HYP CD C 5.403 -5.813 2.057 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CD . . . . . . . . . c30225_5ug3 1 . 4 . 1085 . 1 1 16 HYP CG C 5.352 -7.153 1.405 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CG . . . . . . . . . c30225_5ug3 1 . 4 . 1086 . 1 1 16 HYP HA H 6.260 -5.179 -1.000 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HA . . . . . . . . . c30225_5ug3 1 . 4 . 1087 . 1 1 16 HYP HB2 H 6.283 -7.348 -0.482 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HB2 . . . . . . . . . c30225_5ug3 1 . 4 . 1088 . 1 1 16 HYP HB3 H 4.524 -7.343 -0.540 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HB3 . . . . . . . . . c30225_5ug3 1 . 4 . 1089 . 1 1 16 HYP HD1 H 6.950 -7.244 2.462 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HD1 . . . . . . . . . c30225_5ug3 1 . 4 . 1090 . 1 1 16 HYP HD22 H 4.526 -5.639 2.633 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HD22 . . . . . . . . . c30225_5ug3 1 . 4 . 1091 . 1 1 16 HYP HD23 H 6.271 -5.755 2.696 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HD23 . . . . . . . . . c30225_5ug3 1 . 4 . 1092 . 1 1 16 HYP HG H 4.463 -7.704 1.676 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HG . . . . . . . . . c30225_5ug3 1 . 4 . 1093 . 1 1 16 HYP N N 5.514 -4.827 0.960 . . . 1.0 . . . . . . . . . . . . A . 16 HYP N . . . . . . . . . c30225_5ug3 1 . 4 . 1094 . 1 1 16 HYP O O 3.302 -5.852 -1.467 . . . 1.0 . . . . . . . . . . . . A . 16 HYP O . . . . . . . . . c30225_5ug3 1 . 4 . 1095 . 1 1 16 HYP OD1 O 6.505 -7.836 1.836 . . . 1.0 . . . . . . . . . . . . A . 16 HYP OD1 . . . . . . . . . c30225_5ug3 1 . 4 . 1096 . 1 1 17 HIS C C 1.562 -3.104 -1.139 . . . 1.0 . . . . . . . . . . . . A . 17 HIS C . . . . . . . . . c30225_5ug3 1 . 4 . 1097 . 1 1 17 HIS CA C 2.833 -3.094 -1.982 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CA . . . . . . . . . c30225_5ug3 1 . 4 . 1098 . 1 1 17 HIS CB C 2.565 -3.764 -3.336 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CB . . . . . . . . . c30225_5ug3 1 . 4 . 1099 . 1 1 17 HIS CD2 C 3.656 -2.315 -5.186 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CD2 . . . . . . . . . c30225_5ug3 1 . 4 . 1100 . 1 1 17 HIS CE1 C 5.289 -3.665 -5.732 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CE1 . . . . . . . . . c30225_5ug3 1 . 4 . 1101 . 1 1 17 HIS CG C 3.560 -3.410 -4.397 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CG . . . . . . . . . c30225_5ug3 1 . 4 . 1102 . 1 1 17 HIS H H 4.658 -3.101 -0.903 . . . 1.0 . . . . . . . . . . . . A . 17 HIS H . . . . . . . . . c30225_5ug3 1 . 4 . 1103 . 1 1 17 HIS HA H 3.095 -2.062 -2.167 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HA . . . . . . . . . c30225_5ug3 1 . 4 . 1104 . 1 1 17 HIS HB2 H 2.590 -4.835 -3.207 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HB2 . . . . . . . . . c30225_5ug3 1 . 4 . 1105 . 1 1 17 HIS HB3 H 1.586 -3.472 -3.687 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HB3 . . . . . . . . . c30225_5ug3 1 . 4 . 1106 . 1 1 17 HIS HD1 H 4.808 -5.112 -4.367 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HD1 . . . . . . . . . c30225_5ug3 1 . 4 . 1107 . 1 1 17 HIS HD2 H 3.001 -1.455 -5.171 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HD2 . . . . . . . . . c30225_5ug3 1 . 4 . 1108 . 1 1 17 HIS HE1 H 6.160 -4.082 -6.218 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HE1 . . . . . . . . . c30225_5ug3 1 . 4 . 1109 . 1 1 17 HIS HE2 H 4.948 -1.954 -6.798 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HE2 . . . . . . . . . c30225_5ug3 1 . 4 . 1110 . 1 1 17 HIS N N 3.970 -3.698 -1.283 . . . 1.0 . . . . . . . . . . . . A . 17 HIS N . . . . . . . . . c30225_5ug3 1 . 4 . 1111 . 1 1 17 HIS ND1 N 4.599 -4.235 -4.764 . . . 1.0 . . . . . . . . . . . . A . 17 HIS ND1 . . . . . . . . . c30225_5ug3 1 . 4 . 1112 . 1 1 17 HIS NE2 N 4.739 -2.499 -6.008 . . . 1.0 . . . . . . . . . . . . A . 17 HIS NE2 . . . . . . . . . c30225_5ug3 1 . 4 . 1113 . 1 1 17 HIS O O 0.893 -2.076 -1.020 . . . 1.0 . . . . . . . . . . . . A . 17 HIS O . . . . . . . . . c30225_5ug3 1 . 4 . 1114 . 1 1 18 VAL C C -1.211 -4.494 -0.739 . . . 1.0 . . . . . . . . . . . . A . 18 VAL C . . . . . . . . . c30225_5ug3 1 . 4 . 1115 . 1 1 18 VAL CA C 0.000 -4.459 0.200 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CA . . . . . . . . . c30225_5ug3 1 . 4 . 1116 . 1 1 18 VAL CB C -0.193 -3.384 1.291 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CB . . . . . . . . . c30225_5ug3 1 . 4 . 1117 . 1 1 18 VAL CG1 C -1.583 -3.462 1.904 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CG1 . . . . . . . . . c30225_5ug3 1 . 4 . 1118 . 1 1 18 VAL CG2 C 0.867 -3.533 2.368 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CG2 . . . . . . . . . c30225_5ug3 1 . 4 . 1119 . 1 1 18 VAL H H 1.879 -5.007 -0.605 . . . 1.0 . . . . . . . . . . . . A . 18 VAL H . . . . . . . . . c30225_5ug3 1 . 4 . 1120 . 1 1 18 VAL HA H 0.072 -5.419 0.690 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HA . . . . . . . . . c30225_5ug3 1 . 4 . 1121 . 1 1 18 VAL HB H -0.072 -2.416 0.835 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HB . . . . . . . . . c30225_5ug3 1 . 4 . 1122 . 1 1 18 VAL HG11 H -2.326 -3.348 1.127 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG11 . . . . . . . . . c30225_5ug3 1 . 4 . 1123 . 1 1 18 VAL HG12 H -1.699 -2.675 2.632 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG12 . . . . . . . . . c30225_5ug3 1 . 4 . 1124 . 1 1 18 VAL HG13 H -1.711 -4.421 2.386 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG13 . . . . . . . . . c30225_5ug3 1 . 4 . 1125 . 1 1 18 VAL HG21 H 0.739 -4.479 2.872 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG21 . . . . . . . . . c30225_5ug3 1 . 4 . 1126 . 1 1 18 VAL HG22 H 0.771 -2.729 3.081 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG22 . . . . . . . . . c30225_5ug3 1 . 4 . 1127 . 1 1 18 VAL HG23 H 1.844 -3.496 1.914 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG23 . . . . . . . . . c30225_5ug3 1 . 4 . 1128 . 1 1 18 VAL N N 1.245 -4.259 -0.547 . . . 1.0 . . . . . . . . . . . . A . 18 VAL N . . . . . . . . . c30225_5ug3 1 . 4 . 1129 . 1 1 18 VAL O O -2.005 -5.434 -0.701 . . . 1.0 . . . . . . . . . . . . A . 18 VAL O . . . . . . . . . c30225_5ug3 1 . 4 . 1130 . 1 1 19 CYS C C -1.927 -4.013 -3.896 . . . 1.0 . . . . . . . . . . . . A . 19 CYS C . . . . . . . . . c30225_5ug3 1 . 4 . 1131 . 1 1 19 CYS CA C -2.405 -3.426 -2.570 . . . 1.0 . . . . . . . . . . . . A . 19 CYS CA . . . . . . . . . c30225_5ug3 1 . 4 . 1132 . 1 1 19 CYS CB C -2.887 -1.983 -2.754 . . . 1.0 . . . . . . . . . . . . A . 19 CYS CB . . . . . . . . . c30225_5ug3 1 . 4 . 1133 . 1 1 19 CYS H H -0.692 -2.741 -1.541 . . . 1.0 . . . . . . . . . . . . A . 19 CYS H . . . . . . . . . c30225_5ug3 1 . 4 . 1134 . 1 1 19 CYS HA H -3.223 -4.026 -2.202 . . . 1.0 . . . . . . . . . . . . A . 19 CYS HA . . . . . . . . . c30225_5ug3 1 . 4 . 1135 . 1 1 19 CYS HB2 H -3.428 -1.910 -3.685 . . . 1.0 . . . . . . . . . . . . A . 19 CYS HB2 . . . . . . . . . c30225_5ug3 1 . 4 . 1136 . 1 1 19 CYS HB3 H -3.548 -1.724 -1.940 . . . 1.0 . . . . . . . . . . . . A . 19 CYS HB3 . . . . . . . . . c30225_5ug3 1 . 4 . 1137 . 1 1 19 CYS N N -1.340 -3.478 -1.581 . . . 1.0 . . . . . . . . . . . . A . 19 CYS N . . . . . . . . . c30225_5ug3 1 . 4 . 1138 . 1 1 19 CYS O O -1.517 -3.240 -4.788 . . . 1.0 . . . . . . . . . . . . A . 19 CYS O . . . . . . . . . c30225_5ug3 1 . 4 . 1139 . 1 1 19 CYS OXT O -1.937 -5.255 -4.033 . . . 1.0 . . . . . . . . . . . . A . 19 CYS OXT . . . . . . . . . c30225_5ug3 1 . 4 . 1140 . 1 1 19 CYS SG S -1.548 -0.741 -2.798 . . . 1.0 . . . . . . . . . . . . A . 19 CYS SG . . . . . . . . . c30225_5ug3 1 . 5 . 1141 . 1 1 1 ILE C C -9.694 -1.550 -0.175 . . . 1.0 . . . . . . . . . . . . A . 1 ILE C . . . . . . . . . c30225_5ug3 1 . 5 . 1142 . 1 1 1 ILE CA C -10.807 -1.148 -1.135 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CA . . . . . . . . . c30225_5ug3 1 . 5 . 1143 . 1 1 1 ILE CB C -10.327 0.040 -1.998 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CB . . . . . . . . . c30225_5ug3 1 . 5 . 1144 . 1 1 1 ILE CD1 C -9.560 2.473 -1.891 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CD1 . . . . . . . . . c30225_5ug3 1 . 5 . 1145 . 1 1 1 ILE CG1 C -10.141 1.296 -1.136 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CG1 . . . . . . . . . c30225_5ug3 1 . 5 . 1146 . 1 1 1 ILE CG2 C -11.311 0.300 -3.130 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CG2 . . . . . . . . . c30225_5ug3 1 . 5 . 1147 . 1 1 1 ILE H1 H -12.369 -1.645 0.143 . . . 1.0 . . . . . . . . . . . . A . 1 ILE H1 . . . . . . . . . c30225_5ug3 1 . 5 . 1148 . 1 1 1 ILE H2 H -12.791 -0.526 -1.046 . . . 1.0 . . . . . . . . . . . . A . 1 ILE H2 . . . . . . . . . c30225_5ug3 1 . 5 . 1149 . 1 1 1 ILE H3 H -11.859 -0.043 0.278 . . . 1.0 . . . . . . . . . . . . A . 1 ILE H3 . . . . . . . . . c30225_5ug3 1 . 5 . 1150 . 1 1 1 ILE HA H -11.017 -1.982 -1.788 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HA . . . . . . . . . c30225_5ug3 1 . 5 . 1151 . 1 1 1 ILE HB H -9.378 -0.229 -2.438 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HB . . . . . . . . . c30225_5ug3 1 . 5 . 1152 . 1 1 1 ILE HD11 H -9.467 3.317 -1.224 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HD11 . . . . . . . . . c30225_5ug3 1 . 5 . 1153 . 1 1 1 ILE HD12 H -10.211 2.732 -2.712 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HD12 . . . . . . . . . c30225_5ug3 1 . 5 . 1154 . 1 1 1 ILE HD13 H -8.585 2.209 -2.274 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HD13 . . . . . . . . . c30225_5ug3 1 . 5 . 1155 . 1 1 1 ILE HG12 H -11.098 1.598 -0.740 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG12 . . . . . . . . . c30225_5ug3 1 . 5 . 1156 . 1 1 1 ILE HG13 H -9.475 1.066 -0.318 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG13 . . . . . . . . . c30225_5ug3 1 . 5 . 1157 . 1 1 1 ILE HG21 H -11.373 -0.574 -3.761 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG21 . . . . . . . . . c30225_5ug3 1 . 5 . 1158 . 1 1 1 ILE HG22 H -10.973 1.142 -3.717 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG22 . . . . . . . . . c30225_5ug3 1 . 5 . 1159 . 1 1 1 ILE HG23 H -12.286 0.517 -2.719 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG23 . . . . . . . . . c30225_5ug3 1 . 5 . 1160 . 1 1 1 ILE N N -12.041 -0.817 -0.390 . . . 1.0 . . . . . . . . . . . . A . 1 ILE N . . . . . . . . . c30225_5ug3 1 . 5 . 1161 . 1 1 1 ILE O O -9.600 -1.025 0.936 . . . 1.0 . . . . . . . . . . . . A . 1 ILE O . . . . . . . . . c30225_5ug3 1 . 5 . 1162 . 1 1 2 ARG C C -6.450 -2.330 -0.248 . . . 1.0 . . . . . . . . . . . . A . 2 ARG C . . . . . . . . . c30225_5ug3 1 . 5 . 1163 . 1 1 2 ARG CA C -7.751 -2.943 0.224 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CA . . . . . . . . . c30225_5ug3 1 . 5 . 1164 . 1 1 2 ARG CB C -7.638 -4.463 0.183 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CB . . . . . . . . . c30225_5ug3 1 . 5 . 1165 . 1 1 2 ARG CD C -8.783 -6.676 0.273 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CD . . . . . . . . . c30225_5ug3 1 . 5 . 1166 . 1 1 2 ARG CG C -8.906 -5.196 0.582 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CG . . . . . . . . . c30225_5ug3 1 . 5 . 1167 . 1 1 2 ARG CZ C -7.391 -7.644 -1.525 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CZ . . . . . . . . . c30225_5ug3 1 . 5 . 1168 . 1 1 2 ARG H H -8.988 -2.884 -1.478 . . . 1.0 . . . . . . . . . . . . A . 2 ARG H . . . . . . . . . c30225_5ug3 1 . 5 . 1169 . 1 1 2 ARG HA H -7.942 -2.622 1.223 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HA . . . . . . . . . c30225_5ug3 1 . 5 . 1170 . 1 1 2 ARG HB2 H -7.380 -4.763 -0.822 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB2 . . . . . . . . . c30225_5ug3 1 . 5 . 1171 . 1 1 2 ARG HB3 H -6.847 -4.769 0.851 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB3 . . . . . . . . . c30225_5ug3 1 . 5 . 1172 . 1 1 2 ARG HD2 H -8.019 -7.102 0.904 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD2 . . . . . . . . . c30225_5ug3 1 . 5 . 1173 . 1 1 2 ARG HD3 H -9.728 -7.156 0.477 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD3 . . . . . . . . . c30225_5ug3 1 . 5 . 1174 . 1 1 2 ARG HE H -8.980 -6.456 -1.809 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HE . . . . . . . . . c30225_5ug3 1 . 5 . 1175 . 1 1 2 ARG HG2 H -9.070 -5.068 1.641 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG2 . . . . . . . . . c30225_5ug3 1 . 5 . 1176 . 1 1 2 ARG HG3 H -9.739 -4.787 0.031 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG3 . . . . . . . . . c30225_5ug3 1 . 5 . 1177 . 1 1 2 ARG HH11 H -6.857 -8.227 0.342 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH11 . . . . . . . . . c30225_5ug3 1 . 5 . 1178 . 1 1 2 ARG HH12 H -5.866 -8.848 -0.939 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH12 . . . . . . . . . c30225_5ug3 1 . 5 . 1179 . 1 1 2 ARG HH21 H -7.668 -7.269 -3.499 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH21 . . . . . . . . . c30225_5ug3 1 . 5 . 1180 . 1 1 2 ARG HH22 H -6.313 -8.286 -3.117 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH22 . . . . . . . . . c30225_5ug3 1 . 5 . 1181 . 1 1 2 ARG N N -8.857 -2.485 -0.597 . . . 1.0 . . . . . . . . . . . . A . 2 ARG N . . . . . . . . . c30225_5ug3 1 . 5 . 1182 . 1 1 2 ARG NE N -8.426 -6.903 -1.129 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NE . . . . . . . . . c30225_5ug3 1 . 5 . 1183 . 1 1 2 ARG NH1 N -6.647 -8.291 -0.635 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH1 . . . . . . . . . c30225_5ug3 1 . 5 . 1184 . 1 1 2 ARG NH2 N -7.104 -7.745 -2.817 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH2 . . . . . . . . . c30225_5ug3 1 . 5 . 1185 . 1 1 2 ARG O O -5.365 -2.734 0.162 . . . 1.0 . . . . . . . . . . . . A . 2 ARG O . . . . . . . . . c30225_5ug3 1 . 5 . 1186 . 1 1 3 ASP C C -5.247 0.705 -1.191 . . . 1.0 . . . . . . . . . . . . A . 3 ASP C . . . . . . . . . c30225_5ug3 1 . 5 . 1187 . 1 1 3 ASP CA C -5.430 -0.703 -1.719 . . . 1.0 . . . . . . . . . . . . A . 3 ASP CA . . . . . . . . . c30225_5ug3 1 . 5 . 1188 . 1 1 3 ASP CB C -5.576 -0.686 -3.235 . . . 1.0 . . . . . . . . . . . . A . 3 ASP CB . . . . . . . . . c30225_5ug3 1 . 5 . 1189 . 1 1 3 ASP CG C -6.890 -0.098 -3.708 . . . 1.0 . . . . . . . . . . . . A . 3 ASP CG . . . . . . . . . c30225_5ug3 1 . 5 . 1190 . 1 1 3 ASP H H -7.477 -1.036 -1.329 . . . 1.0 . . . . . . . . . . . . A . 3 ASP H . . . . . . . . . c30225_5ug3 1 . 5 . 1191 . 1 1 3 ASP HA H -4.556 -1.282 -1.461 . . . 1.0 . . . . . . . . . . . . A . 3 ASP HA . . . . . . . . . c30225_5ug3 1 . 5 . 1192 . 1 1 3 ASP HB2 H -4.777 -0.097 -3.647 . . . 1.0 . . . . . . . . . . . . A . 3 ASP HB2 . . . . . . . . . c30225_5ug3 1 . 5 . 1193 . 1 1 3 ASP HB3 H -5.501 -1.695 -3.604 . . . 1.0 . . . . . . . . . . . . A . 3 ASP HB3 . . . . . . . . . c30225_5ug3 1 . 5 . 1194 . 1 1 3 ASP N N -6.577 -1.346 -1.105 . . . 1.0 . . . . . . . . . . . . A . 3 ASP N . . . . . . . . . c30225_5ug3 1 . 5 . 1195 . 1 1 3 ASP O O -4.920 1.631 -1.928 . . . 1.0 . . . . . . . . . . . . A . 3 ASP O . . . . . . . . . c30225_5ug3 1 . 5 . 1196 . 1 1 3 ASP OD1 O -7.909 -0.821 -3.676 . . . 1.0 . . . . . . . . . . . . A . 3 ASP OD1 . . . . . . . . . c30225_5ug3 1 . 5 . 1197 . 1 1 3 ASP OD2 O -6.905 1.073 -4.141 . . . 1.0 . . . . . . . . . . . . A . 3 ASP OD2 . . . . . . . . . c30225_5ug3 1 . 5 . 1198 . 1 1 4 GLU C C -3.835 2.576 0.731 . . . 1.0 . . . . . . . . . . . . A . 4 GLU C . . . . . . . . . c30225_5ug3 1 . 5 . 1199 . 1 1 4 GLU CA C -5.292 2.132 0.762 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CA . . . . . . . . . c30225_5ug3 1 . 5 . 1200 . 1 1 4 GLU CB C -5.782 2.049 2.207 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CB . . . . . . . . . c30225_5ug3 1 . 5 . 1201 . 1 1 4 GLU CD C -7.695 1.585 3.774 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CD . . . . . . . . . c30225_5ug3 1 . 5 . 1202 . 1 1 4 GLU CG C -7.239 1.641 2.334 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CG . . . . . . . . . c30225_5ug3 1 . 5 . 1203 . 1 1 4 GLU H H -5.680 0.059 0.626 . . . 1.0 . . . . . . . . . . . . A . 4 GLU H . . . . . . . . . c30225_5ug3 1 . 5 . 1204 . 1 1 4 GLU HA H -5.889 2.854 0.226 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HA . . . . . . . . . c30225_5ug3 1 . 5 . 1205 . 1 1 4 GLU HB2 H -5.183 1.324 2.736 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HB2 . . . . . . . . . c30225_5ug3 1 . 5 . 1206 . 1 1 4 GLU HB3 H -5.660 3.014 2.674 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HB3 . . . . . . . . . c30225_5ug3 1 . 5 . 1207 . 1 1 4 GLU HG2 H -7.849 2.359 1.805 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HG2 . . . . . . . . . c30225_5ug3 1 . 5 . 1208 . 1 1 4 GLU HG3 H -7.368 0.664 1.890 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HG3 . . . . . . . . . c30225_5ug3 1 . 5 . 1209 . 1 1 4 GLU N N -5.440 0.846 0.102 . . . 1.0 . . . . . . . . . . . . A . 4 GLU N . . . . . . . . . c30225_5ug3 1 . 5 . 1210 . 1 1 4 GLU O O -3.526 3.709 0.366 . . . 1.0 . . . . . . . . . . . . A . 4 GLU O . . . . . . . . . c30225_5ug3 1 . 5 . 1211 . 1 1 4 GLU OE1 O -8.457 2.481 4.196 . . . 1.0 . . . . . . . . . . . . A . 4 GLU OE1 . . . . . . . . . c30225_5ug3 1 . 5 . 1212 . 1 1 4 GLU OE2 O -7.282 0.649 4.493 . . . 1.0 . . . . . . . . . . . . A . 4 GLU OE2 . . . . . . . . . c30225_5ug3 1 . 5 . 1213 . 1 1 5 CYS C C -0.949 2.269 -0.252 . . . 1.0 . . . . . . . . . . . . A . 5 CYS C . . . . . . . . . c30225_5ug3 1 . 5 . 1214 . 1 1 5 CYS CA C -1.515 1.948 1.126 . . . 1.0 . . . . . . . . . . . . A . 5 CYS CA . . . . . . . . . c30225_5ug3 1 . 5 . 1215 . 1 1 5 CYS CB C -0.768 0.774 1.734 . . . 1.0 . . . . . . . . . . . . A . 5 CYS CB . . . . . . . . . c30225_5ug3 1 . 5 . 1216 . 1 1 5 CYS H H -3.238 0.759 1.316 . . . 1.0 . . . . . . . . . . . . A . 5 CYS H . . . . . . . . . c30225_5ug3 1 . 5 . 1217 . 1 1 5 CYS HA H -1.379 2.809 1.761 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HA . . . . . . . . . c30225_5ug3 1 . 5 . 1218 . 1 1 5 CYS HB2 H -1.227 -0.145 1.400 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HB2 . . . . . . . . . c30225_5ug3 1 . 5 . 1219 . 1 1 5 CYS HB3 H 0.251 0.799 1.400 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HB3 . . . . . . . . . c30225_5ug3 1 . 5 . 1220 . 1 1 5 CYS N N -2.936 1.660 1.078 . . . 1.0 . . . . . . . . . . . . A . 5 CYS N . . . . . . . . . c30225_5ug3 1 . 5 . 1221 . 1 1 5 CYS O O 0.141 2.822 -0.359 . . . 1.0 . . . . . . . . . . . . A . 5 CYS O . . . . . . . . . c30225_5ug3 1 . 5 . 1222 . 1 1 5 CYS SG S -0.760 0.755 3.552 . . . 1.0 . . . . . . . . . . . . A . 5 CYS SG . . . . . . . . . c30225_5ug3 1 . 5 . 1223 . 1 1 6 CYS C C -1.198 3.810 -2.821 . . . 1.0 . . . . . . . . . . . . A . 6 CYS C . . . . . . . . . c30225_5ug3 1 . 5 . 1224 . 1 1 6 CYS CA C -1.295 2.290 -2.648 . . . 1.0 . . . . . . . . . . . . A . 6 CYS CA . . . . . . . . . c30225_5ug3 1 . 5 . 1225 . 1 1 6 CYS CB C -2.296 1.709 -3.628 . . . 1.0 . . . . . . . . . . . . A . 6 CYS CB . . . . . . . . . c30225_5ug3 1 . 5 . 1226 . 1 1 6 CYS H H -2.494 1.382 -1.172 . . . 1.0 . . . . . . . . . . . . A . 6 CYS H . . . . . . . . . c30225_5ug3 1 . 5 . 1227 . 1 1 6 CYS HA H -0.326 1.856 -2.841 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HA . . . . . . . . . c30225_5ug3 1 . 5 . 1228 . 1 1 6 CYS HB2 H -3.280 1.782 -3.188 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HB2 . . . . . . . . . c30225_5ug3 1 . 5 . 1229 . 1 1 6 CYS HB3 H -2.272 2.283 -4.538 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HB3 . . . . . . . . . c30225_5ug3 1 . 5 . 1230 . 1 1 6 CYS N N -1.682 1.925 -1.299 . . . 1.0 . . . . . . . . . . . . A . 6 CYS N . . . . . . . . . c30225_5ug3 1 . 5 . 1231 . 1 1 6 CYS O O -0.442 4.296 -3.660 . . . 1.0 . . . . . . . . . . . . A . 6 CYS O . . . . . . . . . c30225_5ug3 1 . 5 . 1232 . 1 1 6 CYS SG S -2.004 -0.042 -4.056 . . . 1.0 . . . . . . . . . . . . A . 6 CYS SG . . . . . . . . . c30225_5ug3 1 . 5 . 1233 . 1 1 7 SER C C -0.889 6.536 -1.031 . . . 1.0 . . . . . . . . . . . . A . 7 SER C . . . . . . . . . c30225_5ug3 1 . 5 . 1234 . 1 1 7 SER CA C -1.892 6.018 -2.053 . . . 1.0 . . . . . . . . . . . . A . 7 SER CA . . . . . . . . . c30225_5ug3 1 . 5 . 1235 . 1 1 7 SER CB C -3.274 6.606 -1.774 . . . 1.0 . . . . . . . . . . . . A . 7 SER CB . . . . . . . . . c30225_5ug3 1 . 5 . 1236 . 1 1 7 SER H H -2.552 4.122 -1.373 . . . 1.0 . . . . . . . . . . . . A . 7 SER H . . . . . . . . . c30225_5ug3 1 . 5 . 1237 . 1 1 7 SER HA H -1.573 6.314 -3.041 . . . 1.0 . . . . . . . . . . . . A . 7 SER HA . . . . . . . . . c30225_5ug3 1 . 5 . 1238 . 1 1 7 SER HB2 H -3.572 6.354 -0.767 . . . 1.0 . . . . . . . . . . . . A . 7 SER HB2 . . . . . . . . . c30225_5ug3 1 . 5 . 1239 . 1 1 7 SER HB3 H -3.234 7.679 -1.880 . . . 1.0 . . . . . . . . . . . . A . 7 SER HB3 . . . . . . . . . c30225_5ug3 1 . 5 . 1240 . 1 1 7 SER HG H -5.097 6.068 -2.244 . . . 1.0 . . . . . . . . . . . . A . 7 SER HG . . . . . . . . . c30225_5ug3 1 . 5 . 1241 . 1 1 7 SER N N -1.946 4.558 -2.013 . . . 1.0 . . . . . . . . . . . . A . 7 SER N . . . . . . . . . c30225_5ug3 1 . 5 . 1242 . 1 1 7 SER O O -0.802 7.735 -0.764 . . . 1.0 . . . . . . . . . . . . A . 7 SER O . . . . . . . . . c30225_5ug3 1 . 5 . 1243 . 1 1 7 SER OG O -4.236 6.093 -2.678 . . . 1.0 . . . . . . . . . . . . A . 7 SER OG . . . . . . . . . c30225_5ug3 1 . 5 . 1244 . 1 1 8 ASN C C 2.186 5.335 0.158 . . . 1.0 . . . . . . . . . . . . A . 8 ASN C . . . . . . . . . c30225_5ug3 1 . 5 . 1245 . 1 1 8 ASN CA C 0.853 5.932 0.552 . . . 1.0 . . . . . . . . . . . . A . 8 ASN CA . . . . . . . . . c30225_5ug3 1 . 5 . 1246 . 1 1 8 ASN CB C 0.445 5.345 1.899 . . . 1.0 . . . . . . . . . . . . A . 8 ASN CB . . . . . . . . . c30225_5ug3 1 . 5 . 1247 . 1 1 8 ASN CG C -0.879 5.876 2.406 . . . 1.0 . . . . . . . . . . . . A . 8 ASN CG . . . . . . . . . c30225_5ug3 1 . 5 . 1248 . 1 1 8 ASN H H -0.237 4.677 -0.739 . . . 1.0 . . . . . . . . . . . . A . 8 ASN H . . . . . . . . . c30225_5ug3 1 . 5 . 1249 . 1 1 8 ASN HA H 0.939 7.004 0.630 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HA . . . . . . . . . c30225_5ug3 1 . 5 . 1250 . 1 1 8 ASN HB2 H 0.367 4.273 1.795 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HB2 . . . . . . . . . c30225_5ug3 1 . 5 . 1251 . 1 1 8 ASN HB3 H 1.206 5.575 2.626 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HB3 . . . . . . . . . c30225_5ug3 1 . 5 . 1252 . 1 1 8 ASN HD21 H -1.843 4.514 1.336 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HD21 . . . . . . . . . c30225_5ug3 1 . 5 . 1253 . 1 1 8 ASN HD22 H -2.836 5.570 2.286 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HD22 . . . . . . . . . c30225_5ug3 1 . 5 . 1254 . 1 1 8 ASN N N -0.133 5.612 -0.461 . . . 1.0 . . . . . . . . . . . . A . 8 ASN N . . . . . . . . . c30225_5ug3 1 . 5 . 1255 . 1 1 8 ASN ND2 N -1.958 5.262 1.964 . . . 1.0 . . . . . . . . . . . . A . 8 ASN ND2 . . . . . . . . . c30225_5ug3 1 . 5 . 1256 . 1 1 8 ASN O O 2.461 4.176 0.470 . . . 1.0 . . . . . . . . . . . . A . 8 ASN O . . . . . . . . . c30225_5ug3 1 . 5 . 1257 . 1 1 8 ASN OD1 O -0.929 6.840 3.167 . . . 1.0 . . . . . . . . . . . . A . 8 ASN OD1 . . . . . . . . . c30225_5ug3 1 . 5 . 1258 . 1 1 9 PRO C C 5.173 5.025 0.134 . . . 1.0 . . . . . . . . . . . . A . 9 PRO C . . . . . . . . . c30225_5ug3 1 . 5 . 1259 . 1 1 9 PRO CA C 4.329 5.611 -0.994 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CA . . . . . . . . . c30225_5ug3 1 . 5 . 1260 . 1 1 9 PRO CB C 4.994 6.859 -1.577 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CB . . . . . . . . . c30225_5ug3 1 . 5 . 1261 . 1 1 9 PRO CD C 2.795 7.497 -0.951 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CD . . . . . . . . . c30225_5ug3 1 . 5 . 1262 . 1 1 9 PRO CG C 3.863 7.731 -1.979 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CG . . . . . . . . . c30225_5ug3 1 . 5 . 1263 . 1 1 9 PRO HA H 4.208 4.864 -1.766 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HA . . . . . . . . . c30225_5ug3 1 . 5 . 1264 . 1 1 9 PRO HB2 H 5.600 7.330 -0.820 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HB2 . . . . . . . . . c30225_5ug3 1 . 5 . 1265 . 1 1 9 PRO HB3 H 5.607 6.587 -2.423 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HB3 . . . . . . . . . c30225_5ug3 1 . 5 . 1266 . 1 1 9 PRO HD2 H 2.916 8.171 -0.118 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HD2 . . . . . . . . . c30225_5ug3 1 . 5 . 1267 . 1 1 9 PRO HD3 H 1.821 7.607 -1.390 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HD3 . . . . . . . . . c30225_5ug3 1 . 5 . 1268 . 1 1 9 PRO HG2 H 4.173 8.767 -1.971 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HG2 . . . . . . . . . c30225_5ug3 1 . 5 . 1269 . 1 1 9 PRO HG3 H 3.510 7.450 -2.960 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HG3 . . . . . . . . . c30225_5ug3 1 . 5 . 1270 . 1 1 9 PRO N N 3.030 6.098 -0.539 . . . 1.0 . . . . . . . . . . . . A . 9 PRO N . . . . . . . . . c30225_5ug3 1 . 5 . 1271 . 1 1 9 PRO O O 6.014 4.170 -0.111 . . . 1.0 . . . . . . . . . . . . A . 9 PRO O . . . . . . . . . c30225_5ug3 1 . 5 . 1272 . 1 1 10 VAL C C 5.298 3.607 2.941 . . . 1.0 . . . . . . . . . . . . A . 10 VAL C . . . . . . . . . c30225_5ug3 1 . 5 . 1273 . 1 1 10 VAL CA C 5.721 5.003 2.501 . . . 1.0 . . . . . . . . . . . . A . 10 VAL CA . . . . . . . . . c30225_5ug3 1 . 5 . 1274 . 1 1 10 VAL CB C 5.624 5.985 3.691 . . . 1.0 . . . . . . . . . . . . A . 10 VAL CB . . . . . . . . . c30225_5ug3 1 . 5 . 1275 . 1 1 10 VAL CG1 C 4.367 5.764 4.516 . . . 1.0 . . . . . . . . . . . . A . 10 VAL CG1 . . . . . . . . . c30225_5ug3 1 . 5 . 1276 . 1 1 10 VAL CG2 C 6.866 5.898 4.565 . . . 1.0 . . . . . . . . . . . . A . 10 VAL CG2 . . . . . . . . . c30225_5ug3 1 . 5 . 1277 . 1 1 10 VAL H H 4.136 6.037 1.524 . . . 1.0 . . . . . . . . . . . . A . 10 VAL H . . . . . . . . . c30225_5ug3 1 . 5 . 1278 . 1 1 10 VAL HA H 6.750 4.964 2.175 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HA . . . . . . . . . c30225_5ug3 1 . 5 . 1279 . 1 1 10 VAL HB H 5.568 6.975 3.283 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HB . . . . . . . . . c30225_5ug3 1 . 5 . 1280 . 1 1 10 VAL HG11 H 4.317 6.502 5.302 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HG11 . . . . . . . . . c30225_5ug3 1 . 5 . 1281 . 1 1 10 VAL HG12 H 4.395 4.778 4.952 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HG12 . . . . . . . . . c30225_5ug3 1 . 5 . 1282 . 1 1 10 VAL HG13 H 3.499 5.852 3.883 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HG13 . . . . . . . . . c30225_5ug3 1 . 5 . 1283 . 1 1 10 VAL HG21 H 7.739 6.136 3.975 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HG21 . . . . . . . . . c30225_5ug3 1 . 5 . 1284 . 1 1 10 VAL HG22 H 6.959 4.897 4.958 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HG22 . . . . . . . . . c30225_5ug3 1 . 5 . 1285 . 1 1 10 VAL HG23 H 6.782 6.600 5.382 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HG23 . . . . . . . . . c30225_5ug3 1 . 5 . 1286 . 1 1 10 VAL N N 4.909 5.442 1.370 . . . 1.0 . . . . . . . . . . . . A . 10 VAL N . . . . . . . . . c30225_5ug3 1 . 5 . 1287 . 1 1 10 VAL O O 6.109 2.789 3.374 . . . 1.0 . . . . . . . . . . . . A . 10 VAL O . . . . . . . . . c30225_5ug3 1 . 5 . 1288 . 1 1 11 CYS C C 3.889 1.000 2.117 . . . 1.0 . . . . . . . . . . . . A . 11 CYS C . . . . . . . . . c30225_5ug3 1 . 5 . 1289 . 1 1 11 CYS CA C 3.485 2.039 3.158 . . . 1.0 . . . . . . . . . . . . A . 11 CYS CA . . . . . . . . . c30225_5ug3 1 . 5 . 1290 . 1 1 11 CYS CB C 1.960 2.101 3.296 . . . 1.0 . . . . . . . . . . . . A . 11 CYS CB . . . . . . . . . c30225_5ug3 1 . 5 . 1291 . 1 1 11 CYS H H 3.425 4.038 2.459 . . . 1.0 . . . . . . . . . . . . A . 11 CYS H . . . . . . . . . c30225_5ug3 1 . 5 . 1292 . 1 1 11 CYS HA H 3.911 1.757 4.109 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HA . . . . . . . . . c30225_5ug3 1 . 5 . 1293 . 1 1 11 CYS HB2 H 1.696 2.933 3.933 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HB2 . . . . . . . . . c30225_5ug3 1 . 5 . 1294 . 1 1 11 CYS HB3 H 1.523 2.251 2.319 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HB3 . . . . . . . . . c30225_5ug3 1 . 5 . 1295 . 1 1 11 CYS N N 4.020 3.337 2.800 . . . 1.0 . . . . . . . . . . . . A . 11 CYS N . . . . . . . . . c30225_5ug3 1 . 5 . 1296 . 1 1 11 CYS O O 4.239 -0.133 2.457 . . . 1.0 . . . . . . . . . . . . A . 11 CYS O . . . . . . . . . c30225_5ug3 1 . 5 . 1297 . 1 1 11 CYS SG S 1.211 0.599 4.013 . . . 1.0 . . . . . . . . . . . . A . 11 CYS SG . . . . . . . . . c30225_5ug3 1 . 5 . 1298 . 1 1 12 ARG C C 5.657 0.292 -0.494 . . . 1.0 . . . . . . . . . . . . A . 12 ARG C . . . . . . . . . c30225_5ug3 1 . 5 . 1299 . 1 1 12 ARG CA C 4.169 0.457 -0.229 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CA . . . . . . . . . c30225_5ug3 1 . 5 . 1300 . 1 1 12 ARG CB C 3.429 0.822 -1.507 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CB . . . . . . . . . c30225_5ug3 1 . 5 . 1301 . 1 1 12 ARG CD C 2.599 2.602 -3.005 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CD . . . . . . . . . c30225_5ug3 1 . 5 . 1302 . 1 1 12 ARG CG C 3.497 2.279 -1.834 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CG . . . . . . . . . c30225_5ug3 1 . 5 . 1303 . 1 1 12 ARG CZ C 3.053 4.408 -4.624 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CZ . . . . . . . . . c30225_5ug3 1 . 5 . 1304 . 1 1 12 ARG H H 3.622 2.318 0.624 . . . 1.0 . . . . . . . . . . . . A . 12 ARG H . . . . . . . . . c30225_5ug3 1 . 5 . 1305 . 1 1 12 ARG HA H 3.808 -0.475 0.099 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HA . . . . . . . . . c30225_5ug3 1 . 5 . 1306 . 1 1 12 ARG HB2 H 3.862 0.282 -2.330 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HB2 . . . . . . . . . c30225_5ug3 1 . 5 . 1307 . 1 1 12 ARG HB3 H 2.392 0.543 -1.405 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HB3 . . . . . . . . . c30225_5ug3 1 . 5 . 1308 . 1 1 12 ARG HD2 H 2.873 1.977 -3.839 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HD2 . . . . . . . . . c30225_5ug3 1 . 5 . 1309 . 1 1 12 ARG HD3 H 1.584 2.388 -2.713 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HD3 . . . . . . . . . c30225_5ug3 1 . 5 . 1310 . 1 1 12 ARG HE H 2.431 4.672 -2.741 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HE . . . . . . . . . c30225_5ug3 1 . 5 . 1311 . 1 1 12 ARG HG2 H 3.171 2.826 -0.969 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HG2 . . . . . . . . . c30225_5ug3 1 . 5 . 1312 . 1 1 12 ARG HG3 H 4.515 2.541 -2.076 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HG3 . . . . . . . . . c30225_5ug3 1 . 5 . 1313 . 1 1 12 ARG HH11 H 3.483 2.550 -5.312 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH11 . . . . . . . . . c30225_5ug3 1 . 5 . 1314 . 1 1 12 ARG HH12 H 3.722 3.836 -6.450 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH12 . . . . . . . . . c30225_5ug3 1 . 5 . 1315 . 1 1 12 ARG HH21 H 2.727 6.371 -4.252 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH21 . . . . . . . . . c30225_5ug3 1 . 5 . 1316 . 1 1 12 ARG HH22 H 3.313 6.004 -5.841 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH22 . . . . . . . . . c30225_5ug3 1 . 5 . 1317 . 1 1 12 ARG N N 3.865 1.391 0.844 . . . 1.0 . . . . . . . . . . . . A . 12 ARG N . . . . . . . . . c30225_5ug3 1 . 5 . 1318 . 1 1 12 ARG NE N 2.688 4.002 -3.406 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NE . . . . . . . . . c30225_5ug3 1 . 5 . 1319 . 1 1 12 ARG NH1 N 3.452 3.528 -5.533 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NH1 . . . . . . . . . c30225_5ug3 1 . 5 . 1320 . 1 1 12 ARG NH2 N 3.026 5.696 -4.930 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NH2 . . . . . . . . . c30225_5ug3 1 . 5 . 1321 . 1 1 12 ARG O O 6.084 -0.760 -0.964 . . . 1.0 . . . . . . . . . . . . A . 12 ARG O . . . . . . . . . c30225_5ug3 1 . 5 . 1322 . 1 1 13 VAL C C 8.451 0.087 0.498 . . . 1.0 . . . . . . . . . . . . A . 13 VAL C . . . . . . . . . c30225_5ug3 1 . 5 . 1323 . 1 1 13 VAL CA C 7.885 1.218 -0.368 . . . 1.0 . . . . . . . . . . . . A . 13 VAL CA . . . . . . . . . c30225_5ug3 1 . 5 . 1324 . 1 1 13 VAL CB C 8.548 2.554 -0.001 . . . 1.0 . . . . . . . . . . . . A . 13 VAL CB . . . . . . . . . c30225_5ug3 1 . 5 . 1325 . 1 1 13 VAL CG1 C 8.275 2.882 1.447 . . . 1.0 . . . . . . . . . . . . A . 13 VAL CG1 . . . . . . . . . c30225_5ug3 1 . 5 . 1326 . 1 1 13 VAL CG2 C 10.033 2.523 -0.278 . . . 1.0 . . . . . . . . . . . . A . 13 VAL CG2 . . . . . . . . . c30225_5ug3 1 . 5 . 1327 . 1 1 13 VAL H H 6.064 2.153 0.117 . . . 1.0 . . . . . . . . . . . . A . 13 VAL H . . . . . . . . . c30225_5ug3 1 . 5 . 1328 . 1 1 13 VAL HA H 8.092 1.006 -1.408 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HA . . . . . . . . . c30225_5ug3 1 . 5 . 1329 . 1 1 13 VAL HB H 8.106 3.329 -0.609 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HB . . . . . . . . . c30225_5ug3 1 . 5 . 1330 . 1 1 13 VAL HG11 H 7.213 2.739 1.643 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HG11 . . . . . . . . . c30225_5ug3 1 . 5 . 1331 . 1 1 13 VAL HG12 H 8.546 3.908 1.646 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HG12 . . . . . . . . . c30225_5ug3 1 . 5 . 1332 . 1 1 13 VAL HG13 H 8.847 2.224 2.081 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HG13 . . . . . . . . . c30225_5ug3 1 . 5 . 1333 . 1 1 13 VAL HG21 H 10.472 3.460 0.026 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HG21 . . . . . . . . . c30225_5ug3 1 . 5 . 1334 . 1 1 13 VAL HG22 H 10.192 2.371 -1.333 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HG22 . . . . . . . . . c30225_5ug3 1 . 5 . 1335 . 1 1 13 VAL HG23 H 10.481 1.715 0.276 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HG23 . . . . . . . . . c30225_5ug3 1 . 5 . 1336 . 1 1 13 VAL N N 6.447 1.311 -0.203 . . . 1.0 . . . . . . . . . . . . A . 13 VAL N . . . . . . . . . c30225_5ug3 1 . 5 . 1337 . 1 1 13 VAL O O 9.368 -0.623 0.089 . . . 1.0 . . . . . . . . . . . . A . 13 VAL O . . . . . . . . . c30225_5ug3 1 . 5 . 1338 . 1 1 14 ASN C C 7.697 -2.484 2.082 . . . 1.0 . . . . . . . . . . . . A . 14 ASN C . . . . . . . . . c30225_5ug3 1 . 5 . 1339 . 1 1 14 ASN CA C 8.290 -1.178 2.571 . . . 1.0 . . . . . . . . . . . . A . 14 ASN CA . . . . . . . . . c30225_5ug3 1 . 5 . 1340 . 1 1 14 ASN CB C 7.786 -0.973 3.999 . . . 1.0 . . . . . . . . . . . . A . 14 ASN CB . . . . . . . . . c30225_5ug3 1 . 5 . 1341 . 1 1 14 ASN CG C 8.060 0.395 4.572 . . . 1.0 . . . . . . . . . . . . A . 14 ASN CG . . . . . . . . . c30225_5ug3 1 . 5 . 1342 . 1 1 14 ASN H H 7.198 0.553 1.997 . . . 1.0 . . . . . . . . . . . . A . 14 ASN H . . . . . . . . . c30225_5ug3 1 . 5 . 1343 . 1 1 14 ASN HA H 9.368 -1.247 2.570 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HA . . . . . . . . . c30225_5ug3 1 . 5 . 1344 . 1 1 14 ASN HB2 H 6.718 -1.129 4.014 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HB2 . . . . . . . . . c30225_5ug3 1 . 5 . 1345 . 1 1 14 ASN HB3 H 8.253 -1.708 4.640 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HB3 . . . . . . . . . c30225_5ug3 1 . 5 . 1346 . 1 1 14 ASN HD21 H 6.362 0.265 5.583 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HD21 . . . . . . . . . c30225_5ug3 1 . 5 . 1347 . 1 1 14 ASN HD22 H 7.267 1.732 5.807 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HD22 . . . . . . . . . c30225_5ug3 1 . 5 . 1348 . 1 1 14 ASN N N 7.887 -0.085 1.691 . . . 1.0 . . . . . . . . . . . . A . 14 ASN N . . . . . . . . . c30225_5ug3 1 . 5 . 1349 . 1 1 14 ASN ND2 N 7.141 0.845 5.404 . . . 1.0 . . . . . . . . . . . . A . 14 ASN ND2 . . . . . . . . . c30225_5ug3 1 . 5 . 1350 . 1 1 14 ASN O O 8.360 -3.517 2.046 . . . 1.0 . . . . . . . . . . . . A . 14 ASN O . . . . . . . . . c30225_5ug3 1 . 5 . 1351 . 1 1 14 ASN OD1 O 9.067 1.037 4.270 . . . 1.0 . . . . . . . . . . . . A . 14 ASN OD1 . . . . . . . . . c30225_5ug3 1 . 5 . 1352 . 1 1 15 ASN C C 4.834 -3.465 0.197 . . . 1.0 . . . . . . . . . . . . A . 15 ASN C . . . . . . . . . c30225_5ug3 1 . 5 . 1353 . 1 1 15 ASN CA C 5.634 -3.602 1.486 . . . 1.0 . . . . . . . . . . . . A . 15 ASN CA . . . . . . . . . c30225_5ug3 1 . 5 . 1354 . 1 1 15 ASN CB C 4.689 -3.766 2.669 . . . 1.0 . . . . . . . . . . . . A . 15 ASN CB . . . . . . . . . c30225_5ug3 1 . 5 . 1355 . 1 1 15 ASN CG C 4.180 -5.190 2.836 . . . 1.0 . . . . . . . . . . . . A . 15 ASN CG . . . . . . . . . c30225_5ug3 1 . 5 . 1356 . 1 1 15 ASN H H 6.038 -1.541 1.520 . . . 1.0 . . . . . . . . . . . . A . 15 ASN H . . . . . . . . . c30225_5ug3 1 . 5 . 1357 . 1 1 15 ASN HA H 6.291 -4.453 1.418 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HA . . . . . . . . . c30225_5ug3 1 . 5 . 1358 . 1 1 15 ASN HB2 H 5.199 -3.462 3.580 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HB2 . . . . . . . . . c30225_5ug3 1 . 5 . 1359 . 1 1 15 ASN HB3 H 3.843 -3.119 2.510 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HB3 . . . . . . . . . c30225_5ug3 1 . 5 . 1360 . 1 1 15 ASN HD21 H 2.629 -4.812 1.657 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HD21 . . . . . . . . . c30225_5ug3 1 . 5 . 1361 . 1 1 15 ASN HD22 H 2.715 -6.418 2.290 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HD22 . . . . . . . . . c30225_5ug3 1 . 5 . 1362 . 1 1 15 ASN N N 6.436 -2.415 1.694 . . . 1.0 . . . . . . . . . . . . A . 15 ASN N . . . . . . . . . c30225_5ug3 1 . 5 . 1363 . 1 1 15 ASN ND2 N 3.062 -5.504 2.197 . . . 1.0 . . . . . . . . . . . . A . 15 ASN ND2 . . . . . . . . . c30225_5ug3 1 . 5 . 1364 . 1 1 15 ASN O O 3.679 -3.051 0.209 . . . 1.0 . . . . . . . . . . . . A . 15 ASN O . . . . . . . . . c30225_5ug3 1 . 5 . 1365 . 1 1 15 ASN OD1 O 4.783 -5.999 3.540 . . . 1.0 . . . . . . . . . . . . A . 15 ASN OD1 . . . . . . . . . c30225_5ug3 1 . 5 . 1366 . 1 1 16 HYP C C 3.789 -4.609 -2.644 . . . 1.0 . . . . . . . . . . . . A . 16 HYP C . . . . . . . . . c30225_5ug3 1 . 5 . 1367 . 1 1 16 HYP CA C 4.873 -3.599 -2.272 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CA . . . . . . . . . c30225_5ug3 1 . 5 . 1368 . 1 1 16 HYP CB C 6.108 -3.757 -3.136 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CB . . . . . . . . . c30225_5ug3 1 . 5 . 1369 . 1 1 16 HYP CD C 6.797 -4.437 -0.989 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CD . . . . . . . . . c30225_5ug3 1 . 5 . 1370 . 1 1 16 HYP CG C 7.336 -3.919 -2.272 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CG . . . . . . . . . c30225_5ug3 1 . 5 . 1371 . 1 1 16 HYP HA H 4.482 -2.599 -2.378 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HA . . . . . . . . . c30225_5ug3 1 . 5 . 1372 . 1 1 16 HYP HB2 H 6.228 -2.881 -3.751 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HB2 . . . . . . . . . c30225_5ug3 1 . 5 . 1373 . 1 1 16 HYP HB3 H 5.992 -4.628 -3.768 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HB3 . . . . . . . . . c30225_5ug3 1 . 5 . 1374 . 1 1 16 HYP HD1 H 7.682 -2.479 -1.045 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HD1 . . . . . . . . . c30225_5ug3 1 . 5 . 1375 . 1 1 16 HYP HD22 H 6.738 -5.491 -1.007 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HD22 . . . . . . . . . c30225_5ug3 1 . 5 . 1376 . 1 1 16 HYP HD23 H 7.407 -4.105 -0.163 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HD23 . . . . . . . . . c30225_5ug3 1 . 5 . 1377 . 1 1 16 HYP HG H 8.057 -4.586 -2.724 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HG . . . . . . . . . c30225_5ug3 1 . 5 . 1378 . 1 1 16 HYP N N 5.451 -3.815 -0.928 . . . 1.0 . . . . . . . . . . . . A . 16 HYP N . . . . . . . . . c30225_5ug3 1 . 5 . 1379 . 1 1 16 HYP O O 3.315 -4.641 -3.778 . . . 1.0 . . . . . . . . . . . . A . 16 HYP O . . . . . . . . . c30225_5ug3 1 . 5 . 1380 . 1 1 16 HYP OD1 O 7.914 -2.670 -1.968 . . . 1.0 . . . . . . . . . . . . A . 16 HYP OD1 . . . . . . . . . c30225_5ug3 1 . 5 . 1381 . 1 1 17 HIS C C 1.239 -6.072 -0.768 . . . 1.0 . . . . . . . . . . . . A . 17 HIS C . . . . . . . . . c30225_5ug3 1 . 5 . 1382 . 1 1 17 HIS CA C 2.267 -6.335 -1.860 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CA . . . . . . . . . c30225_5ug3 1 . 5 . 1383 . 1 1 17 HIS CB C 2.704 -7.804 -1.836 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CB . . . . . . . . . c30225_5ug3 1 . 5 . 1384 . 1 1 17 HIS CD2 C 4.651 -7.936 -3.552 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CD2 . . . . . . . . . c30225_5ug3 1 . 5 . 1385 . 1 1 17 HIS CE1 C 3.727 -9.327 -4.968 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CE1 . . . . . . . . . c30225_5ug3 1 . 5 . 1386 . 1 1 17 HIS CG C 3.421 -8.246 -3.075 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CG . . . . . . . . . c30225_5ug3 1 . 5 . 1387 . 1 1 17 HIS H H 3.903 -5.455 -0.838 . . . 1.0 . . . . . . . . . . . . A . 17 HIS H . . . . . . . . . c30225_5ug3 1 . 5 . 1388 . 1 1 17 HIS HA H 1.817 -6.115 -2.817 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HA . . . . . . . . . c30225_5ug3 1 . 5 . 1389 . 1 1 17 HIS HB2 H 3.364 -7.962 -0.998 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HB2 . . . . . . . . . c30225_5ug3 1 . 5 . 1390 . 1 1 17 HIS HB3 H 1.830 -8.428 -1.718 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HB3 . . . . . . . . . c30225_5ug3 1 . 5 . 1391 . 1 1 17 HIS HD1 H 1.982 -9.536 -3.918 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HD1 . . . . . . . . . c30225_5ug3 1 . 5 . 1392 . 1 1 17 HIS HD2 H 5.368 -7.271 -3.092 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HD2 . . . . . . . . . c30225_5ug3 1 . 5 . 1393 . 1 1 17 HIS HE1 H 3.564 -9.966 -5.822 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HE1 . . . . . . . . . c30225_5ug3 1 . 5 . 1394 . 1 1 17 HIS HE2 H 5.538 -8.470 -5.377 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HE2 . . . . . . . . . c30225_5ug3 1 . 5 . 1395 . 1 1 17 HIS N N 3.405 -5.440 -1.686 . . . 1.0 . . . . . . . . . . . . A . 17 HIS N . . . . . . . . . c30225_5ug3 1 . 5 . 1396 . 1 1 17 HIS ND1 N 2.871 -9.119 -3.986 . . . 1.0 . . . . . . . . . . . . A . 17 HIS ND1 . . . . . . . . . c30225_5ug3 1 . 5 . 1397 . 1 1 17 HIS NE2 N 4.816 -8.621 -4.730 . . . 1.0 . . . . . . . . . . . . A . 17 HIS NE2 . . . . . . . . . c30225_5ug3 1 . 5 . 1398 . 1 1 17 HIS O O 0.571 -6.985 -0.283 . . . 1.0 . . . . . . . . . . . . A . 17 HIS O . . . . . . . . . c30225_5ug3 1 . 5 . 1399 . 1 1 18 VAL C C -1.193 -4.221 0.250 . . . 1.0 . . . . . . . . . . . . A . 18 VAL C . . . . . . . . . c30225_5ug3 1 . 5 . 1400 . 1 1 18 VAL CA C 0.254 -4.403 0.711 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CA . . . . . . . . . c30225_5ug3 1 . 5 . 1401 . 1 1 18 VAL CB C 0.761 -3.098 1.369 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CB . . . . . . . . . c30225_5ug3 1 . 5 . 1402 . 1 1 18 VAL CG1 C 0.756 -1.945 0.375 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CG1 . . . . . . . . . c30225_5ug3 1 . 5 . 1403 . 1 1 18 VAL CG2 C -0.063 -2.754 2.603 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CG2 . . . . . . . . . c30225_5ug3 1 . 5 . 1404 . 1 1 18 VAL H H 1.632 -4.118 -0.868 . . . 1.0 . . . . . . . . . . . . A . 18 VAL H . . . . . . . . . c30225_5ug3 1 . 5 . 1405 . 1 1 18 VAL HA H 0.284 -5.185 1.455 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HA . . . . . . . . . c30225_5ug3 1 . 5 . 1406 . 1 1 18 VAL HB H 1.782 -3.258 1.683 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HB . . . . . . . . . c30225_5ug3 1 . 5 . 1407 . 1 1 18 VAL HG11 H 1.393 -2.189 -0.462 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG11 . . . . . . . . . c30225_5ug3 1 . 5 . 1408 . 1 1 18 VAL HG12 H 1.123 -1.052 0.857 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG12 . . . . . . . . . c30225_5ug3 1 . 5 . 1409 . 1 1 18 VAL HG13 H -0.250 -1.776 0.024 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG13 . . . . . . . . . c30225_5ug3 1 . 5 . 1410 . 1 1 18 VAL HG21 H 0.312 -1.842 3.044 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG21 . . . . . . . . . c30225_5ug3 1 . 5 . 1411 . 1 1 18 VAL HG22 H 0.012 -3.558 3.320 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG22 . . . . . . . . . c30225_5ug3 1 . 5 . 1412 . 1 1 18 VAL HG23 H -1.096 -2.620 2.320 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG23 . . . . . . . . . c30225_5ug3 1 . 5 . 1413 . 1 1 18 VAL N N 1.123 -4.805 -0.389 . . . 1.0 . . . . . . . . . . . . A . 18 VAL N . . . . . . . . . c30225_5ug3 1 . 5 . 1414 . 1 1 18 VAL O O -2.126 -4.419 1.028 . . . 1.0 . . . . . . . . . . . . A . 18 VAL O . . . . . . . . . c30225_5ug3 1 . 5 . 1415 . 1 1 19 CYS C C -3.304 -4.958 -2.043 . . . 1.0 . . . . . . . . . . . . A . 19 CYS C . . . . . . . . . c30225_5ug3 1 . 5 . 1416 . 1 1 19 CYS CA C -2.719 -3.640 -1.535 . . . 1.0 . . . . . . . . . . . . A . 19 CYS CA . . . . . . . . . c30225_5ug3 1 . 5 . 1417 . 1 1 19 CYS CB C -2.699 -2.612 -2.670 . . . 1.0 . . . . . . . . . . . . A . 19 CYS CB . . . . . . . . . c30225_5ug3 1 . 5 . 1418 . 1 1 19 CYS H H -0.607 -3.735 -1.598 . . . 1.0 . . . . . . . . . . . . A . 19 CYS H . . . . . . . . . c30225_5ug3 1 . 5 . 1419 . 1 1 19 CYS HA H -3.338 -3.268 -0.732 . . . 1.0 . . . . . . . . . . . . A . 19 CYS HA . . . . . . . . . c30225_5ug3 1 . 5 . 1420 . 1 1 19 CYS HB2 H -2.190 -3.036 -3.521 . . . 1.0 . . . . . . . . . . . . A . 19 CYS HB2 . . . . . . . . . c30225_5ug3 1 . 5 . 1421 . 1 1 19 CYS HB3 H -3.715 -2.383 -2.949 . . . 1.0 . . . . . . . . . . . . A . 19 CYS HB3 . . . . . . . . . c30225_5ug3 1 . 5 . 1422 . 1 1 19 CYS N N -1.380 -3.856 -1.009 . . . 1.0 . . . . . . . . . . . . A . 19 CYS N . . . . . . . . . c30225_5ug3 1 . 5 . 1423 . 1 1 19 CYS O O -3.308 -5.177 -3.275 . . . 1.0 . . . . . . . . . . . . A . 19 CYS O . . . . . . . . . c30225_5ug3 1 . 5 . 1424 . 1 1 19 CYS OXT O -3.729 -5.785 -1.208 . . . 1.0 . . . . . . . . . . . . A . 19 CYS OXT . . . . . . . . . c30225_5ug3 1 . 5 . 1425 . 1 1 19 CYS SG S -1.887 -1.027 -2.281 . . . 1.0 . . . . . . . . . . . . A . 19 CYS SG . . . . . . . . . c30225_5ug3 1 . 6 . 1426 . 1 1 1 ILE C C -7.299 -3.227 3.593 . . . 1.0 . . . . . . . . . . . . A . 1 ILE C . . . . . . . . . c30225_5ug3 1 . 6 . 1427 . 1 1 1 ILE CA C -7.302 -4.745 3.747 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CA . . . . . . . . . c30225_5ug3 1 . 6 . 1428 . 1 1 1 ILE CB C -6.898 -5.404 2.401 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CB . . . . . . . . . c30225_5ug3 1 . 6 . 1429 . 1 1 1 ILE CD1 C -5.065 -5.467 0.623 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CD1 . . . . . . . . . c30225_5ug3 1 . 6 . 1430 . 1 1 1 ILE CG1 C -5.530 -4.886 1.941 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CG1 . . . . . . . . . c30225_5ug3 1 . 6 . 1431 . 1 1 1 ILE CG2 C -7.958 -5.151 1.333 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CG2 . . . . . . . . . c30225_5ug3 1 . 6 . 1432 . 1 1 1 ILE H1 H -9.362 -4.921 3.524 . . . 1.0 . . . . . . . . . . . . A . 1 ILE H1 . . . . . . . . . c30225_5ug3 1 . 6 . 1433 . 1 1 1 ILE H2 H -8.855 -4.807 5.129 . . . 1.0 . . . . . . . . . . . . A . 1 ILE H2 . . . . . . . . . c30225_5ug3 1 . 6 . 1434 . 1 1 1 ILE H3 H -8.639 -6.250 4.278 . . . 1.0 . . . . . . . . . . . . A . 1 ILE H3 . . . . . . . . . c30225_5ug3 1 . 6 . 1435 . 1 1 1 ILE HA H -6.572 -5.021 4.494 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HA . . . . . . . . . c30225_5ug3 1 . 6 . 1436 . 1 1 1 ILE HB H -6.835 -6.471 2.558 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HB . . . . . . . . . c30225_5ug3 1 . 6 . 1437 . 1 1 1 ILE HD11 H -5.788 -5.241 -0.146 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HD11 . . . . . . . . . c30225_5ug3 1 . 6 . 1438 . 1 1 1 ILE HD12 H -4.962 -6.538 0.717 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HD12 . . . . . . . . . c30225_5ug3 1 . 6 . 1439 . 1 1 1 ILE HD13 H -4.112 -5.036 0.357 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HD13 . . . . . . . . . c30225_5ug3 1 . 6 . 1440 . 1 1 1 ILE HG12 H -5.579 -3.815 1.826 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG12 . . . . . . . . . c30225_5ug3 1 . 6 . 1441 . 1 1 1 ILE HG13 H -4.791 -5.130 2.690 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG13 . . . . . . . . . c30225_5ug3 1 . 6 . 1442 . 1 1 1 ILE HG21 H -7.660 -5.628 0.411 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG21 . . . . . . . . . c30225_5ug3 1 . 6 . 1443 . 1 1 1 ILE HG22 H -8.059 -4.088 1.171 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG22 . . . . . . . . . c30225_5ug3 1 . 6 . 1444 . 1 1 1 ILE HG23 H -8.904 -5.556 1.659 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG23 . . . . . . . . . c30225_5ug3 1 . 6 . 1445 . 1 1 1 ILE N N -8.630 -5.214 4.200 . . . 1.0 . . . . . . . . . . . . A . 1 ILE N . . . . . . . . . c30225_5ug3 1 . 6 . 1446 . 1 1 1 ILE O O -8.267 -2.642 3.109 . . . 1.0 . . . . . . . . . . . . A . 1 ILE O . . . . . . . . . c30225_5ug3 1 . 6 . 1447 . 1 1 2 ARG C C -5.631 -0.808 2.471 . . . 1.0 . . . . . . . . . . . . A . 2 ARG C . . . . . . . . . c30225_5ug3 1 . 6 . 1448 . 1 1 2 ARG CA C -6.088 -1.152 3.883 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CA . . . . . . . . . c30225_5ug3 1 . 6 . 1449 . 1 1 2 ARG CB C -5.111 -0.588 4.914 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CB . . . . . . . . . c30225_5ug3 1 . 6 . 1450 . 1 1 2 ARG CD C -4.616 -0.131 7.330 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CD . . . . . . . . . c30225_5ug3 1 . 6 . 1451 . 1 1 2 ARG CG C -5.523 -0.855 6.351 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CG . . . . . . . . . c30225_5ug3 1 . 6 . 1452 . 1 1 2 ARG CZ C -3.743 2.163 7.578 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CZ . . . . . . . . . c30225_5ug3 1 . 6 . 1453 . 1 1 2 ARG H H -5.499 -3.094 4.450 . . . 1.0 . . . . . . . . . . . . A . 2 ARG H . . . . . . . . . c30225_5ug3 1 . 6 . 1454 . 1 1 2 ARG HA H -7.060 -0.720 4.049 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HA . . . . . . . . . c30225_5ug3 1 . 6 . 1455 . 1 1 2 ARG HB2 H -4.139 -1.030 4.753 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB2 . . . . . . . . . c30225_5ug3 1 . 6 . 1456 . 1 1 2 ARG HB3 H -5.037 0.481 4.776 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB3 . . . . . . . . . c30225_5ug3 1 . 6 . 1457 . 1 1 2 ARG HD2 H -4.918 -0.384 8.337 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD2 . . . . . . . . . c30225_5ug3 1 . 6 . 1458 . 1 1 2 ARG HD3 H -3.599 -0.456 7.168 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD3 . . . . . . . . . c30225_5ug3 1 . 6 . 1459 . 1 1 2 ARG HE H -5.482 1.682 6.715 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HE . . . . . . . . . c30225_5ug3 1 . 6 . 1460 . 1 1 2 ARG HG2 H -6.537 -0.514 6.494 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG2 . . . . . . . . . c30225_5ug3 1 . 6 . 1461 . 1 1 2 ARG HG3 H -5.468 -1.917 6.540 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG3 . . . . . . . . . c30225_5ug3 1 . 6 . 1462 . 1 1 2 ARG HH11 H -2.538 0.719 8.339 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH11 . . . . . . . . . c30225_5ug3 1 . 6 . 1463 . 1 1 2 ARG HH12 H -1.950 2.340 8.505 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH12 . . . . . . . . . c30225_5ug3 1 . 6 . 1464 . 1 1 2 ARG HH21 H -4.702 3.824 6.904 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH21 . . . . . . . . . c30225_5ug3 1 . 6 . 1465 . 1 1 2 ARG HH22 H -3.175 4.107 7.683 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH22 . . . . . . . . . c30225_5ug3 1 . 6 . 1466 . 1 1 2 ARG N N -6.221 -2.588 4.027 . . . 1.0 . . . . . . . . . . . . A . 2 ARG N . . . . . . . . . c30225_5ug3 1 . 6 . 1467 . 1 1 2 ARG NE N -4.685 1.319 7.162 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NE . . . . . . . . . c30225_5ug3 1 . 6 . 1468 . 1 1 2 ARG NH1 N -2.657 1.705 8.189 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH1 . . . . . . . . . c30225_5ug3 1 . 6 . 1469 . 1 1 2 ARG NH2 N -3.885 3.468 7.373 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH2 . . . . . . . . . c30225_5ug3 1 . 6 . 1470 . 1 1 2 ARG O O -4.433 -0.703 2.197 . . . 1.0 . . . . . . . . . . . . A . 2 ARG O . . . . . . . . . c30225_5ug3 1 . 6 . 1471 . 1 1 3 ASP C C -5.833 1.077 0.012 . . . 1.0 . . . . . . . . . . . . A . 3 ASP C . . . . . . . . . c30225_5ug3 1 . 6 . 1472 . 1 1 3 ASP CA C -6.325 -0.348 0.175 . . . 1.0 . . . . . . . . . . . . A . 3 ASP CA . . . . . . . . . c30225_5ug3 1 . 6 . 1473 . 1 1 3 ASP CB C -7.589 -0.579 -0.657 . . . 1.0 . . . . . . . . . . . . A . 3 ASP CB . . . . . . . . . c30225_5ug3 1 . 6 . 1474 . 1 1 3 ASP CG C -7.353 -0.449 -2.147 . . . 1.0 . . . . . . . . . . . . A . 3 ASP CG . . . . . . . . . c30225_5ug3 1 . 6 . 1475 . 1 1 3 ASP H H -7.533 -0.695 1.880 . . . 1.0 . . . . . . . . . . . . A . 3 ASP H . . . . . . . . . c30225_5ug3 1 . 6 . 1476 . 1 1 3 ASP HA H -5.554 -1.012 -0.148 . . . 1.0 . . . . . . . . . . . . A . 3 ASP HA . . . . . . . . . c30225_5ug3 1 . 6 . 1477 . 1 1 3 ASP HB2 H -7.963 -1.571 -0.458 . . . 1.0 . . . . . . . . . . . . A . 3 ASP HB2 . . . . . . . . . c30225_5ug3 1 . 6 . 1478 . 1 1 3 ASP HB3 H -8.336 0.145 -0.366 . . . 1.0 . . . . . . . . . . . . A . 3 ASP HB3 . . . . . . . . . c30225_5ug3 1 . 6 . 1479 . 1 1 3 ASP N N -6.599 -0.634 1.581 . . . 1.0 . . . . . . . . . . . . A . 3 ASP N . . . . . . . . . c30225_5ug3 1 . 6 . 1480 . 1 1 3 ASP O O -5.281 1.465 -1.017 . . . 1.0 . . . . . . . . . . . . A . 3 ASP O . . . . . . . . . c30225_5ug3 1 . 6 . 1481 . 1 1 3 ASP OD1 O -7.662 0.623 -2.708 . . . 1.0 . . . . . . . . . . . . A . 3 ASP OD1 . . . . . . . . . c30225_5ug3 1 . 6 . 1482 . 1 1 3 ASP OD2 O -6.835 -1.408 -2.764 . . . 1.0 . . . . . . . . . . . . A . 3 ASP OD2 . . . . . . . . . c30225_5ug3 1 . 6 . 1483 . 1 1 4 GLU C C -4.110 3.375 1.057 . . . 1.0 . . . . . . . . . . . . A . 4 GLU C . . . . . . . . . c30225_5ug3 1 . 6 . 1484 . 1 1 4 GLU CA C -5.627 3.231 1.120 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CA . . . . . . . . . c30225_5ug3 1 . 6 . 1485 . 1 1 4 GLU CB C -6.155 3.872 2.405 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CB . . . . . . . . . c30225_5ug3 1 . 6 . 1486 . 1 1 4 GLU CD C -6.245 3.780 4.928 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CD . . . . . . . . . c30225_5ug3 1 . 6 . 1487 . 1 1 4 GLU CG C -5.689 3.161 3.668 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CG . . . . . . . . . c30225_5ug3 1 . 6 . 1488 . 1 1 4 GLU H H -6.447 1.424 1.847 . . . 1.0 . . . . . . . . . . . . A . 4 GLU H . . . . . . . . . c30225_5ug3 1 . 6 . 1489 . 1 1 4 GLU HA H -6.064 3.732 0.272 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HA . . . . . . . . . c30225_5ug3 1 . 6 . 1490 . 1 1 4 GLU HB2 H -5.816 4.896 2.449 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HB2 . . . . . . . . . c30225_5ug3 1 . 6 . 1491 . 1 1 4 GLU HB3 H -7.234 3.858 2.387 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HB3 . . . . . . . . . c30225_5ug3 1 . 6 . 1492 . 1 1 4 GLU HG2 H -6.008 2.131 3.622 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HG2 . . . . . . . . . c30225_5ug3 1 . 6 . 1493 . 1 1 4 GLU HG3 H -4.610 3.200 3.710 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HG3 . . . . . . . . . c30225_5ug3 1 . 6 . 1494 . 1 1 4 GLU N N -6.020 1.832 1.067 . . . 1.0 . . . . . . . . . . . . A . 4 GLU N . . . . . . . . . c30225_5ug3 1 . 6 . 1495 . 1 1 4 GLU O O -3.591 4.363 0.535 . . . 1.0 . . . . . . . . . . . . A . 4 GLU O . . . . . . . . . c30225_5ug3 1 . 6 . 1496 . 1 1 4 GLU OE1 O -5.656 4.757 5.421 . . . 1.0 . . . . . . . . . . . . A . 4 GLU OE1 . . . . . . . . . c30225_5ug3 1 . 6 . 1497 . 1 1 4 GLU OE2 O -7.283 3.298 5.426 . . . 1.0 . . . . . . . . . . . . A . 4 GLU OE2 . . . . . . . . . c30225_5ug3 1 . 6 . 1498 . 1 1 5 CYS C C -1.278 2.479 0.322 . . . 1.0 . . . . . . . . . . . . A . 5 CYS C . . . . . . . . . c30225_5ug3 1 . 6 . 1499 . 1 1 5 CYS CA C -1.957 2.435 1.690 . . . 1.0 . . . . . . . . . . . . A . 5 CYS CA . . . . . . . . . c30225_5ug3 1 . 6 . 1500 . 1 1 5 CYS CB C -1.452 1.244 2.507 . . . 1.0 . . . . . . . . . . . . A . 5 CYS CB . . . . . . . . . c30225_5ug3 1 . 6 . 1501 . 1 1 5 CYS H H -3.868 1.561 1.863 . . . 1.0 . . . . . . . . . . . . A . 5 CYS H . . . . . . . . . c30225_5ug3 1 . 6 . 1502 . 1 1 5 CYS HA H -1.716 3.343 2.221 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HA . . . . . . . . . c30225_5ug3 1 . 6 . 1503 . 1 1 5 CYS HB2 H -0.767 1.600 3.255 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HB2 . . . . . . . . . c30225_5ug3 1 . 6 . 1504 . 1 1 5 CYS HB3 H -2.294 0.775 2.994 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HB3 . . . . . . . . . c30225_5ug3 1 . 6 . 1505 . 1 1 5 CYS N N -3.403 2.371 1.565 . . . 1.0 . . . . . . . . . . . . A . 5 CYS N . . . . . . . . . c30225_5ug3 1 . 6 . 1506 . 1 1 5 CYS O O -0.117 2.861 0.211 . . . 1.0 . . . . . . . . . . . . A . 5 CYS O . . . . . . . . . c30225_5ug3 1 . 6 . 1507 . 1 1 5 CYS SG S -0.592 -0.036 1.539 . . . 1.0 . . . . . . . . . . . . A . 5 CYS SG . . . . . . . . . c30225_5ug3 1 . 6 . 1508 . 1 1 6 CYS C C -1.135 3.569 -2.487 . . . 1.0 . . . . . . . . . . . . A . 6 CYS C . . . . . . . . . c30225_5ug3 1 . 6 . 1509 . 1 1 6 CYS CA C -1.505 2.148 -2.077 . . . 1.0 . . . . . . . . . . . . A . 6 CYS CA . . . . . . . . . c30225_5ug3 1 . 6 . 1510 . 1 1 6 CYS CB C -2.570 1.608 -3.019 . . . 1.0 . . . . . . . . . . . . A . 6 CYS CB . . . . . . . . . c30225_5ug3 1 . 6 . 1511 . 1 1 6 CYS H H -2.922 1.778 -0.568 . . . 1.0 . . . . . . . . . . . . A . 6 CYS H . . . . . . . . . c30225_5ug3 1 . 6 . 1512 . 1 1 6 CYS HA H -0.625 1.523 -2.133 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HA . . . . . . . . . c30225_5ug3 1 . 6 . 1513 . 1 1 6 CYS HB2 H -3.454 2.219 -2.919 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HB2 . . . . . . . . . c30225_5ug3 1 . 6 . 1514 . 1 1 6 CYS HB3 H -2.207 1.667 -4.028 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HB3 . . . . . . . . . c30225_5ug3 1 . 6 . 1515 . 1 1 6 CYS N N -2.011 2.104 -0.717 . . . 1.0 . . . . . . . . . . . . A . 6 CYS N . . . . . . . . . c30225_5ug3 1 . 6 . 1516 . 1 1 6 CYS O O -0.168 3.780 -3.209 . . . 1.0 . . . . . . . . . . . . A . 6 CYS O . . . . . . . . . c30225_5ug3 1 . 6 . 1517 . 1 1 6 CYS SG S -3.051 -0.119 -2.697 . . . 1.0 . . . . . . . . . . . . A . 6 CYS SG . . . . . . . . . c30225_5ug3 1 . 6 . 1518 . 1 1 7 SER C C -0.577 6.511 -1.436 . . . 1.0 . . . . . . . . . . . . A . 7 SER C . . . . . . . . . c30225_5ug3 1 . 6 . 1519 . 1 1 7 SER CA C -1.654 5.938 -2.352 . . . 1.0 . . . . . . . . . . . . A . 7 SER CA . . . . . . . . . c30225_5ug3 1 . 6 . 1520 . 1 1 7 SER CB C -2.951 6.747 -2.232 . . . 1.0 . . . . . . . . . . . . A . 7 SER CB . . . . . . . . . c30225_5ug3 1 . 6 . 1521 . 1 1 7 SER H H -2.643 4.320 -1.411 . . . 1.0 . . . . . . . . . . . . A . 7 SER H . . . . . . . . . c30225_5ug3 1 . 6 . 1522 . 1 1 7 SER HA H -1.304 5.976 -3.373 . . . 1.0 . . . . . . . . . . . . A . 7 SER HA . . . . . . . . . c30225_5ug3 1 . 6 . 1523 . 1 1 7 SER HB2 H -3.736 6.243 -2.775 . . . 1.0 . . . . . . . . . . . . A . 7 SER HB2 . . . . . . . . . c30225_5ug3 1 . 6 . 1524 . 1 1 7 SER HB3 H -3.228 6.824 -1.190 . . . 1.0 . . . . . . . . . . . . A . 7 SER HB3 . . . . . . . . . c30225_5ug3 1 . 6 . 1525 . 1 1 7 SER HG H -2.600 7.991 -3.708 . . . 1.0 . . . . . . . . . . . . A . 7 SER HG . . . . . . . . . c30225_5ug3 1 . 6 . 1526 . 1 1 7 SER N N -1.899 4.544 -2.011 . . . 1.0 . . . . . . . . . . . . A . 7 SER N . . . . . . . . . c30225_5ug3 1 . 6 . 1527 . 1 1 7 SER O O -0.104 7.633 -1.622 . . . 1.0 . . . . . . . . . . . . A . 7 SER O . . . . . . . . . c30225_5ug3 1 . 6 . 1528 . 1 1 7 SER OG O -2.798 8.052 -2.764 . . . 1.0 . . . . . . . . . . . . A . 7 SER OG . . . . . . . . . c30225_5ug3 1 . 6 . 1529 . 1 1 8 ASN C C 2.151 5.489 0.128 . . . 1.0 . . . . . . . . . . . . A . 8 ASN C . . . . . . . . . c30225_5ug3 1 . 6 . 1530 . 1 1 8 ASN CA C 0.820 6.092 0.512 . . . 1.0 . . . . . . . . . . . . A . 8 ASN CA . . . . . . . . . c30225_5ug3 1 . 6 . 1531 . 1 1 8 ASN CB C 0.440 5.579 1.893 . . . 1.0 . . . . . . . . . . . . A . 8 ASN CB . . . . . . . . . c30225_5ug3 1 . 6 . 1532 . 1 1 8 ASN CG C -0.765 6.287 2.480 . . . 1.0 . . . . . . . . . . . . A . 8 ASN CG . . . . . . . . . c30225_5ug3 1 . 6 . 1533 . 1 1 8 ASN H H -0.574 4.811 -0.409 . . . 1.0 . . . . . . . . . . . . A . 8 ASN H . . . . . . . . . c30225_5ug3 1 . 6 . 1534 . 1 1 8 ASN HA H 0.895 7.167 0.530 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HA . . . . . . . . . c30225_5ug3 1 . 6 . 1535 . 1 1 8 ASN HB2 H 0.221 4.527 1.810 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HB2 . . . . . . . . . c30225_5ug3 1 . 6 . 1536 . 1 1 8 ASN HB3 H 1.279 5.713 2.562 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HB3 . . . . . . . . . c30225_5ug3 1 . 6 . 1537 . 1 1 8 ASN HD21 H -2.002 5.082 1.492 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HD21 . . . . . . . . . c30225_5ug3 1 . 6 . 1538 . 1 1 8 ASN HD22 H -2.747 6.272 2.503 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HD22 . . . . . . . . . c30225_5ug3 1 . 6 . 1539 . 1 1 8 ASN N N -0.187 5.710 -0.461 . . . 1.0 . . . . . . . . . . . . A . 8 ASN N . . . . . . . . . c30225_5ug3 1 . 6 . 1540 . 1 1 8 ASN ND2 N -1.955 5.838 2.120 . . . 1.0 . . . . . . . . . . . . A . 8 ASN ND2 . . . . . . . . . c30225_5ug3 1 . 6 . 1541 . 1 1 8 ASN O O 2.352 4.281 0.275 . . . 1.0 . . . . . . . . . . . . A . 8 ASN O . . . . . . . . . c30225_5ug3 1 . 6 . 1542 . 1 1 8 ASN OD1 O -0.627 7.249 3.234 . . . 1.0 . . . . . . . . . . . . A . 8 ASN OD1 . . . . . . . . . c30225_5ug3 1 . 6 . 1543 . 1 1 9 PRO C C 5.155 5.106 0.316 . . . 1.0 . . . . . . . . . . . . A . 9 PRO C . . . . . . . . . c30225_5ug3 1 . 6 . 1544 . 1 1 9 PRO CA C 4.379 5.797 -0.798 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CA . . . . . . . . . c30225_5ug3 1 . 6 . 1545 . 1 1 9 PRO CB C 5.113 7.051 -1.286 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CB . . . . . . . . . c30225_5ug3 1 . 6 . 1546 . 1 1 9 PRO CD C 2.978 7.758 -0.522 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CD . . . . . . . . . c30225_5ug3 1 . 6 . 1547 . 1 1 9 PRO CG C 4.409 8.188 -0.636 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CG . . . . . . . . . c30225_5ug3 1 . 6 . 1548 . 1 1 9 PRO HA H 4.255 5.105 -1.614 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HA . . . . . . . . . c30225_5ug3 1 . 6 . 1549 . 1 1 9 PRO HB2 H 6.150 7.005 -0.989 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HB2 . . . . . . . . . c30225_5ug3 1 . 6 . 1550 . 1 1 9 PRO HB3 H 5.039 7.112 -2.357 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HB3 . . . . . . . . . c30225_5ug3 1 . 6 . 1551 . 1 1 9 PRO HD2 H 2.520 8.213 0.334 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HD2 . . . . . . . . . c30225_5ug3 1 . 6 . 1552 . 1 1 9 PRO HD3 H 2.436 8.003 -1.420 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HD3 . . . . . . . . . c30225_5ug3 1 . 6 . 1553 . 1 1 9 PRO HG2 H 4.827 8.370 0.343 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HG2 . . . . . . . . . c30225_5ug3 1 . 6 . 1554 . 1 1 9 PRO HG3 H 4.488 9.072 -1.252 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HG3 . . . . . . . . . c30225_5ug3 1 . 6 . 1555 . 1 1 9 PRO N N 3.089 6.299 -0.355 . . . 1.0 . . . . . . . . . . . . A . 9 PRO N . . . . . . . . . c30225_5ug3 1 . 6 . 1556 . 1 1 9 PRO O O 6.055 4.321 0.045 . . . 1.0 . . . . . . . . . . . . A . 9 PRO O . . . . . . . . . c30225_5ug3 1 . 6 . 1557 . 1 1 10 VAL C C 5.077 3.318 2.863 . . . 1.0 . . . . . . . . . . . . A . 10 VAL C . . . . . . . . . c30225_5ug3 1 . 6 . 1558 . 1 1 10 VAL CA C 5.465 4.782 2.707 . . . 1.0 . . . . . . . . . . . . A . 10 VAL CA . . . . . . . . . c30225_5ug3 1 . 6 . 1559 . 1 1 10 VAL CB C 5.152 5.553 4.009 . . . 1.0 . . . . . . . . . . . . A . 10 VAL CB . . . . . . . . . c30225_5ug3 1 . 6 . 1560 . 1 1 10 VAL CG1 C 3.800 5.166 4.592 . . . 1.0 . . . . . . . . . . . . A . 10 VAL CG1 . . . . . . . . . c30225_5ug3 1 . 6 . 1561 . 1 1 10 VAL CG2 C 6.263 5.365 5.030 . . . 1.0 . . . . . . . . . . . . A . 10 VAL CG2 . . . . . . . . . c30225_5ug3 1 . 6 . 1562 . 1 1 10 VAL H H 4.003 5.960 1.716 . . . 1.0 . . . . . . . . . . . . A . 10 VAL H . . . . . . . . . c30225_5ug3 1 . 6 . 1563 . 1 1 10 VAL HA H 6.529 4.843 2.520 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HA . . . . . . . . . c30225_5ug3 1 . 6 . 1564 . 1 1 10 VAL HB H 5.102 6.592 3.757 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HB . . . . . . . . . c30225_5ug3 1 . 6 . 1565 . 1 1 10 VAL HG11 H 3.795 4.110 4.818 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HG11 . . . . . . . . . c30225_5ug3 1 . 6 . 1566 . 1 1 10 VAL HG12 H 3.024 5.382 3.875 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HG12 . . . . . . . . . c30225_5ug3 1 . 6 . 1567 . 1 1 10 VAL HG13 H 3.622 5.728 5.495 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HG13 . . . . . . . . . c30225_5ug3 1 . 6 . 1568 . 1 1 10 VAL HG21 H 6.024 5.916 5.927 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HG21 . . . . . . . . . c30225_5ug3 1 . 6 . 1569 . 1 1 10 VAL HG22 H 7.193 5.729 4.621 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HG22 . . . . . . . . . c30225_5ug3 1 . 6 . 1570 . 1 1 10 VAL HG23 H 6.359 4.315 5.269 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HG23 . . . . . . . . . c30225_5ug3 1 . 6 . 1571 . 1 1 10 VAL N N 4.775 5.366 1.563 . . . 1.0 . . . . . . . . . . . . A . 10 VAL N . . . . . . . . . c30225_5ug3 1 . 6 . 1572 . 1 1 10 VAL O O 5.869 2.482 3.301 . . . 1.0 . . . . . . . . . . . . A . 10 VAL O . . . . . . . . . c30225_5ug3 1 . 6 . 1573 . 1 1 11 CYS C C 4.036 0.820 1.433 . . . 1.0 . . . . . . . . . . . . A . 11 CYS C . . . . . . . . . c30225_5ug3 1 . 6 . 1574 . 1 1 11 CYS CA C 3.385 1.639 2.536 . . . 1.0 . . . . . . . . . . . . A . 11 CYS CA . . . . . . . . . c30225_5ug3 1 . 6 . 1575 . 1 1 11 CYS CB C 1.861 1.554 2.414 . . . 1.0 . . . . . . . . . . . . A . 11 CYS CB . . . . . . . . . c30225_5ug3 1 . 6 . 1576 . 1 1 11 CYS H H 3.256 3.727 2.179 . . . 1.0 . . . . . . . . . . . . A . 11 CYS H . . . . . . . . . c30225_5ug3 1 . 6 . 1577 . 1 1 11 CYS HA H 3.681 1.228 3.488 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HA . . . . . . . . . c30225_5ug3 1 . 6 . 1578 . 1 1 11 CYS HB2 H 1.410 2.092 3.235 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HB2 . . . . . . . . . c30225_5ug3 1 . 6 . 1579 . 1 1 11 CYS HB3 H 1.554 2.006 1.482 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HB3 . . . . . . . . . c30225_5ug3 1 . 6 . 1580 . 1 1 11 CYS N N 3.855 3.010 2.484 . . . 1.0 . . . . . . . . . . . . A . 11 CYS N . . . . . . . . . c30225_5ug3 1 . 6 . 1581 . 1 1 11 CYS O O 4.588 -0.246 1.686 . . . 1.0 . . . . . . . . . . . . A . 11 CYS O . . . . . . . . . c30225_5ug3 1 . 6 . 1582 . 1 1 11 CYS SG S 1.221 -0.158 2.443 . . . 1.0 . . . . . . . . . . . . A . 11 CYS SG . . . . . . . . . c30225_5ug3 1 . 6 . 1583 . 1 1 12 ARG C C 5.992 0.489 -1.031 . . . 1.0 . . . . . . . . . . . . A . 12 ARG C . . . . . . . . . c30225_5ug3 1 . 6 . 1584 . 1 1 12 ARG CA C 4.475 0.567 -0.931 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CA . . . . . . . . . c30225_5ug3 1 . 6 . 1585 . 1 1 12 ARG CB C 3.850 1.067 -2.233 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CB . . . . . . . . . c30225_5ug3 1 . 6 . 1586 . 1 1 12 ARG CD C 2.941 3.007 -3.519 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CD . . . . . . . . . c30225_5ug3 1 . 6 . 1587 . 1 1 12 ARG CG C 3.729 2.565 -2.300 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CG . . . . . . . . . c30225_5ug3 1 . 6 . 1588 . 1 1 12 ARG CZ C 2.387 5.104 -4.698 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CZ . . . . . . . . . c30225_5ug3 1 . 6 . 1589 . 1 1 12 ARG H H 3.670 2.248 0.079 . . . 1.0 . . . . . . . . . . . . A . 12 ARG H . . . . . . . . . c30225_5ug3 1 . 6 . 1590 . 1 1 12 ARG HA H 4.129 -0.412 -0.761 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HA . . . . . . . . . c30225_5ug3 1 . 6 . 1591 . 1 1 12 ARG HB2 H 4.461 0.743 -3.059 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HB2 . . . . . . . . . c30225_5ug3 1 . 6 . 1592 . 1 1 12 ARG HB3 H 2.864 0.641 -2.334 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HB3 . . . . . . . . . c30225_5ug3 1 . 6 . 1593 . 1 1 12 ARG HD2 H 3.283 2.449 -4.378 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HD2 . . . . . . . . . c30225_5ug3 1 . 6 . 1594 . 1 1 12 ARG HD3 H 1.897 2.792 -3.340 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HD3 . . . . . . . . . c30225_5ug3 1 . 6 . 1595 . 1 1 12 ARG HE H 3.771 4.919 -3.268 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HE . . . . . . . . . c30225_5ug3 1 . 6 . 1596 . 1 1 12 ARG HG2 H 3.212 2.893 -1.416 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HG2 . . . . . . . . . c30225_5ug3 1 . 6 . 1597 . 1 1 12 ARG HG3 H 4.714 2.999 -2.333 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HG3 . . . . . . . . . c30225_5ug3 1 . 6 . 1598 . 1 1 12 ARG HH11 H 1.285 3.506 -5.268 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH11 . . . . . . . . . c30225_5ug3 1 . 6 . 1599 . 1 1 12 ARG HH12 H 0.935 4.984 -6.105 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH12 . . . . . . . . . c30225_5ug3 1 . 6 . 1600 . 1 1 12 ARG HH21 H 3.312 6.873 -4.358 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH21 . . . . . . . . . c30225_5ug3 1 . 6 . 1601 . 1 1 12 ARG HH22 H 2.073 6.903 -5.570 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH22 . . . . . . . . . c30225_5ug3 1 . 6 . 1602 . 1 1 12 ARG N N 4.013 1.338 0.213 . . . 1.0 . . . . . . . . . . . . A . 12 ARG N . . . . . . . . . c30225_5ug3 1 . 6 . 1603 . 1 1 12 ARG NE N 3.092 4.436 -3.786 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NE . . . . . . . . . c30225_5ug3 1 . 6 . 1604 . 1 1 12 ARG NH1 N 1.461 4.483 -5.413 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NH1 . . . . . . . . . c30225_5ug3 1 . 6 . 1605 . 1 1 12 ARG NH2 N 2.610 6.395 -4.893 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NH2 . . . . . . . . . c30225_5ug3 1 . 6 . 1606 . 1 1 12 ARG O O 6.528 -0.375 -1.723 . . . 1.0 . . . . . . . . . . . . A . 12 ARG O . . . . . . . . . c30225_5ug3 1 . 6 . 1607 . 1 1 13 VAL C C 8.621 0.205 0.602 . . . 1.0 . . . . . . . . . . . . A . 13 VAL C . . . . . . . . . c30225_5ug3 1 . 6 . 1608 . 1 1 13 VAL CA C 8.125 1.338 -0.308 . . . 1.0 . . . . . . . . . . . . A . 13 VAL CA . . . . . . . . . c30225_5ug3 1 . 6 . 1609 . 1 1 13 VAL CB C 8.666 2.686 0.190 . . . 1.0 . . . . . . . . . . . . A . 13 VAL CB . . . . . . . . . c30225_5ug3 1 . 6 . 1610 . 1 1 13 VAL CG1 C 8.180 2.938 1.596 . . . 1.0 . . . . . . . . . . . . A . 13 VAL CG1 . . . . . . . . . c30225_5ug3 1 . 6 . 1611 . 1 1 13 VAL CG2 C 10.175 2.733 0.127 . . . 1.0 . . . . . . . . . . . . A . 13 VAL CG2 . . . . . . . . . c30225_5ug3 1 . 6 . 1612 . 1 1 13 VAL H H 6.215 2.085 0.135 . . . 1.0 . . . . . . . . . . . . A . 13 VAL H . . . . . . . . . c30225_5ug3 1 . 6 . 1613 . 1 1 13 VAL HA H 8.486 1.173 -1.311 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HA . . . . . . . . . c30225_5ug3 1 . 6 . 1614 . 1 1 13 VAL HB H 8.274 3.466 -0.447 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HB . . . . . . . . . c30225_5ug3 1 . 6 . 1615 . 1 1 13 VAL HG11 H 8.359 3.967 1.866 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HG11 . . . . . . . . . c30225_5ug3 1 . 6 . 1616 . 1 1 13 VAL HG12 H 8.703 2.286 2.278 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HG12 . . . . . . . . . c30225_5ug3 1 . 6 . 1617 . 1 1 13 VAL HG13 H 7.114 2.724 1.639 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HG13 . . . . . . . . . c30225_5ug3 1 . 6 . 1618 . 1 1 13 VAL HG21 H 10.517 3.673 0.531 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HG21 . . . . . . . . . c30225_5ug3 1 . 6 . 1619 . 1 1 13 VAL HG22 H 10.493 2.640 -0.898 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HG22 . . . . . . . . . c30225_5ug3 1 . 6 . 1620 . 1 1 13 VAL HG23 H 10.580 1.921 0.708 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HG23 . . . . . . . . . c30225_5ug3 1 . 6 . 1621 . 1 1 13 VAL N N 6.681 1.375 -0.346 . . . 1.0 . . . . . . . . . . . . A . 13 VAL N . . . . . . . . . c30225_5ug3 1 . 6 . 1622 . 1 1 13 VAL O O 9.665 -0.393 0.343 . . . 1.0 . . . . . . . . . . . . A . 13 VAL O . . . . . . . . . c30225_5ug3 1 . 6 . 1623 . 1 1 14 ASN C C 7.570 -2.440 2.423 . . . 1.0 . . . . . . . . . . . . A . 14 ASN C . . . . . . . . . c30225_5ug3 1 . 6 . 1624 . 1 1 14 ASN CA C 8.308 -1.114 2.619 . . . 1.0 . . . . . . . . . . . . A . 14 ASN CA . . . . . . . . . c30225_5ug3 1 . 6 . 1625 . 1 1 14 ASN CB C 8.148 -0.616 4.067 . . . 1.0 . . . . . . . . . . . . A . 14 ASN CB . . . . . . . . . c30225_5ug3 1 . 6 . 1626 . 1 1 14 ASN CG C 6.772 -0.873 4.663 . . . 1.0 . . . . . . . . . . . . A . 14 ASN CG . . . . . . . . . c30225_5ug3 1 . 6 . 1627 . 1 1 14 ASN H H 7.018 0.374 1.809 . . . 1.0 . . . . . . . . . . . . A . 14 ASN H . . . . . . . . . c30225_5ug3 1 . 6 . 1628 . 1 1 14 ASN HA H 9.358 -1.287 2.436 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HA . . . . . . . . . c30225_5ug3 1 . 6 . 1629 . 1 1 14 ASN HB2 H 8.877 -1.111 4.687 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HB2 . . . . . . . . . c30225_5ug3 1 . 6 . 1630 . 1 1 14 ASN HB3 H 8.333 0.449 4.089 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HB3 . . . . . . . . . c30225_5ug3 1 . 6 . 1631 . 1 1 14 ASN HD21 H 6.115 0.893 4.026 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HD21 . . . . . . . . . c30225_5ug3 1 . 6 . 1632 . 1 1 14 ASN HD22 H 4.969 -0.076 4.891 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HD22 . . . . . . . . . c30225_5ug3 1 . 6 . 1633 . 1 1 14 ASN N N 7.868 -0.100 1.662 . . . 1.0 . . . . . . . . . . . . A . 14 ASN N . . . . . . . . . c30225_5ug3 1 . 6 . 1634 . 1 1 14 ASN ND2 N 5.863 0.074 4.512 . . . 1.0 . . . . . . . . . . . . A . 14 ASN ND2 . . . . . . . . . c30225_5ug3 1 . 6 . 1635 . 1 1 14 ASN O O 8.170 -3.508 2.527 . . . 1.0 . . . . . . . . . . . . A . 14 ASN O . . . . . . . . . c30225_5ug3 1 . 6 . 1636 . 1 1 14 ASN OD1 O 6.533 -1.915 5.273 . . . 1.0 . . . . . . . . . . . . A . 14 ASN OD1 . . . . . . . . . c30225_5ug3 1 . 6 . 1637 . 1 1 15 ASN C C 5.830 -4.332 0.722 . . . 1.0 . . . . . . . . . . . . A . 15 ASN C . . . . . . . . . c30225_5ug3 1 . 6 . 1638 . 1 1 15 ASN CA C 5.463 -3.565 1.987 . . . 1.0 . . . . . . . . . . . . A . 15 ASN CA . . . . . . . . . c30225_5ug3 1 . 6 . 1639 . 1 1 15 ASN CB C 3.971 -3.197 1.990 . . . 1.0 . . . . . . . . . . . . A . 15 ASN CB . . . . . . . . . c30225_5ug3 1 . 6 . 1640 . 1 1 15 ASN CG C 3.264 -3.559 0.695 . . . 1.0 . . . . . . . . . . . . A . 15 ASN CG . . . . . . . . . c30225_5ug3 1 . 6 . 1641 . 1 1 15 ASN H H 5.853 -1.502 2.015 . . . 1.0 . . . . . . . . . . . . A . 15 ASN H . . . . . . . . . c30225_5ug3 1 . 6 . 1642 . 1 1 15 ASN HA H 5.663 -4.213 2.839 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HA . . . . . . . . . c30225_5ug3 1 . 6 . 1643 . 1 1 15 ASN HB2 H 3.483 -3.717 2.799 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HB2 . . . . . . . . . c30225_5ug3 1 . 6 . 1644 . 1 1 15 ASN HB3 H 3.874 -2.131 2.146 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HB3 . . . . . . . . . c30225_5ug3 1 . 6 . 1645 . 1 1 15 ASN HD21 H 3.444 -1.712 0.032 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HD21 . . . . . . . . . c30225_5ug3 1 . 6 . 1646 . 1 1 15 ASN HD22 H 2.661 -2.813 -1.039 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HD22 . . . . . . . . . c30225_5ug3 1 . 6 . 1647 . 1 1 15 ASN N N 6.277 -2.373 2.132 . . . 1.0 . . . . . . . . . . . . A . 15 ASN N . . . . . . . . . c30225_5ug3 1 . 6 . 1648 . 1 1 15 ASN ND2 N 3.106 -2.596 -0.191 . . . 1.0 . . . . . . . . . . . . A . 15 ASN ND2 . . . . . . . . . c30225_5ug3 1 . 6 . 1649 . 1 1 15 ASN O O 6.183 -3.753 -0.310 . . . 1.0 . . . . . . . . . . . . A . 15 ASN O . . . . . . . . . c30225_5ug3 1 . 6 . 1650 . 1 1 15 ASN OD1 O 2.850 -4.693 0.503 . . . 1.0 . . . . . . . . . . . . A . 15 ASN OD1 . . . . . . . . . c30225_5ug3 1 . 6 . 1651 . 1 1 16 HYP C C 5.122 -6.500 -1.439 . . . 1.0 . . . . . . . . . . . . A . 16 HYP C . . . . . . . . . c30225_5ug3 1 . 6 . 1652 . 1 1 16 HYP CA C 6.096 -6.574 -0.268 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CA . . . . . . . . . c30225_5ug3 1 . 6 . 1653 . 1 1 16 HYP CB C 6.027 -7.918 0.423 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CB . . . . . . . . . c30225_5ug3 1 . 6 . 1654 . 1 1 16 HYP CD C 5.342 -6.336 2.082 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CD . . . . . . . . . c30225_5ug3 1 . 6 . 1655 . 1 1 16 HYP CG C 5.391 -7.799 1.787 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CG . . . . . . . . . c30225_5ug3 1 . 6 . 1656 . 1 1 16 HYP HA H 7.088 -6.405 -0.629 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HA . . . . . . . . . c30225_5ug3 1 . 6 . 1657 . 1 1 16 HYP HB2 H 7.026 -8.307 0.539 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HB2 . . . . . . . . . c30225_5ug3 1 . 6 . 1658 . 1 1 16 HYP HB3 H 5.447 -8.600 -0.185 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HB3 . . . . . . . . . c30225_5ug3 1 . 6 . 1659 . 1 1 16 HYP HD1 H 6.264 -7.733 3.517 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HD1 . . . . . . . . . c30225_5ug3 1 . 6 . 1660 . 1 1 16 HYP HD22 H 4.351 -6.041 2.367 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HD22 . . . . . . . . . c30225_5ug3 1 . 6 . 1661 . 1 1 16 HYP HD23 H 6.033 -6.105 2.879 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HD23 . . . . . . . . . c30225_5ug3 1 . 6 . 1662 . 1 1 16 HYP HG H 4.406 -8.245 1.789 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HG . . . . . . . . . c30225_5ug3 1 . 6 . 1663 . 1 1 16 HYP N N 5.757 -5.654 0.828 . . . 1.0 . . . . . . . . . . . . A . 16 HYP N . . . . . . . . . c30225_5ug3 1 . 6 . 1664 . 1 1 16 HYP O O 5.405 -5.859 -2.452 . . . 1.0 . . . . . . . . . . . . A . 16 HYP O . . . . . . . . . c30225_5ug3 1 . 6 . 1665 . 1 1 16 HYP OD1 O 6.193 -8.384 2.795 . . . 1.0 . . . . . . . . . . . . A . 16 HYP OD1 . . . . . . . . . c30225_5ug3 1 . 6 . 1666 . 1 1 17 HIS C C 1.566 -7.220 -1.744 . . . 1.0 . . . . . . . . . . . . A . 17 HIS C . . . . . . . . . c30225_5ug3 1 . 6 . 1667 . 1 1 17 HIS CA C 2.964 -7.156 -2.346 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CA . . . . . . . . . c30225_5ug3 1 . 6 . 1668 . 1 1 17 HIS CB C 3.167 -8.333 -3.313 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CB . . . . . . . . . c30225_5ug3 1 . 6 . 1669 . 1 1 17 HIS CD2 C 5.585 -8.619 -4.214 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CD2 . . . . . . . . . c30225_5ug3 1 . 6 . 1670 . 1 1 17 HIS CE1 C 5.384 -7.443 -6.048 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CE1 . . . . . . . . . c30225_5ug3 1 . 6 . 1671 . 1 1 17 HIS CG C 4.313 -8.157 -4.262 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CG . . . . . . . . . c30225_5ug3 1 . 6 . 1672 . 1 1 17 HIS H H 3.811 -7.641 -0.466 . . . 1.0 . . . . . . . . . . . . A . 17 HIS H . . . . . . . . . c30225_5ug3 1 . 6 . 1673 . 1 1 17 HIS HA H 3.059 -6.233 -2.898 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HA . . . . . . . . . c30225_5ug3 1 . 6 . 1674 . 1 1 17 HIS HB2 H 3.348 -9.231 -2.741 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HB2 . . . . . . . . . c30225_5ug3 1 . 6 . 1675 . 1 1 17 HIS HB3 H 2.267 -8.464 -3.898 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HB3 . . . . . . . . . c30225_5ug3 1 . 6 . 1676 . 1 1 17 HIS HD1 H 3.417 -6.959 -5.748 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HD1 . . . . . . . . . c30225_5ug3 1 . 6 . 1677 . 1 1 17 HIS HD2 H 6.013 -9.235 -3.436 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HD2 . . . . . . . . . c30225_5ug3 1 . 6 . 1678 . 1 1 17 HIS HE1 H 5.605 -6.955 -6.985 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HE1 . . . . . . . . . c30225_5ug3 1 . 6 . 1679 . 1 1 17 HIS HE2 H 7.095 -8.497 -5.666 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HE2 . . . . . . . . . c30225_5ug3 1 . 6 . 1680 . 1 1 17 HIS N N 3.979 -7.151 -1.298 . . . 1.0 . . . . . . . . . . . . A . 17 HIS N . . . . . . . . . c30225_5ug3 1 . 6 . 1681 . 1 1 17 HIS ND1 N 4.221 -7.424 -5.424 . . . 1.0 . . . . . . . . . . . . A . 17 HIS ND1 . . . . . . . . . c30225_5ug3 1 . 6 . 1682 . 1 1 17 HIS NE2 N 6.230 -8.162 -5.336 . . . 1.0 . . . . . . . . . . . . A . 17 HIS NE2 . . . . . . . . . c30225_5ug3 1 . 6 . 1683 . 1 1 17 HIS O O 0.738 -8.035 -2.154 . . . 1.0 . . . . . . . . . . . . A . 17 HIS O . . . . . . . . . c30225_5ug3 1 . 6 . 1684 . 1 1 18 VAL C C -0.962 -5.535 -1.085 . . . 1.0 . . . . . . . . . . . . A . 18 VAL C . . . . . . . . . c30225_5ug3 1 . 6 . 1685 . 1 1 18 VAL CA C -0.018 -6.291 -0.159 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CA . . . . . . . . . c30225_5ug3 1 . 6 . 1686 . 1 1 18 VAL CB C 0.012 -5.610 1.231 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CB . . . . . . . . . c30225_5ug3 1 . 6 . 1687 . 1 1 18 VAL CG1 C -1.389 -5.497 1.814 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CG1 . . . . . . . . . c30225_5ug3 1 . 6 . 1688 . 1 1 18 VAL CG2 C 0.917 -6.380 2.180 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CG2 . . . . . . . . . c30225_5ug3 1 . 6 . 1689 . 1 1 18 VAL H H 2.026 -5.764 -0.440 . . . 1.0 . . . . . . . . . . . . A . 18 VAL H . . . . . . . . . c30225_5ug3 1 . 6 . 1690 . 1 1 18 VAL HA H -0.384 -7.301 -0.038 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HA . . . . . . . . . c30225_5ug3 1 . 6 . 1691 . 1 1 18 VAL HB H 0.413 -4.615 1.114 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HB . . . . . . . . . c30225_5ug3 1 . 6 . 1692 . 1 1 18 VAL HG11 H -1.336 -5.028 2.785 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG11 . . . . . . . . . c30225_5ug3 1 . 6 . 1693 . 1 1 18 VAL HG12 H -1.819 -6.482 1.912 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG12 . . . . . . . . . c30225_5ug3 1 . 6 . 1694 . 1 1 18 VAL HG13 H -2.004 -4.898 1.158 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG13 . . . . . . . . . c30225_5ug3 1 . 6 . 1695 . 1 1 18 VAL HG21 H 1.925 -6.380 1.796 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG21 . . . . . . . . . c30225_5ug3 1 . 6 . 1696 . 1 1 18 VAL HG22 H 0.566 -7.395 2.268 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG22 . . . . . . . . . c30225_5ug3 1 . 6 . 1697 . 1 1 18 VAL HG23 H 0.903 -5.909 3.151 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG23 . . . . . . . . . c30225_5ug3 1 . 6 . 1698 . 1 1 18 VAL N N 1.307 -6.366 -0.764 . . . 1.0 . . . . . . . . . . . . A . 18 VAL N . . . . . . . . . c30225_5ug3 1 . 6 . 1699 . 1 1 18 VAL O O -2.110 -5.932 -1.284 . . . 1.0 . . . . . . . . . . . . A . 18 VAL O . . . . . . . . . c30225_5ug3 1 . 6 . 1700 . 1 1 19 CYS C C -0.973 -4.245 -4.044 . . . 1.0 . . . . . . . . . . . . A . 19 CYS C . . . . . . . . . c30225_5ug3 1 . 6 . 1701 . 1 1 19 CYS CA C -1.222 -3.698 -2.643 . . . 1.0 . . . . . . . . . . . . A . 19 CYS CA . . . . . . . . . c30225_5ug3 1 . 6 . 1702 . 1 1 19 CYS CB C -0.858 -2.212 -2.579 . . . 1.0 . . . . . . . . . . . . A . 19 CYS CB . . . . . . . . . c30225_5ug3 1 . 6 . 1703 . 1 1 19 CYS H H 0.460 -4.189 -1.467 . . . 1.0 . . . . . . . . . . . . A . 19 CYS H . . . . . . . . . c30225_5ug3 1 . 6 . 1704 . 1 1 19 CYS HA H -2.268 -3.816 -2.405 . . . 1.0 . . . . . . . . . . . . A . 19 CYS HA . . . . . . . . . c30225_5ug3 1 . 6 . 1705 . 1 1 19 CYS HB2 H -1.102 -1.828 -1.598 . . . 1.0 . . . . . . . . . . . . A . 19 CYS HB2 . . . . . . . . . c30225_5ug3 1 . 6 . 1706 . 1 1 19 CYS HB3 H 0.203 -2.098 -2.752 . . . 1.0 . . . . . . . . . . . . A . 19 CYS HB3 . . . . . . . . . c30225_5ug3 1 . 6 . 1707 . 1 1 19 CYS N N -0.456 -4.464 -1.676 . . . 1.0 . . . . . . . . . . . . A . 19 CYS N . . . . . . . . . c30225_5ug3 1 . 6 . 1708 . 1 1 19 CYS O O -1.843 -4.979 -4.558 . . . 1.0 . . . . . . . . . . . . A . 19 CYS O . . . . . . . . . c30225_5ug3 1 . 6 . 1709 . 1 1 19 CYS OXT O 0.111 -3.972 -4.613 . . . 1.0 . . . . . . . . . . . . A . 19 CYS OXT . . . . . . . . . c30225_5ug3 1 . 6 . 1710 . 1 1 19 CYS SG S -1.733 -1.188 -3.807 . . . 1.0 . . . . . . . . . . . . A . 19 CYS SG . . . . . . . . . c30225_5ug3 1 . 7 . 1711 . 1 1 1 ILE C C -9.149 -0.963 5.126 . . . 1.0 . . . . . . . . . . . . A . 1 ILE C . . . . . . . . . c30225_5ug3 1 . 7 . 1712 . 1 1 1 ILE CA C -10.533 -0.485 5.557 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CA . . . . . . . . . c30225_5ug3 1 . 7 . 1713 . 1 1 1 ILE CB C -10.472 1.014 5.929 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CB . . . . . . . . . c30225_5ug3 1 . 7 . 1714 . 1 1 1 ILE CD1 C -9.477 2.688 7.573 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CD1 . . . . . . . . . c30225_5ug3 1 . 7 . 1715 . 1 1 1 ILE CG1 C -9.647 1.231 7.201 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CG1 . . . . . . . . . c30225_5ug3 1 . 7 . 1716 . 1 1 1 ILE CG2 C -11.880 1.565 6.104 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CG2 . . . . . . . . . c30225_5ug3 1 . 7 . 1717 . 1 1 1 ILE H1 H -11.985 -0.968 6.965 . . . 1.0 . . . . . . . . . . . . A . 1 ILE H1 . . . . . . . . . c30225_5ug3 1 . 7 . 1718 . 1 1 1 ILE H2 H -10.400 -1.237 7.491 . . . 1.0 . . . . . . . . . . . . A . 1 ILE H2 . . . . . . . . . c30225_5ug3 1 . 7 . 1719 . 1 1 1 ILE H3 H -11.117 -2.297 6.386 . . . 1.0 . . . . . . . . . . . . A . 1 ILE H3 . . . . . . . . . c30225_5ug3 1 . 7 . 1720 . 1 1 1 ILE HA H -11.212 -0.597 4.725 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HA . . . . . . . . . c30225_5ug3 1 . 7 . 1721 . 1 1 1 ILE HB H -10.007 1.544 5.111 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HB . . . . . . . . . c30225_5ug3 1 . 7 . 1722 . 1 1 1 ILE HD11 H -10.446 3.135 7.731 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HD11 . . . . . . . . . c30225_5ug3 1 . 7 . 1723 . 1 1 1 ILE HD12 H -8.966 3.207 6.775 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HD12 . . . . . . . . . c30225_5ug3 1 . 7 . 1724 . 1 1 1 ILE HD13 H -8.895 2.762 8.480 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HD13 . . . . . . . . . c30225_5ug3 1 . 7 . 1725 . 1 1 1 ILE HG12 H -10.133 0.734 8.026 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG12 . . . . . . . . . c30225_5ug3 1 . 7 . 1726 . 1 1 1 ILE HG13 H -8.663 0.807 7.061 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG13 . . . . . . . . . c30225_5ug3 1 . 7 . 1727 . 1 1 1 ILE HG21 H -11.827 2.605 6.385 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG21 . . . . . . . . . c30225_5ug3 1 . 7 . 1728 . 1 1 1 ILE HG22 H -12.389 1.009 6.877 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG22 . . . . . . . . . c30225_5ug3 1 . 7 . 1729 . 1 1 1 ILE HG23 H -12.424 1.469 5.177 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG23 . . . . . . . . . c30225_5ug3 1 . 7 . 1730 . 1 1 1 ILE N N -11.044 -1.302 6.677 . . . 1.0 . . . . . . . . . . . . A . 1 ILE N . . . . . . . . . c30225_5ug3 1 . 7 . 1731 . 1 1 1 ILE O O -8.290 -1.248 5.960 . . . 1.0 . . . . . . . . . . . . A . 1 ILE O . . . . . . . . . c30225_5ug3 1 . 7 . 1732 . 1 1 2 ARG C C -7.544 -1.003 1.837 . . . 1.0 . . . . . . . . . . . . A . 2 ARG C . . . . . . . . . c30225_5ug3 1 . 7 . 1733 . 1 1 2 ARG CA C -7.679 -1.499 3.269 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CA . . . . . . . . . c30225_5ug3 1 . 7 . 1734 . 1 1 2 ARG CB C -7.552 -3.026 3.318 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CB . . . . . . . . . c30225_5ug3 1 . 7 . 1735 . 1 1 2 ARG CD C -8.315 -5.259 2.461 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CD . . . . . . . . . c30225_5ug3 1 . 7 . 1736 . 1 1 2 ARG CG C -8.551 -3.759 2.434 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CG . . . . . . . . . c30225_5ug3 1 . 7 . 1737 . 1 1 2 ARG CZ C -9.130 -7.245 1.240 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CZ . . . . . . . . . c30225_5ug3 1 . 7 . 1738 . 1 1 2 ARG H H -9.673 -0.840 3.206 . . . 1.0 . . . . . . . . . . . . A . 2 ARG H . . . . . . . . . c30225_5ug3 1 . 7 . 1739 . 1 1 2 ARG HA H -6.897 -1.059 3.864 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HA . . . . . . . . . c30225_5ug3 1 . 7 . 1740 . 1 1 2 ARG HB2 H -6.557 -3.303 3.004 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB2 . . . . . . . . . c30225_5ug3 1 . 7 . 1741 . 1 1 2 ARG HB3 H -7.702 -3.350 4.336 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB3 . . . . . . . . . c30225_5ug3 1 . 7 . 1742 . 1 1 2 ARG HD2 H -7.318 -5.460 2.100 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD2 . . . . . . . . . c30225_5ug3 1 . 7 . 1743 . 1 1 2 ARG HD3 H -8.407 -5.607 3.479 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD3 . . . . . . . . . c30225_5ug3 1 . 7 . 1744 . 1 1 2 ARG HE H -10.076 -5.484 1.337 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HE . . . . . . . . . c30225_5ug3 1 . 7 . 1745 . 1 1 2 ARG HG2 H -9.549 -3.554 2.789 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG2 . . . . . . . . . c30225_5ug3 1 . 7 . 1746 . 1 1 2 ARG HG3 H -8.447 -3.405 1.419 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG3 . . . . . . . . . c30225_5ug3 1 . 7 . 1747 . 1 1 2 ARG HH11 H -7.356 -7.517 2.188 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH11 . . . . . . . . . c30225_5ug3 1 . 7 . 1748 . 1 1 2 ARG HH12 H -7.956 -8.898 1.323 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH12 . . . . . . . . . c30225_5ug3 1 . 7 . 1749 . 1 1 2 ARG HH21 H -10.865 -7.289 0.194 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH21 . . . . . . . . . c30225_5ug3 1 . 7 . 1750 . 1 1 2 ARG HH22 H -9.952 -8.763 0.185 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH22 . . . . . . . . . c30225_5ug3 1 . 7 . 1751 . 1 1 2 ARG N N -8.948 -1.067 3.822 . . . 1.0 . . . . . . . . . . . . A . 2 ARG N . . . . . . . . . c30225_5ug3 1 . 7 . 1752 . 1 1 2 ARG NE N -9.275 -5.977 1.626 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NE . . . . . . . . . c30225_5ug3 1 . 7 . 1753 . 1 1 2 ARG NH1 N -8.062 -7.942 1.613 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH1 . . . . . . . . . c30225_5ug3 1 . 7 . 1754 . 1 1 2 ARG NH2 N -10.056 -7.811 0.479 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH2 . . . . . . . . . c30225_5ug3 1 . 7 . 1755 . 1 1 2 ARG O O -8.407 -0.269 1.350 . . . 1.0 . . . . . . . . . . . . A . 2 ARG O . . . . . . . . . c30225_5ug3 1 . 7 . 1756 . 1 1 3 ASP C C -6.056 0.531 -0.264 . . . 1.0 . . . . . . . . . . . . A . 3 ASP C . . . . . . . . . c30225_5ug3 1 . 7 . 1757 . 1 1 3 ASP CA C -6.155 -0.991 -0.190 . . . 1.0 . . . . . . . . . . . . A . 3 ASP CA . . . . . . . . . c30225_5ug3 1 . 7 . 1758 . 1 1 3 ASP CB C -7.209 -1.525 -1.166 . . . 1.0 . . . . . . . . . . . . A . 3 ASP CB . . . . . . . . . c30225_5ug3 1 . 7 . 1759 . 1 1 3 ASP CG C -6.747 -1.472 -2.610 . . . 1.0 . . . . . . . . . . . . A . 3 ASP CG . . . . . . . . . c30225_5ug3 1 . 7 . 1760 . 1 1 3 ASP H H -5.836 -2.015 1.629 . . . 1.0 . . . . . . . . . . . . A . 3 ASP H . . . . . . . . . c30225_5ug3 1 . 7 . 1761 . 1 1 3 ASP HA H -5.194 -1.409 -0.450 . . . 1.0 . . . . . . . . . . . . A . 3 ASP HA . . . . . . . . . c30225_5ug3 1 . 7 . 1762 . 1 1 3 ASP HB2 H -7.432 -2.551 -0.917 . . . 1.0 . . . . . . . . . . . . A . 3 ASP HB2 . . . . . . . . . c30225_5ug3 1 . 7 . 1763 . 1 1 3 ASP HB3 H -8.106 -0.935 -1.069 . . . 1.0 . . . . . . . . . . . . A . 3 ASP HB3 . . . . . . . . . c30225_5ug3 1 . 7 . 1764 . 1 1 3 ASP N N -6.460 -1.408 1.179 . . . 1.0 . . . . . . . . . . . . A . 3 ASP N . . . . . . . . . c30225_5ug3 1 . 7 . 1765 . 1 1 3 ASP O O -6.394 1.154 -1.269 . . . 1.0 . . . . . . . . . . . . A . 3 ASP O . . . . . . . . . c30225_5ug3 1 . 7 . 1766 . 1 1 3 ASP OD1 O -7.246 -0.619 -3.375 . . . 1.0 . . . . . . . . . . . . A . 3 ASP OD1 . . . . . . . . . c30225_5ug3 1 . 7 . 1767 . 1 1 3 ASP OD2 O -5.885 -2.292 -2.987 . . . 1.0 . . . . . . . . . . . . A . 3 ASP OD2 . . . . . . . . . c30225_5ug3 1 . 7 . 1768 . 1 1 4 GLU C C -3.984 2.959 0.869 . . . 1.0 . . . . . . . . . . . . A . 4 GLU C . . . . . . . . . c30225_5ug3 1 . 7 . 1769 . 1 1 4 GLU CA C -5.449 2.562 0.918 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CA . . . . . . . . . c30225_5ug3 1 . 7 . 1770 . 1 1 4 GLU CB C -6.078 3.072 2.213 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CB . . . . . . . . . c30225_5ug3 1 . 7 . 1771 . 1 1 4 GLU CD C -5.961 3.167 4.728 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CD . . . . . . . . . c30225_5ug3 1 . 7 . 1772 . 1 1 4 GLU CG C -5.421 2.526 3.470 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CG . . . . . . . . . c30225_5ug3 1 . 7 . 1773 . 1 1 4 GLU H H -5.319 0.563 1.586 . . . 1.0 . . . . . . . . . . . . A . 4 GLU H . . . . . . . . . c30225_5ug3 1 . 7 . 1774 . 1 1 4 GLU HA H -5.962 3.003 0.077 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HA . . . . . . . . . c30225_5ug3 1 . 7 . 1775 . 1 1 4 GLU HB2 H -6.007 4.148 2.235 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HB2 . . . . . . . . . c30225_5ug3 1 . 7 . 1776 . 1 1 4 GLU HB3 H -7.120 2.789 2.228 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HB3 . . . . . . . . . c30225_5ug3 1 . 7 . 1777 . 1 1 4 GLU HG2 H -5.598 1.461 3.521 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HG2 . . . . . . . . . c30225_5ug3 1 . 7 . 1778 . 1 1 4 GLU HG3 H -4.357 2.710 3.416 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HG3 . . . . . . . . . c30225_5ug3 1 . 7 . 1779 . 1 1 4 GLU N N -5.585 1.120 0.823 . . . 1.0 . . . . . . . . . . . . A . 4 GLU N . . . . . . . . . c30225_5ug3 1 . 7 . 1780 . 1 1 4 GLU O O -3.642 4.079 0.503 . . . 1.0 . . . . . . . . . . . . A . 4 GLU O . . . . . . . . . c30225_5ug3 1 . 7 . 1781 . 1 1 4 GLU OE1 O -5.611 4.331 5.006 . . . 1.0 . . . . . . . . . . . . A . 4 GLU OE1 . . . . . . . . . c30225_5ug3 1 . 7 . 1782 . 1 1 4 GLU OE2 O -6.728 2.502 5.453 . . . 1.0 . . . . . . . . . . . . A . 4 GLU OE2 . . . . . . . . . c30225_5ug3 1 . 7 . 1783 . 1 1 5 CYS C C -1.086 2.451 -0.116 . . . 1.0 . . . . . . . . . . . . A . 5 CYS C . . . . . . . . . c30225_5ug3 1 . 7 . 1784 . 1 1 5 CYS CA C -1.693 2.277 1.276 . . . 1.0 . . . . . . . . . . . . A . 5 CYS CA . . . . . . . . . c30225_5ug3 1 . 7 . 1785 . 1 1 5 CYS CB C -0.990 1.167 2.049 . . . 1.0 . . . . . . . . . . . . A . 5 CYS CB . . . . . . . . . c30225_5ug3 1 . 7 . 1786 . 1 1 5 CYS H H -3.444 1.127 1.449 . . . 1.0 . . . . . . . . . . . . A . 5 CYS H . . . . . . . . . c30225_5ug3 1 . 7 . 1787 . 1 1 5 CYS HA H -1.560 3.202 1.817 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HA . . . . . . . . . c30225_5ug3 1 . 7 . 1788 . 1 1 5 CYS HB2 H -1.571 0.262 1.970 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HB2 . . . . . . . . . c30225_5ug3 1 . 7 . 1789 . 1 1 5 CYS HB3 H -0.022 1.000 1.617 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HB3 . . . . . . . . . c30225_5ug3 1 . 7 . 1790 . 1 1 5 CYS N N -3.117 2.023 1.218 . . . 1.0 . . . . . . . . . . . . A . 5 CYS N . . . . . . . . . c30225_5ug3 1 . 7 . 1791 . 1 1 5 CYS O O 0.093 2.765 -0.250 . . . 1.0 . . . . . . . . . . . . A . 5 CYS O . . . . . . . . . c30225_5ug3 1 . 7 . 1792 . 1 1 5 CYS SG S -0.765 1.528 3.826 . . . 1.0 . . . . . . . . . . . . A . 5 CYS SG . . . . . . . . . c30225_5ug3 1 . 7 . 1793 . 1 1 6 CYS C C -1.147 3.953 -2.731 . . . 1.0 . . . . . . . . . . . . A . 6 CYS C . . . . . . . . . c30225_5ug3 1 . 7 . 1794 . 1 1 6 CYS CA C -1.458 2.475 -2.514 . . . 1.0 . . . . . . . . . . . . A . 6 CYS CA . . . . . . . . . c30225_5ug3 1 . 7 . 1795 . 1 1 6 CYS CB C -2.550 2.038 -3.477 . . . 1.0 . . . . . . . . . . . . A . 6 CYS CB . . . . . . . . . c30225_5ug3 1 . 7 . 1796 . 1 1 6 CYS H H -2.794 1.904 -0.993 . . . 1.0 . . . . . . . . . . . . A . 6 CYS H . . . . . . . . . c30225_5ug3 1 . 7 . 1797 . 1 1 6 CYS HA H -0.564 1.896 -2.697 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HA . . . . . . . . . c30225_5ug3 1 . 7 . 1798 . 1 1 6 CYS HB2 H -3.448 2.593 -3.256 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HB2 . . . . . . . . . c30225_5ug3 1 . 7 . 1799 . 1 1 6 CYS HB3 H -2.235 2.257 -4.480 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HB3 . . . . . . . . . c30225_5ug3 1 . 7 . 1800 . 1 1 6 CYS N N -1.887 2.234 -1.149 . . . 1.0 . . . . . . . . . . . . A . 6 CYS N . . . . . . . . . c30225_5ug3 1 . 7 . 1801 . 1 1 6 CYS O O -0.212 4.299 -3.450 . . . 1.0 . . . . . . . . . . . . A . 6 CYS O . . . . . . . . . c30225_5ug3 1 . 7 . 1802 . 1 1 6 CYS SG S -2.953 0.266 -3.391 . . . 1.0 . . . . . . . . . . . . A . 6 CYS SG . . . . . . . . . c30225_5ug3 1 . 7 . 1803 . 1 1 7 SER C C -0.747 6.701 -1.093 . . . 1.0 . . . . . . . . . . . . A . 7 SER C . . . . . . . . . c30225_5ug3 1 . 7 . 1804 . 1 1 7 SER CA C -1.706 6.254 -2.188 . . . 1.0 . . . . . . . . . . . . A . 7 SER CA . . . . . . . . . c30225_5ug3 1 . 7 . 1805 . 1 1 7 SER CB C -3.041 6.992 -2.076 . . . 1.0 . . . . . . . . . . . . A . 7 SER CB . . . . . . . . . c30225_5ug3 1 . 7 . 1806 . 1 1 7 SER H H -2.659 4.485 -1.531 . . . 1.0 . . . . . . . . . . . . A . 7 SER H . . . . . . . . . c30225_5ug3 1 . 7 . 1807 . 1 1 7 SER HA H -1.264 6.462 -3.150 . . . 1.0 . . . . . . . . . . . . A . 7 SER HA . . . . . . . . . c30225_5ug3 1 . 7 . 1808 . 1 1 7 SER HB2 H -2.859 8.030 -1.837 . . . 1.0 . . . . . . . . . . . . A . 7 SER HB2 . . . . . . . . . c30225_5ug3 1 . 7 . 1809 . 1 1 7 SER HB3 H -3.568 6.926 -3.016 . . . 1.0 . . . . . . . . . . . . A . 7 SER HB3 . . . . . . . . . c30225_5ug3 1 . 7 . 1810 . 1 1 7 SER HG H -4.143 7.115 -0.452 . . . 1.0 . . . . . . . . . . . . A . 7 SER HG . . . . . . . . . c30225_5ug3 1 . 7 . 1811 . 1 1 7 SER N N -1.923 4.818 -2.092 . . . 1.0 . . . . . . . . . . . . A . 7 SER N . . . . . . . . . c30225_5ug3 1 . 7 . 1812 . 1 1 7 SER O O -0.501 7.888 -0.899 . . . 1.0 . . . . . . . . . . . . A . 7 SER O . . . . . . . . . c30225_5ug3 1 . 7 . 1813 . 1 1 7 SER OG O -3.848 6.423 -1.058 . . . 1.0 . . . . . . . . . . . . A . 7 SER OG . . . . . . . . . c30225_5ug3 1 . 7 . 1814 . 1 1 8 ASN C C 2.068 5.386 0.317 . . . 1.0 . . . . . . . . . . . . A . 8 ASN C . . . . . . . . . c30225_5ug3 1 . 7 . 1815 . 1 1 8 ASN CA C 0.721 5.957 0.705 . . . 1.0 . . . . . . . . . . . . A . 8 ASN CA . . . . . . . . . c30225_5ug3 1 . 7 . 1816 . 1 1 8 ASN CB C 0.261 5.273 1.996 . . . 1.0 . . . . . . . . . . . . A . 8 ASN CB . . . . . . . . . c30225_5ug3 1 . 7 . 1817 . 1 1 8 ASN CG C -1.051 5.800 2.559 . . . 1.0 . . . . . . . . . . . . A . 8 ASN CG . . . . . . . . . c30225_5ug3 1 . 7 . 1818 . 1 1 8 ASN H H -0.454 4.794 -0.603 . . . 1.0 . . . . . . . . . . . . A . 8 ASN H . . . . . . . . . c30225_5ug3 1 . 7 . 1819 . 1 1 8 ASN HA H 0.807 7.021 0.864 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HA . . . . . . . . . c30225_5ug3 1 . 7 . 1820 . 1 1 8 ASN HB2 H 0.139 4.222 1.786 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HB2 . . . . . . . . . c30225_5ug3 1 . 7 . 1821 . 1 1 8 ASN HB3 H 1.030 5.391 2.747 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HB3 . . . . . . . . . c30225_5ug3 1 . 7 . 1822 . 1 1 8 ASN HD21 H -1.838 5.913 0.742 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HD21 . . . . . . . . . c30225_5ug3 1 . 7 . 1823 . 1 1 8 ASN HD22 H -2.868 6.409 2.042 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HD22 . . . . . . . . . c30225_5ug3 1 . 7 . 1824 . 1 1 8 ASN N N -0.218 5.719 -0.380 . . . 1.0 . . . . . . . . . . . . A . 8 ASN N . . . . . . . . . c30225_5ug3 1 . 7 . 1825 . 1 1 8 ASN ND2 N -2.014 6.068 1.697 . . . 1.0 . . . . . . . . . . . . A . 8 ASN ND2 . . . . . . . . . c30225_5ug3 1 . 7 . 1826 . 1 1 8 ASN O O 2.339 4.211 0.572 . . . 1.0 . . . . . . . . . . . . A . 8 ASN O . . . . . . . . . c30225_5ug3 1 . 7 . 1827 . 1 1 8 ASN OD1 O -1.210 5.919 3.773 . . . 1.0 . . . . . . . . . . . . A . 8 ASN OD1 . . . . . . . . . c30225_5ug3 1 . 7 . 1828 . 1 1 9 PRO C C 5.034 4.987 0.233 . . . 1.0 . . . . . . . . . . . . A . 9 PRO C . . . . . . . . . c30225_5ug3 1 . 7 . 1829 . 1 1 9 PRO CA C 4.209 5.706 -0.824 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CA . . . . . . . . . c30225_5ug3 1 . 7 . 1830 . 1 1 9 PRO CB C 4.913 6.982 -1.293 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CB . . . . . . . . . c30225_5ug3 1 . 7 . 1831 . 1 1 9 PRO CD C 2.758 7.633 -0.534 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CD . . . . . . . . . c30225_5ug3 1 . 7 . 1832 . 1 1 9 PRO CG C 3.813 7.946 -1.552 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CG . . . . . . . . . c30225_5ug3 1 . 7 . 1833 . 1 1 9 PRO HA H 4.053 5.039 -1.661 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HA . . . . . . . . . c30225_5ug3 1 . 7 . 1834 . 1 1 9 PRO HB2 H 5.567 7.337 -0.515 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HB2 . . . . . . . . . c30225_5ug3 1 . 7 . 1835 . 1 1 9 PRO HB3 H 5.481 6.778 -2.189 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HB3 . . . . . . . . . c30225_5ug3 1 . 7 . 1836 . 1 1 9 PRO HD2 H 2.926 8.196 0.373 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HD2 . . . . . . . . . c30225_5ug3 1 . 7 . 1837 . 1 1 9 PRO HD3 H 1.781 7.840 -0.932 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HD3 . . . . . . . . . c30225_5ug3 1 . 7 . 1838 . 1 1 9 PRO HG2 H 4.172 8.958 -1.425 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HG2 . . . . . . . . . c30225_5ug3 1 . 7 . 1839 . 1 1 9 PRO HG3 H 3.426 7.807 -2.549 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HG3 . . . . . . . . . c30225_5ug3 1 . 7 . 1840 . 1 1 9 PRO N N 2.935 6.190 -0.301 . . . 1.0 . . . . . . . . . . . . A . 9 PRO N . . . . . . . . . c30225_5ug3 1 . 7 . 1841 . 1 1 9 PRO O O 5.801 4.089 -0.081 . . . 1.0 . . . . . . . . . . . . A . 9 PRO O . . . . . . . . . c30225_5ug3 1 . 7 . 1842 . 1 1 10 VAL C C 5.236 3.236 2.661 . . . 1.0 . . . . . . . . . . . . A . 10 VAL C . . . . . . . . . c30225_5ug3 1 . 7 . 1843 . 1 1 10 VAL CA C 5.564 4.724 2.581 . . . 1.0 . . . . . . . . . . . . A . 10 VAL CA . . . . . . . . . c30225_5ug3 1 . 7 . 1844 . 1 1 10 VAL CB C 5.251 5.400 3.934 . . . 1.0 . . . . . . . . . . . . A . 10 VAL CB . . . . . . . . . c30225_5ug3 1 . 7 . 1845 . 1 1 10 VAL CG1 C 5.871 4.624 5.088 . . . 1.0 . . . . . . . . . . . . A . 10 VAL CG1 . . . . . . . . . c30225_5ug3 1 . 7 . 1846 . 1 1 10 VAL CG2 C 5.745 6.839 3.936 . . . 1.0 . . . . . . . . . . . . A . 10 VAL CG2 . . . . . . . . . c30225_5ug3 1 . 7 . 1847 . 1 1 10 VAL H H 4.145 6.025 1.687 . . . 1.0 . . . . . . . . . . . . A . 10 VAL H . . . . . . . . . c30225_5ug3 1 . 7 . 1848 . 1 1 10 VAL HA H 6.622 4.836 2.376 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HA . . . . . . . . . c30225_5ug3 1 . 7 . 1849 . 1 1 10 VAL HB H 4.180 5.410 4.070 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HB . . . . . . . . . c30225_5ug3 1 . 7 . 1850 . 1 1 10 VAL HG11 H 5.455 3.628 5.116 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HG11 . . . . . . . . . c30225_5ug3 1 . 7 . 1851 . 1 1 10 VAL HG12 H 5.657 5.131 6.018 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HG12 . . . . . . . . . c30225_5ug3 1 . 7 . 1852 . 1 1 10 VAL HG13 H 6.939 4.565 4.949 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HG13 . . . . . . . . . c30225_5ug3 1 . 7 . 1853 . 1 1 10 VAL HG21 H 5.273 7.382 3.131 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HG21 . . . . . . . . . c30225_5ug3 1 . 7 . 1854 . 1 1 10 VAL HG22 H 6.814 6.854 3.800 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HG22 . . . . . . . . . c30225_5ug3 1 . 7 . 1855 . 1 1 10 VAL HG23 H 5.495 7.304 4.877 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HG23 . . . . . . . . . c30225_5ug3 1 . 7 . 1856 . 1 1 10 VAL N N 4.828 5.345 1.490 . . . 1.0 . . . . . . . . . . . . A . 10 VAL N . . . . . . . . . c30225_5ug3 1 . 7 . 1857 . 1 1 10 VAL O O 6.136 2.397 2.739 . . . 1.0 . . . . . . . . . . . . A . 10 VAL O . . . . . . . . . c30225_5ug3 1 . 7 . 1858 . 1 1 11 CYS C C 4.048 0.711 1.538 . . . 1.0 . . . . . . . . . . . . A . 11 CYS C . . . . . . . . . c30225_5ug3 1 . 7 . 1859 . 1 1 11 CYS CA C 3.487 1.546 2.679 . . . 1.0 . . . . . . . . . . . . A . 11 CYS CA . . . . . . . . . c30225_5ug3 1 . 7 . 1860 . 1 1 11 CYS CB C 1.969 1.504 2.590 . . . 1.0 . . . . . . . . . . . . A . 11 CYS CB . . . . . . . . . c30225_5ug3 1 . 7 . 1861 . 1 1 11 CYS H H 3.284 3.629 2.502 . . . 1.0 . . . . . . . . . . . . A . 11 CYS H . . . . . . . . . c30225_5ug3 1 . 7 . 1862 . 1 1 11 CYS HA H 3.800 1.129 3.622 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HA . . . . . . . . . c30225_5ug3 1 . 7 . 1863 . 1 1 11 CYS HB2 H 1.669 1.935 1.648 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HB2 . . . . . . . . . c30225_5ug3 1 . 7 . 1864 . 1 1 11 CYS HB3 H 1.656 0.479 2.618 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HB3 . . . . . . . . . c30225_5ug3 1 . 7 . 1865 . 1 1 11 CYS N N 3.949 2.918 2.605 . . . 1.0 . . . . . . . . . . . . A . 11 CYS N . . . . . . . . . c30225_5ug3 1 . 7 . 1866 . 1 1 11 CYS O O 4.717 -0.296 1.759 . . . 1.0 . . . . . . . . . . . . A . 11 CYS O . . . . . . . . . c30225_5ug3 1 . 7 . 1867 . 1 1 11 CYS SG S 1.074 2.392 3.898 . . . 1.0 . . . . . . . . . . . . A . 11 CYS SG . . . . . . . . . c30225_5ug3 1 . 7 . 1868 . 1 1 12 ARG C C 5.594 0.179 -1.072 . . . 1.0 . . . . . . . . . . . . A . 12 ARG C . . . . . . . . . c30225_5ug3 1 . 7 . 1869 . 1 1 12 ARG CA C 4.100 0.379 -0.878 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CA . . . . . . . . . c30225_5ug3 1 . 7 . 1870 . 1 1 12 ARG CB C 3.450 0.983 -2.122 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CB . . . . . . . . . c30225_5ug3 1 . 7 . 1871 . 1 1 12 ARG CD C 2.709 3.040 -3.331 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CD . . . . . . . . . c30225_5ug3 1 . 7 . 1872 . 1 1 12 ARG CG C 3.546 2.480 -2.192 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CG . . . . . . . . . c30225_5ug3 1 . 7 . 1873 . 1 1 12 ARG CZ C 2.102 2.376 -5.636 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CZ . . . . . . . . . c30225_5ug3 1 . 7 . 1874 . 1 1 12 ARG H H 3.361 2.038 0.215 . . . 1.0 . . . . . . . . . . . . A . 12 ARG H . . . . . . . . . c30225_5ug3 1 . 7 . 1875 . 1 1 12 ARG HA H 3.676 -0.570 -0.729 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HA . . . . . . . . . c30225_5ug3 1 . 7 . 1876 . 1 1 12 ARG HB2 H 3.933 0.583 -2.995 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HB2 . . . . . . . . . c30225_5ug3 1 . 7 . 1877 . 1 1 12 ARG HB3 H 2.405 0.709 -2.139 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HB3 . . . . . . . . . c30225_5ug3 1 . 7 . 1878 . 1 1 12 ARG HD2 H 1.667 2.969 -3.061 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HD2 . . . . . . . . . c30225_5ug3 1 . 7 . 1879 . 1 1 12 ARG HD3 H 2.972 4.078 -3.476 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HD3 . . . . . . . . . c30225_5ug3 1 . 7 . 1880 . 1 1 12 ARG HE H 3.725 1.748 -4.643 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HE . . . . . . . . . c30225_5ug3 1 . 7 . 1881 . 1 1 12 ARG HG2 H 3.180 2.874 -1.262 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HG2 . . . . . . . . . c30225_5ug3 1 . 7 . 1882 . 1 1 12 ARG HG3 H 4.577 2.761 -2.330 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HG3 . . . . . . . . . c30225_5ug3 1 . 7 . 1883 . 1 1 12 ARG HH11 H 0.811 3.693 -4.778 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH11 . . . . . . . . . c30225_5ug3 1 . 7 . 1884 . 1 1 12 ARG HH12 H 0.404 3.192 -6.389 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH12 . . . . . . . . . c30225_5ug3 1 . 7 . 1885 . 1 1 12 ARG HH21 H 3.180 1.084 -6.769 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH21 . . . . . . . . . c30225_5ug3 1 . 7 . 1886 . 1 1 12 ARG HH22 H 1.747 1.710 -7.518 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH22 . . . . . . . . . c30225_5ug3 1 . 7 . 1887 . 1 1 12 ARG N N 3.783 1.159 0.315 . . . 1.0 . . . . . . . . . . . . A . 12 ARG N . . . . . . . . . c30225_5ug3 1 . 7 . 1888 . 1 1 12 ARG NE N 2.925 2.316 -4.585 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NE . . . . . . . . . c30225_5ug3 1 . 7 . 1889 . 1 1 12 ARG NH1 N 1.019 3.147 -5.598 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NH1 . . . . . . . . . c30225_5ug3 1 . 7 . 1890 . 1 1 12 ARG NH2 N 2.364 1.667 -6.728 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NH2 . . . . . . . . . c30225_5ug3 1 . 7 . 1891 . 1 1 12 ARG O O 6.016 -0.705 -1.817 . . . 1.0 . . . . . . . . . . . . A . 12 ARG O . . . . . . . . . c30225_5ug3 1 . 7 . 1892 . 1 1 13 VAL C C 8.409 -0.029 0.547 . . . 1.0 . . . . . . . . . . . . A . 13 VAL C . . . . . . . . . c30225_5ug3 1 . 7 . 1893 . 1 1 13 VAL CA C 7.816 0.910 -0.503 . . . 1.0 . . . . . . . . . . . . A . 13 VAL CA . . . . . . . . . c30225_5ug3 1 . 7 . 1894 . 1 1 13 VAL CB C 8.405 2.315 -0.410 . . . 1.0 . . . . . . . . . . . . A . 13 VAL CB . . . . . . . . . c30225_5ug3 1 . 7 . 1895 . 1 1 13 VAL CG1 C 9.909 2.282 -0.253 . . . 1.0 . . . . . . . . . . . . A . 13 VAL CG1 . . . . . . . . . c30225_5ug3 1 . 7 . 1896 . 1 1 13 VAL CG2 C 7.995 3.073 -1.654 . . . 1.0 . . . . . . . . . . . . A . 13 VAL CG2 . . . . . . . . . c30225_5ug3 1 . 7 . 1897 . 1 1 13 VAL H H 5.991 1.691 0.159 . . . 1.0 . . . . . . . . . . . . A . 13 VAL H . . . . . . . . . c30225_5ug3 1 . 7 . 1898 . 1 1 13 VAL HA H 8.054 0.519 -1.482 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HA . . . . . . . . . c30225_5ug3 1 . 7 . 1899 . 1 1 13 VAL HB H 7.980 2.812 0.448 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HB . . . . . . . . . c30225_5ug3 1 . 7 . 1900 . 1 1 13 VAL HG11 H 10.276 3.290 -0.136 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HG11 . . . . . . . . . c30225_5ug3 1 . 7 . 1901 . 1 1 13 VAL HG12 H 10.353 1.832 -1.127 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HG12 . . . . . . . . . c30225_5ug3 1 . 7 . 1902 . 1 1 13 VAL HG13 H 10.160 1.703 0.622 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HG13 . . . . . . . . . c30225_5ug3 1 . 7 . 1903 . 1 1 13 VAL HG21 H 6.937 2.898 -1.834 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HG21 . . . . . . . . . c30225_5ug3 1 . 7 . 1904 . 1 1 13 VAL HG22 H 8.568 2.722 -2.497 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HG22 . . . . . . . . . c30225_5ug3 1 . 7 . 1905 . 1 1 13 VAL HG23 H 8.166 4.128 -1.510 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HG23 . . . . . . . . . c30225_5ug3 1 . 7 . 1906 . 1 1 13 VAL N N 6.383 0.997 -0.410 . . . 1.0 . . . . . . . . . . . . A . 13 VAL N . . . . . . . . . c30225_5ug3 1 . 7 . 1907 . 1 1 13 VAL O O 9.218 -0.894 0.216 . . . 1.0 . . . . . . . . . . . . A . 13 VAL O . . . . . . . . . c30225_5ug3 1 . 7 . 1908 . 1 1 14 ASN C C 7.956 -2.136 2.783 . . . 1.0 . . . . . . . . . . . . A . 14 ASN C . . . . . . . . . c30225_5ug3 1 . 7 . 1909 . 1 1 14 ASN CA C 8.553 -0.736 2.859 . . . 1.0 . . . . . . . . . . . . A . 14 ASN CA . . . . . . . . . c30225_5ug3 1 . 7 . 1910 . 1 1 14 ASN CB C 8.316 -0.146 4.258 . . . 1.0 . . . . . . . . . . . . A . 14 ASN CB . . . . . . . . . c30225_5ug3 1 . 7 . 1911 . 1 1 14 ASN CG C 6.935 -0.440 4.824 . . . 1.0 . . . . . . . . . . . . A . 14 ASN CG . . . . . . . . . c30225_5ug3 1 . 7 . 1912 . 1 1 14 ASN H H 7.330 0.794 2.025 . . . 1.0 . . . . . . . . . . . . A . 14 ASN H . . . . . . . . . c30225_5ug3 1 . 7 . 1913 . 1 1 14 ASN HA H 9.617 -0.811 2.690 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HA . . . . . . . . . c30225_5ug3 1 . 7 . 1914 . 1 1 14 ASN HB2 H 9.044 -0.565 4.930 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HB2 . . . . . . . . . c30225_5ug3 1 . 7 . 1915 . 1 1 14 ASN HB3 H 8.448 0.926 4.214 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HB3 . . . . . . . . . c30225_5ug3 1 . 7 . 1916 . 1 1 14 ASN HD21 H 6.213 1.240 4.047 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HD21 . . . . . . . . . c30225_5ug3 1 . 7 . 1917 . 1 1 14 ASN HD22 H 5.090 0.270 4.936 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HD22 . . . . . . . . . c30225_5ug3 1 . 7 . 1918 . 1 1 14 ASN N N 8.001 0.113 1.804 . . . 1.0 . . . . . . . . . . . . A . 14 ASN N . . . . . . . . . c30225_5ug3 1 . 7 . 1919 . 1 1 14 ASN ND2 N 5.984 0.443 4.578 . . . 1.0 . . . . . . . . . . . . A . 14 ASN ND2 . . . . . . . . . c30225_5ug3 1 . 7 . 1920 . 1 1 14 ASN O O 8.572 -3.113 3.215 . . . 1.0 . . . . . . . . . . . . A . 14 ASN O . . . . . . . . . c30225_5ug3 1 . 7 . 1921 . 1 1 14 ASN OD1 O 6.732 -1.453 5.492 . . . 1.0 . . . . . . . . . . . . A . 14 ASN OD1 . . . . . . . . . c30225_5ug3 1 . 7 . 1922 . 1 1 15 ASN C C 5.483 -3.625 0.705 . . . 1.0 . . . . . . . . . . . . A . 15 ASN C . . . . . . . . . c30225_5ug3 1 . 7 . 1923 . 1 1 15 ASN CA C 6.061 -3.481 2.104 . . . 1.0 . . . . . . . . . . . . A . 15 ASN CA . . . . . . . . . c30225_5ug3 1 . 7 . 1924 . 1 1 15 ASN CB C 4.937 -3.564 3.128 . . . 1.0 . . . . . . . . . . . . A . 15 ASN CB . . . . . . . . . c30225_5ug3 1 . 7 . 1925 . 1 1 15 ASN CG C 4.172 -4.875 3.045 . . . 1.0 . . . . . . . . . . . . A . 15 ASN CG . . . . . . . . . c30225_5ug3 1 . 7 . 1926 . 1 1 15 ASN H H 6.352 -1.419 1.848 . . . 1.0 . . . . . . . . . . . . A . 15 ASN H . . . . . . . . . c30225_5ug3 1 . 7 . 1927 . 1 1 15 ASN HA H 6.772 -4.271 2.284 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HA . . . . . . . . . c30225_5ug3 1 . 7 . 1928 . 1 1 15 ASN HB2 H 5.349 -3.466 4.121 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HB2 . . . . . . . . . c30225_5ug3 1 . 7 . 1929 . 1 1 15 ASN HB3 H 4.254 -2.753 2.941 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HB3 . . . . . . . . . c30225_5ug3 1 . 7 . 1930 . 1 1 15 ASN HD21 H 2.491 -3.974 3.603 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HD21 . . . . . . . . . c30225_5ug3 1 . 7 . 1931 . 1 1 15 ASN HD22 H 2.372 -5.672 3.296 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HD22 . . . . . . . . . c30225_5ug3 1 . 7 . 1932 . 1 1 15 ASN N N 6.766 -2.224 2.216 . . . 1.0 . . . . . . . . . . . . A . 15 ASN N . . . . . . . . . c30225_5ug3 1 . 7 . 1933 . 1 1 15 ASN ND2 N 2.884 -4.837 3.345 . . . 1.0 . . . . . . . . . . . . A . 15 ASN ND2 . . . . . . . . . c30225_5ug3 1 . 7 . 1934 . 1 1 15 ASN O O 4.353 -3.218 0.436 . . . 1.0 . . . . . . . . . . . . A . 15 ASN O . . . . . . . . . c30225_5ug3 1 . 7 . 1935 . 1 1 15 ASN OD1 O 4.734 -5.916 2.704 . . . 1.0 . . . . . . . . . . . . A . 15 ASN OD1 . . . . . . . . . c30225_5ug3 1 . 7 . 1936 . 1 1 16 HYP C C 4.914 -5.509 -1.862 . . . 1.0 . . . . . . . . . . . . A . 16 HYP C . . . . . . . . . c30225_5ug3 1 . 7 . 1937 . 1 1 16 HYP CA C 5.873 -4.348 -1.619 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CA . . . . . . . . . c30225_5ug3 1 . 7 . 1938 . 1 1 16 HYP CB C 7.225 -4.599 -2.253 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CB . . . . . . . . . c30225_5ug3 1 . 7 . 1939 . 1 1 16 HYP CD C 7.611 -4.741 0.073 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CD . . . . . . . . . c30225_5ug3 1 . 7 . 1940 . 1 1 16 HYP CG C 8.320 -4.517 -1.215 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CG . . . . . . . . . c30225_5ug3 1 . 7 . 1941 . 1 1 16 HYP HA H 5.449 -3.438 -2.013 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HA . . . . . . . . . c30225_5ug3 1 . 7 . 1942 . 1 1 16 HYP HB2 H 7.409 -3.856 -3.013 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HB2 . . . . . . . . . c30225_5ug3 1 . 7 . 1943 . 1 1 16 HYP HB3 H 7.227 -5.583 -2.703 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HB3 . . . . . . . . . c30225_5ug3 1 . 7 . 1944 . 1 1 16 HYP HD1 H 8.495 -2.821 -0.315 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HD1 . . . . . . . . . c30225_5ug3 1 . 7 . 1945 . 1 1 16 HYP HD22 H 7.579 -5.768 0.310 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HD22 . . . . . . . . . c30225_5ug3 1 . 7 . 1946 . 1 1 16 HYP HD23 H 8.089 -4.185 0.865 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HD23 . . . . . . . . . c30225_5ug3 1 . 7 . 1947 . 1 1 16 HYP HG H 9.099 -5.243 -1.396 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HG . . . . . . . . . c30225_5ug3 1 . 7 . 1948 . 1 1 16 HYP N N 6.260 -4.200 -0.203 . . . 1.0 . . . . . . . . . . . . A . 16 HYP N . . . . . . . . . c30225_5ug3 1 . 7 . 1949 . 1 1 16 HYP O O 5.030 -6.230 -2.853 . . . 1.0 . . . . . . . . . . . . A . 16 HYP O . . . . . . . . . c30225_5ug3 1 . 7 . 1950 . 1 1 16 HYP OD1 O 8.845 -3.212 -1.138 . . . 1.0 . . . . . . . . . . . . A . 16 HYP OD1 . . . . . . . . . c30225_5ug3 1 . 7 . 1951 . 1 1 17 HIS C C 1.609 -6.185 -0.520 . . . 1.0 . . . . . . . . . . . . A . 17 HIS C . . . . . . . . . c30225_5ug3 1 . 7 . 1952 . 1 1 17 HIS CA C 2.925 -6.693 -1.099 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CA . . . . . . . . . c30225_5ug3 1 . 7 . 1953 . 1 1 17 HIS CB C 3.321 -8.013 -0.427 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CB . . . . . . . . . c30225_5ug3 1 . 7 . 1954 . 1 1 17 HIS CD2 C 4.262 -9.239 -2.512 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CD2 . . . . . . . . . c30225_5ug3 1 . 7 . 1955 . 1 1 17 HIS CE1 C 6.090 -10.049 -1.616 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CE1 . . . . . . . . . c30225_5ug3 1 . 7 . 1956 . 1 1 17 HIS CG C 4.294 -8.834 -1.221 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CG . . . . . . . . . c30225_5ug3 1 . 7 . 1957 . 1 1 17 HIS H H 3.974 -5.123 -0.145 . . . 1.0 . . . . . . . . . . . . A . 17 HIS H . . . . . . . . . c30225_5ug3 1 . 7 . 1958 . 1 1 17 HIS HA H 2.789 -6.867 -2.157 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HA . . . . . . . . . c30225_5ug3 1 . 7 . 1959 . 1 1 17 HIS HB2 H 3.774 -7.799 0.530 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HB2 . . . . . . . . . c30225_5ug3 1 . 7 . 1960 . 1 1 17 HIS HB3 H 2.434 -8.609 -0.271 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HB3 . . . . . . . . . c30225_5ug3 1 . 7 . 1961 . 1 1 17 HIS HD1 H 5.761 -9.247 0.239 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HD1 . . . . . . . . . c30225_5ug3 1 . 7 . 1962 . 1 1 17 HIS HD2 H 3.495 -9.010 -3.238 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HD2 . . . . . . . . . c30225_5ug3 1 . 7 . 1963 . 1 1 17 HIS HE1 H 7.025 -10.571 -1.485 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HE1 . . . . . . . . . c30225_5ug3 1 . 7 . 1964 . 1 1 17 HIS HE2 H 5.611 -10.456 -3.566 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HE2 . . . . . . . . . c30225_5ug3 1 . 7 . 1965 . 1 1 17 HIS N N 3.970 -5.688 -0.948 . . . 1.0 . . . . . . . . . . . . A . 17 HIS N . . . . . . . . . c30225_5ug3 1 . 7 . 1966 . 1 1 17 HIS ND1 N 5.452 -9.360 -0.689 . . . 1.0 . . . . . . . . . . . . A . 17 HIS ND1 . . . . . . . . . c30225_5ug3 1 . 7 . 1967 . 1 1 17 HIS NE2 N 5.387 -9.991 -2.730 . . . 1.0 . . . . . . . . . . . . A . 17 HIS NE2 . . . . . . . . . c30225_5ug3 1 . 7 . 1968 . 1 1 17 HIS O O 0.698 -6.963 -0.243 . . . 1.0 . . . . . . . . . . . . A . 17 HIS O . . . . . . . . . c30225_5ug3 1 . 7 . 1969 . 1 1 18 VAL C C -0.543 -3.680 -0.946 . . . 1.0 . . . . . . . . . . . . A . 18 VAL C . . . . . . . . . c30225_5ug3 1 . 7 . 1970 . 1 1 18 VAL CA C 0.298 -4.263 0.189 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CA . . . . . . . . . c30225_5ug3 1 . 7 . 1971 . 1 1 18 VAL CB C 0.627 -3.164 1.229 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CB . . . . . . . . . c30225_5ug3 1 . 7 . 1972 . 1 1 18 VAL CG1 C 1.346 -1.990 0.581 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CG1 . . . . . . . . . c30225_5ug3 1 . 7 . 1973 . 1 1 18 VAL CG2 C -0.631 -2.693 1.947 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CG2 . . . . . . . . . c30225_5ug3 1 . 7 . 1974 . 1 1 18 VAL H H 2.270 -4.298 -0.587 . . . 1.0 . . . . . . . . . . . . A . 18 VAL H . . . . . . . . . c30225_5ug3 1 . 7 . 1975 . 1 1 18 VAL HA H -0.272 -5.039 0.681 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HA . . . . . . . . . c30225_5ug3 1 . 7 . 1976 . 1 1 18 VAL HB H 1.291 -3.591 1.966 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HB . . . . . . . . . c30225_5ug3 1 . 7 . 1977 . 1 1 18 VAL HG11 H 1.542 -1.234 1.325 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG11 . . . . . . . . . c30225_5ug3 1 . 7 . 1978 . 1 1 18 VAL HG12 H 0.728 -1.576 -0.202 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG12 . . . . . . . . . c30225_5ug3 1 . 7 . 1979 . 1 1 18 VAL HG13 H 2.279 -2.330 0.161 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG13 . . . . . . . . . c30225_5ug3 1 . 7 . 1980 . 1 1 18 VAL HG21 H -1.317 -2.266 1.230 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG21 . . . . . . . . . c30225_5ug3 1 . 7 . 1981 . 1 1 18 VAL HG22 H -0.369 -1.947 2.682 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG22 . . . . . . . . . c30225_5ug3 1 . 7 . 1982 . 1 1 18 VAL HG23 H -1.100 -3.532 2.439 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG23 . . . . . . . . . c30225_5ug3 1 . 7 . 1983 . 1 1 18 VAL N N 1.512 -4.873 -0.345 . . . 1.0 . . . . . . . . . . . . A . 18 VAL N . . . . . . . . . c30225_5ug3 1 . 7 . 1984 . 1 1 18 VAL O O -1.731 -3.392 -0.787 . . . 1.0 . . . . . . . . . . . . A . 18 VAL O . . . . . . . . . c30225_5ug3 1 . 7 . 1985 . 1 1 19 CYS C C 0.006 -3.552 -4.527 . . . 1.0 . . . . . . . . . . . . A . 19 CYS C . . . . . . . . . c30225_5ug3 1 . 7 . 1986 . 1 1 19 CYS CA C -0.587 -2.960 -3.257 . . . 1.0 . . . . . . . . . . . . A . 19 CYS CA . . . . . . . . . c30225_5ug3 1 . 7 . 1987 . 1 1 19 CYS CB C -0.449 -1.437 -3.261 . . . 1.0 . . . . . . . . . . . . A . 19 CYS CB . . . . . . . . . c30225_5ug3 1 . 7 . 1988 . 1 1 19 CYS H H 1.020 -3.783 -2.177 . . . 1.0 . . . . . . . . . . . . A . 19 CYS H . . . . . . . . . c30225_5ug3 1 . 7 . 1989 . 1 1 19 CYS HA H -1.632 -3.223 -3.201 . . . 1.0 . . . . . . . . . . . . A . 19 CYS HA . . . . . . . . . c30225_5ug3 1 . 7 . 1990 . 1 1 19 CYS HB2 H -0.725 -1.055 -2.289 . . . 1.0 . . . . . . . . . . . . A . 19 CYS HB2 . . . . . . . . . c30225_5ug3 1 . 7 . 1991 . 1 1 19 CYS HB3 H 0.580 -1.177 -3.464 . . . 1.0 . . . . . . . . . . . . A . 19 CYS HB3 . . . . . . . . . c30225_5ug3 1 . 7 . 1992 . 1 1 19 CYS N N 0.080 -3.518 -2.099 . . . 1.0 . . . . . . . . . . . . A . 19 CYS N . . . . . . . . . c30225_5ug3 1 . 7 . 1993 . 1 1 19 CYS O O 1.039 -3.035 -5.004 . . . 1.0 . . . . . . . . . . . . A . 19 CYS O . . . . . . . . . c30225_5ug3 1 . 7 . 1994 . 1 1 19 CYS OXT O -0.543 -4.555 -5.029 . . . 1.0 . . . . . . . . . . . . A . 19 CYS OXT . . . . . . . . . c30225_5ug3 1 . 7 . 1995 . 1 1 19 CYS SG S -1.488 -0.597 -4.500 . . . 1.0 . . . . . . . . . . . . A . 19 CYS SG . . . . . . . . . c30225_5ug3 1 . 8 . 1996 . 1 1 1 ILE C C -6.483 -4.747 -3.520 . . . 1.0 . . . . . . . . . . . . A . 1 ILE C . . . . . . . . . c30225_5ug3 1 . 8 . 1997 . 1 1 1 ILE CA C -6.107 -6.058 -4.196 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CA . . . . . . . . . c30225_5ug3 1 . 8 . 1998 . 1 1 1 ILE CB C -4.838 -5.853 -5.055 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CB . . . . . . . . . c30225_5ug3 1 . 8 . 1999 . 1 1 1 ILE CD1 C -3.899 -4.626 -7.082 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CD1 . . . . . . . . . c30225_5ug3 1 . 8 . 2000 . 1 1 1 ILE CG1 C -5.118 -4.912 -6.232 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CG1 . . . . . . . . . c30225_5ug3 1 . 8 . 2001 . 1 1 1 ILE CG2 C -4.322 -7.194 -5.557 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CG2 . . . . . . . . . c30225_5ug3 1 . 8 . 2002 . 1 1 1 ILE H1 H -6.976 -7.445 -5.485 . . . 1.0 . . . . . . . . . . . . A . 1 ILE H1 . . . . . . . . . c30225_5ug3 1 . 8 . 2003 . 1 1 1 ILE H2 H -7.503 -5.856 -5.726 . . . 1.0 . . . . . . . . . . . . A . 1 ILE H2 . . . . . . . . . c30225_5ug3 1 . 8 . 2004 . 1 1 1 ILE H3 H -8.061 -6.738 -4.400 . . . 1.0 . . . . . . . . . . . . A . 1 ILE H3 . . . . . . . . . c30225_5ug3 1 . 8 . 2005 . 1 1 1 ILE HA H -5.886 -6.792 -3.433 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HA . . . . . . . . . c30225_5ug3 1 . 8 . 2006 . 1 1 1 ILE HB H -4.077 -5.416 -4.428 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HB . . . . . . . . . c30225_5ug3 1 . 8 . 2007 . 1 1 1 ILE HD11 H -3.516 -5.553 -7.485 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HD11 . . . . . . . . . c30225_5ug3 1 . 8 . 2008 . 1 1 1 ILE HD12 H -3.139 -4.157 -6.476 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HD12 . . . . . . . . . c30225_5ug3 1 . 8 . 2009 . 1 1 1 ILE HD13 H -4.171 -3.967 -7.892 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HD13 . . . . . . . . . c30225_5ug3 1 . 8 . 2010 . 1 1 1 ILE HG12 H -5.868 -5.355 -6.868 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG12 . . . . . . . . . c30225_5ug3 1 . 8 . 2011 . 1 1 1 ILE HG13 H -5.485 -3.970 -5.851 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG13 . . . . . . . . . c30225_5ug3 1 . 8 . 2012 . 1 1 1 ILE HG21 H -4.088 -7.827 -4.714 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG21 . . . . . . . . . c30225_5ug3 1 . 8 . 2013 . 1 1 1 ILE HG22 H -3.431 -7.038 -6.149 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG22 . . . . . . . . . c30225_5ug3 1 . 8 . 2014 . 1 1 1 ILE HG23 H -5.078 -7.667 -6.163 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG23 . . . . . . . . . c30225_5ug3 1 . 8 . 2015 . 1 1 1 ILE N N -7.238 -6.559 -5.009 . . . 1.0 . . . . . . . . . . . . A . 1 ILE N . . . . . . . . . c30225_5ug3 1 . 8 . 2016 . 1 1 1 ILE O O -7.189 -3.926 -4.101 . . . 1.0 . . . . . . . . . . . . A . 1 ILE O . . . . . . . . . c30225_5ug3 1 . 8 . 2017 . 1 1 2 ARG C C -5.457 -2.208 -1.995 . . . 1.0 . . . . . . . . . . . . A . 2 ARG C . . . . . . . . . c30225_5ug3 1 . 8 . 2018 . 1 1 2 ARG CA C -6.345 -3.357 -1.540 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CA . . . . . . . . . c30225_5ug3 1 . 8 . 2019 . 1 1 2 ARG CB C -6.182 -3.581 -0.034 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CB . . . . . . . . . c30225_5ug3 1 . 8 . 2020 . 1 1 2 ARG CD C -6.980 -4.758 2.037 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CD . . . . . . . . . c30225_5ug3 1 . 8 . 2021 . 1 1 2 ARG CG C -7.065 -4.686 0.520 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CG . . . . . . . . . c30225_5ug3 1 . 8 . 2022 . 1 1 2 ARG CZ C -5.160 -4.638 3.700 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CZ . . . . . . . . . c30225_5ug3 1 . 8 . 2023 . 1 1 2 ARG H H -5.462 -5.244 -1.875 . . . 1.0 . . . . . . . . . . . . A . 2 ARG H . . . . . . . . . c30225_5ug3 1 . 8 . 2024 . 1 1 2 ARG HA H -7.371 -3.108 -1.748 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HA . . . . . . . . . c30225_5ug3 1 . 8 . 2025 . 1 1 2 ARG HB2 H -5.153 -3.835 0.168 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB2 . . . . . . . . . c30225_5ug3 1 . 8 . 2026 . 1 1 2 ARG HB3 H -6.425 -2.664 0.482 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB3 . . . . . . . . . c30225_5ug3 1 . 8 . 2027 . 1 1 2 ARG HD2 H -7.323 -3.821 2.447 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD2 . . . . . . . . . c30225_5ug3 1 . 8 . 2028 . 1 1 2 ARG HD3 H -7.621 -5.556 2.381 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD3 . . . . . . . . . c30225_5ug3 1 . 8 . 2029 . 1 1 2 ARG HE H -5.009 -5.476 1.887 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HE . . . . . . . . . c30225_5ug3 1 . 8 . 2030 . 1 1 2 ARG HG2 H -8.089 -4.492 0.237 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG2 . . . . . . . . . c30225_5ug3 1 . 8 . 2031 . 1 1 2 ARG HG3 H -6.746 -5.631 0.105 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG3 . . . . . . . . . c30225_5ug3 1 . 8 . 2032 . 1 1 2 ARG HH11 H -6.908 -3.811 4.308 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH11 . . . . . . . . . c30225_5ug3 1 . 8 . 2033 . 1 1 2 ARG HH12 H -5.610 -3.739 5.457 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH12 . . . . . . . . . c30225_5ug3 1 . 8 . 2034 . 1 1 2 ARG HH21 H -3.297 -5.376 3.402 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH21 . . . . . . . . . c30225_5ug3 1 . 8 . 2035 . 1 1 2 ARG HH22 H -3.552 -4.611 4.936 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH22 . . . . . . . . . c30225_5ug3 1 . 8 . 2036 . 1 1 2 ARG N N -6.029 -4.563 -2.286 . . . 1.0 . . . . . . . . . . . . A . 2 ARG N . . . . . . . . . c30225_5ug3 1 . 8 . 2037 . 1 1 2 ARG NE N -5.617 -5.008 2.504 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NE . . . . . . . . . c30225_5ug3 1 . 8 . 2038 . 1 1 2 ARG NH1 N -5.956 -4.012 4.556 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH1 . . . . . . . . . c30225_5ug3 1 . 8 . 2039 . 1 1 2 ARG NH2 N -3.905 -4.899 4.041 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH2 . . . . . . . . . c30225_5ug3 1 . 8 . 2040 . 1 1 2 ARG O O -4.234 -2.323 -2.005 . . . 1.0 . . . . . . . . . . . . A . 2 ARG O . . . . . . . . . c30225_5ug3 1 . 8 . 2041 . 1 1 3 ASP C C -4.983 1.024 -1.791 . . . 1.0 . . . . . . . . . . . . A . 3 ASP C . . . . . . . . . c30225_5ug3 1 . 8 . 2042 . 1 1 3 ASP CA C -5.359 0.045 -2.901 . . . 1.0 . . . . . . . . . . . . A . 3 ASP CA . . . . . . . . . c30225_5ug3 1 . 8 . 2043 . 1 1 3 ASP CB C -6.228 0.730 -3.963 . . . 1.0 . . . . . . . . . . . . A . 3 ASP CB . . . . . . . . . c30225_5ug3 1 . 8 . 2044 . 1 1 3 ASP CG C -5.471 1.738 -4.805 . . . 1.0 . . . . . . . . . . . . A . 3 ASP CG . . . . . . . . . c30225_5ug3 1 . 8 . 2045 . 1 1 3 ASP H H -7.058 -1.043 -2.248 . . . 1.0 . . . . . . . . . . . . A . 3 ASP H . . . . . . . . . c30225_5ug3 1 . 8 . 2046 . 1 1 3 ASP HA H -4.457 -0.321 -3.361 . . . 1.0 . . . . . . . . . . . . A . 3 ASP HA . . . . . . . . . c30225_5ug3 1 . 8 . 2047 . 1 1 3 ASP HB2 H -6.633 -0.022 -4.622 . . . 1.0 . . . . . . . . . . . . A . 3 ASP HB2 . . . . . . . . . c30225_5ug3 1 . 8 . 2048 . 1 1 3 ASP HB3 H -7.042 1.242 -3.470 . . . 1.0 . . . . . . . . . . . . A . 3 ASP HB3 . . . . . . . . . c30225_5ug3 1 . 8 . 2049 . 1 1 3 ASP N N -6.080 -1.099 -2.352 . . . 1.0 . . . . . . . . . . . . A . 3 ASP N . . . . . . . . . c30225_5ug3 1 . 8 . 2050 . 1 1 3 ASP O O -4.590 2.163 -2.044 . . . 1.0 . . . . . . . . . . . . A . 3 ASP O . . . . . . . . . c30225_5ug3 1 . 8 . 2051 . 1 1 3 ASP OD1 O -5.750 2.952 -4.690 . . . 1.0 . . . . . . . . . . . . A . 3 ASP OD1 . . . . . . . . . c30225_5ug3 1 . 8 . 2052 . 1 1 3 ASP OD2 O -4.612 1.320 -5.607 . . . 1.0 . . . . . . . . . . . . A . 3 ASP OD2 . . . . . . . . . c30225_5ug3 1 . 8 . 2053 . 1 1 4 GLU C C -3.411 1.929 0.648 . . . 1.0 . . . . . . . . . . . . A . 4 GLU C . . . . . . . . . c30225_5ug3 1 . 8 . 2054 . 1 1 4 GLU CA C -4.840 1.392 0.612 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CA . . . . . . . . . c30225_5ug3 1 . 8 . 2055 . 1 1 4 GLU CB C -5.132 0.612 1.894 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CB . . . . . . . . . c30225_5ug3 1 . 8 . 2056 . 1 1 4 GLU CD C -7.530 1.383 2.022 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CD . . . . . . . . . c30225_5ug3 1 . 8 . 2057 . 1 1 4 GLU CG C -6.586 0.197 2.034 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CG . . . . . . . . . c30225_5ug3 1 . 8 . 2058 . 1 1 4 GLU H H -5.307 -0.392 -0.432 . . . 1.0 . . . . . . . . . . . . A . 4 GLU H . . . . . . . . . c30225_5ug3 1 . 8 . 2059 . 1 1 4 GLU HA H -5.519 2.228 0.553 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HA . . . . . . . . . c30225_5ug3 1 . 8 . 2060 . 1 1 4 GLU HB2 H -4.523 -0.279 1.905 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HB2 . . . . . . . . . c30225_5ug3 1 . 8 . 2061 . 1 1 4 GLU HB3 H -4.872 1.226 2.743 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HB3 . . . . . . . . . c30225_5ug3 1 . 8 . 2062 . 1 1 4 GLU HG2 H -6.842 -0.453 1.212 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HG2 . . . . . . . . . c30225_5ug3 1 . 8 . 2063 . 1 1 4 GLU HG3 H -6.709 -0.334 2.966 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HG3 . . . . . . . . . c30225_5ug3 1 . 8 . 2064 . 1 1 4 GLU N N -5.073 0.550 -0.557 . . . 1.0 . . . . . . . . . . . . A . 4 GLU N . . . . . . . . . c30225_5ug3 1 . 8 . 2065 . 1 1 4 GLU O O -3.194 3.135 0.541 . . . 1.0 . . . . . . . . . . . . A . 4 GLU O . . . . . . . . . c30225_5ug3 1 . 8 . 2066 . 1 1 4 GLU OE1 O -8.272 1.549 1.030 . . . 1.0 . . . . . . . . . . . . A . 4 GLU OE1 . . . . . . . . . c30225_5ug3 1 . 8 . 2067 . 1 1 4 GLU OE2 O -7.527 2.161 3.000 . . . 1.0 . . . . . . . . . . . . A . 4 GLU OE2 . . . . . . . . . c30225_5ug3 1 . 8 . 2068 . 1 1 5 CYS C C -0.509 1.997 -0.449 . . . 1.0 . . . . . . . . . . . . A . 5 CYS C . . . . . . . . . c30225_5ug3 1 . 8 . 2069 . 1 1 5 CYS CA C -1.043 1.443 0.864 . . . 1.0 . . . . . . . . . . . . A . 5 CYS CA . . . . . . . . . c30225_5ug3 1 . 8 . 2070 . 1 1 5 CYS CB C -0.195 0.272 1.342 . . . 1.0 . . . . . . . . . . . . A . 5 CYS CB . . . . . . . . . c30225_5ug3 1 . 8 . 2071 . 1 1 5 CYS H H -2.644 0.083 0.747 . . . 1.0 . . . . . . . . . . . . A . 5 CYS H . . . . . . . . . c30225_5ug3 1 . 8 . 2072 . 1 1 5 CYS HA H -0.996 2.225 1.607 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HA . . . . . . . . . c30225_5ug3 1 . 8 . 2073 . 1 1 5 CYS HB2 H -0.536 -0.631 0.858 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HB2 . . . . . . . . . c30225_5ug3 1 . 8 . 2074 . 1 1 5 CYS HB3 H 0.829 0.449 1.079 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HB3 . . . . . . . . . c30225_5ug3 1 . 8 . 2075 . 1 1 5 CYS N N -2.432 1.036 0.749 . . . 1.0 . . . . . . . . . . . . A . 5 CYS N . . . . . . . . . c30225_5ug3 1 . 8 . 2076 . 1 1 5 CYS O O 0.591 2.533 -0.506 . . . 1.0 . . . . . . . . . . . . A . 5 CYS O . . . . . . . . . c30225_5ug3 1 . 8 . 2077 . 1 1 5 CYS SG S -0.280 0.003 3.140 . . . 1.0 . . . . . . . . . . . . A . 5 CYS SG . . . . . . . . . c30225_5ug3 1 . 8 . 2078 . 1 1 6 CYS C C -0.998 3.948 -2.760 . . . 1.0 . . . . . . . . . . . . A . 6 CYS C . . . . . . . . . c30225_5ug3 1 . 8 . 2079 . 1 1 6 CYS CA C -0.950 2.423 -2.786 . . . 1.0 . . . . . . . . . . . . A . 6 CYS CA . . . . . . . . . c30225_5ug3 1 . 8 . 2080 . 1 1 6 CYS CB C -1.912 1.871 -3.818 . . . 1.0 . . . . . . . . . . . . A . 6 CYS CB . . . . . . . . . c30225_5ug3 1 . 8 . 2081 . 1 1 6 CYS H H -2.156 1.407 -1.402 . . . 1.0 . . . . . . . . . . . . A . 6 CYS H . . . . . . . . . c30225_5ug3 1 . 8 . 2082 . 1 1 6 CYS HA H 0.054 2.104 -3.025 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HA . . . . . . . . . c30225_5ug3 1 . 8 . 2083 . 1 1 6 CYS HB2 H -2.915 2.171 -3.547 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HB2 . . . . . . . . . c30225_5ug3 1 . 8 . 2084 . 1 1 6 CYS HB3 H -1.666 2.272 -4.785 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HB3 . . . . . . . . . c30225_5ug3 1 . 8 . 2085 . 1 1 6 CYS N N -1.303 1.879 -1.496 . . . 1.0 . . . . . . . . . . . . A . 6 CYS N . . . . . . . . . c30225_5ug3 1 . 8 . 2086 . 1 1 6 CYS O O -0.227 4.614 -3.444 . . . 1.0 . . . . . . . . . . . . A . 6 CYS O . . . . . . . . . c30225_5ug3 1 . 8 . 2087 . 1 1 6 CYS SG S -1.879 0.054 -3.932 . . . 1.0 . . . . . . . . . . . . A . 6 CYS SG . . . . . . . . . c30225_5ug3 1 . 8 . 2088 . 1 1 7 SER C C -0.990 6.421 -0.744 . . . 1.0 . . . . . . . . . . . . A . 7 SER C . . . . . . . . . c30225_5ug3 1 . 8 . 2089 . 1 1 7 SER CA C -1.991 5.941 -1.785 . . . 1.0 . . . . . . . . . . . . A . 7 SER CA . . . . . . . . . c30225_5ug3 1 . 8 . 2090 . 1 1 7 SER CB C -3.408 6.315 -1.366 . . . 1.0 . . . . . . . . . . . . A . 7 SER CB . . . . . . . . . c30225_5ug3 1 . 8 . 2091 . 1 1 7 SER H H -2.490 3.916 -1.423 . . . 1.0 . . . . . . . . . . . . A . 7 SER H . . . . . . . . . c30225_5ug3 1 . 8 . 2092 . 1 1 7 SER HA H -1.764 6.400 -2.736 . . . 1.0 . . . . . . . . . . . . A . 7 SER HA . . . . . . . . . c30225_5ug3 1 . 8 . 2093 . 1 1 7 SER HB2 H -3.587 5.967 -0.360 . . . 1.0 . . . . . . . . . . . . A . 7 SER HB2 . . . . . . . . . c30225_5ug3 1 . 8 . 2094 . 1 1 7 SER HB3 H -3.522 7.388 -1.402 . . . 1.0 . . . . . . . . . . . . A . 7 SER HB3 . . . . . . . . . c30225_5ug3 1 . 8 . 2095 . 1 1 7 SER HG H -3.909 5.374 -3.014 . . . 1.0 . . . . . . . . . . . . A . 7 SER HG . . . . . . . . . c30225_5ug3 1 . 8 . 2096 . 1 1 7 SER N N -1.888 4.497 -1.940 . . . 1.0 . . . . . . . . . . . . A . 7 SER N . . . . . . . . . c30225_5ug3 1 . 8 . 2097 . 1 1 7 SER O O -0.926 7.599 -0.405 . . . 1.0 . . . . . . . . . . . . A . 7 SER O . . . . . . . . . c30225_5ug3 1 . 8 . 2098 . 1 1 7 SER OG O -4.360 5.724 -2.232 . . . 1.0 . . . . . . . . . . . . A . 7 SER OG . . . . . . . . . c30225_5ug3 1 . 8 . 2099 . 1 1 8 ASN C C 2.135 5.302 0.304 . . . 1.0 . . . . . . . . . . . . A . 8 ASN C . . . . . . . . . c30225_5ug3 1 . 8 . 2100 . 1 1 8 ASN CA C 0.776 5.746 0.784 . . . 1.0 . . . . . . . . . . . . A . 8 ASN CA . . . . . . . . . c30225_5ug3 1 . 8 . 2101 . 1 1 8 ASN CB C 0.431 4.981 2.053 . . . 1.0 . . . . . . . . . . . . A . 8 ASN CB . . . . . . . . . c30225_5ug3 1 . 8 . 2102 . 1 1 8 ASN CG C -0.877 5.423 2.664 . . . 1.0 . . . . . . . . . . . . A . 8 ASN CG . . . . . . . . . c30225_5ug3 1 . 8 . 2103 . 1 1 8 ASN H H -0.282 4.568 -0.596 . . . 1.0 . . . . . . . . . . . . A . 8 ASN H . . . . . . . . . c30225_5ug3 1 . 8 . 2104 . 1 1 8 ASN HA H 0.788 6.805 0.989 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HA . . . . . . . . . c30225_5ug3 1 . 8 . 2105 . 1 1 8 ASN HB2 H 0.360 3.933 1.811 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HB2 . . . . . . . . . c30225_5ug3 1 . 8 . 2106 . 1 1 8 ASN HB3 H 1.215 5.126 2.776 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HB3 . . . . . . . . . c30225_5ug3 1 . 8 . 2107 . 1 1 8 ASN HD21 H -1.857 4.217 1.435 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HD21 . . . . . . . . . c30225_5ug3 1 . 8 . 2108 . 1 1 8 ASN HD22 H -2.832 5.120 2.549 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HD22 . . . . . . . . . c30225_5ug3 1 . 8 . 2109 . 1 1 8 ASN N N -0.207 5.478 -0.245 . . . 1.0 . . . . . . . . . . . . A . 8 ASN N . . . . . . . . . c30225_5ug3 1 . 8 . 2110 . 1 1 8 ASN ND2 N -1.963 4.868 2.168 . . . 1.0 . . . . . . . . . . . . A . 8 ASN ND2 . . . . . . . . . c30225_5ug3 1 . 8 . 2111 . 1 1 8 ASN O O 2.530 4.155 0.521 . . . 1.0 . . . . . . . . . . . . A . 8 ASN O . . . . . . . . . c30225_5ug3 1 . 8 . 2112 . 1 1 8 ASN OD1 O -0.913 6.275 3.549 . . . 1.0 . . . . . . . . . . . . A . 8 ASN OD1 . . . . . . . . . c30225_5ug3 1 . 8 . 2113 . 1 1 9 PRO C C 5.149 5.311 0.099 . . . 1.0 . . . . . . . . . . . . A . 9 PRO C . . . . . . . . . c30225_5ug3 1 . 8 . 2114 . 1 1 9 PRO CA C 4.172 5.862 -0.932 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CA . . . . . . . . . c30225_5ug3 1 . 8 . 2115 . 1 1 9 PRO CB C 4.666 7.200 -1.486 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CB . . . . . . . . . c30225_5ug3 1 . 8 . 2116 . 1 1 9 PRO CD C 2.495 7.590 -0.623 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CD . . . . . . . . . c30225_5ug3 1 . 8 . 2117 . 1 1 9 PRO CG C 3.426 7.982 -1.727 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CG . . . . . . . . . c30225_5ug3 1 . 8 . 2118 . 1 1 9 PRO HA H 4.067 5.148 -1.734 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HA . . . . . . . . . c30225_5ug3 1 . 8 . 2119 . 1 1 9 PRO HB2 H 5.295 7.681 -0.756 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HB2 . . . . . . . . . c30225_5ug3 1 . 8 . 2120 . 1 1 9 PRO HB3 H 5.216 7.038 -2.400 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HB3 . . . . . . . . . c30225_5ug3 1 . 8 . 2121 . 1 1 9 PRO HD2 H 2.658 8.207 0.246 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HD2 . . . . . . . . . c30225_5ug3 1 . 8 . 2122 . 1 1 9 PRO HD3 H 1.475 7.658 -0.953 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HD3 . . . . . . . . . c30225_5ug3 1 . 8 . 2123 . 1 1 9 PRO HG2 H 3.643 9.039 -1.683 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HG2 . . . . . . . . . c30225_5ug3 1 . 8 . 2124 . 1 1 9 PRO HG3 H 3.004 7.721 -2.685 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HG3 . . . . . . . . . c30225_5ug3 1 . 8 . 2125 . 1 1 9 PRO N N 2.871 6.191 -0.359 . . . 1.0 . . . . . . . . . . . . A . 9 PRO N . . . . . . . . . c30225_5ug3 1 . 8 . 2126 . 1 1 9 PRO O O 6.120 4.660 -0.257 . . . 1.0 . . . . . . . . . . . . A . 9 PRO O . . . . . . . . . c30225_5ug3 1 . 8 . 2127 . 1 1 10 VAL C C 5.395 3.615 2.792 . . . 1.0 . . . . . . . . . . . . A . 10 VAL C . . . . . . . . . c30225_5ug3 1 . 8 . 2128 . 1 1 10 VAL CA C 5.753 5.058 2.437 . . . 1.0 . . . . . . . . . . . . A . 10 VAL CA . . . . . . . . . c30225_5ug3 1 . 8 . 2129 . 1 1 10 VAL CB C 5.681 5.951 3.697 . . . 1.0 . . . . . . . . . . . . A . 10 VAL CB . . . . . . . . . c30225_5ug3 1 . 8 . 2130 . 1 1 10 VAL CG1 C 6.624 5.448 4.780 . . . 1.0 . . . . . . . . . . . . A . 10 VAL CG1 . . . . . . . . . c30225_5ug3 1 . 8 . 2131 . 1 1 10 VAL CG2 C 6.000 7.397 3.345 . . . 1.0 . . . . . . . . . . . . A . 10 VAL CG2 . . . . . . . . . c30225_5ug3 1 . 8 . 2132 . 1 1 10 VAL H H 4.059 6.047 1.611 . . . 1.0 . . . . . . . . . . . . A . 10 VAL H . . . . . . . . . c30225_5ug3 1 . 8 . 2133 . 1 1 10 VAL HA H 6.771 5.076 2.062 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HA . . . . . . . . . c30225_5ug3 1 . 8 . 2134 . 1 1 10 VAL HB H 4.675 5.914 4.084 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HB . . . . . . . . . c30225_5ug3 1 . 8 . 2135 . 1 1 10 VAL HG11 H 6.550 6.087 5.647 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HG11 . . . . . . . . . c30225_5ug3 1 . 8 . 2136 . 1 1 10 VAL HG12 H 7.638 5.462 4.408 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HG12 . . . . . . . . . c30225_5ug3 1 . 8 . 2137 . 1 1 10 VAL HG13 H 6.353 4.439 5.052 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HG13 . . . . . . . . . c30225_5ug3 1 . 8 . 2138 . 1 1 10 VAL HG21 H 5.304 7.749 2.601 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HG21 . . . . . . . . . c30225_5ug3 1 . 8 . 2139 . 1 1 10 VAL HG22 H 7.004 7.457 2.954 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HG22 . . . . . . . . . c30225_5ug3 1 . 8 . 2140 . 1 1 10 VAL HG23 H 5.922 8.008 4.230 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HG23 . . . . . . . . . c30225_5ug3 1 . 8 . 2141 . 1 1 10 VAL N N 4.880 5.550 1.377 . . . 1.0 . . . . . . . . . . . . A . 10 VAL N . . . . . . . . . c30225_5ug3 1 . 8 . 2142 . 1 1 10 VAL O O 6.255 2.804 3.145 . . . 1.0 . . . . . . . . . . . . A . 10 VAL O . . . . . . . . . c30225_5ug3 1 . 8 . 2143 . 1 1 11 CYS C C 4.094 1.031 1.754 . . . 1.0 . . . . . . . . . . . . A . 11 CYS C . . . . . . . . . c30225_5ug3 1 . 8 . 2144 . 1 1 11 CYS CA C 3.700 1.918 2.925 . . . 1.0 . . . . . . . . . . . . A . 11 CYS CA . . . . . . . . . c30225_5ug3 1 . 8 . 2145 . 1 1 11 CYS CB C 2.190 1.824 3.174 . . . 1.0 . . . . . . . . . . . . A . 11 CYS CB . . . . . . . . . c30225_5ug3 1 . 8 . 2146 . 1 1 11 CYS H H 3.465 3.952 2.400 . . . 1.0 . . . . . . . . . . . . A . 11 CYS H . . . . . . . . . c30225_5ug3 1 . 8 . 2147 . 1 1 11 CYS HA H 4.222 1.575 3.807 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HA . . . . . . . . . c30225_5ug3 1 . 8 . 2148 . 1 1 11 CYS HB2 H 1.907 2.549 3.922 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HB2 . . . . . . . . . c30225_5ug3 1 . 8 . 2149 . 1 1 11 CYS HB3 H 1.667 2.037 2.253 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HB3 . . . . . . . . . c30225_5ug3 1 . 8 . 2150 . 1 1 11 CYS N N 4.124 3.279 2.671 . . . 1.0 . . . . . . . . . . . . A . 11 CYS N . . . . . . . . . c30225_5ug3 1 . 8 . 2151 . 1 1 11 CYS O O 4.638 -0.053 1.948 . . . 1.0 . . . . . . . . . . . . A . 11 CYS O . . . . . . . . . c30225_5ug3 1 . 8 . 2152 . 1 1 11 CYS SG S 1.649 0.177 3.756 . . . 1.0 . . . . . . . . . . . . A . 11 CYS SG . . . . . . . . . c30225_5ug3 1 . 8 . 2153 . 1 1 12 ARG C C 5.521 0.395 -0.968 . . . 1.0 . . . . . . . . . . . . A . 12 ARG C . . . . . . . . . c30225_5ug3 1 . 8 . 2154 . 1 1 12 ARG CA C 4.063 0.680 -0.647 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CA . . . . . . . . . c30225_5ug3 1 . 8 . 2155 . 1 1 12 ARG CB C 3.334 1.245 -1.856 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CB . . . . . . . . . c30225_5ug3 1 . 8 . 2156 . 1 1 12 ARG CD C 2.801 3.252 -3.232 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CD . . . . . . . . . c30225_5ug3 1 . 8 . 2157 . 1 1 12 ARG CG C 3.698 2.665 -2.155 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CG . . . . . . . . . c30225_5ug3 1 . 8 . 2158 . 1 1 12 ARG CZ C 1.985 2.650 -5.492 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CZ . . . . . . . . . c30225_5ug3 1 . 8 . 2159 . 1 1 12 ARG H H 3.586 2.448 0.426 . . . 1.0 . . . . . . . . . . . . A . 12 ARG H . . . . . . . . . c30225_5ug3 1 . 8 . 2160 . 1 1 12 ARG HA H 3.618 -0.239 -0.405 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HA . . . . . . . . . c30225_5ug3 1 . 8 . 2161 . 1 1 12 ARG HB2 H 3.576 0.649 -2.719 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HB2 . . . . . . . . . c30225_5ug3 1 . 8 . 2162 . 1 1 12 ARG HB3 H 2.268 1.196 -1.680 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HB3 . . . . . . . . . c30225_5ug3 1 . 8 . 2163 . 1 1 12 ARG HD2 H 1.810 3.378 -2.825 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HD2 . . . . . . . . . c30225_5ug3 1 . 8 . 2164 . 1 1 12 ARG HD3 H 3.195 4.212 -3.526 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HD3 . . . . . . . . . c30225_5ug3 1 . 8 . 2165 . 1 1 12 ARG HE H 3.248 1.551 -4.390 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HE . . . . . . . . . c30225_5ug3 1 . 8 . 2166 . 1 1 12 ARG HG2 H 3.581 3.222 -1.246 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HG2 . . . . . . . . . c30225_5ug3 1 . 8 . 2167 . 1 1 12 ARG HG3 H 4.726 2.705 -2.482 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HG3 . . . . . . . . . c30225_5ug3 1 . 8 . 2168 . 1 1 12 ARG HH11 H 1.302 4.437 -4.818 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH11 . . . . . . . . . c30225_5ug3 1 . 8 . 2169 . 1 1 12 ARG HH12 H 0.722 3.963 -6.382 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH12 . . . . . . . . . c30225_5ug3 1 . 8 . 2170 . 1 1 12 ARG HH21 H 2.479 0.930 -6.444 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH21 . . . . . . . . . c30225_5ug3 1 . 8 . 2171 . 1 1 12 ARG HH22 H 1.396 1.974 -7.309 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH22 . . . . . . . . . c30225_5ug3 1 . 8 . 2172 . 1 1 12 ARG N N 3.881 1.517 0.533 . . . 1.0 . . . . . . . . . . . . A . 12 ARG N . . . . . . . . . c30225_5ug3 1 . 8 . 2173 . 1 1 12 ARG NE N 2.725 2.387 -4.412 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NE . . . . . . . . . c30225_5ug3 1 . 8 . 2174 . 1 1 12 ARG NH1 N 1.282 3.774 -5.571 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NH1 . . . . . . . . . c30225_5ug3 1 . 8 . 2175 . 1 1 12 ARG NH2 N 1.951 1.783 -6.494 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NH2 . . . . . . . . . c30225_5ug3 1 . 8 . 2176 . 1 1 12 ARG O O 5.828 -0.528 -1.721 . . . 1.0 . . . . . . . . . . . . A . 12 ARG O . . . . . . . . . c30225_5ug3 1 . 8 . 2177 . 1 1 13 VAL C C 8.323 -0.111 0.434 . . . 1.0 . . . . . . . . . . . . A . 13 VAL C . . . . . . . . . c30225_5ug3 1 . 8 . 2178 . 1 1 13 VAL CA C 7.828 0.936 -0.563 . . . 1.0 . . . . . . . . . . . . A . 13 VAL CA . . . . . . . . . c30225_5ug3 1 . 8 . 2179 . 1 1 13 VAL CB C 8.625 2.231 -0.376 . . . 1.0 . . . . . . . . . . . . A . 13 VAL CB . . . . . . . . . c30225_5ug3 1 . 8 . 2180 . 1 1 13 VAL CG1 C 8.455 3.146 -1.578 . . . 1.0 . . . . . . . . . . . . A . 13 VAL CG1 . . . . . . . . . c30225_5ug3 1 . 8 . 2181 . 1 1 13 VAL CG2 C 8.194 2.924 0.899 . . . 1.0 . . . . . . . . . . . . A . 13 VAL CG2 . . . . . . . . . c30225_5ug3 1 . 8 . 2182 . 1 1 13 VAL H H 6.119 1.955 0.101 . . . 1.0 . . . . . . . . . . . . A . 13 VAL H . . . . . . . . . c30225_5ug3 1 . 8 . 2183 . 1 1 13 VAL HA H 7.999 0.574 -1.566 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HA . . . . . . . . . c30225_5ug3 1 . 8 . 2184 . 1 1 13 VAL HB H 9.657 1.981 -0.282 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HB . . . . . . . . . c30225_5ug3 1 . 8 . 2185 . 1 1 13 VAL HG11 H 9.034 4.044 -1.429 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HG11 . . . . . . . . . c30225_5ug3 1 . 8 . 2186 . 1 1 13 VAL HG12 H 7.413 3.404 -1.689 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HG12 . . . . . . . . . c30225_5ug3 1 . 8 . 2187 . 1 1 13 VAL HG13 H 8.797 2.640 -2.467 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HG13 . . . . . . . . . c30225_5ug3 1 . 8 . 2188 . 1 1 13 VAL HG21 H 7.136 3.152 0.841 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HG21 . . . . . . . . . c30225_5ug3 1 . 8 . 2189 . 1 1 13 VAL HG22 H 8.756 3.836 1.025 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HG22 . . . . . . . . . c30225_5ug3 1 . 8 . 2190 . 1 1 13 VAL HG23 H 8.368 2.268 1.738 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HG23 . . . . . . . . . c30225_5ug3 1 . 8 . 2191 . 1 1 13 VAL N N 6.412 1.181 -0.411 . . . 1.0 . . . . . . . . . . . . A . 13 VAL N . . . . . . . . . c30225_5ug3 1 . 8 . 2192 . 1 1 13 VAL O O 9.227 -0.887 0.124 . . . 1.0 . . . . . . . . . . . . A . 13 VAL O . . . . . . . . . c30225_5ug3 1 . 8 . 2193 . 1 1 14 ASN C C 7.496 -2.406 2.584 . . . 1.0 . . . . . . . . . . . . A . 14 ASN C . . . . . . . . . c30225_5ug3 1 . 8 . 2194 . 1 1 14 ASN CA C 8.201 -1.054 2.664 . . . 1.0 . . . . . . . . . . . . A . 14 ASN CA . . . . . . . . . c30225_5ug3 1 . 8 . 2195 . 1 1 14 ASN CB C 8.029 -0.441 4.066 . . . 1.0 . . . . . . . . . . . . A . 14 ASN CB . . . . . . . . . c30225_5ug3 1 . 8 . 2196 . 1 1 14 ASN CG C 6.717 -0.808 4.741 . . . 1.0 . . . . . . . . . . . . A . 14 ASN CG . . . . . . . . . c30225_5ug3 1 . 8 . 2197 . 1 1 14 ASN H H 6.975 0.460 1.811 . . . 1.0 . . . . . . . . . . . . A . 14 ASN H . . . . . . . . . c30225_5ug3 1 . 8 . 2198 . 1 1 14 ASN HA H 9.254 -1.216 2.490 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HA . . . . . . . . . c30225_5ug3 1 . 8 . 2199 . 1 1 14 ASN HB2 H 8.835 -0.781 4.697 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HB2 . . . . . . . . . c30225_5ug3 1 . 8 . 2200 . 1 1 14 ASN HB3 H 8.077 0.635 3.982 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HB3 . . . . . . . . . c30225_5ug3 1 . 8 . 2201 . 1 1 14 ASN HD21 H 5.835 0.789 3.972 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HD21 . . . . . . . . . c30225_5ug3 1 . 8 . 2202 . 1 1 14 ASN HD22 H 4.841 -0.214 4.970 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HD22 . . . . . . . . . c30225_5ug3 1 . 8 . 2203 . 1 1 14 ASN N N 7.729 -0.143 1.626 . . . 1.0 . . . . . . . . . . . . A . 14 ASN N . . . . . . . . . c30225_5ug3 1 . 8 . 2204 . 1 1 14 ASN ND2 N 5.697 0.003 4.541 . . . 1.0 . . . . . . . . . . . . A . 14 ASN ND2 . . . . . . . . . c30225_5ug3 1 . 8 . 2205 . 1 1 14 ASN O O 8.099 -3.439 2.878 . . . 1.0 . . . . . . . . . . . . A . 14 ASN O . . . . . . . . . c30225_5ug3 1 . 8 . 2206 . 1 1 14 ASN OD1 O 6.626 -1.811 5.446 . . . 1.0 . . . . . . . . . . . . A . 14 ASN OD1 . . . . . . . . . c30225_5ug3 1 . 8 . 2207 . 1 1 15 ASN C C 5.972 -4.569 1.068 . . . 1.0 . . . . . . . . . . . . A . 15 ASN C . . . . . . . . . c30225_5ug3 1 . 8 . 2208 . 1 1 15 ASN CA C 5.434 -3.601 2.110 . . . 1.0 . . . . . . . . . . . . A . 15 ASN CA . . . . . . . . . c30225_5ug3 1 . 8 . 2209 . 1 1 15 ASN CB C 3.962 -3.233 1.838 . . . 1.0 . . . . . . . . . . . . A . 15 ASN CB . . . . . . . . . c30225_5ug3 1 . 8 . 2210 . 1 1 15 ASN CG C 3.683 -2.529 0.501 . . . 1.0 . . . . . . . . . . . . A . 15 ASN CG . . . . . . . . . c30225_5ug3 1 . 8 . 2211 . 1 1 15 ASN H H 5.803 -1.558 1.931 . . . 1.0 . . . . . . . . . . . . A . 15 ASN H . . . . . . . . . c30225_5ug3 1 . 8 . 2212 . 1 1 15 ASN HA H 5.492 -4.096 3.076 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HA . . . . . . . . . c30225_5ug3 1 . 8 . 2213 . 1 1 15 ASN HB2 H 3.369 -4.126 1.865 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HB2 . . . . . . . . . c30225_5ug3 1 . 8 . 2214 . 1 1 15 ASN HB3 H 3.629 -2.575 2.631 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HB3 . . . . . . . . . c30225_5ug3 1 . 8 . 2215 . 1 1 15 ASN HD21 H 5.198 -3.442 -0.417 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HD21 . . . . . . . . . c30225_5ug3 1 . 8 . 2216 . 1 1 15 ASN HD22 H 4.271 -2.348 -1.386 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HD22 . . . . . . . . . c30225_5ug3 1 . 8 . 2217 . 1 1 15 ASN N N 6.228 -2.399 2.181 . . . 1.0 . . . . . . . . . . . . A . 15 ASN N . . . . . . . . . c30225_5ug3 1 . 8 . 2218 . 1 1 15 ASN ND2 N 4.462 -2.801 -0.536 . . . 1.0 . . . . . . . . . . . . A . 15 ASN ND2 . . . . . . . . . c30225_5ug3 1 . 8 . 2219 . 1 1 15 ASN O O 6.649 -4.174 0.119 . . . 1.0 . . . . . . . . . . . . A . 15 ASN O . . . . . . . . . c30225_5ug3 1 . 8 . 2220 . 1 1 15 ASN OD1 O 2.747 -1.739 0.405 . . . 1.0 . . . . . . . . . . . . A . 15 ASN OD1 . . . . . . . . . c30225_5ug3 1 . 8 . 2221 . 1 1 16 HYP C C 5.436 -6.760 -1.034 . . . 1.0 . . . . . . . . . . . . A . 16 HYP C . . . . . . . . . c30225_5ug3 1 . 8 . 2222 . 1 1 16 HYP CA C 6.116 -6.893 0.323 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CA . . . . . . . . . c30225_5ug3 1 . 8 . 2223 . 1 1 16 HYP CB C 5.692 -8.151 1.047 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CB . . . . . . . . . c30225_5ug3 1 . 8 . 2224 . 1 1 16 HYP CD C 4.931 -6.347 2.432 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CD . . . . . . . . . c30225_5ug3 1 . 8 . 2225 . 1 1 16 HYP CG C 4.897 -7.833 2.292 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CG . . . . . . . . . c30225_5ug3 1 . 8 . 2226 . 1 1 16 HYP HA H 7.180 -6.891 0.188 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HA . . . . . . . . . c30225_5ug3 1 . 8 . 2227 . 1 1 16 HYP HB2 H 6.572 -8.707 1.334 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HB2 . . . . . . . . . c30225_5ug3 1 . 8 . 2228 . 1 1 16 HYP HB3 H 5.091 -8.757 0.383 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HB3 . . . . . . . . . c30225_5ug3 1 . 8 . 2229 . 1 1 16 HYP HD1 H 5.642 -7.597 4.060 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HD1 . . . . . . . . . c30225_5ug3 1 . 8 . 2230 . 1 1 16 HYP HD22 H 3.941 -5.947 2.448 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HD22 . . . . . . . . . c30225_5ug3 1 . 8 . 2231 . 1 1 16 HYP HD23 H 5.445 -6.079 3.343 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HD23 . . . . . . . . . c30225_5ug3 1 . 8 . 2232 . 1 1 16 HYP HG H 3.887 -8.206 2.206 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HG . . . . . . . . . c30225_5ug3 1 . 8 . 2233 . 1 1 16 HYP N N 5.688 -5.846 1.257 . . . 1.0 . . . . . . . . . . . . A . 16 HYP N . . . . . . . . . c30225_5ug3 1 . 8 . 2234 . 1 1 16 HYP O O 6.042 -6.293 -1.997 . . . 1.0 . . . . . . . . . . . . A . 16 HYP O . . . . . . . . . c30225_5ug3 1 . 8 . 2235 . 1 1 16 HYP OD1 O 5.513 -8.347 3.452 . . . 1.0 . . . . . . . . . . . . A . 16 HYP OD1 . . . . . . . . . c30225_5ug3 1 . 8 . 2236 . 1 1 17 HIS C C 1.901 -6.780 -1.910 . . . 1.0 . . . . . . . . . . . . A . 17 HIS C . . . . . . . . . c30225_5ug3 1 . 8 . 2237 . 1 1 17 HIS CA C 3.359 -7.000 -2.298 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CA . . . . . . . . . c30225_5ug3 1 . 8 . 2238 . 1 1 17 HIS CB C 3.466 -8.233 -3.212 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CB . . . . . . . . . c30225_5ug3 1 . 8 . 2239 . 1 1 17 HIS CD2 C 5.935 -8.917 -3.638 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CD2 . . . . . . . . . c30225_5ug3 1 . 8 . 2240 . 1 1 17 HIS CE1 C 6.155 -8.087 -5.649 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CE1 . . . . . . . . . c30225_5ug3 1 . 8 . 2241 . 1 1 17 HIS CG C 4.757 -8.341 -3.970 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CG . . . . . . . . . c30225_5ug3 1 . 8 . 2242 . 1 1 17 HIS H H 3.775 -7.572 -0.304 . . . 1.0 . . . . . . . . . . . . A . 17 HIS H . . . . . . . . . c30225_5ug3 1 . 8 . 2243 . 1 1 17 HIS HA H 3.714 -6.130 -2.830 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HA . . . . . . . . . c30225_5ug3 1 . 8 . 2244 . 1 1 17 HIS HB2 H 3.364 -9.123 -2.612 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HB2 . . . . . . . . . c30225_5ug3 1 . 8 . 2245 . 1 1 17 HIS HB3 H 2.661 -8.201 -3.932 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HB3 . . . . . . . . . c30225_5ug3 1 . 8 . 2246 . 1 1 17 HIS HD1 H 4.249 -7.354 -5.760 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HD1 . . . . . . . . . c30225_5ug3 1 . 8 . 2247 . 1 1 17 HIS HD2 H 6.165 -9.412 -2.707 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HD2 . . . . . . . . . c30225_5ug3 1 . 8 . 2248 . 1 1 17 HIS HE1 H 6.571 -7.802 -6.605 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HE1 . . . . . . . . . c30225_5ug3 1 . 8 . 2249 . 1 1 17 HIS HE2 H 7.758 -8.900 -4.674 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HE2 . . . . . . . . . c30225_5ug3 1 . 8 . 2250 . 1 1 17 HIS N N 4.173 -7.154 -1.094 . . . 1.0 . . . . . . . . . . . . A . 17 HIS N . . . . . . . . . c30225_5ug3 1 . 8 . 2251 . 1 1 17 HIS ND1 N 4.930 -7.831 -5.236 . . . 1.0 . . . . . . . . . . . . A . 17 HIS ND1 . . . . . . . . . c30225_5ug3 1 . 8 . 2252 . 1 1 17 HIS NE2 N 6.788 -8.746 -4.699 . . . 1.0 . . . . . . . . . . . . A . 17 HIS NE2 . . . . . . . . . c30225_5ug3 1 . 8 . 2253 . 1 1 17 HIS O O 0.997 -7.415 -2.456 . . . 1.0 . . . . . . . . . . . . A . 17 HIS O . . . . . . . . . c30225_5ug3 1 . 8 . 2254 . 1 1 18 VAL C C -0.340 -4.511 -1.259 . . . 1.0 . . . . . . . . . . . . A . 18 VAL C . . . . . . . . . c30225_5ug3 1 . 8 . 2255 . 1 1 18 VAL CA C 0.329 -5.630 -0.460 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CA . . . . . . . . . c30225_5ug3 1 . 8 . 2256 . 1 1 18 VAL CB C 0.339 -5.279 1.045 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CB . . . . . . . . . c30225_5ug3 1 . 8 . 2257 . 1 1 18 VAL CG1 C 1.259 -6.215 1.812 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CG1 . . . . . . . . . c30225_5ug3 1 . 8 . 2258 . 1 1 18 VAL CG2 C 0.708 -3.826 1.284 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CG2 . . . . . . . . . c30225_5ug3 1 . 8 . 2259 . 1 1 18 VAL H H 2.422 -5.390 -0.567 . . . 1.0 . . . . . . . . . . . . A . 18 VAL H . . . . . . . . . c30225_5ug3 1 . 8 . 2260 . 1 1 18 VAL HA H -0.245 -6.534 -0.588 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HA . . . . . . . . . c30225_5ug3 1 . 8 . 2261 . 1 1 18 VAL HB H -0.650 -5.428 1.419 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HB . . . . . . . . . c30225_5ug3 1 . 8 . 2262 . 1 1 18 VAL HG11 H 0.869 -7.221 1.764 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG11 . . . . . . . . . c30225_5ug3 1 . 8 . 2263 . 1 1 18 VAL HG12 H 1.316 -5.900 2.844 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG12 . . . . . . . . . c30225_5ug3 1 . 8 . 2264 . 1 1 18 VAL HG13 H 2.243 -6.191 1.372 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG13 . . . . . . . . . c30225_5ug3 1 . 8 . 2265 . 1 1 18 VAL HG21 H 0.767 -3.638 2.346 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG21 . . . . . . . . . c30225_5ug3 1 . 8 . 2266 . 1 1 18 VAL HG22 H -0.045 -3.188 0.848 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG22 . . . . . . . . . c30225_5ug3 1 . 8 . 2267 . 1 1 18 VAL HG23 H 1.664 -3.616 0.829 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG23 . . . . . . . . . c30225_5ug3 1 . 8 . 2268 . 1 1 18 VAL N N 1.673 -5.885 -0.952 . . . 1.0 . . . . . . . . . . . . A . 18 VAL N . . . . . . . . . c30225_5ug3 1 . 8 . 2269 . 1 1 18 VAL O O -1.462 -4.098 -0.964 . . . 1.0 . . . . . . . . . . . . A . 18 VAL O . . . . . . . . . c30225_5ug3 1 . 8 . 2270 . 1 1 19 CYS C C 0.177 -3.427 -4.615 . . . 1.0 . . . . . . . . . . . . A . 19 CYS C . . . . . . . . . c30225_5ug3 1 . 8 . 2271 . 1 1 19 CYS CA C -0.156 -3.029 -3.181 . . . 1.0 . . . . . . . . . . . . A . 19 CYS CA . . . . . . . . . c30225_5ug3 1 . 8 . 2272 . 1 1 19 CYS CB C 0.415 -1.644 -2.847 . . . 1.0 . . . . . . . . . . . . A . 19 CYS CB . . . . . . . . . c30225_5ug3 1 . 8 . 2273 . 1 1 19 CYS H H 1.276 -4.363 -2.412 . . . 1.0 . . . . . . . . . . . . A . 19 CYS H . . . . . . . . . c30225_5ug3 1 . 8 . 2274 . 1 1 19 CYS HA H -1.231 -3.006 -3.067 . . . 1.0 . . . . . . . . . . . . A . 19 CYS HA . . . . . . . . . c30225_5ug3 1 . 8 . 2275 . 1 1 19 CYS HB2 H -0.023 -1.299 -1.922 . . . 1.0 . . . . . . . . . . . . A . 19 CYS HB2 . . . . . . . . . c30225_5ug3 1 . 8 . 2276 . 1 1 19 CYS HB3 H 1.483 -1.724 -2.722 . . . 1.0 . . . . . . . . . . . . A . 19 CYS HB3 . . . . . . . . . c30225_5ug3 1 . 8 . 2277 . 1 1 19 CYS N N 0.368 -4.029 -2.269 . . . 1.0 . . . . . . . . . . . . A . 19 CYS N . . . . . . . . . c30225_5ug3 1 . 8 . 2278 . 1 1 19 CYS O O -0.637 -4.139 -5.235 . . . 1.0 . . . . . . . . . . . . A . 19 CYS O . . . . . . . . . c30225_5ug3 1 . 8 . 2279 . 1 1 19 CYS OXT O 1.267 -3.060 -5.107 . . . 1.0 . . . . . . . . . . . . A . 19 CYS OXT . . . . . . . . . c30225_5ug3 1 . 8 . 2280 . 1 1 19 CYS SG S 0.098 -0.364 -4.111 . . . 1.0 . . . . . . . . . . . . A . 19 CYS SG . . . . . . . . . c30225_5ug3 1 . 9 . 2281 . 1 1 1 ILE C C -9.365 -3.882 -2.416 . . . 1.0 . . . . . . . . . . . . A . 1 ILE C . . . . . . . . . c30225_5ug3 1 . 9 . 2282 . 1 1 1 ILE CA C -10.598 -3.771 -3.304 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CA . . . . . . . . . c30225_5ug3 1 . 9 . 2283 . 1 1 1 ILE CB C -10.997 -2.283 -3.443 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CB . . . . . . . . . c30225_5ug3 1 . 9 . 2284 . 1 1 1 ILE CD1 C -11.777 -0.241 -2.121 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CD1 . . . . . . . . . c30225_5ug3 1 . 9 . 2285 . 1 1 1 ILE CG1 C -11.496 -1.728 -2.105 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CG1 . . . . . . . . . c30225_5ug3 1 . 9 . 2286 . 1 1 1 ILE CG2 C -12.059 -2.123 -4.522 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CG2 . . . . . . . . . c30225_5ug3 1 . 9 . 2287 . 1 1 1 ILE H1 H -11.973 -4.252 -1.822 . . . 1.0 . . . . . . . . . . . . A . 1 ILE H1 . . . . . . . . . c30225_5ug3 1 . 9 . 2288 . 1 1 1 ILE H2 H -11.411 -5.582 -2.693 . . . 1.0 . . . . . . . . . . . . A . 1 ILE H2 . . . . . . . . . c30225_5ug3 1 . 9 . 2289 . 1 1 1 ILE H3 H -12.533 -4.532 -3.392 . . . 1.0 . . . . . . . . . . . . A . 1 ILE H3 . . . . . . . . . c30225_5ug3 1 . 9 . 2290 . 1 1 1 ILE HA H -10.351 -4.146 -4.286 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HA . . . . . . . . . c30225_5ug3 1 . 9 . 2291 . 1 1 1 ILE HB H -10.123 -1.728 -3.750 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HB . . . . . . . . . c30225_5ug3 1 . 9 . 2292 . 1 1 1 ILE HD11 H -12.523 -0.023 -2.870 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HD11 . . . . . . . . . c30225_5ug3 1 . 9 . 2293 . 1 1 1 ILE HD12 H -10.868 0.295 -2.352 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HD12 . . . . . . . . . c30225_5ug3 1 . 9 . 2294 . 1 1 1 ILE HD13 H -12.140 0.068 -1.152 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HD13 . . . . . . . . . c30225_5ug3 1 . 9 . 2295 . 1 1 1 ILE HG12 H -12.410 -2.232 -1.835 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG12 . . . . . . . . . c30225_5ug3 1 . 9 . 2296 . 1 1 1 ILE HG13 H -10.751 -1.919 -1.346 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG13 . . . . . . . . . c30225_5ug3 1 . 9 . 2297 . 1 1 1 ILE HG21 H -12.932 -2.703 -4.258 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG21 . . . . . . . . . c30225_5ug3 1 . 9 . 2298 . 1 1 1 ILE HG22 H -11.669 -2.470 -5.468 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG22 . . . . . . . . . c30225_5ug3 1 . 9 . 2299 . 1 1 1 ILE HG23 H -12.331 -1.082 -4.606 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG23 . . . . . . . . . c30225_5ug3 1 . 9 . 2300 . 1 1 1 ILE N N -11.705 -4.588 -2.766 . . . 1.0 . . . . . . . . . . . . A . 1 ILE N . . . . . . . . . c30225_5ug3 1 . 9 . 2301 . 1 1 1 ILE O O -9.459 -3.827 -1.187 . . . 1.0 . . . . . . . . . . . . A . 1 ILE O . . . . . . . . . c30225_5ug3 1 . 9 . 2302 . 1 1 2 ARG C C -6.071 -2.969 -2.632 . . . 1.0 . . . . . . . . . . . . A . 2 ARG C . . . . . . . . . c30225_5ug3 1 . 9 . 2303 . 1 1 2 ARG CA C -6.961 -4.171 -2.327 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CA . . . . . . . . . c30225_5ug3 1 . 9 . 2304 . 1 1 2 ARG CB C -6.254 -5.477 -2.700 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CB . . . . . . . . . c30225_5ug3 1 . 9 . 2305 . 1 1 2 ARG CD C -6.306 -7.991 -2.706 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CD . . . . . . . . . c30225_5ug3 1 . 9 . 2306 . 1 1 2 ARG CG C -7.057 -6.720 -2.354 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CG . . . . . . . . . c30225_5ug3 1 . 9 . 2307 . 1 1 2 ARG CZ C -6.507 -10.342 -1.974 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CZ . . . . . . . . . c30225_5ug3 1 . 9 . 2308 . 1 1 2 ARG H H -8.207 -4.108 -4.017 . . . 1.0 . . . . . . . . . . . . A . 2 ARG H . . . . . . . . . c30225_5ug3 1 . 9 . 2309 . 1 1 2 ARG HA H -7.188 -4.180 -1.278 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HA . . . . . . . . . c30225_5ug3 1 . 9 . 2310 . 1 1 2 ARG HB2 H -6.067 -5.480 -3.764 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB2 . . . . . . . . . c30225_5ug3 1 . 9 . 2311 . 1 1 2 ARG HB3 H -5.312 -5.526 -2.177 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB3 . . . . . . . . . c30225_5ug3 1 . 9 . 2312 . 1 1 2 ARG HD2 H -6.125 -8.005 -3.771 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD2 . . . . . . . . . c30225_5ug3 1 . 9 . 2313 . 1 1 2 ARG HD3 H -5.363 -7.995 -2.180 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD3 . . . . . . . . . c30225_5ug3 1 . 9 . 2314 . 1 1 2 ARG HE H -8.046 -9.119 -2.358 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HE . . . . . . . . . c30225_5ug3 1 . 9 . 2315 . 1 1 2 ARG HG2 H -7.264 -6.718 -1.293 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG2 . . . . . . . . . c30225_5ug3 1 . 9 . 2316 . 1 1 2 ARG HG3 H -7.988 -6.698 -2.902 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG3 . . . . . . . . . c30225_5ug3 1 . 9 . 2317 . 1 1 2 ARG HH11 H -4.597 -9.716 -2.239 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH11 . . . . . . . . . c30225_5ug3 1 . 9 . 2318 . 1 1 2 ARG HH12 H -4.770 -11.354 -1.696 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH12 . . . . . . . . . c30225_5ug3 1 . 9 . 2319 . 1 1 2 ARG HH21 H -8.280 -11.269 -1.641 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH21 . . . . . . . . . c30225_5ug3 1 . 9 . 2320 . 1 1 2 ARG HH22 H -6.870 -12.239 -1.360 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH22 . . . . . . . . . c30225_5ug3 1 . 9 . 2321 . 1 1 2 ARG N N -8.215 -4.058 -3.040 . . . 1.0 . . . . . . . . . . . . A . 2 ARG N . . . . . . . . . c30225_5ug3 1 . 9 . 2322 . 1 1 2 ARG NE N -7.062 -9.186 -2.336 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NE . . . . . . . . . c30225_5ug3 1 . 9 . 2323 . 1 1 2 ARG NH1 N -5.185 -10.481 -1.967 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH1 . . . . . . . . . c30225_5ug3 1 . 9 . 2324 . 1 1 2 ARG NH2 N -7.279 -11.365 -1.629 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH2 . . . . . . . . . c30225_5ug3 1 . 9 . 2325 . 1 1 2 ARG O O -5.035 -3.094 -3.294 . . . 1.0 . . . . . . . . . . . . A . 2 ARG O . . . . . . . . . c30225_5ug3 1 . 9 . 2326 . 1 1 3 ASP C C -5.962 0.404 -1.255 . . . 1.0 . . . . . . . . . . . . A . 3 ASP C . . . . . . . . . c30225_5ug3 1 . 9 . 2327 . 1 1 3 ASP CA C -5.778 -0.561 -2.417 . . . 1.0 . . . . . . . . . . . . A . 3 ASP CA . . . . . . . . . c30225_5ug3 1 . 9 . 2328 . 1 1 3 ASP CB C -6.303 0.076 -3.700 . . . 1.0 . . . . . . . . . . . . A . 3 ASP CB . . . . . . . . . c30225_5ug3 1 . 9 . 2329 . 1 1 3 ASP CG C -5.385 1.146 -4.263 . . . 1.0 . . . . . . . . . . . . A . 3 ASP CG . . . . . . . . . c30225_5ug3 1 . 9 . 2330 . 1 1 3 ASP H H -7.299 -1.781 -1.599 . . . 1.0 . . . . . . . . . . . . A . 3 ASP H . . . . . . . . . c30225_5ug3 1 . 9 . 2331 . 1 1 3 ASP HA H -4.729 -0.786 -2.530 . . . 1.0 . . . . . . . . . . . . A . 3 ASP HA . . . . . . . . . c30225_5ug3 1 . 9 . 2332 . 1 1 3 ASP HB2 H -6.425 -0.693 -4.442 . . . 1.0 . . . . . . . . . . . . A . 3 ASP HB2 . . . . . . . . . c30225_5ug3 1 . 9 . 2333 . 1 1 3 ASP HB3 H -7.261 0.524 -3.490 . . . 1.0 . . . . . . . . . . . . A . 3 ASP HB3 . . . . . . . . . c30225_5ug3 1 . 9 . 2334 . 1 1 3 ASP N N -6.489 -1.805 -2.151 . . . 1.0 . . . . . . . . . . . . A . 3 ASP N . . . . . . . . . c30225_5ug3 1 . 9 . 2335 . 1 1 3 ASP O O -6.799 1.307 -1.299 . . . 1.0 . . . . . . . . . . . . A . 3 ASP O . . . . . . . . . c30225_5ug3 1 . 9 . 2336 . 1 1 3 ASP OD1 O -5.380 2.270 -3.720 . . . 1.0 . . . . . . . . . . . . A . 3 ASP OD1 . . . . . . . . . c30225_5ug3 1 . 9 . 2337 . 1 1 3 ASP OD2 O -4.659 0.875 -5.240 . . . 1.0 . . . . . . . . . . . . A . 3 ASP OD2 . . . . . . . . . c30225_5ug3 1 . 9 . 2338 . 1 1 4 GLU C C -3.957 1.808 1.166 . . . 1.0 . . . . . . . . . . . . A . 4 GLU C . . . . . . . . . c30225_5ug3 1 . 9 . 2339 . 1 1 4 GLU CA C -5.266 1.044 0.975 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CA . . . . . . . . . c30225_5ug3 1 . 9 . 2340 . 1 1 4 GLU CB C -5.606 0.231 2.234 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CB . . . . . . . . . c30225_5ug3 1 . 9 . 2341 . 1 1 4 GLU CD C -4.930 -1.584 3.855 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CD . . . . . . . . . c30225_5ug3 1 . 9 . 2342 . 1 1 4 GLU CG C -4.624 -0.892 2.544 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CG . . . . . . . . . c30225_5ug3 1 . 9 . 2343 . 1 1 4 GLU H H -4.565 -0.563 -0.229 . . . 1.0 . . . . . . . . . . . . A . 4 GLU H . . . . . . . . . c30225_5ug3 1 . 9 . 2344 . 1 1 4 GLU HA H -6.055 1.763 0.805 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HA . . . . . . . . . c30225_5ug3 1 . 9 . 2345 . 1 1 4 GLU HB2 H -5.629 0.899 3.081 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HB2 . . . . . . . . . c30225_5ug3 1 . 9 . 2346 . 1 1 4 GLU HB3 H -6.587 -0.205 2.108 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HB3 . . . . . . . . . c30225_5ug3 1 . 9 . 2347 . 1 1 4 GLU HG2 H -4.668 -1.621 1.750 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HG2 . . . . . . . . . c30225_5ug3 1 . 9 . 2348 . 1 1 4 GLU HG3 H -3.629 -0.477 2.596 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HG3 . . . . . . . . . c30225_5ug3 1 . 9 . 2349 . 1 1 4 GLU N N -5.200 0.187 -0.204 . . . 1.0 . . . . . . . . . . . . A . 4 GLU N . . . . . . . . . c30225_5ug3 1 . 9 . 2350 . 1 1 4 GLU O O -3.954 3.017 1.390 . . . 1.0 . . . . . . . . . . . . A . 4 GLU O . . . . . . . . . c30225_5ug3 1 . 9 . 2351 . 1 1 4 GLU OE1 O -4.432 -1.125 4.905 . . . 1.0 . . . . . . . . . . . . A . 4 GLU OE1 . . . . . . . . . c30225_5ug3 1 . 9 . 2352 . 1 1 4 GLU OE2 O -5.664 -2.598 3.846 . . . 1.0 . . . . . . . . . . . . A . 4 GLU OE2 . . . . . . . . . c30225_5ug3 1 . 9 . 2353 . 1 1 5 CYS C C -0.953 2.166 -0.077 . . . 1.0 . . . . . . . . . . . . A . 5 CYS C . . . . . . . . . c30225_5ug3 1 . 9 . 2354 . 1 1 5 CYS CA C -1.538 1.683 1.241 . . . 1.0 . . . . . . . . . . . . A . 5 CYS CA . . . . . . . . . c30225_5ug3 1 . 9 . 2355 . 1 1 5 CYS CB C -0.605 0.661 1.876 . . . 1.0 . . . . . . . . . . . . A . 5 CYS CB . . . . . . . . . c30225_5ug3 1 . 9 . 2356 . 1 1 5 CYS H H -2.910 0.144 0.816 . . . 1.0 . . . . . . . . . . . . A . 5 CYS H . . . . . . . . . c30225_5ug3 1 . 9 . 2357 . 1 1 5 CYS HA H -1.641 2.526 1.908 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HA . . . . . . . . . c30225_5ug3 1 . 9 . 2358 . 1 1 5 CYS HB2 H -0.909 -0.328 1.570 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HB2 . . . . . . . . . c30225_5ug3 1 . 9 . 2359 . 1 1 5 CYS HB3 H 0.396 0.841 1.531 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HB3 . . . . . . . . . c30225_5ug3 1 . 9 . 2360 . 1 1 5 CYS N N -2.849 1.100 1.052 . . . 1.0 . . . . . . . . . . . . A . 5 CYS N . . . . . . . . . c30225_5ug3 1 . 9 . 2361 . 1 1 5 CYS O O 0.100 2.792 -0.103 . . . 1.0 . . . . . . . . . . . . A . 5 CYS O . . . . . . . . . c30225_5ug3 1 . 9 . 2362 . 1 1 5 CYS SG S -0.584 0.686 3.694 . . . 1.0 . . . . . . . . . . . . A . 5 CYS SG . . . . . . . . . c30225_5ug3 1 . 9 . 2363 . 1 1 6 CYS C C -1.092 3.684 -2.734 . . . 1.0 . . . . . . . . . . . . A . 6 CYS C . . . . . . . . . c30225_5ug3 1 . 9 . 2364 . 1 1 6 CYS CA C -1.131 2.176 -2.495 . . . 1.0 . . . . . . . . . . . . A . 6 CYS CA . . . . . . . . . c30225_5ug3 1 . 9 . 2365 . 1 1 6 CYS CB C -2.012 1.495 -3.530 . . . 1.0 . . . . . . . . . . . . A . 6 CYS CB . . . . . . . . . c30225_5ug3 1 . 9 . 2366 . 1 1 6 CYS H H -2.493 1.400 -1.088 . . . 1.0 . . . . . . . . . . . . A . 6 CYS H . . . . . . . . . c30225_5ug3 1 . 9 . 2367 . 1 1 6 CYS HA H -0.127 1.785 -2.573 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HA . . . . . . . . . c30225_5ug3 1 . 9 . 2368 . 1 1 6 CYS HB2 H -2.991 1.947 -3.500 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HB2 . . . . . . . . . c30225_5ug3 1 . 9 . 2369 . 1 1 6 CYS HB3 H -1.583 1.638 -4.504 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HB3 . . . . . . . . . c30225_5ug3 1 . 9 . 2370 . 1 1 6 CYS N N -1.631 1.861 -1.169 . . . 1.0 . . . . . . . . . . . . A . 6 CYS N . . . . . . . . . c30225_5ug3 1 . 9 . 2371 . 1 1 6 CYS O O -0.296 4.169 -3.535 . . . 1.0 . . . . . . . . . . . . A . 6 CYS O . . . . . . . . . c30225_5ug3 1 . 9 . 2372 . 1 1 6 CYS SG S -2.223 -0.299 -3.267 . . . 1.0 . . . . . . . . . . . . A . 6 CYS SG . . . . . . . . . c30225_5ug3 1 . 9 . 2373 . 1 1 7 SER C C -0.996 6.455 -1.066 . . . 1.0 . . . . . . . . . . . . A . 7 SER C . . . . . . . . . c30225_5ug3 1 . 9 . 2374 . 1 1 7 SER CA C -1.948 5.873 -2.109 . . . 1.0 . . . . . . . . . . . . A . 7 SER CA . . . . . . . . . c30225_5ug3 1 . 9 . 2375 . 1 1 7 SER CB C -3.373 6.399 -1.898 . . . 1.0 . . . . . . . . . . . . A . 7 SER CB . . . . . . . . . c30225_5ug3 1 . 9 . 2376 . 1 1 7 SER H H -2.571 3.973 -1.421 . . . 1.0 . . . . . . . . . . . . A . 7 SER H . . . . . . . . . c30225_5ug3 1 . 9 . 2377 . 1 1 7 SER HA H -1.606 6.153 -3.094 . . . 1.0 . . . . . . . . . . . . A . 7 SER HA . . . . . . . . . c30225_5ug3 1 . 9 . 2378 . 1 1 7 SER HB2 H -4.051 5.866 -2.548 . . . 1.0 . . . . . . . . . . . . A . 7 SER HB2 . . . . . . . . . c30225_5ug3 1 . 9 . 2379 . 1 1 7 SER HB3 H -3.663 6.238 -0.869 . . . 1.0 . . . . . . . . . . . . A . 7 SER HB3 . . . . . . . . . c30225_5ug3 1 . 9 . 2380 . 1 1 7 SER HG H -3.722 8.262 -1.386 . . . 1.0 . . . . . . . . . . . . A . 7 SER HG . . . . . . . . . c30225_5ug3 1 . 9 . 2381 . 1 1 7 SER N N -1.934 4.420 -2.021 . . . 1.0 . . . . . . . . . . . . A . 7 SER N . . . . . . . . . c30225_5ug3 1 . 9 . 2382 . 1 1 7 SER O O -1.023 7.646 -0.755 . . . 1.0 . . . . . . . . . . . . A . 7 SER O . . . . . . . . . c30225_5ug3 1 . 9 . 2383 . 1 1 7 SER OG O -3.466 7.785 -2.186 . . . 1.0 . . . . . . . . . . . . A . 7 SER OG . . . . . . . . . c30225_5ug3 1 . 9 . 2384 . 1 1 8 ASN C C 2.171 5.446 0.111 . . . 1.0 . . . . . . . . . . . . A . 8 ASN C . . . . . . . . . c30225_5ug3 1 . 9 . 2385 . 1 1 8 ASN CA C 0.797 5.954 0.503 . . . 1.0 . . . . . . . . . . . . A . 8 ASN CA . . . . . . . . . c30225_5ug3 1 . 9 . 2386 . 1 1 8 ASN CB C 0.402 5.323 1.834 . . . 1.0 . . . . . . . . . . . . A . 8 ASN CB . . . . . . . . . c30225_5ug3 1 . 9 . 2387 . 1 1 8 ASN CG C -0.961 5.766 2.313 . . . 1.0 . . . . . . . . . . . . A . 8 ASN CG . . . . . . . . . c30225_5ug3 1 . 9 . 2388 . 1 1 8 ASN H H -0.171 4.658 -0.838 . . . 1.0 . . . . . . . . . . . . A . 8 ASN H . . . . . . . . . c30225_5ug3 1 . 9 . 2389 . 1 1 8 ASN HA H 0.814 7.027 0.598 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HA . . . . . . . . . c30225_5ug3 1 . 9 . 2390 . 1 1 8 ASN HB2 H 0.387 4.250 1.712 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HB2 . . . . . . . . . c30225_5ug3 1 . 9 . 2391 . 1 1 8 ASN HB3 H 1.133 5.585 2.581 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HB3 . . . . . . . . . c30225_5ug3 1 . 9 . 2392 . 1 1 8 ASN HD21 H -1.807 4.354 1.215 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HD21 . . . . . . . . . c30225_5ug3 1 . 9 . 2393 . 1 1 8 ASN HD22 H -2.892 5.350 2.124 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HD22 . . . . . . . . . c30225_5ug3 1 . 9 . 2394 . 1 1 8 ASN N N -0.155 5.587 -0.527 . . . 1.0 . . . . . . . . . . . . A . 8 ASN N . . . . . . . . . c30225_5ug3 1 . 9 . 2395 . 1 1 8 ASN ND2 N -1.988 5.088 1.839 . . . 1.0 . . . . . . . . . . . . A . 8 ASN ND2 . . . . . . . . . c30225_5ug3 1 . 9 . 2396 . 1 1 8 ASN O O 2.503 4.289 0.378 . . . 1.0 . . . . . . . . . . . . A . 8 ASN O . . . . . . . . . c30225_5ug3 1 . 9 . 2397 . 1 1 8 ASN OD1 O -1.089 6.711 3.089 . . . 1.0 . . . . . . . . . . . . A . 8 ASN OD1 . . . . . . . . . c30225_5ug3 1 . 9 . 2398 . 1 1 9 PRO C C 5.225 5.370 0.073 . . . 1.0 . . . . . . . . . . . . A . 9 PRO C . . . . . . . . . c30225_5ug3 1 . 9 . 2399 . 1 1 9 PRO CA C 4.298 5.872 -1.031 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CA . . . . . . . . . c30225_5ug3 1 . 9 . 2400 . 1 1 9 PRO CB C 4.858 7.141 -1.683 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CB . . . . . . . . . c30225_5ug3 1 . 9 . 2401 . 1 1 9 PRO CD C 2.724 7.708 -0.812 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CD . . . . . . . . . c30225_5ug3 1 . 9 . 2402 . 1 1 9 PRO CG C 4.094 8.257 -1.065 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CG . . . . . . . . . c30225_5ug3 1 . 9 . 2403 . 1 1 9 PRO HA H 4.192 5.096 -1.776 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HA . . . . . . . . . c30225_5ug3 1 . 9 . 2404 . 1 1 9 PRO HB2 H 5.915 7.220 -1.478 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HB2 . . . . . . . . . c30225_5ug3 1 . 9 . 2405 . 1 1 9 PRO HB3 H 4.692 7.100 -2.745 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HB3 . . . . . . . . . c30225_5ug3 1 . 9 . 2406 . 1 1 9 PRO HD2 H 2.277 8.196 0.034 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HD2 . . . . . . . . . c30225_5ug3 1 . 9 . 2407 . 1 1 9 PRO HD3 H 2.102 7.817 -1.688 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HD3 . . . . . . . . . c30225_5ug3 1 . 9 . 2408 . 1 1 9 PRO HG2 H 4.560 8.552 -0.135 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HG2 . . . . . . . . . c30225_5ug3 1 . 9 . 2409 . 1 1 9 PRO HG3 H 4.045 9.092 -1.747 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HG3 . . . . . . . . . c30225_5ug3 1 . 9 . 2410 . 1 1 9 PRO N N 2.990 6.286 -0.528 . . . 1.0 . . . . . . . . . . . . A . 9 PRO N . . . . . . . . . c30225_5ug3 1 . 9 . 2411 . 1 1 9 PRO O O 6.219 4.707 -0.202 . . . 1.0 . . . . . . . . . . . . A . 9 PRO O . . . . . . . . . c30225_5ug3 1 . 9 . 2412 . 1 1 10 VAL C C 5.313 3.801 2.852 . . . 1.0 . . . . . . . . . . . . A . 10 VAL C . . . . . . . . . c30225_5ug3 1 . 9 . 2413 . 1 1 10 VAL CA C 5.705 5.221 2.444 . . . 1.0 . . . . . . . . . . . . A . 10 VAL CA . . . . . . . . . c30225_5ug3 1 . 9 . 2414 . 1 1 10 VAL CB C 5.571 6.173 3.654 . . . 1.0 . . . . . . . . . . . . A . 10 VAL CB . . . . . . . . . c30225_5ug3 1 . 9 . 2415 . 1 1 10 VAL CG1 C 6.446 5.712 4.810 . . . 1.0 . . . . . . . . . . . . A . 10 VAL CG1 . . . . . . . . . c30225_5ug3 1 . 9 . 2416 . 1 1 10 VAL CG2 C 5.924 7.599 3.255 . . . 1.0 . . . . . . . . . . . . A . 10 VAL CG2 . . . . . . . . . c30225_5ug3 1 . 9 . 2417 . 1 1 10 VAL H H 4.069 6.187 1.489 . . . 1.0 . . . . . . . . . . . . A . 10 VAL H . . . . . . . . . c30225_5ug3 1 . 9 . 2418 . 1 1 10 VAL HA H 6.742 5.213 2.124 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HA . . . . . . . . . c30225_5ug3 1 . 9 . 2419 . 1 1 10 VAL HB H 4.543 6.160 3.983 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HB . . . . . . . . . c30225_5ug3 1 . 9 . 2420 . 1 1 10 VAL HG11 H 6.192 4.695 5.069 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HG11 . . . . . . . . . c30225_5ug3 1 . 9 . 2421 . 1 1 10 VAL HG12 H 6.283 6.353 5.663 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HG12 . . . . . . . . . c30225_5ug3 1 . 9 . 2422 . 1 1 10 VAL HG13 H 7.484 5.760 4.517 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HG13 . . . . . . . . . c30225_5ug3 1 . 9 . 2423 . 1 1 10 VAL HG21 H 5.280 7.920 2.452 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HG21 . . . . . . . . . c30225_5ug3 1 . 9 . 2424 . 1 1 10 VAL HG22 H 6.951 7.637 2.928 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HG22 . . . . . . . . . c30225_5ug3 1 . 9 . 2425 . 1 1 10 VAL HG23 H 5.793 8.253 4.104 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HG23 . . . . . . . . . c30225_5ug3 1 . 9 . 2426 . 1 1 10 VAL N N 4.893 5.668 1.320 . . . 1.0 . . . . . . . . . . . . A . 10 VAL N . . . . . . . . . c30225_5ug3 1 . 9 . 2427 . 1 1 10 VAL O O 6.161 2.968 3.171 . . . 1.0 . . . . . . . . . . . . A . 10 VAL O . . . . . . . . . c30225_5ug3 1 . 9 . 2428 . 1 1 11 CYS C C 3.938 1.182 2.089 . . . 1.0 . . . . . . . . . . . . A . 11 CYS C . . . . . . . . . c30225_5ug3 1 . 9 . 2429 . 1 1 11 CYS CA C 3.561 2.187 3.174 . . . 1.0 . . . . . . . . . . . . A . 11 CYS CA . . . . . . . . . c30225_5ug3 1 . 9 . 2430 . 1 1 11 CYS CB C 2.045 2.187 3.403 . . . 1.0 . . . . . . . . . . . . A . 11 CYS CB . . . . . . . . . c30225_5ug3 1 . 9 . 2431 . 1 1 11 CYS H H 3.382 4.204 2.562 . . . 1.0 . . . . . . . . . . . . A . 11 CYS H . . . . . . . . . c30225_5ug3 1 . 9 . 2432 . 1 1 11 CYS HA H 4.053 1.903 4.093 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HA . . . . . . . . . c30225_5ug3 1 . 9 . 2433 . 1 1 11 CYS HB2 H 1.790 2.993 4.070 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HB2 . . . . . . . . . c30225_5ug3 1 . 9 . 2434 . 1 1 11 CYS HB3 H 1.547 2.339 2.457 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HB3 . . . . . . . . . c30225_5ug3 1 . 9 . 2435 . 1 1 11 CYS N N 4.028 3.513 2.818 . . . 1.0 . . . . . . . . . . . . A . 11 CYS N . . . . . . . . . c30225_5ug3 1 . 9 . 2436 . 1 1 11 CYS O O 4.274 0.036 2.386 . . . 1.0 . . . . . . . . . . . . A . 11 CYS O . . . . . . . . . c30225_5ug3 1 . 9 . 2437 . 1 1 11 CYS SG S 1.397 0.643 4.131 . . . 1.0 . . . . . . . . . . . . A . 11 CYS SG . . . . . . . . . c30225_5ug3 1 . 9 . 2438 . 1 1 12 ARG C C 5.625 0.426 -0.554 . . . 1.0 . . . . . . . . . . . . A . 12 ARG C . . . . . . . . . c30225_5ug3 1 . 9 . 2439 . 1 1 12 ARG CA C 4.153 0.697 -0.276 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CA . . . . . . . . . c30225_5ug3 1 . 9 . 2440 . 1 1 12 ARG CB C 3.447 1.156 -1.540 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CB . . . . . . . . . c30225_5ug3 1 . 9 . 2441 . 1 1 12 ARG CD C 2.911 3.047 -3.062 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CD . . . . . . . . . c30225_5ug3 1 . 9 . 2442 . 1 1 12 ARG CG C 3.716 2.591 -1.866 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CG . . . . . . . . . c30225_5ug3 1 . 9 . 2443 . 1 1 12 ARG CZ C 2.424 2.196 -5.336 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CZ . . . . . . . . . c30225_5ug3 1 . 9 . 2444 . 1 1 12 ARG H H 3.720 2.562 0.638 . . . 1.0 . . . . . . . . . . . . A . 12 ARG H . . . . . . . . . c30225_5ug3 1 . 9 . 2445 . 1 1 12 ARG HA H 3.722 -0.215 0.022 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HA . . . . . . . . . c30225_5ug3 1 . 9 . 2446 . 1 1 12 ARG HB2 H 3.782 0.553 -2.369 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HB2 . . . . . . . . . c30225_5ug3 1 . 9 . 2447 . 1 1 12 ARG HB3 H 2.382 1.028 -1.415 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HB3 . . . . . . . . . c30225_5ug3 1 . 9 . 2448 . 1 1 12 ARG HD2 H 1.865 2.960 -2.815 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HD2 . . . . . . . . . c30225_5ug3 1 . 9 . 2449 . 1 1 12 ARG HD3 H 3.147 4.080 -3.273 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HD3 . . . . . . . . . c30225_5ug3 1 . 9 . 2450 . 1 1 12 ARG HE H 4.017 1.692 -4.232 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HE . . . . . . . . . c30225_5ug3 1 . 9 . 2451 . 1 1 12 ARG HG2 H 3.438 3.173 -1.006 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HG2 . . . . . . . . . c30225_5ug3 1 . 9 . 2452 . 1 1 12 ARG HG3 H 4.769 2.718 -2.072 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HG3 . . . . . . . . . c30225_5ug3 1 . 9 . 2453 . 1 1 12 ARG HH11 H 1.056 3.524 -4.639 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH11 . . . . . . . . . c30225_5ug3 1 . 9 . 2454 . 1 1 12 ARG HH12 H 0.736 2.890 -6.221 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH12 . . . . . . . . . c30225_5ug3 1 . 9 . 2455 . 1 1 12 ARG HH21 H 3.607 0.875 -6.320 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH21 . . . . . . . . . c30225_5ug3 1 . 9 . 2456 . 1 1 12 ARG HH22 H 2.191 1.392 -7.180 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH22 . . . . . . . . . c30225_5ug3 1 . 9 . 2457 . 1 1 12 ARG N N 3.918 1.616 0.828 . . . 1.0 . . . . . . . . . . . . A . 12 ARG N . . . . . . . . . c30225_5ug3 1 . 9 . 2458 . 1 1 12 ARG NE N 3.196 2.239 -4.249 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NE . . . . . . . . . c30225_5ug3 1 . 9 . 2459 . 1 1 12 ARG NH1 N 1.318 2.931 -5.405 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NH1 . . . . . . . . . c30225_5ug3 1 . 9 . 2460 . 1 1 12 ARG NH2 N 2.768 1.427 -6.360 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NH2 . . . . . . . . . c30225_5ug3 1 . 9 . 2461 . 1 1 12 ARG O O 5.956 -0.542 -1.230 . . . 1.0 . . . . . . . . . . . . A . 12 ARG O . . . . . . . . . c30225_5ug3 1 . 9 . 2462 . 1 1 13 VAL C C 8.382 -0.142 0.655 . . . 1.0 . . . . . . . . . . . . A . 13 VAL C . . . . . . . . . c30225_5ug3 1 . 9 . 2463 . 1 1 13 VAL CA C 7.927 1.018 -0.225 . . . 1.0 . . . . . . . . . . . . A . 13 VAL CA . . . . . . . . . c30225_5ug3 1 . 9 . 2464 . 1 1 13 VAL CB C 8.768 2.264 0.079 . . . 1.0 . . . . . . . . . . . . A . 13 VAL CB . . . . . . . . . c30225_5ug3 1 . 9 . 2465 . 1 1 13 VAL CG1 C 8.709 3.252 -1.073 . . . 1.0 . . . . . . . . . . . . A . 13 VAL CG1 . . . . . . . . . c30225_5ug3 1 . 9 . 2466 . 1 1 13 VAL CG2 C 8.309 2.911 1.364 . . . 1.0 . . . . . . . . . . . . A . 13 VAL CG2 . . . . . . . . . c30225_5ug3 1 . 9 . 2467 . 1 1 13 VAL H H 6.216 2.068 0.401 . . . 1.0 . . . . . . . . . . . . A . 13 VAL H . . . . . . . . . c30225_5ug3 1 . 9 . 2468 . 1 1 13 VAL HA H 8.094 0.748 -1.259 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HA . . . . . . . . . c30225_5ug3 1 . 9 . 2469 . 1 1 13 VAL HB H 9.780 1.960 0.209 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HB . . . . . . . . . c30225_5ug3 1 . 9 . 2470 . 1 1 13 VAL HG11 H 7.687 3.556 -1.236 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HG11 . . . . . . . . . c30225_5ug3 1 . 9 . 2471 . 1 1 13 VAL HG12 H 9.093 2.784 -1.967 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HG12 . . . . . . . . . c30225_5ug3 1 . 9 . 2472 . 1 1 13 VAL HG13 H 9.309 4.118 -0.835 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HG13 . . . . . . . . . c30225_5ug3 1 . 9 . 2473 . 1 1 13 VAL HG21 H 7.257 3.155 1.285 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HG21 . . . . . . . . . c30225_5ug3 1 . 9 . 2474 . 1 1 13 VAL HG22 H 8.878 3.809 1.542 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HG22 . . . . . . . . . c30225_5ug3 1 . 9 . 2475 . 1 1 13 VAL HG23 H 8.451 2.220 2.181 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HG23 . . . . . . . . . c30225_5ug3 1 . 9 . 2476 . 1 1 13 VAL N N 6.511 1.268 -0.064 . . . 1.0 . . . . . . . . . . . . A . 13 VAL N . . . . . . . . . c30225_5ug3 1 . 9 . 2477 . 1 1 13 VAL O O 9.280 -0.897 0.272 . . . 1.0 . . . . . . . . . . . . A . 13 VAL O . . . . . . . . . c30225_5ug3 1 . 9 . 2478 . 1 1 14 ASN C C 7.662 -2.732 2.022 . . . 1.0 . . . . . . . . . . . . A . 14 ASN C . . . . . . . . . c30225_5ug3 1 . 9 . 2479 . 1 1 14 ASN CA C 8.094 -1.438 2.691 . . . 1.0 . . . . . . . . . . . . A . 14 ASN CA . . . . . . . . . c30225_5ug3 1 . 9 . 2480 . 1 1 14 ASN CB C 7.401 -1.371 4.058 . . . 1.0 . . . . . . . . . . . . A . 14 ASN CB . . . . . . . . . c30225_5ug3 1 . 9 . 2481 . 1 1 14 ASN CG C 7.325 0.018 4.636 . . . 1.0 . . . . . . . . . . . . A . 14 ASN CG . . . . . . . . . c30225_5ug3 1 . 9 . 2482 . 1 1 14 ASN H H 7.113 0.384 2.136 . . . 1.0 . . . . . . . . . . . . A . 14 ASN H . . . . . . . . . c30225_5ug3 1 . 9 . 2483 . 1 1 14 ASN HA H 9.164 -1.455 2.835 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HA . . . . . . . . . c30225_5ug3 1 . 9 . 2484 . 1 1 14 ASN HB2 H 6.394 -1.746 3.957 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HB2 . . . . . . . . . c30225_5ug3 1 . 9 . 2485 . 1 1 14 ASN HB3 H 7.941 -1.999 4.752 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HB3 . . . . . . . . . c30225_5ug3 1 . 9 . 2486 . 1 1 14 ASN HD21 H 5.408 0.118 4.130 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HD21 . . . . . . . . . c30225_5ug3 1 . 9 . 2487 . 1 1 14 ASN HD22 H 6.063 1.523 4.914 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HD22 . . . . . . . . . c30225_5ug3 1 . 9 . 2488 . 1 1 14 ASN N N 7.770 -0.294 1.833 . . . 1.0 . . . . . . . . . . . . A . 14 ASN N . . . . . . . . . c30225_5ug3 1 . 9 . 2489 . 1 1 14 ASN ND2 N 6.150 0.612 4.554 . . . 1.0 . . . . . . . . . . . . A . 14 ASN ND2 . . . . . . . . . c30225_5ug3 1 . 9 . 2490 . 1 1 14 ASN O O 8.439 -3.679 1.907 . . . 1.0 . . . . . . . . . . . . A . 14 ASN O . . . . . . . . . c30225_5ug3 1 . 9 . 2491 . 1 1 14 ASN OD1 O 8.297 0.533 5.189 . . . 1.0 . . . . . . . . . . . . A . 14 ASN OD1 . . . . . . . . . c30225_5ug3 1 . 9 . 2492 . 1 1 15 ASN C C 6.173 -4.188 -0.389 . . . 1.0 . . . . . . . . . . . . A . 15 ASN C . . . . . . . . . c30225_5ug3 1 . 9 . 2493 . 1 1 15 ASN CA C 5.794 -3.942 1.068 . . . 1.0 . . . . . . . . . . . . A . 15 ASN CA . . . . . . . . . c30225_5ug3 1 . 9 . 2494 . 1 1 15 ASN CB C 4.272 -3.803 1.245 . . . 1.0 . . . . . . . . . . . . A . 15 ASN CB . . . . . . . . . c30225_5ug3 1 . 9 . 2495 . 1 1 15 ASN CG C 3.606 -2.777 0.329 . . . 1.0 . . . . . . . . . . . . A . 15 ASN CG . . . . . . . . . c30225_5ug3 1 . 9 . 2496 . 1 1 15 ASN H H 5.880 -1.950 1.611 . . . 1.0 . . . . . . . . . . . . A . 15 ASN H . . . . . . . . . c30225_5ug3 1 . 9 . 2497 . 1 1 15 ASN HA H 6.136 -4.782 1.658 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HA . . . . . . . . . c30225_5ug3 1 . 9 . 2498 . 1 1 15 ASN HB2 H 3.816 -4.752 1.065 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HB2 . . . . . . . . . c30225_5ug3 1 . 9 . 2499 . 1 1 15 ASN HB3 H 4.076 -3.508 2.269 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HB3 . . . . . . . . . c30225_5ug3 1 . 9 . 2500 . 1 1 15 ASN HD21 H 2.297 -2.357 1.749 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HD21 . . . . . . . . . c30225_5ug3 1 . 9 . 2501 . 1 1 15 ASN HD22 H 2.123 -1.474 0.277 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HD22 . . . . . . . . . c30225_5ug3 1 . 9 . 2502 . 1 1 15 ASN N N 6.414 -2.756 1.583 . . . 1.0 . . . . . . . . . . . . A . 15 ASN N . . . . . . . . . c30225_5ug3 1 . 9 . 2503 . 1 1 15 ASN ND2 N 2.572 -2.136 0.834 . . . 1.0 . . . . . . . . . . . . A . 15 ASN ND2 . . . . . . . . . c30225_5ug3 1 . 9 . 2504 . 1 1 15 ASN O O 6.611 -3.288 -1.103 . . . 1.0 . . . . . . . . . . . . A . 15 ASN O . . . . . . . . . c30225_5ug3 1 . 9 . 2505 . 1 1 15 ASN OD1 O 3.992 -2.571 -0.814 . . . 1.0 . . . . . . . . . . . . A . 15 ASN OD1 . . . . . . . . . c30225_5ug3 1 . 9 . 2506 . 1 1 16 HYP C C 5.060 -5.514 -3.104 . . . 1.0 . . . . . . . . . . . . A . 16 HYP C . . . . . . . . . c30225_5ug3 1 . 9 . 2507 . 1 1 16 HYP CA C 6.255 -5.841 -2.216 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CA . . . . . . . . . c30225_5ug3 1 . 9 . 2508 . 1 1 16 HYP CB C 6.410 -7.334 -2.070 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CB . . . . . . . . . c30225_5ug3 1 . 9 . 2509 . 1 1 16 HYP CD C 5.683 -6.565 0.079 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CD . . . . . . . . . c30225_5ug3 1 . 9 . 2510 . 1 1 16 HYP CG C 5.935 -7.805 -0.719 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CG . . . . . . . . . c30225_5ug3 1 . 9 . 2511 . 1 1 16 HYP HA H 7.155 -5.412 -2.628 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HA . . . . . . . . . c30225_5ug3 1 . 9 . 2512 . 1 1 16 HYP HB2 H 7.450 -7.596 -2.182 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HB2 . . . . . . . . . c30225_5ug3 1 . 9 . 2513 . 1 1 16 HYP HB3 H 5.832 -7.824 -2.842 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HB3 . . . . . . . . . c30225_5ug3 1 . 9 . 2514 . 1 1 16 HYP HD1 H 7.134 -8.019 0.773 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HD1 . . . . . . . . . c30225_5ug3 1 . 9 . 2515 . 1 1 16 HYP HD22 H 4.663 -6.508 0.380 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HD22 . . . . . . . . . c30225_5ug3 1 . 9 . 2516 . 1 1 16 HYP HD23 H 6.317 -6.559 0.951 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HD23 . . . . . . . . . c30225_5ug3 1 . 9 . 2517 . 1 1 16 HYP HG H 5.048 -8.413 -0.816 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HG . . . . . . . . . c30225_5ug3 1 . 9 . 2518 . 1 1 16 HYP N N 6.036 -5.436 -0.817 . . . 1.0 . . . . . . . . . . . . A . 16 HYP N . . . . . . . . . c30225_5ug3 1 . 9 . 2519 . 1 1 16 HYP O O 4.522 -6.392 -3.781 . . . 1.0 . . . . . . . . . . . . A . 16 HYP O . . . . . . . . . c30225_5ug3 1 . 9 . 2520 . 1 1 16 HYP OD1 O 6.946 -8.514 -0.037 . . . 1.0 . . . . . . . . . . . . A . 16 HYP OD1 . . . . . . . . . c30225_5ug3 1 . 9 . 2521 . 1 1 17 HIS C C 2.180 -4.302 -3.289 . . . 1.0 . . . . . . . . . . . . A . 17 HIS C . . . . . . . . . c30225_5ug3 1 . 9 . 2522 . 1 1 17 HIS CA C 3.502 -3.757 -3.846 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CA . . . . . . . . . c30225_5ug3 1 . 9 . 2523 . 1 1 17 HIS CB C 3.677 -4.113 -5.336 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CB . . . . . . . . . c30225_5ug3 1 . 9 . 2524 . 1 1 17 HIS CD2 C 2.300 -2.268 -6.545 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CD2 . . . . . . . . . c30225_5ug3 1 . 9 . 2525 . 1 1 17 HIS CE1 C 0.975 -3.568 -7.703 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CE1 . . . . . . . . . c30225_5ug3 1 . 9 . 2526 . 1 1 17 HIS CG C 2.626 -3.548 -6.248 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CG . . . . . . . . . c30225_5ug3 1 . 9 . 2527 . 1 1 17 HIS H H 5.100 -3.629 -2.450 . . . 1.0 . . . . . . . . . . . . A . 17 HIS H . . . . . . . . . c30225_5ug3 1 . 9 . 2528 . 1 1 17 HIS HA H 3.489 -2.681 -3.747 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HA . . . . . . . . . c30225_5ug3 1 . 9 . 2529 . 1 1 17 HIS HB2 H 4.633 -3.743 -5.671 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HB2 . . . . . . . . . c30225_5ug3 1 . 9 . 2530 . 1 1 17 HIS HB3 H 3.660 -5.188 -5.440 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HB3 . . . . . . . . . c30225_5ug3 1 . 9 . 2531 . 1 1 17 HIS HD1 H 1.762 -5.320 -6.994 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HD1 . . . . . . . . . c30225_5ug3 1 . 9 . 2532 . 1 1 17 HIS HD2 H 2.759 -1.378 -6.137 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HD2 . . . . . . . . . c30225_5ug3 1 . 9 . 2533 . 1 1 17 HIS HE1 H 0.204 -3.915 -8.376 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HE1 . . . . . . . . . c30225_5ug3 1 . 9 . 2534 . 1 1 17 HIS HE2 H 0.973 -1.549 -8.001 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HE2 . . . . . . . . . c30225_5ug3 1 . 9 . 2535 . 1 1 17 HIS N N 4.636 -4.253 -3.055 . . . 1.0 . . . . . . . . . . . . A . 17 HIS N . . . . . . . . . c30225_5ug3 1 . 9 . 2536 . 1 1 17 HIS ND1 N 1.775 -4.335 -6.989 . . . 1.0 . . . . . . . . . . . . A . 17 HIS ND1 . . . . . . . . . c30225_5ug3 1 . 9 . 2537 . 1 1 17 HIS NE2 N 1.271 -2.308 -7.453 . . . 1.0 . . . . . . . . . . . . A . 17 HIS NE2 . . . . . . . . . c30225_5ug3 1 . 9 . 2538 . 1 1 17 HIS O O 1.121 -4.169 -3.904 . . . 1.0 . . . . . . . . . . . . A . 17 HIS O . . . . . . . . . c30225_5ug3 1 . 9 . 2539 . 1 1 18 VAL C C 0.484 -4.373 -0.519 . . . 1.0 . . . . . . . . . . . . A . 18 VAL C . . . . . . . . . c30225_5ug3 1 . 9 . 2540 . 1 1 18 VAL CA C 1.067 -5.430 -1.444 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CA . . . . . . . . . c30225_5ug3 1 . 9 . 2541 . 1 1 18 VAL CB C 1.399 -6.712 -0.645 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CB . . . . . . . . . c30225_5ug3 1 . 9 . 2542 . 1 1 18 VAL CG1 C 0.132 -7.372 -0.118 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CG1 . . . . . . . . . c30225_5ug3 1 . 9 . 2543 . 1 1 18 VAL CG2 C 2.191 -7.687 -1.503 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CG2 . . . . . . . . . c30225_5ug3 1 . 9 . 2544 . 1 1 18 VAL H H 3.100 -4.894 -1.622 . . . 1.0 . . . . . . . . . . . . A . 18 VAL H . . . . . . . . . c30225_5ug3 1 . 9 . 2545 . 1 1 18 VAL HA H 0.342 -5.673 -2.209 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HA . . . . . . . . . c30225_5ug3 1 . 9 . 2546 . 1 1 18 VAL HB H 2.011 -6.434 0.201 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HB . . . . . . . . . c30225_5ug3 1 . 9 . 2547 . 1 1 18 VAL HG11 H -0.401 -6.676 0.511 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG11 . . . . . . . . . c30225_5ug3 1 . 9 . 2548 . 1 1 18 VAL HG12 H 0.395 -8.248 0.457 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG12 . . . . . . . . . c30225_5ug3 1 . 9 . 2549 . 1 1 18 VAL HG13 H -0.496 -7.661 -0.948 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG13 . . . . . . . . . c30225_5ug3 1 . 9 . 2550 . 1 1 18 VAL HG21 H 3.111 -7.221 -1.823 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG21 . . . . . . . . . c30225_5ug3 1 . 9 . 2551 . 1 1 18 VAL HG22 H 1.607 -7.961 -2.369 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG22 . . . . . . . . . c30225_5ug3 1 . 9 . 2552 . 1 1 18 VAL HG23 H 2.417 -8.572 -0.928 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG23 . . . . . . . . . c30225_5ug3 1 . 9 . 2553 . 1 1 18 VAL N N 2.245 -4.876 -2.094 . . . 1.0 . . . . . . . . . . . . A . 18 VAL N . . . . . . . . . c30225_5ug3 1 . 9 . 2554 . 1 1 18 VAL O O 0.567 -4.469 0.706 . . . 1.0 . . . . . . . . . . . . A . 18 VAL O . . . . . . . . . c30225_5ug3 1 . 9 . 2555 . 1 1 19 CYS C C -2.057 -2.241 -0.185 . . . 1.0 . . . . . . . . . . . . A . 19 CYS C . . . . . . . . . c30225_5ug3 1 . 9 . 2556 . 1 1 19 CYS CA C -0.545 -2.189 -0.394 . . . 1.0 . . . . . . . . . . . . A . 19 CYS CA . . . . . . . . . c30225_5ug3 1 . 9 . 2557 . 1 1 19 CYS CB C -0.132 -0.920 -1.143 . . . 1.0 . . . . . . . . . . . . A . 19 CYS CB . . . . . . . . . c30225_5ug3 1 . 9 . 2558 . 1 1 19 CYS H H -0.163 -3.361 -2.104 . . . 1.0 . . . . . . . . . . . . A . 19 CYS H . . . . . . . . . c30225_5ug3 1 . 9 . 2559 . 1 1 19 CYS HA H -0.064 -2.193 0.571 . . . 1.0 . . . . . . . . . . . . A . 19 CYS HA . . . . . . . . . c30225_5ug3 1 . 9 . 2560 . 1 1 19 CYS HB2 H -0.724 -0.092 -0.784 . . . 1.0 . . . . . . . . . . . . A . 19 CYS HB2 . . . . . . . . . c30225_5ug3 1 . 9 . 2561 . 1 1 19 CYS HB3 H 0.911 -0.721 -0.944 . . . 1.0 . . . . . . . . . . . . A . 19 CYS HB3 . . . . . . . . . c30225_5ug3 1 . 9 . 2562 . 1 1 19 CYS N N -0.069 -3.342 -1.128 . . . 1.0 . . . . . . . . . . . . A . 19 CYS N . . . . . . . . . c30225_5ug3 1 . 9 . 2563 . 1 1 19 CYS O O -2.573 -3.336 0.117 . . . 1.0 . . . . . . . . . . . . A . 19 CYS O . . . . . . . . . c30225_5ug3 1 . 9 . 2564 . 1 1 19 CYS OXT O -2.716 -1.186 -0.287 . . . 1.0 . . . . . . . . . . . . A . 19 CYS OXT . . . . . . . . . c30225_5ug3 1 . 9 . 2565 . 1 1 19 CYS SG S -0.343 -1.002 -2.955 . . . 1.0 . . . . . . . . . . . . A . 19 CYS SG . . . . . . . . . c30225_5ug3 1 . 10 . 2566 . 1 1 1 ILE C C -8.236 -4.654 0.038 . . . 1.0 . . . . . . . . . . . . A . 1 ILE C . . . . . . . . . c30225_5ug3 1 . 10 . 2567 . 1 1 1 ILE CA C -8.020 -6.100 0.463 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CA . . . . . . . . . c30225_5ug3 1 . 10 . 2568 . 1 1 1 ILE CB C -6.577 -6.522 0.096 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CB . . . . . . . . . c30225_5ug3 1 . 10 . 2569 . 1 1 1 ILE CD1 C -6.623 -8.416 1.806 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CD1 . . . . . . . . . c30225_5ug3 1 . 10 . 2570 . 1 1 1 ILE CG1 C -6.369 -8.016 0.369 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CG1 . . . . . . . . . c30225_5ug3 1 . 10 . 2571 . 1 1 1 ILE CG2 C -5.560 -5.691 0.869 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CG2 . . . . . . . . . c30225_5ug3 1 . 10 . 2572 . 1 1 1 ILE H1 H -8.930 -6.901 -1.225 . . . 1.0 . . . . . . . . . . . . A . 1 ILE H1 . . . . . . . . . c30225_5ug3 1 . 10 . 2573 . 1 1 1 ILE H2 H -9.979 -6.681 0.079 . . . 1.0 . . . . . . . . . . . . A . 1 ILE H2 . . . . . . . . . c30225_5ug3 1 . 10 . 2574 . 1 1 1 ILE H3 H -8.876 -7.960 0.092 . . . 1.0 . . . . . . . . . . . . A . 1 ILE H3 . . . . . . . . . c30225_5ug3 1 . 10 . 2575 . 1 1 1 ILE HA H -8.142 -6.176 1.533 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HA . . . . . . . . . c30225_5ug3 1 . 10 . 2576 . 1 1 1 ILE HB H -6.431 -6.333 -0.956 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HB . . . . . . . . . c30225_5ug3 1 . 10 . 2577 . 1 1 1 ILE HD11 H -6.449 -9.475 1.919 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HD11 . . . . . . . . . c30225_5ug3 1 . 10 . 2578 . 1 1 1 ILE HD12 H -7.645 -8.189 2.066 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HD12 . . . . . . . . . c30225_5ug3 1 . 10 . 2579 . 1 1 1 ILE HD13 H -5.956 -7.871 2.455 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HD13 . . . . . . . . . c30225_5ug3 1 . 10 . 2580 . 1 1 1 ILE HG12 H -7.040 -8.584 -0.255 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG12 . . . . . . . . . c30225_5ug3 1 . 10 . 2581 . 1 1 1 ILE HG13 H -5.350 -8.278 0.127 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG13 . . . . . . . . . c30225_5ug3 1 . 10 . 2582 . 1 1 1 ILE HG21 H -4.562 -5.993 0.588 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG21 . . . . . . . . . c30225_5ug3 1 . 10 . 2583 . 1 1 1 ILE HG22 H -5.698 -5.846 1.928 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG22 . . . . . . . . . c30225_5ug3 1 . 10 . 2584 . 1 1 1 ILE HG23 H -5.698 -4.645 0.637 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG23 . . . . . . . . . c30225_5ug3 1 . 10 . 2585 . 1 1 1 ILE N N -9.018 -6.971 -0.192 . . . 1.0 . . . . . . . . . . . . A . 1 ILE N . . . . . . . . . c30225_5ug3 1 . 10 . 2586 . 1 1 1 ILE O O -8.455 -4.377 -1.142 . . . 1.0 . . . . . . . . . . . . A . 1 ILE O . . . . . . . . . c30225_5ug3 1 . 10 . 2587 . 1 1 2 ARG C C -6.993 -1.749 0.293 . . . 1.0 . . . . . . . . . . . . A . 2 ARG C . . . . . . . . . c30225_5ug3 1 . 10 . 2588 . 1 1 2 ARG CA C -8.340 -2.326 0.697 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CA . . . . . . . . . c30225_5ug3 1 . 10 . 2589 . 1 1 2 ARG CB C -8.881 -1.554 1.903 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CB . . . . . . . . . c30225_5ug3 1 . 10 . 2590 . 1 1 2 ARG CD C -10.708 -1.237 3.601 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CD . . . . . . . . . c30225_5ug3 1 . 10 . 2591 . 1 1 2 ARG CG C -10.166 -2.118 2.483 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CG . . . . . . . . . c30225_5ug3 1 . 10 . 2592 . 1 1 2 ARG CZ C -10.047 -0.722 5.926 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CZ . . . . . . . . . c30225_5ug3 1 . 10 . 2593 . 1 1 2 ARG H H -8.060 -4.016 1.923 . . . 1.0 . . . . . . . . . . . . A . 2 ARG H . . . . . . . . . c30225_5ug3 1 . 10 . 2594 . 1 1 2 ARG HA H -9.026 -2.232 -0.124 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HA . . . . . . . . . c30225_5ug3 1 . 10 . 2595 . 1 1 2 ARG HB2 H -8.132 -1.563 2.674 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB2 . . . . . . . . . c30225_5ug3 1 . 10 . 2596 . 1 1 2 ARG HB3 H -9.065 -0.533 1.606 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB3 . . . . . . . . . c30225_5ug3 1 . 10 . 2597 . 1 1 2 ARG HD2 H -10.987 -0.282 3.183 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD2 . . . . . . . . . c30225_5ug3 1 . 10 . 2598 . 1 1 2 ARG HD3 H -11.582 -1.712 4.021 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD3 . . . . . . . . . c30225_5ug3 1 . 10 . 2599 . 1 1 2 ARG HE H -8.778 -1.084 4.424 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HE . . . . . . . . . c30225_5ug3 1 . 10 . 2600 . 1 1 2 ARG HG2 H -10.905 -2.181 1.699 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG2 . . . . . . . . . c30225_5ug3 1 . 10 . 2601 . 1 1 2 ARG HG3 H -9.970 -3.106 2.876 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG3 . . . . . . . . . c30225_5ug3 1 . 10 . 2602 . 1 1 2 ARG HH11 H -12.055 -0.794 5.629 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH11 . . . . . . . . . c30225_5ug3 1 . 10 . 2603 . 1 1 2 ARG HH12 H -11.558 -0.421 7.249 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH12 . . . . . . . . . c30225_5ug3 1 . 10 . 2604 . 1 1 2 ARG HH21 H -8.126 -0.574 6.549 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH21 . . . . . . . . . c30225_5ug3 1 . 10 . 2605 . 1 1 2 ARG HH22 H -9.327 -0.286 7.767 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH22 . . . . . . . . . c30225_5ug3 1 . 10 . 2606 . 1 1 2 ARG N N -8.196 -3.737 0.995 . . . 1.0 . . . . . . . . . . . . A . 2 ARG N . . . . . . . . . c30225_5ug3 1 . 10 . 2607 . 1 1 2 ARG NE N -9.728 -1.017 4.666 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NE . . . . . . . . . c30225_5ug3 1 . 10 . 2608 . 1 1 2 ARG NH1 N -11.321 -0.638 6.297 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH1 . . . . . . . . . c30225_5ug3 1 . 10 . 2609 . 1 1 2 ARG NH2 N -9.090 -0.512 6.818 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH2 . . . . . . . . . c30225_5ug3 1 . 10 . 2610 . 1 1 2 ARG O O -6.064 -1.704 1.100 . . . 1.0 . . . . . . . . . . . . A . 2 ARG O . . . . . . . . . c30225_5ug3 1 . 10 . 2611 . 1 1 3 ASP C C -5.540 0.732 -1.031 . . . 1.0 . . . . . . . . . . . . A . 3 ASP C . . . . . . . . . c30225_5ug3 1 . 10 . 2612 . 1 1 3 ASP CA C -5.641 -0.728 -1.444 . . . 1.0 . . . . . . . . . . . . A . 3 ASP CA . . . . . . . . . c30225_5ug3 1 . 10 . 2613 . 1 1 3 ASP CB C -5.542 -0.840 -2.964 . . . 1.0 . . . . . . . . . . . . A . 3 ASP CB . . . . . . . . . c30225_5ug3 1 . 10 . 2614 . 1 1 3 ASP CG C -5.475 -2.273 -3.446 . . . 1.0 . . . . . . . . . . . . A . 3 ASP CG . . . . . . . . . c30225_5ug3 1 . 10 . 2615 . 1 1 3 ASP H H -7.660 -1.360 -1.548 . . . 1.0 . . . . . . . . . . . . A . 3 ASP H . . . . . . . . . c30225_5ug3 1 . 10 . 2616 . 1 1 3 ASP HA H -4.823 -1.273 -0.996 . . . 1.0 . . . . . . . . . . . . A . 3 ASP HA . . . . . . . . . c30225_5ug3 1 . 10 . 2617 . 1 1 3 ASP HB2 H -6.405 -0.371 -3.411 . . . 1.0 . . . . . . . . . . . . A . 3 ASP HB2 . . . . . . . . . c30225_5ug3 1 . 10 . 2618 . 1 1 3 ASP HB3 H -4.650 -0.327 -3.290 . . . 1.0 . . . . . . . . . . . . A . 3 ASP HB3 . . . . . . . . . c30225_5ug3 1 . 10 . 2619 . 1 1 3 ASP N N -6.884 -1.306 -0.950 . . . 1.0 . . . . . . . . . . . . A . 3 ASP N . . . . . . . . . c30225_5ug3 1 . 10 . 2620 . 1 1 3 ASP O O -5.410 1.624 -1.869 . . . 1.0 . . . . . . . . . . . . A . 3 ASP O . . . . . . . . . c30225_5ug3 1 . 10 . 2621 . 1 1 3 ASP OD1 O -6.479 -2.766 -4.003 . . . 1.0 . . . . . . . . . . . . A . 3 ASP OD1 . . . . . . . . . c30225_5ug3 1 . 10 . 2622 . 1 1 3 ASP OD2 O -4.425 -2.915 -3.273 . . . 1.0 . . . . . . . . . . . . A . 3 ASP OD2 . . . . . . . . . c30225_5ug3 1 . 10 . 2623 . 1 1 4 GLU C C -4.162 2.817 0.923 . . . 1.0 . . . . . . . . . . . . A . 4 GLU C . . . . . . . . . c30225_5ug3 1 . 10 . 2624 . 1 1 4 GLU CA C -5.589 2.304 0.802 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CA . . . . . . . . . c30225_5ug3 1 . 10 . 2625 . 1 1 4 GLU CB C -6.275 2.313 2.164 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CB . . . . . . . . . c30225_5ug3 1 . 10 . 2626 . 1 1 4 GLU CD C -7.181 4.647 1.974 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CD . . . . . . . . . c30225_5ug3 1 . 10 . 2627 . 1 1 4 GLU CG C -6.333 3.687 2.783 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CG . . . . . . . . . c30225_5ug3 1 . 10 . 2628 . 1 1 4 GLU H H -5.634 0.212 0.887 . . . 1.0 . . . . . . . . . . . . A . 4 GLU H . . . . . . . . . c30225_5ug3 1 . 10 . 2629 . 1 1 4 GLU HA H -6.137 2.940 0.125 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HA . . . . . . . . . c30225_5ug3 1 . 10 . 2630 . 1 1 4 GLU HB2 H -7.284 1.945 2.052 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HB2 . . . . . . . . . c30225_5ug3 1 . 10 . 2631 . 1 1 4 GLU HB3 H -5.733 1.661 2.834 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HB3 . . . . . . . . . c30225_5ug3 1 . 10 . 2632 . 1 1 4 GLU HG2 H -6.743 3.611 3.778 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HG2 . . . . . . . . . c30225_5ug3 1 . 10 . 2633 . 1 1 4 GLU HG3 H -5.330 4.069 2.831 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HG3 . . . . . . . . . c30225_5ug3 1 . 10 . 2634 . 1 1 4 GLU N N -5.595 0.967 0.266 . . . 1.0 . . . . . . . . . . . . A . 4 GLU N . . . . . . . . . c30225_5ug3 1 . 10 . 2635 . 1 1 4 GLU O O -3.812 3.856 0.362 . . . 1.0 . . . . . . . . . . . . A . 4 GLU O . . . . . . . . . c30225_5ug3 1 . 10 . 2636 . 1 1 4 GLU OE1 O -6.608 5.472 1.233 . . . 1.0 . . . . . . . . . . . . A . 4 GLU OE1 . . . . . . . . . c30225_5ug3 1 . 10 . 2637 . 1 1 4 GLU OE2 O -8.423 4.585 2.073 . . . 1.0 . . . . . . . . . . . . A . 4 GLU OE2 . . . . . . . . . c30225_5ug3 1 . 10 . 2638 . 1 1 5 CYS C C -1.152 2.422 0.550 . . . 1.0 . . . . . . . . . . . . A . 5 CYS C . . . . . . . . . c30225_5ug3 1 . 10 . 2639 . 1 1 5 CYS CA C -1.950 2.460 1.854 . . . 1.0 . . . . . . . . . . . . A . 5 CYS CA . . . . . . . . . c30225_5ug3 1 . 10 . 2640 . 1 1 5 CYS CB C -1.310 1.540 2.883 . . . 1.0 . . . . . . . . . . . . A . 5 CYS CB . . . . . . . . . c30225_5ug3 1 . 10 . 2641 . 1 1 5 CYS H H -3.641 1.220 2.018 . . . 1.0 . . . . . . . . . . . . A . 5 CYS H . . . . . . . . . c30225_5ug3 1 . 10 . 2642 . 1 1 5 CYS HA H -1.953 3.470 2.235 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HA . . . . . . . . . c30225_5ug3 1 . 10 . 2643 . 1 1 5 CYS HB2 H -0.530 2.071 3.388 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HB2 . . . . . . . . . c30225_5ug3 1 . 10 . 2644 . 1 1 5 CYS HB3 H -2.059 1.243 3.603 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HB3 . . . . . . . . . c30225_5ug3 1 . 10 . 2645 . 1 1 5 CYS N N -3.324 2.062 1.626 . . . 1.0 . . . . . . . . . . . . A . 5 CYS N . . . . . . . . . c30225_5ug3 1 . 10 . 2646 . 1 1 5 CYS O O -0.025 2.903 0.482 . . . 1.0 . . . . . . . . . . . . A . 5 CYS O . . . . . . . . . c30225_5ug3 1 . 10 . 2647 . 1 1 5 CYS SG S -0.593 0.027 2.174 . . . 1.0 . . . . . . . . . . . . A . 5 CYS SG . . . . . . . . . c30225_5ug3 1 . 10 . 2648 . 1 1 6 CYS C C -0.938 3.197 -2.365 . . . 1.0 . . . . . . . . . . . . A . 6 CYS C . . . . . . . . . c30225_5ug3 1 . 10 . 2649 . 1 1 6 CYS CA C -1.135 1.792 -1.800 . . . 1.0 . . . . . . . . . . . . A . 6 CYS CA . . . . . . . . . c30225_5ug3 1 . 10 . 2650 . 1 1 6 CYS CB C -2.018 0.973 -2.732 . . . 1.0 . . . . . . . . . . . . A . 6 CYS CB . . . . . . . . . c30225_5ug3 1 . 10 . 2651 . 1 1 6 CYS H H -2.630 1.439 -0.356 . . . 1.0 . . . . . . . . . . . . A . 6 CYS H . . . . . . . . . c30225_5ug3 1 . 10 . 2652 . 1 1 6 CYS HA H -0.170 1.313 -1.705 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HA . . . . . . . . . c30225_5ug3 1 . 10 . 2653 . 1 1 6 CYS HB2 H -2.262 0.038 -2.251 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HB2 . . . . . . . . . c30225_5ug3 1 . 10 . 2654 . 1 1 6 CYS HB3 H -2.929 1.524 -2.914 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HB3 . . . . . . . . . c30225_5ug3 1 . 10 . 2655 . 1 1 6 CYS N N -1.750 1.849 -0.484 . . . 1.0 . . . . . . . . . . . . A . 6 CYS N . . . . . . . . . c30225_5ug3 1 . 10 . 2656 . 1 1 6 CYS O O -0.030 3.435 -3.156 . . . 1.0 . . . . . . . . . . . . A . 6 CYS O . . . . . . . . . c30225_5ug3 1 . 10 . 2657 . 1 1 6 CYS SG S -1.271 0.582 -4.344 . . . 1.0 . . . . . . . . . . . . A . 6 CYS SG . . . . . . . . . c30225_5ug3 1 . 10 . 2658 . 1 1 7 SER C C -0.678 6.273 -1.486 . . . 1.0 . . . . . . . . . . . . A . 7 SER C . . . . . . . . . c30225_5ug3 1 . 10 . 2659 . 1 1 7 SER CA C -1.679 5.521 -2.363 . . . 1.0 . . . . . . . . . . . . A . 7 SER CA . . . . . . . . . c30225_5ug3 1 . 10 . 2660 . 1 1 7 SER CB C -3.057 6.180 -2.281 . . . 1.0 . . . . . . . . . . . . A . 7 SER CB . . . . . . . . . c30225_5ug3 1 . 10 . 2661 . 1 1 7 SER H H -2.492 3.879 -1.303 . . . 1.0 . . . . . . . . . . . . A . 7 SER H . . . . . . . . . c30225_5ug3 1 . 10 . 2662 . 1 1 7 SER HA H -1.336 5.532 -3.387 . . . 1.0 . . . . . . . . . . . . A . 7 SER HA . . . . . . . . . c30225_5ug3 1 . 10 . 2663 . 1 1 7 SER HB2 H -3.312 6.355 -1.247 . . . 1.0 . . . . . . . . . . . . A . 7 SER HB2 . . . . . . . . . c30225_5ug3 1 . 10 . 2664 . 1 1 7 SER HB3 H -3.035 7.119 -2.813 . . . 1.0 . . . . . . . . . . . . A . 7 SER HB3 . . . . . . . . . c30225_5ug3 1 . 10 . 2665 . 1 1 7 SER HG H -3.630 4.725 -3.471 . . . 1.0 . . . . . . . . . . . . A . 7 SER HG . . . . . . . . . c30225_5ug3 1 . 10 . 2666 . 1 1 7 SER N N -1.780 4.131 -1.930 . . . 1.0 . . . . . . . . . . . . A . 7 SER N . . . . . . . . . c30225_5ug3 1 . 10 . 2667 . 1 1 7 SER O O -0.518 7.489 -1.592 . . . 1.0 . . . . . . . . . . . . A . 7 SER O . . . . . . . . . c30225_5ug3 1 . 10 . 2668 . 1 1 7 SER OG O -4.052 5.348 -2.864 . . . 1.0 . . . . . . . . . . . . A . 7 SER OG . . . . . . . . . c30225_5ug3 1 . 10 . 2669 . 1 1 8 ASN C C 2.333 5.581 0.035 . . . 1.0 . . . . . . . . . . . . A . 8 ASN C . . . . . . . . . c30225_5ug3 1 . 10 . 2670 . 1 1 8 ASN CA C 0.935 6.073 0.337 . . . 1.0 . . . . . . . . . . . . A . 8 ASN CA . . . . . . . . . c30225_5ug3 1 . 10 . 2671 . 1 1 8 ASN CB C 0.556 5.615 1.737 . . . 1.0 . . . . . . . . . . . . A . 8 ASN CB . . . . . . . . . c30225_5ug3 1 . 10 . 2672 . 1 1 8 ASN CG C -0.754 6.214 2.222 . . . 1.0 . . . . . . . . . . . . A . 8 ASN CG . . . . . . . . . c30225_5ug3 1 . 10 . 2673 . 1 1 8 ASN H H -0.121 4.548 -0.661 . . . 1.0 . . . . . . . . . . . . A . 8 ASN H . . . . . . . . . c30225_5ug3 1 . 10 . 2674 . 1 1 8 ASN HA H 0.903 7.149 0.282 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HA . . . . . . . . . c30225_5ug3 1 . 10 . 2675 . 1 1 8 ASN HB2 H 0.469 4.541 1.724 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HB2 . . . . . . . . . c30225_5ug3 1 . 10 . 2676 . 1 1 8 ASN HB3 H 1.340 5.893 2.428 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HB3 . . . . . . . . . c30225_5ug3 1 . 10 . 2677 . 1 1 8 ASN HD21 H -1.799 4.852 1.215 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HD21 . . . . . . . . . c30225_5ug3 1 . 10 . 2678 . 1 1 8 ASN HD22 H -2.729 5.998 2.118 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HD22 . . . . . . . . . c30225_5ug3 1 . 10 . 2679 . 1 1 8 ASN N N 0.000 5.522 -0.630 . . . 1.0 . . . . . . . . . . . . A . 8 ASN N . . . . . . . . . c30225_5ug3 1 . 10 . 2680 . 1 1 8 ASN ND2 N -1.871 5.629 1.809 . . . 1.0 . . . . . . . . . . . . A . 8 ASN ND2 . . . . . . . . . c30225_5ug3 1 . 10 . 2681 . 1 1 8 ASN O O 2.611 4.387 0.157 . . . 1.0 . . . . . . . . . . . . A . 8 ASN O . . . . . . . . . c30225_5ug3 1 . 10 . 2682 . 1 1 8 ASN OD1 O -0.765 7.215 2.938 . . . 1.0 . . . . . . . . . . . . A . 8 ASN OD1 . . . . . . . . . c30225_5ug3 1 . 10 . 2683 . 1 1 9 PRO C C 5.376 5.443 0.414 . . . 1.0 . . . . . . . . . . . . A . 9 PRO C . . . . . . . . . c30225_5ug3 1 . 10 . 2684 . 1 1 9 PRO CA C 4.597 6.098 -0.722 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CA . . . . . . . . . c30225_5ug3 1 . 10 . 2685 . 1 1 9 PRO CB C 5.244 7.425 -1.130 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CB . . . . . . . . . c30225_5ug3 1 . 10 . 2686 . 1 1 9 PRO CD C 3.036 7.936 -0.426 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CD . . . . . . . . . c30225_5ug3 1 . 10 . 2687 . 1 1 9 PRO CG C 4.437 8.468 -0.442 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CG . . . . . . . . . c30225_5ug3 1 . 10 . 2688 . 1 1 9 PRO HA H 4.575 5.425 -1.563 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HA . . . . . . . . . c30225_5ug3 1 . 10 . 2689 . 1 1 9 PRO HB2 H 6.275 7.444 -0.810 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HB2 . . . . . . . . . c30225_5ug3 1 . 10 . 2690 . 1 1 9 PRO HB3 H 5.190 7.536 -2.199 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HB3 . . . . . . . . . c30225_5ug3 1 . 10 . 2691 . 1 1 9 PRO HD2 H 2.507 8.306 0.432 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HD2 . . . . . . . . . c30225_5ug3 1 . 10 . 2692 . 1 1 9 PRO HD3 H 2.520 8.200 -1.337 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HD3 . . . . . . . . . c30225_5ug3 1 . 10 . 2693 . 1 1 9 PRO HG2 H 4.799 8.609 0.567 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HG2 . . . . . . . . . c30225_5ug3 1 . 10 . 2694 . 1 1 9 PRO HG3 H 4.482 9.395 -0.993 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HG3 . . . . . . . . . c30225_5ug3 1 . 10 . 2695 . 1 1 9 PRO N N 3.243 6.480 -0.338 . . . 1.0 . . . . . . . . . . . . A . 9 PRO N . . . . . . . . . c30225_5ug3 1 . 10 . 2696 . 1 1 9 PRO O O 6.398 4.804 0.180 . . . 1.0 . . . . . . . . . . . . A . 9 PRO O . . . . . . . . . c30225_5ug3 1 . 10 . 2697 . 1 1 10 VAL C C 5.084 3.532 2.952 . . . 1.0 . . . . . . . . . . . . A . 10 VAL C . . . . . . . . . c30225_5ug3 1 . 10 . 2698 . 1 1 10 VAL CA C 5.528 4.985 2.792 . . . 1.0 . . . . . . . . . . . . A . 10 VAL CA . . . . . . . . . c30225_5ug3 1 . 10 . 2699 . 1 1 10 VAL CB C 5.228 5.776 4.085 . . . 1.0 . . . . . . . . . . . . A . 10 VAL CB . . . . . . . . . c30225_5ug3 1 . 10 . 2700 . 1 1 10 VAL CG1 C 5.886 5.127 5.293 . . . 1.0 . . . . . . . . . . . . A . 10 VAL CG1 . . . . . . . . . c30225_5ug3 1 . 10 . 2701 . 1 1 10 VAL CG2 C 5.694 7.216 3.940 . . . 1.0 . . . . . . . . . . . . A . 10 VAL CG2 . . . . . . . . . c30225_5ug3 1 . 10 . 2702 . 1 1 10 VAL H H 4.064 6.118 1.759 . . . 1.0 . . . . . . . . . . . . A . 10 VAL H . . . . . . . . . c30225_5ug3 1 . 10 . 2703 . 1 1 10 VAL HA H 6.600 5.000 2.621 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HA . . . . . . . . . c30225_5ug3 1 . 10 . 2704 . 1 1 10 VAL HB H 4.160 5.780 4.242 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HB . . . . . . . . . c30225_5ug3 1 . 10 . 2705 . 1 1 10 VAL HG11 H 6.956 5.109 5.154 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HG11 . . . . . . . . . c30225_5ug3 1 . 10 . 2706 . 1 1 10 VAL HG12 H 5.520 4.116 5.401 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HG12 . . . . . . . . . c30225_5ug3 1 . 10 . 2707 . 1 1 10 VAL HG13 H 5.647 5.692 6.181 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HG13 . . . . . . . . . c30225_5ug3 1 . 10 . 2708 . 1 1 10 VAL HG21 H 5.444 7.766 4.833 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HG21 . . . . . . . . . c30225_5ug3 1 . 10 . 2709 . 1 1 10 VAL HG22 H 5.208 7.668 3.090 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HG22 . . . . . . . . . c30225_5ug3 1 . 10 . 2710 . 1 1 10 VAL HG23 H 6.762 7.233 3.794 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HG23 . . . . . . . . . c30225_5ug3 1 . 10 . 2711 . 1 1 10 VAL N N 4.884 5.590 1.634 . . . 1.0 . . . . . . . . . . . . A . 10 VAL N . . . . . . . . . c30225_5ug3 1 . 10 . 2712 . 1 1 10 VAL O O 5.830 2.689 3.454 . . . 1.0 . . . . . . . . . . . . A . 10 VAL O . . . . . . . . . c30225_5ug3 1 . 10 . 2713 . 1 1 11 CYS C C 3.966 1.028 1.429 . . . 1.0 . . . . . . . . . . . . A . 11 CYS C . . . . . . . . . c30225_5ug3 1 . 10 . 2714 . 1 1 11 CYS CA C 3.422 1.847 2.588 . . . 1.0 . . . . . . . . . . . . A . 11 CYS CA . . . . . . . . . c30225_5ug3 1 . 10 . 2715 . 1 1 11 CYS CB C 1.898 1.744 2.623 . . . 1.0 . . . . . . . . . . . . A . 11 CYS CB . . . . . . . . . c30225_5ug3 1 . 10 . 2716 . 1 1 11 CYS H H 3.311 3.906 2.101 . . . 1.0 . . . . . . . . . . . . A . 11 CYS H . . . . . . . . . c30225_5ug3 1 . 10 . 2717 . 1 1 11 CYS HA H 3.814 1.440 3.504 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HA . . . . . . . . . c30225_5ug3 1 . 10 . 2718 . 1 1 11 CYS HB2 H 1.519 2.355 3.428 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HB2 . . . . . . . . . c30225_5ug3 1 . 10 . 2719 . 1 1 11 CYS HB3 H 1.494 2.094 1.685 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HB3 . . . . . . . . . c30225_5ug3 1 . 10 . 2720 . 1 1 11 CYS N N 3.884 3.216 2.500 . . . 1.0 . . . . . . . . . . . . A . 11 CYS N . . . . . . . . . c30225_5ug3 1 . 10 . 2721 . 1 1 11 CYS O O 4.451 -0.083 1.624 . . . 1.0 . . . . . . . . . . . . A . 11 CYS O . . . . . . . . . c30225_5ug3 1 . 10 . 2722 . 1 1 11 CYS SG S 1.306 0.035 2.885 . . . 1.0 . . . . . . . . . . . . A . 11 CYS SG . . . . . . . . . c30225_5ug3 1 . 10 . 2723 . 1 1 12 ARG C C 5.831 0.615 -1.030 . . . 1.0 . . . . . . . . . . . . A . 12 ARG C . . . . . . . . . c30225_5ug3 1 . 10 . 2724 . 1 1 12 ARG CA C 4.329 0.832 -0.953 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CA . . . . . . . . . c30225_5ug3 1 . 10 . 2725 . 1 1 12 ARG CB C 3.788 1.448 -2.239 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CB . . . . . . . . . c30225_5ug3 1 . 10 . 2726 . 1 1 12 ARG CD C 3.131 3.510 -3.467 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CD . . . . . . . . . c30225_5ug3 1 . 10 . 2727 . 1 1 12 ARG CG C 3.874 2.945 -2.272 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CG . . . . . . . . . c30225_5ug3 1 . 10 . 2728 . 1 1 12 ARG CZ C 2.490 5.766 -4.241 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CZ . . . . . . . . . c30225_5ug3 1 . 10 . 2729 . 1 1 12 ARG H H 3.605 2.510 0.128 . . . 1.0 . . . . . . . . . . . . A . 12 ARG H . . . . . . . . . c30225_5ug3 1 . 10 . 2730 . 1 1 12 ARG HA H 3.888 -0.118 -0.840 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HA . . . . . . . . . c30225_5ug3 1 . 10 . 2731 . 1 1 12 ARG HB2 H 4.356 1.065 -3.072 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HB2 . . . . . . . . . c30225_5ug3 1 . 10 . 2732 . 1 1 12 ARG HB3 H 2.753 1.163 -2.356 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HB3 . . . . . . . . . c30225_5ug3 1 . 10 . 2733 . 1 1 12 ARG HD2 H 3.458 2.994 -4.357 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HD2 . . . . . . . . . c30225_5ug3 1 . 10 . 2734 . 1 1 12 ARG HD3 H 2.075 3.337 -3.320 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HD3 . . . . . . . . . c30225_5ug3 1 . 10 . 2735 . 1 1 12 ARG HE H 4.214 5.305 -3.329 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HE . . . . . . . . . c30225_5ug3 1 . 10 . 2736 . 1 1 12 ARG HG2 H 3.428 3.317 -1.368 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HG2 . . . . . . . . . c30225_5ug3 1 . 10 . 2737 . 1 1 12 ARG HG3 H 4.911 3.237 -2.320 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HG3 . . . . . . . . . c30225_5ug3 1 . 10 . 2738 . 1 1 12 ARG HH11 H 1.046 4.359 -4.475 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH11 . . . . . . . . . c30225_5ug3 1 . 10 . 2739 . 1 1 12 ARG HH12 H 0.658 5.936 -5.090 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH12 . . . . . . . . . c30225_5ug3 1 . 10 . 2740 . 1 1 12 ARG HH21 H 3.696 7.393 -4.125 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH21 . . . . . . . . . c30225_5ug3 1 . 10 . 2741 . 1 1 12 ARG HH22 H 2.156 7.659 -4.878 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH22 . . . . . . . . . c30225_5ug3 1 . 10 . 2742 . 1 1 12 ARG N N 3.924 1.585 0.225 . . . 1.0 . . . . . . . . . . . . A . 12 ARG N . . . . . . . . . c30225_5ug3 1 . 10 . 2743 . 1 1 12 ARG NE N 3.355 4.944 -3.644 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NE . . . . . . . . . c30225_5ug3 1 . 10 . 2744 . 1 1 12 ARG NH1 N 1.304 5.320 -4.631 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NH1 . . . . . . . . . c30225_5ug3 1 . 10 . 2745 . 1 1 12 ARG NH2 N 2.805 7.039 -4.428 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NH2 . . . . . . . . . c30225_5ug3 1 . 10 . 2746 . 1 1 12 ARG O O 6.301 -0.260 -1.752 . . . 1.0 . . . . . . . . . . . . A . 12 ARG O . . . . . . . . . c30225_5ug3 1 . 10 . 2747 . 1 1 13 VAL C C 8.372 0.020 0.657 . . . 1.0 . . . . . . . . . . . . A . 13 VAL C . . . . . . . . . c30225_5ug3 1 . 10 . 2748 . 1 1 13 VAL CA C 8.009 1.230 -0.210 . . . 1.0 . . . . . . . . . . . . A . 13 VAL CA . . . . . . . . . c30225_5ug3 1 . 10 . 2749 . 1 1 13 VAL CB C 8.666 2.499 0.354 . . . 1.0 . . . . . . . . . . . . A . 13 VAL CB . . . . . . . . . c30225_5ug3 1 . 10 . 2750 . 1 1 13 VAL CG1 C 8.082 2.828 1.704 . . . 1.0 . . . . . . . . . . . . A . 13 VAL CG1 . . . . . . . . . c30225_5ug3 1 . 10 . 2751 . 1 1 13 VAL CG2 C 10.161 2.343 0.462 . . . 1.0 . . . . . . . . . . . . A . 13 VAL CG2 . . . . . . . . . c30225_5ug3 1 . 10 . 2752 . 1 1 13 VAL H H 6.157 2.115 0.228 . . . 1.0 . . . . . . . . . . . . A . 13 VAL H . . . . . . . . . c30225_5ug3 1 . 10 . 2753 . 1 1 13 VAL HA H 8.381 1.070 -1.211 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HA . . . . . . . . . c30225_5ug3 1 . 10 . 2754 . 1 1 13 VAL HB H 8.455 3.321 -0.316 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HB . . . . . . . . . c30225_5ug3 1 . 10 . 2755 . 1 1 13 VAL HG11 H 8.372 3.824 1.993 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HG11 . . . . . . . . . c30225_5ug3 1 . 10 . 2756 . 1 1 13 VAL HG12 H 8.446 2.119 2.433 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HG12 . . . . . . . . . c30225_5ug3 1 . 10 . 2757 . 1 1 13 VAL HG13 H 6.999 2.762 1.651 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HG13 . . . . . . . . . c30225_5ug3 1 . 10 . 2758 . 1 1 13 VAL HG21 H 10.575 3.231 0.913 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HG21 . . . . . . . . . c30225_5ug3 1 . 10 . 2759 . 1 1 13 VAL HG22 H 10.579 2.204 -0.522 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HG22 . . . . . . . . . c30225_5ug3 1 . 10 . 2760 . 1 1 13 VAL HG23 H 10.385 1.488 1.076 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HG23 . . . . . . . . . c30225_5ug3 1 . 10 . 2761 . 1 1 13 VAL N N 6.576 1.399 -0.283 . . . 1.0 . . . . . . . . . . . . A . 13 VAL N . . . . . . . . . c30225_5ug3 1 . 10 . 2762 . 1 1 13 VAL O O 9.273 -0.748 0.316 . . . 1.0 . . . . . . . . . . . . A . 13 VAL O . . . . . . . . . c30225_5ug3 1 . 10 . 2763 . 1 1 14 ASN C C 7.225 -2.532 2.270 . . . 1.0 . . . . . . . . . . . . A . 14 ASN C . . . . . . . . . c30225_5ug3 1 . 10 . 2764 . 1 1 14 ASN CA C 7.976 -1.266 2.671 . . . 1.0 . . . . . . . . . . . . A . 14 ASN CA . . . . . . . . . c30225_5ug3 1 . 10 . 2765 . 1 1 14 ASN CB C 7.671 -0.905 4.134 . . . 1.0 . . . . . . . . . . . . A . 14 ASN CB . . . . . . . . . c30225_5ug3 1 . 10 . 2766 . 1 1 14 ASN CG C 6.192 -0.931 4.478 . . . 1.0 . . . . . . . . . . . . A . 14 ASN CG . . . . . . . . . c30225_5ug3 1 . 10 . 2767 . 1 1 14 ASN H H 6.935 0.464 1.997 . . . 1.0 . . . . . . . . . . . . A . 14 ASN H . . . . . . . . . c30225_5ug3 1 . 10 . 2768 . 1 1 14 ASN HA H 9.034 -1.462 2.582 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HA . . . . . . . . . c30225_5ug3 1 . 10 . 2769 . 1 1 14 ASN HB2 H 8.176 -1.606 4.776 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HB2 . . . . . . . . . c30225_5ug3 1 . 10 . 2770 . 1 1 14 ASN HB3 H 8.048 0.087 4.333 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HB3 . . . . . . . . . c30225_5ug3 1 . 10 . 2771 . 1 1 14 ASN HD21 H 6.046 1.024 4.153 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HD21 . . . . . . . . . c30225_5ug3 1 . 10 . 2772 . 1 1 14 ASN HD22 H 4.594 0.222 4.638 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HD22 . . . . . . . . . c30225_5ug3 1 . 10 . 2773 . 1 1 14 ASN N N 7.664 -0.162 1.771 . . . 1.0 . . . . . . . . . . . . A . 14 ASN N . . . . . . . . . c30225_5ug3 1 . 10 . 2774 . 1 1 14 ASN ND2 N 5.546 0.217 4.415 . . . 1.0 . . . . . . . . . . . . A . 14 ASN ND2 . . . . . . . . . c30225_5ug3 1 . 10 . 2775 . 1 1 14 ASN O O 7.715 -3.643 2.479 . . . 1.0 . . . . . . . . . . . . A . 14 ASN O . . . . . . . . . c30225_5ug3 1 . 10 . 2776 . 1 1 14 ASN OD1 O 5.637 -1.974 4.826 . . . 1.0 . . . . . . . . . . . . A . 14 ASN OD1 . . . . . . . . . c30225_5ug3 1 . 10 . 2777 . 1 1 15 ASN C C 5.902 -4.218 0.113 . . . 1.0 . . . . . . . . . . . . A . 15 ASN C . . . . . . . . . c30225_5ug3 1 . 10 . 2778 . 1 1 15 ASN CA C 5.241 -3.493 1.271 . . . 1.0 . . . . . . . . . . . . A . 15 ASN CA . . . . . . . . . c30225_5ug3 1 . 10 . 2779 . 1 1 15 ASN CB C 3.805 -3.041 0.934 . . . 1.0 . . . . . . . . . . . . A . 15 ASN CB . . . . . . . . . c30225_5ug3 1 . 10 . 2780 . 1 1 15 ASN CG C 3.405 -3.124 -0.544 . . . 1.0 . . . . . . . . . . . . A . 15 ASN CG . . . . . . . . . c30225_5ug3 1 . 10 . 2781 . 1 1 15 ASN H H 5.691 -1.469 1.555 . . . 1.0 . . . . . . . . . . . . A . 15 ASN H . . . . . . . . . c30225_5ug3 1 . 10 . 2782 . 1 1 15 ASN HA H 5.196 -4.178 2.109 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HA . . . . . . . . . c30225_5ug3 1 . 10 . 2783 . 1 1 15 ASN HB2 H 3.125 -3.660 1.492 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HB2 . . . . . . . . . c30225_5ug3 1 . 10 . 2784 . 1 1 15 ASN HB3 H 3.684 -2.016 1.257 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HB3 . . . . . . . . . c30225_5ug3 1 . 10 . 2785 . 1 1 15 ASN HD21 H 2.707 -1.281 -0.460 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HD21 . . . . . . . . . c30225_5ug3 1 . 10 . 2786 . 1 1 15 ASN HD22 H 2.573 -2.047 -2.003 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HD22 . . . . . . . . . c30225_5ug3 1 . 10 . 2787 . 1 1 15 ASN N N 6.042 -2.367 1.690 . . . 1.0 . . . . . . . . . . . . A . 15 ASN N . . . . . . . . . c30225_5ug3 1 . 10 . 2788 . 1 1 15 ASN ND2 N 2.838 -2.043 -1.050 . . . 1.0 . . . . . . . . . . . . A . 15 ASN ND2 . . . . . . . . . c30225_5ug3 1 . 10 . 2789 . 1 1 15 ASN O O 6.386 -3.615 -0.849 . . . 1.0 . . . . . . . . . . . . A . 15 ASN O . . . . . . . . . c30225_5ug3 1 . 10 . 2790 . 1 1 15 ASN OD1 O 3.555 -4.150 -1.209 . . . 1.0 . . . . . . . . . . . . A . 15 ASN OD1 . . . . . . . . . c30225_5ug3 1 . 10 . 2791 . 1 1 16 HYP C C 5.613 -6.571 -1.974 . . . 1.0 . . . . . . . . . . . . A . 16 HYP C . . . . . . . . . c30225_5ug3 1 . 10 . 2792 . 1 1 16 HYP CA C 6.513 -6.434 -0.758 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CA . . . . . . . . . c30225_5ug3 1 . 10 . 2793 . 1 1 16 HYP CB C 6.604 -7.735 0.006 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CB . . . . . . . . . c30225_5ug3 1 . 10 . 2794 . 1 1 16 HYP CD C 5.463 -6.229 1.474 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CD . . . . . . . . . c30225_5ug3 1 . 10 . 2795 . 1 1 16 HYP CG C 5.832 -7.666 1.303 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CG . . . . . . . . . c30225_5ug3 1 . 10 . 2796 . 1 1 16 HYP HA H 7.482 -6.122 -1.071 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HA . . . . . . . . . c30225_5ug3 1 . 10 . 2797 . 1 1 16 HYP HB2 H 7.638 -7.944 0.229 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HB2 . . . . . . . . . c30225_5ug3 1 . 10 . 2798 . 1 1 16 HYP HB3 H 6.202 -8.532 -0.606 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HB3 . . . . . . . . . c30225_5ug3 1 . 10 . 2799 . 1 1 16 HYP HD1 H 6.555 -7.268 3.054 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HD1 . . . . . . . . . c30225_5ug3 1 . 10 . 2800 . 1 1 16 HYP HD22 H 4.405 -6.118 1.580 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HD22 . . . . . . . . . c30225_5ug3 1 . 10 . 2801 . 1 1 16 HYP HD23 H 5.958 -5.834 2.346 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HD23 . . . . . . . . . c30225_5ug3 1 . 10 . 2802 . 1 1 16 HYP HG H 4.961 -8.304 1.263 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HG . . . . . . . . . c30225_5ug3 1 . 10 . 2803 . 1 1 16 HYP N N 5.951 -5.535 0.254 . . . 1.0 . . . . . . . . . . . . A . 16 HYP N . . . . . . . . . c30225_5ug3 1 . 10 . 2804 . 1 1 16 HYP O O 6.009 -6.244 -3.090 . . . 1.0 . . . . . . . . . . . . A . 16 HYP O . . . . . . . . . c30225_5ug3 1 . 10 . 2805 . 1 1 16 HYP OD1 O 6.632 -8.002 2.420 . . . 1.0 . . . . . . . . . . . . A . 16 HYP OD1 . . . . . . . . . c30225_5ug3 1 . 10 . 2806 . 1 1 17 HIS C C 2.004 -7.170 -2.319 . . . 1.0 . . . . . . . . . . . . A . 17 HIS C . . . . . . . . . c30225_5ug3 1 . 10 . 2807 . 1 1 17 HIS CA C 3.439 -7.234 -2.827 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CA . . . . . . . . . c30225_5ug3 1 . 10 . 2808 . 1 1 17 HIS CB C 3.670 -8.571 -3.547 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CB . . . . . . . . . c30225_5ug3 1 . 10 . 2809 . 1 1 17 HIS CD2 C 4.781 -7.765 -5.746 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CD2 . . . . . . . . . c30225_5ug3 1 . 10 . 2810 . 1 1 17 HIS CE1 C 6.576 -9.012 -5.679 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CE1 . . . . . . . . . c30225_5ug3 1 . 10 . 2811 . 1 1 17 HIS CG C 4.716 -8.509 -4.618 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CG . . . . . . . . . c30225_5ug3 1 . 10 . 2812 . 1 1 17 HIS H H 4.146 -7.274 -0.832 . . . 1.0 . . . . . . . . . . . . A . 17 HIS H . . . . . . . . . c30225_5ug3 1 . 10 . 2813 . 1 1 17 HIS HA H 3.586 -6.433 -3.535 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HA . . . . . . . . . c30225_5ug3 1 . 10 . 2814 . 1 1 17 HIS HB2 H 3.981 -9.311 -2.825 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HB2 . . . . . . . . . c30225_5ug3 1 . 10 . 2815 . 1 1 17 HIS HB3 H 2.744 -8.889 -4.003 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HB3 . . . . . . . . . c30225_5ug3 1 . 10 . 2816 . 1 1 17 HIS HD1 H 6.101 -9.935 -3.914 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HD1 . . . . . . . . . c30225_5ug3 1 . 10 . 2817 . 1 1 17 HIS HD2 H 4.052 -7.039 -6.078 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HD2 . . . . . . . . . c30225_5ug3 1 . 10 . 2818 . 1 1 17 HIS HE1 H 7.521 -9.467 -5.936 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HE1 . . . . . . . . . c30225_5ug3 1 . 10 . 2819 . 1 1 17 HIS HE2 H 6.167 -7.852 -7.313 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HE2 . . . . . . . . . c30225_5ug3 1 . 10 . 2820 . 1 1 17 HIS N N 4.401 -7.047 -1.748 . . . 1.0 . . . . . . . . . . . . A . 17 HIS N . . . . . . . . . c30225_5ug3 1 . 10 . 2821 . 1 1 17 HIS ND1 N 5.855 -9.281 -4.607 . . . 1.0 . . . . . . . . . . . . A . 17 HIS ND1 . . . . . . . . . c30225_5ug3 1 . 10 . 2822 . 1 1 17 HIS NE2 N 5.946 -8.096 -6.387 . . . 1.0 . . . . . . . . . . . . A . 17 HIS NE2 . . . . . . . . . c30225_5ug3 1 . 10 . 2823 . 1 1 17 HIS O O 1.193 -8.048 -2.618 . . . 1.0 . . . . . . . . . . . . A . 17 HIS O . . . . . . . . . c30225_5ug3 1 . 10 . 2824 . 1 1 18 VAL C C -0.379 -5.006 -2.156 . . . 1.0 . . . . . . . . . . . . A . 18 VAL C . . . . . . . . . c30225_5ug3 1 . 10 . 2825 . 1 1 18 VAL CA C 0.282 -5.946 -1.159 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CA . . . . . . . . . c30225_5ug3 1 . 10 . 2826 . 1 1 18 VAL CB C 0.111 -5.419 0.292 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CB . . . . . . . . . c30225_5ug3 1 . 10 . 2827 . 1 1 18 VAL CG1 C 0.400 -3.931 0.399 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CG1 . . . . . . . . . c30225_5ug3 1 . 10 . 2828 . 1 1 18 VAL CG2 C -1.286 -5.729 0.810 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CG2 . . . . . . . . . c30225_5ug3 1 . 10 . 2829 . 1 1 18 VAL H H 2.374 -5.506 -1.243 . . . 1.0 . . . . . . . . . . . . A . 18 VAL H . . . . . . . . . c30225_5ug3 1 . 10 . 2830 . 1 1 18 VAL HA H -0.208 -6.908 -1.228 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HA . . . . . . . . . c30225_5ug3 1 . 10 . 2831 . 1 1 18 VAL HB H 0.819 -5.938 0.921 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HB . . . . . . . . . c30225_5ug3 1 . 10 . 2832 . 1 1 18 VAL HG11 H 0.305 -3.618 1.427 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG11 . . . . . . . . . c30225_5ug3 1 . 10 . 2833 . 1 1 18 VAL HG12 H -0.302 -3.383 -0.211 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG12 . . . . . . . . . c30225_5ug3 1 . 10 . 2834 . 1 1 18 VAL HG13 H 1.404 -3.734 0.055 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG13 . . . . . . . . . c30225_5ug3 1 . 10 . 2835 . 1 1 18 VAL HG21 H -1.384 -5.368 1.823 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG21 . . . . . . . . . c30225_5ug3 1 . 10 . 2836 . 1 1 18 VAL HG22 H -1.449 -6.796 0.792 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG22 . . . . . . . . . c30225_5ug3 1 . 10 . 2837 . 1 1 18 VAL HG23 H -2.018 -5.243 0.183 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG23 . . . . . . . . . c30225_5ug3 1 . 10 . 2838 . 1 1 18 VAL N N 1.676 -6.143 -1.546 . . . 1.0 . . . . . . . . . . . . A . 18 VAL N . . . . . . . . . c30225_5ug3 1 . 10 . 2839 . 1 1 18 VAL O O -1.567 -5.121 -2.446 . . . 1.0 . . . . . . . . . . . . A . 18 VAL O . . . . . . . . . c30225_5ug3 1 . 10 . 2840 . 1 1 19 CYS C C 1.211 -2.387 -4.204 . . . 1.0 . . . . . . . . . . . . A . 19 CYS C . . . . . . . . . c30225_5ug3 1 . 10 . 2841 . 1 1 19 CYS CA C 0.011 -3.204 -3.758 . . . 1.0 . . . . . . . . . . . . A . 19 CYS CA . . . . . . . . . c30225_5ug3 1 . 10 . 2842 . 1 1 19 CYS CB C -1.128 -2.277 -3.314 . . . 1.0 . . . . . . . . . . . . A . 19 CYS CB . . . . . . . . . c30225_5ug3 1 . 10 . 2843 . 1 1 19 CYS H H 1.348 -4.035 -2.368 . . . 1.0 . . . . . . . . . . . . A . 19 CYS H . . . . . . . . . c30225_5ug3 1 . 10 . 2844 . 1 1 19 CYS HA H -0.326 -3.807 -4.588 . . . 1.0 . . . . . . . . . . . . A . 19 CYS HA . . . . . . . . . c30225_5ug3 1 . 10 . 2845 . 1 1 19 CYS HB2 H -1.910 -2.869 -2.863 . . . 1.0 . . . . . . . . . . . . A . 19 CYS HB2 . . . . . . . . . c30225_5ug3 1 . 10 . 2846 . 1 1 19 CYS HB3 H -0.751 -1.569 -2.587 . . . 1.0 . . . . . . . . . . . . A . 19 CYS HB3 . . . . . . . . . c30225_5ug3 1 . 10 . 2847 . 1 1 19 CYS N N 0.428 -4.102 -2.698 . . . 1.0 . . . . . . . . . . . . A . 19 CYS N . . . . . . . . . c30225_5ug3 1 . 10 . 2848 . 1 1 19 CYS O O 1.620 -1.476 -3.457 . . . 1.0 . . . . . . . . . . . . A . 19 CYS O . . . . . . . . . c30225_5ug3 1 . 10 . 2849 . 1 1 19 CYS OXT O 1.763 -2.679 -5.285 . . . 1.0 . . . . . . . . . . . . A . 19 CYS OXT . . . . . . . . . c30225_5ug3 1 . 10 . 2850 . 1 1 19 CYS SG S -1.871 -1.325 -4.684 . . . 1.0 . . . . . . . . . . . . A . 19 CYS SG . . . . . . . . . c30225_5ug3 1 . 11 . 2851 . 1 1 1 ILE C C -10.193 -1.972 -1.317 . . . 1.0 . . . . . . . . . . . . A . 1 ILE C . . . . . . . . . c30225_5ug3 1 . 11 . 2852 . 1 1 1 ILE CA C -10.776 -2.120 -2.721 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CA . . . . . . . . . c30225_5ug3 1 . 11 . 2853 . 1 1 1 ILE CB C -12.009 -3.059 -2.699 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CB . . . . . . . . . c30225_5ug3 1 . 11 . 2854 . 1 1 1 ILE CD1 C -14.449 -3.239 -1.970 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CD1 . . . . . . . . . c30225_5ug3 1 . 11 . 2855 . 1 1 1 ILE CG1 C -13.186 -2.404 -1.966 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CG1 . . . . . . . . . c30225_5ug3 1 . 11 . 2856 . 1 1 1 ILE CG2 C -11.655 -4.396 -2.062 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CG2 . . . . . . . . . c30225_5ug3 1 . 11 . 2857 . 1 1 1 ILE H1 H -8.946 -1.943 -3.715 . . . 1.0 . . . . . . . . . . . . A . 1 ILE H1 . . . . . . . . . c30225_5ug3 1 . 11 . 2858 . 1 1 1 ILE H2 H -10.157 -2.701 -4.624 . . . 1.0 . . . . . . . . . . . . A . 1 ILE H2 . . . . . . . . . c30225_5ug3 1 . 11 . 2859 . 1 1 1 ILE H3 H -9.397 -3.540 -3.372 . . . 1.0 . . . . . . . . . . . . A . 1 ILE H3 . . . . . . . . . c30225_5ug3 1 . 11 . 2860 . 1 1 1 ILE HA H -11.091 -1.151 -3.055 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HA . . . . . . . . . c30225_5ug3 1 . 11 . 2861 . 1 1 1 ILE HB H -12.294 -3.250 -3.719 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HB . . . . . . . . . c30225_5ug3 1 . 11 . 2862 . 1 1 1 ILE HD11 H -14.771 -3.399 -2.988 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HD11 . . . . . . . . . c30225_5ug3 1 . 11 . 2863 . 1 1 1 ILE HD12 H -15.224 -2.720 -1.425 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HD12 . . . . . . . . . c30225_5ug3 1 . 11 . 2864 . 1 1 1 ILE HD13 H -14.253 -4.191 -1.501 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HD13 . . . . . . . . . c30225_5ug3 1 . 11 . 2865 . 1 1 1 ILE HG12 H -12.908 -2.231 -0.939 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG12 . . . . . . . . . c30225_5ug3 1 . 11 . 2866 . 1 1 1 ILE HG13 H -13.411 -1.458 -2.438 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG13 . . . . . . . . . c30225_5ug3 1 . 11 . 2867 . 1 1 1 ILE HG21 H -10.863 -4.864 -2.625 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG21 . . . . . . . . . c30225_5ug3 1 . 11 . 2868 . 1 1 1 ILE HG22 H -12.525 -5.036 -2.063 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG22 . . . . . . . . . c30225_5ug3 1 . 11 . 2869 . 1 1 1 ILE HG23 H -11.327 -4.236 -1.046 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG23 . . . . . . . . . c30225_5ug3 1 . 11 . 2870 . 1 1 1 ILE N N -9.749 -2.612 -3.671 . . . 1.0 . . . . . . . . . . . . A . 1 ILE N . . . . . . . . . c30225_5ug3 1 . 11 . 2871 . 1 1 1 ILE O O -10.883 -1.605 -0.366 . . . 1.0 . . . . . . . . . . . . A . 1 ILE O . . . . . . . . . c30225_5ug3 1 . 11 . 2872 . 1 1 2 ARG C C -6.821 -1.436 -0.278 . . . 1.0 . . . . . . . . . . . . A . 2 ARG C . . . . . . . . . c30225_5ug3 1 . 11 . 2873 . 1 1 2 ARG CA C -8.157 -2.091 0.031 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CA . . . . . . . . . c30225_5ug3 1 . 11 . 2874 . 1 1 2 ARG CB C -7.929 -3.441 0.725 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CB . . . . . . . . . c30225_5ug3 1 . 11 . 2875 . 1 1 2 ARG CD C -9.602 -3.171 2.599 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CD . . . . . . . . . c30225_5ug3 1 . 11 . 2876 . 1 1 2 ARG CG C -9.158 -4.021 1.415 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CG . . . . . . . . . c30225_5ug3 1 . 11 . 2877 . 1 1 2 ARG CZ C -10.371 -0.854 2.958 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CZ . . . . . . . . . c30225_5ug3 1 . 11 . 2878 . 1 1 2 ARG H H -8.433 -2.545 -2.005 . . . 1.0 . . . . . . . . . . . . A . 2 ARG H . . . . . . . . . c30225_5ug3 1 . 11 . 2879 . 1 1 2 ARG HA H -8.725 -1.445 0.676 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HA . . . . . . . . . c30225_5ug3 1 . 11 . 2880 . 1 1 2 ARG HB2 H -7.595 -4.155 -0.012 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB2 . . . . . . . . . c30225_5ug3 1 . 11 . 2881 . 1 1 2 ARG HB3 H -7.154 -3.319 1.467 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB3 . . . . . . . . . c30225_5ug3 1 . 11 . 2882 . 1 1 2 ARG HD2 H -10.313 -3.733 3.183 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD2 . . . . . . . . . c30225_5ug3 1 . 11 . 2883 . 1 1 2 ARG HD3 H -8.738 -2.947 3.205 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD3 . . . . . . . . . c30225_5ug3 1 . 11 . 2884 . 1 1 2 ARG HE H -10.544 -1.869 1.243 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HE . . . . . . . . . c30225_5ug3 1 . 11 . 2885 . 1 1 2 ARG HG2 H -9.966 -4.074 0.702 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG2 . . . . . . . . . c30225_5ug3 1 . 11 . 2886 . 1 1 2 ARG HG3 H -8.922 -5.015 1.767 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG3 . . . . . . . . . c30225_5ug3 1 . 11 . 2887 . 1 1 2 ARG HH11 H -9.538 -1.706 4.593 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH11 . . . . . . . . . c30225_5ug3 1 . 11 . 2888 . 1 1 2 ARG HH12 H -10.076 -0.073 4.802 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH12 . . . . . . . . . c30225_5ug3 1 . 11 . 2889 . 1 1 2 ARG HH21 H -11.240 0.267 1.517 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH21 . . . . . . . . . c30225_5ug3 1 . 11 . 2890 . 1 1 2 ARG HH22 H -11.045 1.051 3.050 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH22 . . . . . . . . . c30225_5ug3 1 . 11 . 2891 . 1 1 2 ARG N N -8.906 -2.246 -1.211 . . . 1.0 . . . . . . . . . . . . A . 2 ARG N . . . . . . . . . c30225_5ug3 1 . 11 . 2892 . 1 1 2 ARG NE N -10.222 -1.919 2.176 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NE . . . . . . . . . c30225_5ug3 1 . 11 . 2893 . 1 1 2 ARG NH1 N -9.962 -0.880 4.218 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH1 . . . . . . . . . c30225_5ug3 1 . 11 . 2894 . 1 1 2 ARG NH2 N -10.930 0.242 2.470 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH2 . . . . . . . . . c30225_5ug3 1 . 11 . 2895 . 1 1 2 ARG O O -5.778 -1.812 0.259 . . . 1.0 . . . . . . . . . . . . A . 2 ARG O . . . . . . . . . c30225_5ug3 1 . 11 . 2896 . 1 1 3 ASP C C -5.220 1.366 -0.928 . . . 1.0 . . . . . . . . . . . . A . 3 ASP C . . . . . . . . . c30225_5ug3 1 . 11 . 2897 . 1 1 3 ASP CA C -5.672 0.144 -1.719 . . . 1.0 . . . . . . . . . . . . A . 3 ASP CA . . . . . . . . . c30225_5ug3 1 . 11 . 2898 . 1 1 3 ASP CB C -5.935 0.521 -3.176 . . . 1.0 . . . . . . . . . . . . A . 3 ASP CB . . . . . . . . . c30225_5ug3 1 . 11 . 2899 . 1 1 3 ASP CG C -6.352 -0.672 -4.016 . . . 1.0 . . . . . . . . . . . . A . 3 ASP CG . . . . . . . . . c30225_5ug3 1 . 11 . 2900 . 1 1 3 ASP H H -7.745 -0.083 -1.406 . . . 1.0 . . . . . . . . . . . . A . 3 ASP H . . . . . . . . . c30225_5ug3 1 . 11 . 2901 . 1 1 3 ASP HA H -4.891 -0.600 -1.687 . . . 1.0 . . . . . . . . . . . . A . 3 ASP HA . . . . . . . . . c30225_5ug3 1 . 11 . 2902 . 1 1 3 ASP HB2 H -6.725 1.255 -3.208 . . . 1.0 . . . . . . . . . . . . A . 3 ASP HB2 . . . . . . . . . c30225_5ug3 1 . 11 . 2903 . 1 1 3 ASP HB3 H -5.039 0.943 -3.600 . . . 1.0 . . . . . . . . . . . . A . 3 ASP HB3 . . . . . . . . . c30225_5ug3 1 . 11 . 2904 . 1 1 3 ASP N N -6.871 -0.443 -1.146 . . . 1.0 . . . . . . . . . . . . A . 3 ASP N . . . . . . . . . c30225_5ug3 1 . 11 . 2905 . 1 1 3 ASP O O -4.970 2.434 -1.497 . . . 1.0 . . . . . . . . . . . . A . 3 ASP O . . . . . . . . . c30225_5ug3 1 . 11 . 2906 . 1 1 3 ASP OD1 O -7.541 -1.067 -3.952 . . . 1.0 . . . . . . . . . . . . A . 3 ASP OD1 . . . . . . . . . c30225_5ug3 1 . 11 . 2907 . 1 1 3 ASP OD2 O -5.500 -1.216 -4.751 . . . 1.0 . . . . . . . . . . . . A . 3 ASP OD2 . . . . . . . . . c30225_5ug3 1 . 11 . 2908 . 1 1 4 GLU C C -3.169 2.545 1.031 . . . 1.0 . . . . . . . . . . . . A . 4 GLU C . . . . . . . . . c30225_5ug3 1 . 11 . 2909 . 1 1 4 GLU CA C -4.650 2.272 1.258 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CA . . . . . . . . . c30225_5ug3 1 . 11 . 2910 . 1 1 4 GLU CB C -4.884 1.918 2.733 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CB . . . . . . . . . c30225_5ug3 1 . 11 . 2911 . 1 1 4 GLU CD C -7.345 1.433 2.418 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CD . . . . . . . . . c30225_5ug3 1 . 11 . 2912 . 1 1 4 GLU CG C -6.302 2.172 3.223 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CG . . . . . . . . . c30225_5ug3 1 . 11 . 2913 . 1 1 4 GLU H H -5.376 0.341 0.777 . . . 1.0 . . . . . . . . . . . . A . 4 GLU H . . . . . . . . . c30225_5ug3 1 . 11 . 2914 . 1 1 4 GLU HA H -5.208 3.163 1.020 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HA . . . . . . . . . c30225_5ug3 1 . 11 . 2915 . 1 1 4 GLU HB2 H -4.664 0.871 2.876 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HB2 . . . . . . . . . c30225_5ug3 1 . 11 . 2916 . 1 1 4 GLU HB3 H -4.209 2.501 3.339 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HB3 . . . . . . . . . c30225_5ug3 1 . 11 . 2917 . 1 1 4 GLU HG2 H -6.375 1.854 4.252 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HG2 . . . . . . . . . c30225_5ug3 1 . 11 . 2918 . 1 1 4 GLU HG3 H -6.505 3.230 3.160 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HG3 . . . . . . . . . c30225_5ug3 1 . 11 . 2919 . 1 1 4 GLU N N -5.119 1.203 0.384 . . . 1.0 . . . . . . . . . . . . A . 4 GLU N . . . . . . . . . c30225_5ug3 1 . 11 . 2920 . 1 1 4 GLU O O -2.796 3.623 0.576 . . . 1.0 . . . . . . . . . . . . A . 4 GLU O . . . . . . . . . c30225_5ug3 1 . 11 . 2921 . 1 1 4 GLU OE1 O -8.104 2.095 1.681 . . . 1.0 . . . . . . . . . . . . A . 4 GLU OE1 . . . . . . . . . c30225_5ug3 1 . 11 . 2922 . 1 1 4 GLU OE2 O -7.396 0.193 2.505 . . . 1.0 . . . . . . . . . . . . A . 4 GLU OE2 . . . . . . . . . c30225_5ug3 1 . 11 . 2923 . 1 1 5 CYS C C -0.452 2.084 -0.201 . . . 1.0 . . . . . . . . . . . . A . 5 CYS C . . . . . . . . . c30225_5ug3 1 . 11 . 2924 . 1 1 5 CYS CA C -0.891 1.700 1.204 . . . 1.0 . . . . . . . . . . . . A . 5 CYS CA . . . . . . . . . c30225_5ug3 1 . 11 . 2925 . 1 1 5 CYS CB C -0.223 0.408 1.641 . . . 1.0 . . . . . . . . . . . . A . 5 CYS CB . . . . . . . . . c30225_5ug3 1 . 11 . 2926 . 1 1 5 CYS H H -2.693 0.676 1.567 . . . 1.0 . . . . . . . . . . . . A . 5 CYS H . . . . . . . . . c30225_5ug3 1 . 11 . 2927 . 1 1 5 CYS HA H -0.599 2.486 1.883 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HA . . . . . . . . . c30225_5ug3 1 . 11 . 2928 . 1 1 5 CYS HB2 H -0.675 -0.420 1.117 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HB2 . . . . . . . . . c30225_5ug3 1 . 11 . 2929 . 1 1 5 CYS HB3 H 0.819 0.453 1.402 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HB3 . . . . . . . . . c30225_5ug3 1 . 11 . 2930 . 1 1 5 CYS N N -2.333 1.547 1.297 . . . 1.0 . . . . . . . . . . . . A . 5 CYS N . . . . . . . . . c30225_5ug3 1 . 11 . 2931 . 1 1 5 CYS O O 0.576 2.724 -0.389 . . . 1.0 . . . . . . . . . . . . A . 5 CYS O . . . . . . . . . c30225_5ug3 1 . 11 . 2932 . 1 1 5 CYS SG S -0.377 0.088 3.423 . . . 1.0 . . . . . . . . . . . . A . 5 CYS SG . . . . . . . . . c30225_5ug3 1 . 11 . 2933 . 1 1 6 CYS C C -1.013 3.559 -2.779 . . . 1.0 . . . . . . . . . . . . A . 6 CYS C . . . . . . . . . c30225_5ug3 1 . 11 . 2934 . 1 1 6 CYS CA C -1.007 2.045 -2.560 . . . 1.0 . . . . . . . . . . . . A . 6 CYS CA . . . . . . . . . c30225_5ug3 1 . 11 . 2935 . 1 1 6 CYS CB C -2.091 1.394 -3.402 . . . 1.0 . . . . . . . . . . . . A . 6 CYS CB . . . . . . . . . c30225_5ug3 1 . 11 . 2936 . 1 1 6 CYS H H -2.049 1.185 -0.956 . . . 1.0 . . . . . . . . . . . . A . 6 CYS H . . . . . . . . . c30225_5ug3 1 . 11 . 2937 . 1 1 6 CYS HA H -0.042 1.646 -2.838 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HA . . . . . . . . . c30225_5ug3 1 . 11 . 2938 . 1 1 6 CYS HB2 H -3.049 1.718 -3.016 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HB2 . . . . . . . . . c30225_5ug3 1 . 11 . 2939 . 1 1 6 CYS HB3 H -1.990 1.716 -4.422 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HB3 . . . . . . . . . c30225_5ug3 1 . 11 . 2940 . 1 1 6 CYS N N -1.257 1.718 -1.173 . . . 1.0 . . . . . . . . . . . . A . 6 CYS N . . . . . . . . . c30225_5ug3 1 . 11 . 2941 . 1 1 6 CYS O O -0.340 4.073 -3.672 . . . 1.0 . . . . . . . . . . . . A . 6 CYS O . . . . . . . . . c30225_5ug3 1 . 11 . 2942 . 1 1 6 CYS SG S -2.071 -0.436 -3.380 . . . 1.0 . . . . . . . . . . . . A . 6 CYS SG . . . . . . . . . c30225_5ug3 1 . 11 . 2943 . 1 1 7 SER C C -0.812 6.380 -1.163 . . . 1.0 . . . . . . . . . . . . A . 7 SER C . . . . . . . . . c30225_5ug3 1 . 11 . 2944 . 1 1 7 SER CA C -1.862 5.720 -2.058 . . . 1.0 . . . . . . . . . . . . A . 7 SER CA . . . . . . . . . c30225_5ug3 1 . 11 . 2945 . 1 1 7 SER CB C -3.275 6.174 -1.670 . . . 1.0 . . . . . . . . . . . . A . 7 SER CB . . . . . . . . . c30225_5ug3 1 . 11 . 2946 . 1 1 7 SER H H -2.284 3.808 -1.256 . . . 1.0 . . . . . . . . . . . . A . 7 SER H . . . . . . . . . c30225_5ug3 1 . 11 . 2947 . 1 1 7 SER HA H -1.669 5.995 -3.083 . . . 1.0 . . . . . . . . . . . . A . 7 SER HA . . . . . . . . . c30225_5ug3 1 . 11 . 2948 . 1 1 7 SER HB2 H -3.994 5.692 -2.315 . . . 1.0 . . . . . . . . . . . . A . 7 SER HB2 . . . . . . . . . c30225_5ug3 1 . 11 . 2949 . 1 1 7 SER HB3 H -3.470 5.891 -0.645 . . . 1.0 . . . . . . . . . . . . A . 7 SER HB3 . . . . . . . . . c30225_5ug3 1 . 11 . 2950 . 1 1 7 SER HG H -4.298 7.778 -2.169 . . . 1.0 . . . . . . . . . . . . A . 7 SER HG . . . . . . . . . c30225_5ug3 1 . 11 . 2951 . 1 1 7 SER N N -1.770 4.271 -1.957 . . . 1.0 . . . . . . . . . . . . A . 7 SER N . . . . . . . . . c30225_5ug3 1 . 11 . 2952 . 1 1 7 SER O O -0.627 7.597 -1.185 . . . 1.0 . . . . . . . . . . . . A . 7 SER O . . . . . . . . . c30225_5ug3 1 . 11 . 2953 . 1 1 7 SER OG O -3.426 7.578 -1.793 . . . 1.0 . . . . . . . . . . . . A . 7 SER OG . . . . . . . . . c30225_5ug3 1 . 11 . 2954 . 1 1 8 ASN C C 2.241 5.495 0.212 . . . 1.0 . . . . . . . . . . . . A . 8 ASN C . . . . . . . . . c30225_5ug3 1 . 11 . 2955 . 1 1 8 ASN CA C 0.876 6.034 0.563 . . . 1.0 . . . . . . . . . . . . A . 8 ASN CA . . . . . . . . . c30225_5ug3 1 . 11 . 2956 . 1 1 8 ASN CB C 0.521 5.564 1.965 . . . 1.0 . . . . . . . . . . . . A . 8 ASN CB . . . . . . . . . c30225_5ug3 1 . 11 . 2957 . 1 1 8 ASN CG C -0.772 6.163 2.467 . . . 1.0 . . . . . . . . . . . . A . 8 ASN CG . . . . . . . . . c30225_5ug3 1 . 11 . 2958 . 1 1 8 ASN H H -0.243 4.589 -0.497 . . . 1.0 . . . . . . . . . . . . A . 8 ASN H . . . . . . . . . c30225_5ug3 1 . 11 . 2959 . 1 1 8 ASN HA H 0.889 7.111 0.535 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HA . . . . . . . . . c30225_5ug3 1 . 11 . 2960 . 1 1 8 ASN HB2 H 0.427 4.490 1.951 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HB2 . . . . . . . . . c30225_5ug3 1 . 11 . 2961 . 1 1 8 ASN HB3 H 1.316 5.840 2.642 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HB3 . . . . . . . . . c30225_5ug3 1 . 11 . 2962 . 1 1 8 ASN HD21 H -1.817 4.798 1.457 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HD21 . . . . . . . . . c30225_5ug3 1 . 11 . 2963 . 1 1 8 ASN HD22 H -2.739 5.941 2.386 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HD22 . . . . . . . . . c30225_5ug3 1 . 11 . 2964 . 1 1 8 ASN N N -0.110 5.556 -0.399 . . . 1.0 . . . . . . . . . . . . A . 8 ASN N . . . . . . . . . c30225_5ug3 1 . 11 . 2965 . 1 1 8 ASN ND2 N -1.886 5.581 2.063 . . . 1.0 . . . . . . . . . . . . A . 8 ASN ND2 . . . . . . . . . c30225_5ug3 1 . 11 . 2966 . 1 1 8 ASN O O 2.539 4.334 0.497 . . . 1.0 . . . . . . . . . . . . A . 8 ASN O . . . . . . . . . c30225_5ug3 1 . 11 . 2967 . 1 1 8 ASN OD1 O -0.770 7.163 3.181 . . . 1.0 . . . . . . . . . . . . A . 8 ASN OD1 . . . . . . . . . c30225_5ug3 1 . 11 . 2968 . 1 1 9 PRO C C 5.267 5.273 0.257 . . . 1.0 . . . . . . . . . . . . A . 9 PRO C . . . . . . . . . c30225_5ug3 1 . 11 . 2969 . 1 1 9 PRO CA C 4.406 5.865 -0.854 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CA . . . . . . . . . c30225_5ug3 1 . 11 . 2970 . 1 1 9 PRO CB C 5.049 7.132 -1.430 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CB . . . . . . . . . c30225_5ug3 1 . 11 . 2971 . 1 1 9 PRO CD C 2.892 7.746 -0.656 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CD . . . . . . . . . c30225_5ug3 1 . 11 . 2972 . 1 1 9 PRO CG C 4.289 8.257 -0.824 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CG . . . . . . . . . c30225_5ug3 1 . 11 . 2973 . 1 1 9 PRO HA H 4.292 5.130 -1.633 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HA . . . . . . . . . c30225_5ug3 1 . 11 . 2974 . 1 1 9 PRO HB2 H 6.094 7.167 -1.159 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HB2 . . . . . . . . . c30225_5ug3 1 . 11 . 2975 . 1 1 9 PRO HB3 H 4.948 7.130 -2.502 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HB3 . . . . . . . . . c30225_5ug3 1 . 11 . 2976 . 1 1 9 PRO HD2 H 2.416 8.232 0.174 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HD2 . . . . . . . . . c30225_5ug3 1 . 11 . 2977 . 1 1 9 PRO HD3 H 2.322 7.889 -1.562 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HD3 . . . . . . . . . c30225_5ug3 1 . 11 . 2978 . 1 1 9 PRO HG2 H 4.715 8.516 0.134 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HG2 . . . . . . . . . c30225_5ug3 1 . 11 . 2979 . 1 1 9 PRO HG3 H 4.302 9.109 -1.486 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HG3 . . . . . . . . . c30225_5ug3 1 . 11 . 2980 . 1 1 9 PRO N N 3.103 6.316 -0.386 . . . 1.0 . . . . . . . . . . . . A . 9 PRO N . . . . . . . . . c30225_5ug3 1 . 11 . 2981 . 1 1 9 PRO O O 6.200 4.531 -0.017 . . . 1.0 . . . . . . . . . . . . A . 9 PRO O . . . . . . . . . c30225_5ug3 1 . 11 . 2982 . 1 1 10 VAL C C 5.299 3.625 2.957 . . . 1.0 . . . . . . . . . . . . A . 10 VAL C . . . . . . . . . c30225_5ug3 1 . 11 . 2983 . 1 1 10 VAL CA C 5.695 5.060 2.641 . . . 1.0 . . . . . . . . . . . . A . 10 VAL CA . . . . . . . . . c30225_5ug3 1 . 11 . 2984 . 1 1 10 VAL CB C 5.502 5.942 3.894 . . . 1.0 . . . . . . . . . . . . A . 10 VAL CB . . . . . . . . . c30225_5ug3 1 . 11 . 2985 . 1 1 10 VAL CG1 C 4.120 5.767 4.508 . . . 1.0 . . . . . . . . . . . . A . 10 VAL CG1 . . . . . . . . . c30225_5ug3 1 . 11 . 2986 . 1 1 10 VAL CG2 C 6.592 5.672 4.918 . . . 1.0 . . . . . . . . . . . . A . 10 VAL CG2 . . . . . . . . . c30225_5ug3 1 . 11 . 2987 . 1 1 10 VAL H H 4.140 6.137 1.671 . . . 1.0 . . . . . . . . . . . . A . 10 VAL H . . . . . . . . . c30225_5ug3 1 . 11 . 2988 . 1 1 10 VAL HA H 6.744 5.078 2.366 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HA . . . . . . . . . c30225_5ug3 1 . 11 . 2989 . 1 1 10 VAL HB H 5.580 6.961 3.580 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HB . . . . . . . . . c30225_5ug3 1 . 11 . 2990 . 1 1 10 VAL HG11 H 3.368 6.037 3.785 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HG11 . . . . . . . . . c30225_5ug3 1 . 11 . 2991 . 1 1 10 VAL HG12 H 4.030 6.401 5.377 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HG12 . . . . . . . . . c30225_5ug3 1 . 11 . 2992 . 1 1 10 VAL HG13 H 3.986 4.736 4.799 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HG13 . . . . . . . . . c30225_5ug3 1 . 11 . 2993 . 1 1 10 VAL HG21 H 6.448 6.312 5.774 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HG21 . . . . . . . . . c30225_5ug3 1 . 11 . 2994 . 1 1 10 VAL HG22 H 7.557 5.874 4.478 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HG22 . . . . . . . . . c30225_5ug3 1 . 11 . 2995 . 1 1 10 VAL HG23 H 6.547 4.639 5.229 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HG23 . . . . . . . . . c30225_5ug3 1 . 11 . 2996 . 1 1 10 VAL N N 4.927 5.569 1.508 . . . 1.0 . . . . . . . . . . . . A . 10 VAL N . . . . . . . . . c30225_5ug3 1 . 11 . 2997 . 1 1 10 VAL O O 6.135 2.786 3.297 . . . 1.0 . . . . . . . . . . . . A . 10 VAL O . . . . . . . . . c30225_5ug3 1 . 11 . 2998 . 1 1 11 CYS C C 3.908 1.073 1.946 . . . 1.0 . . . . . . . . . . . . A . 11 CYS C . . . . . . . . . c30225_5ug3 1 . 11 . 2999 . 1 1 11 CYS CA C 3.558 1.995 3.105 . . . 1.0 . . . . . . . . . . . . A . 11 CYS CA . . . . . . . . . c30225_5ug3 1 . 11 . 3000 . 1 1 11 CYS CB C 2.055 1.954 3.387 . . . 1.0 . . . . . . . . . . . . A . 11 CYS CB . . . . . . . . . c30225_5ug3 1 . 11 . 3001 . 1 1 11 CYS H H 3.397 4.044 2.575 . . . 1.0 . . . . . . . . . . . . A . 11 CYS H . . . . . . . . . c30225_5ug3 1 . 11 . 3002 . 1 1 11 CYS HA H 4.082 1.650 3.983 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HA . . . . . . . . . c30225_5ug3 1 . 11 . 3003 . 1 1 11 CYS HB2 H 1.801 2.747 4.073 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HB2 . . . . . . . . . c30225_5ug3 1 . 11 . 3004 . 1 1 11 CYS HB3 H 1.515 2.094 2.463 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HB3 . . . . . . . . . c30225_5ug3 1 . 11 . 3005 . 1 1 11 CYS N N 4.026 3.337 2.833 . . . 1.0 . . . . . . . . . . . . A . 11 CYS N . . . . . . . . . c30225_5ug3 1 . 11 . 3006 . 1 1 11 CYS O O 4.381 -0.037 2.157 . . . 1.0 . . . . . . . . . . . . A . 11 CYS O . . . . . . . . . c30225_5ug3 1 . 11 . 3007 . 1 1 11 CYS SG S 1.504 0.374 4.125 . . . 1.0 . . . . . . . . . . . . A . 11 CYS SG . . . . . . . . . c30225_5ug3 1 . 11 . 3008 . 1 1 12 ARG C C 5.409 0.412 -0.717 . . . 1.0 . . . . . . . . . . . . A . 12 ARG C . . . . . . . . . c30225_5ug3 1 . 11 . 3009 . 1 1 12 ARG CA C 3.940 0.689 -0.443 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CA . . . . . . . . . c30225_5ug3 1 . 11 . 3010 . 1 1 12 ARG CB C 3.260 1.247 -1.687 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CB . . . . . . . . . c30225_5ug3 1 . 11 . 3011 . 1 1 12 ARG CD C 2.743 3.280 -3.047 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CD . . . . . . . . . c30225_5ug3 1 . 11 . 3012 . 1 1 12 ARG CG C 3.563 2.697 -1.910 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CG . . . . . . . . . c30225_5ug3 1 . 11 . 3013 . 1 1 12 ARG CZ C 2.568 3.019 -5.495 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CZ . . . . . . . . . c30225_5ug3 1 . 11 . 3014 . 1 1 12 ARG H H 3.432 2.477 0.587 . . . 1.0 . . . . . . . . . . . . A . 12 ARG H . . . . . . . . . c30225_5ug3 1 . 11 . 3015 . 1 1 12 ARG HA H 3.487 -0.229 -0.203 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HA . . . . . . . . . c30225_5ug3 1 . 11 . 3016 . 1 1 12 ARG HB2 H 3.598 0.693 -2.549 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HB2 . . . . . . . . . c30225_5ug3 1 . 11 . 3017 . 1 1 12 ARG HB3 H 2.190 1.131 -1.586 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HB3 . . . . . . . . . c30225_5ug3 1 . 11 . 3018 . 1 1 12 ARG HD2 H 1.699 3.210 -2.784 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HD2 . . . . . . . . . c30225_5ug3 1 . 11 . 3019 . 1 1 12 ARG HD3 H 3.013 4.318 -3.172 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HD3 . . . . . . . . . c30225_5ug3 1 . 11 . 3020 . 1 1 12 ARG HE H 3.446 1.716 -4.258 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HE . . . . . . . . . c30225_5ug3 1 . 11 . 3021 . 1 1 12 ARG HG2 H 3.325 3.216 -1.002 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HG2 . . . . . . . . . c30225_5ug3 1 . 11 . 3022 . 1 1 12 ARG HG3 H 4.612 2.807 -2.133 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HG3 . . . . . . . . . c30225_5ug3 1 . 11 . 3023 . 1 1 12 ARG HH11 H 1.725 4.716 -4.779 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH11 . . . . . . . . . c30225_5ug3 1 . 11 . 3024 . 1 1 12 ARG HH12 H 1.628 4.508 -6.496 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH12 . . . . . . . . . c30225_5ug3 1 . 11 . 3025 . 1 1 12 ARG HH21 H 3.301 1.427 -6.518 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH21 . . . . . . . . . c30225_5ug3 1 . 11 . 3026 . 1 1 12 ARG HH22 H 2.500 2.628 -7.484 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH22 . . . . . . . . . c30225_5ug3 1 . 11 . 3027 . 1 1 12 ARG N N 3.728 1.547 0.717 . . . 1.0 . . . . . . . . . . . . A . 12 ARG N . . . . . . . . . c30225_5ug3 1 . 11 . 3028 . 1 1 12 ARG NE N 2.968 2.575 -4.305 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NE . . . . . . . . . c30225_5ug3 1 . 11 . 3029 . 1 1 12 ARG NH1 N 1.920 4.174 -5.597 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NH1 . . . . . . . . . c30225_5ug3 1 . 11 . 3030 . 1 1 12 ARG NH2 N 2.813 2.303 -6.587 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NH2 . . . . . . . . . c30225_5ug3 1 . 11 . 3031 . 1 1 12 ARG O O 5.750 -0.623 -1.290 . . . 1.0 . . . . . . . . . . . . A . 12 ARG O . . . . . . . . . c30225_5ug3 1 . 11 . 3032 . 1 1 13 VAL C C 8.253 -0.015 0.314 . . . 1.0 . . . . . . . . . . . . A . 13 VAL C . . . . . . . . . c30225_5ug3 1 . 11 . 3033 . 1 1 13 VAL CA C 7.697 1.160 -0.504 . . . 1.0 . . . . . . . . . . . . A . 13 VAL CA . . . . . . . . . c30225_5ug3 1 . 11 . 3034 . 1 1 13 VAL CB C 8.411 2.465 -0.120 . . . 1.0 . . . . . . . . . . . . A . 13 VAL CB . . . . . . . . . c30225_5ug3 1 . 11 . 3035 . 1 1 13 VAL CG1 C 8.151 2.787 1.329 . . . 1.0 . . . . . . . . . . . . A . 13 VAL CG1 . . . . . . . . . c30225_5ug3 1 . 11 . 3036 . 1 1 13 VAL CG2 C 9.890 2.391 -0.381 . . . 1.0 . . . . . . . . . . . . A . 13 VAL CG2 . . . . . . . . . c30225_5ug3 1 . 11 . 3037 . 1 1 13 VAL H H 5.948 2.119 0.150 . . . 1.0 . . . . . . . . . . . . A . 13 VAL H . . . . . . . . . c30225_5ug3 1 . 11 . 3038 . 1 1 13 VAL HA H 7.869 0.974 -1.554 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HA . . . . . . . . . c30225_5ug3 1 . 11 . 3039 . 1 1 13 VAL HB H 8.000 3.265 -0.720 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HB . . . . . . . . . c30225_5ug3 1 . 11 . 3040 . 1 1 13 VAL HG11 H 8.449 3.801 1.538 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HG11 . . . . . . . . . c30225_5ug3 1 . 11 . 3041 . 1 1 13 VAL HG12 H 8.710 2.107 1.954 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HG12 . . . . . . . . . c30225_5ug3 1 . 11 . 3042 . 1 1 13 VAL HG13 H 7.088 2.666 1.528 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HG13 . . . . . . . . . c30225_5ug3 1 . 11 . 3043 . 1 1 13 VAL HG21 H 10.347 3.316 -0.069 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HG21 . . . . . . . . . c30225_5ug3 1 . 11 . 3044 . 1 1 13 VAL HG22 H 10.060 2.237 -1.432 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HG22 . . . . . . . . . c30225_5ug3 1 . 11 . 3045 . 1 1 13 VAL HG23 H 10.309 1.573 0.181 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HG23 . . . . . . . . . c30225_5ug3 1 . 11 . 3046 . 1 1 13 VAL N N 6.273 1.315 -0.300 . . . 1.0 . . . . . . . . . . . . A . 13 VAL N . . . . . . . . . c30225_5ug3 1 . 11 . 3047 . 1 1 13 VAL O O 9.083 -0.786 -0.175 . . . 1.0 . . . . . . . . . . . . A . 13 VAL O . . . . . . . . . c30225_5ug3 1 . 11 . 3048 . 1 1 14 ASN C C 7.438 -2.497 2.257 . . . 1.0 . . . . . . . . . . . . A . 14 ASN C . . . . . . . . . c30225_5ug3 1 . 11 . 3049 . 1 1 14 ASN CA C 8.279 -1.234 2.421 . . . 1.0 . . . . . . . . . . . . A . 14 ASN CA . . . . . . . . . c30225_5ug3 1 . 11 . 3050 . 1 1 14 ASN CB C 8.274 -0.800 3.895 . . . 1.0 . . . . . . . . . . . . A . 14 ASN CB . . . . . . . . . c30225_5ug3 1 . 11 . 3051 . 1 1 14 ASN CG C 6.887 -0.810 4.509 . . . 1.0 . . . . . . . . . . . . A . 14 ASN CG . . . . . . . . . c30225_5ug3 1 . 11 . 3052 . 1 1 14 ASN H H 7.111 0.472 1.897 . . . 1.0 . . . . . . . . . . . . A . 14 ASN H . . . . . . . . . c30225_5ug3 1 . 11 . 3053 . 1 1 14 ASN HA H 9.294 -1.453 2.124 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HA . . . . . . . . . c30225_5ug3 1 . 11 . 3054 . 1 1 14 ASN HB2 H 8.900 -1.474 4.462 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HB2 . . . . . . . . . c30225_5ug3 1 . 11 . 3055 . 1 1 14 ASN HB3 H 8.673 0.201 3.969 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HB3 . . . . . . . . . c30225_5ug3 1 . 11 . 3056 . 1 1 14 ASN HD21 H 6.626 1.105 4.040 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HD21 . . . . . . . . . c30225_5ug3 1 . 11 . 3057 . 1 1 14 ASN HD22 H 5.300 0.329 4.833 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HD22 . . . . . . . . . c30225_5ug3 1 . 11 . 3058 . 1 1 14 ASN N N 7.786 -0.163 1.555 . . . 1.0 . . . . . . . . . . . . A . 14 ASN N . . . . . . . . . c30225_5ug3 1 . 11 . 3059 . 1 1 14 ASN ND2 N 6.205 0.320 4.459 . . . 1.0 . . . . . . . . . . . . A . 14 ASN ND2 . . . . . . . . . c30225_5ug3 1 . 11 . 3060 . 1 1 14 ASN O O 7.890 -3.601 2.566 . . . 1.0 . . . . . . . . . . . . A . 14 ASN O . . . . . . . . . c30225_5ug3 1 . 11 . 3061 . 1 1 14 ASN OD1 O 6.432 -1.825 5.034 . . . 1.0 . . . . . . . . . . . . A . 14 ASN OD1 . . . . . . . . . c30225_5ug3 1 . 11 . 3062 . 1 1 15 ASN C C 5.728 -4.371 0.512 . . . 1.0 . . . . . . . . . . . . A . 15 ASN C . . . . . . . . . c30225_5ug3 1 . 11 . 3063 . 1 1 15 ASN CA C 5.286 -3.420 1.624 . . . 1.0 . . . . . . . . . . . . A . 15 ASN CA . . . . . . . . . c30225_5ug3 1 . 11 . 3064 . 1 1 15 ASN CB C 3.875 -2.861 1.377 . . . 1.0 . . . . . . . . . . . . A . 15 ASN CB . . . . . . . . . c30225_5ug3 1 . 11 . 3065 . 1 1 15 ASN CG C 3.269 -3.247 0.046 . . . 1.0 . . . . . . . . . . . . A . 15 ASN CG . . . . . . . . . c30225_5ug3 1 . 11 . 3066 . 1 1 15 ASN H H 5.927 -1.436 1.520 . . . 1.0 . . . . . . . . . . . . A . 15 ASN H . . . . . . . . . c30225_5ug3 1 . 11 . 3067 . 1 1 15 ASN HA H 5.282 -3.970 2.556 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HA . . . . . . . . . c30225_5ug3 1 . 11 . 3068 . 1 1 15 ASN HB2 H 3.221 -3.227 2.149 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HB2 . . . . . . . . . c30225_5ug3 1 . 11 . 3069 . 1 1 15 ASN HB3 H 3.916 -1.782 1.436 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HB3 . . . . . . . . . c30225_5ug3 1 . 11 . 3070 . 1 1 15 ASN HD21 H 4.205 -1.751 -0.851 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HD21 . . . . . . . . . c30225_5ug3 1 . 11 . 3071 . 1 1 15 ASN HD22 H 3.183 -2.707 -1.865 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HD22 . . . . . . . . . c30225_5ug3 1 . 11 . 3072 . 1 1 15 ASN N N 6.217 -2.325 1.774 . . . 1.0 . . . . . . . . . . . . A . 15 ASN N . . . . . . . . . c30225_5ug3 1 . 11 . 3073 . 1 1 15 ASN ND2 N 3.590 -2.500 -0.996 . . . 1.0 . . . . . . . . . . . . A . 15 ASN ND2 . . . . . . . . . c30225_5ug3 1 . 11 . 3074 . 1 1 15 ASN O O 6.202 -3.954 -0.546 . . . 1.0 . . . . . . . . . . . . A . 15 ASN O . . . . . . . . . c30225_5ug3 1 . 11 . 3075 . 1 1 15 ASN OD1 O 2.529 -4.218 -0.043 . . . 1.0 . . . . . . . . . . . . A . 15 ASN OD1 . . . . . . . . . c30225_5ug3 1 . 11 . 3076 . 1 1 16 HYP C C 5.115 -6.926 -1.351 . . . 1.0 . . . . . . . . . . . . A . 16 HYP C . . . . . . . . . c30225_5ug3 1 . 11 . 3077 . 1 1 16 HYP CA C 6.011 -6.755 -0.125 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CA . . . . . . . . . c30225_5ug3 1 . 11 . 3078 . 1 1 16 HYP CB C 5.899 -7.955 0.778 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CB . . . . . . . . . c30225_5ug3 1 . 11 . 3079 . 1 1 16 HYP CD C 4.983 -6.150 2.051 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CD . . . . . . . . . c30225_5ug3 1 . 11 . 3080 . 1 1 16 HYP CG C 5.106 -7.638 2.019 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CG . . . . . . . . . c30225_5ug3 1 . 11 . 3081 . 1 1 16 HYP HA H 7.035 -6.630 -0.440 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HA . . . . . . . . . c30225_5ug3 1 . 11 . 3082 . 1 1 16 HYP HB2 H 6.887 -8.273 1.070 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HB2 . . . . . . . . . c30225_5ug3 1 . 11 . 3083 . 1 1 16 HYP HB3 H 5.410 -8.754 0.238 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HB3 . . . . . . . . . c30225_5ug3 1 . 11 . 3084 . 1 1 16 HYP HD1 H 5.928 -7.189 3.703 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HD1 . . . . . . . . . c30225_5ug3 1 . 11 . 3085 . 1 1 16 HYP HD22 H 3.960 -5.852 2.127 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HD22 . . . . . . . . . c30225_5ug3 1 . 11 . 3086 . 1 1 16 HYP HD23 H 5.537 -5.763 2.891 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HD23 . . . . . . . . . c30225_5ug3 1 . 11 . 3087 . 1 1 16 HYP HG H 4.141 -8.125 1.994 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HG . . . . . . . . . c30225_5ug3 1 . 11 . 3088 . 1 1 16 HYP N N 5.580 -5.666 0.780 . . . 1.0 . . . . . . . . . . . . A . 16 HYP N . . . . . . . . . c30225_5ug3 1 . 11 . 3089 . 1 1 16 HYP O O 4.675 -8.035 -1.662 . . . 1.0 . . . . . . . . . . . . A . 16 HYP O . . . . . . . . . c30225_5ug3 1 . 11 . 3090 . 1 1 16 HYP OD1 O 5.810 -8.001 3.186 . . . 1.0 . . . . . . . . . . . . A . 16 HYP OD1 . . . . . . . . . c30225_5ug3 1 . 11 . 3091 . 1 1 17 HIS C C 2.662 -6.361 -3.056 . . . 1.0 . . . . . . . . . . . . A . 17 HIS C . . . . . . . . . c30225_5ug3 1 . 11 . 3092 . 1 1 17 HIS CA C 4.076 -5.819 -3.275 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CA . . . . . . . . . c30225_5ug3 1 . 11 . 3093 . 1 1 17 HIS CB C 4.790 -6.631 -4.366 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CB . . . . . . . . . c30225_5ug3 1 . 11 . 3094 . 1 1 17 HIS CD2 C 6.477 -4.954 -5.413 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CD2 . . . . . . . . . c30225_5ug3 1 . 11 . 3095 . 1 1 17 HIS CE1 C 8.325 -6.028 -4.950 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CE1 . . . . . . . . . c30225_5ug3 1 . 11 . 3096 . 1 1 17 HIS CG C 6.133 -6.087 -4.755 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CG . . . . . . . . . c30225_5ug3 1 . 11 . 3097 . 1 1 17 HIS H H 5.186 -4.964 -1.671 . . . 1.0 . . . . . . . . . . . . A . 17 HIS H . . . . . . . . . c30225_5ug3 1 . 11 . 3098 . 1 1 17 HIS HA H 3.999 -4.794 -3.606 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HA . . . . . . . . . c30225_5ug3 1 . 11 . 3099 . 1 1 17 HIS HB2 H 4.936 -7.641 -4.012 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HB2 . . . . . . . . . c30225_5ug3 1 . 11 . 3100 . 1 1 17 HIS HB3 H 4.170 -6.652 -5.250 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HB3 . . . . . . . . . c30225_5ug3 1 . 11 . 3101 . 1 1 17 HIS HD1 H 7.404 -7.594 -4.009 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HD1 . . . . . . . . . c30225_5ug3 1 . 11 . 3102 . 1 1 17 HIS HD2 H 5.800 -4.201 -5.788 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HD2 . . . . . . . . . c30225_5ug3 1 . 11 . 3103 . 1 1 17 HIS HE1 H 9.369 -6.293 -4.877 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HE1 . . . . . . . . . c30225_5ug3 1 . 11 . 3104 . 1 1 17 HIS HE2 H 8.384 -4.160 -5.779 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HE2 . . . . . . . . . c30225_5ug3 1 . 11 . 3105 . 1 1 17 HIS N N 4.849 -5.819 -2.029 . . . 1.0 . . . . . . . . . . . . A . 17 HIS N . . . . . . . . . c30225_5ug3 1 . 11 . 3106 . 1 1 17 HIS ND1 N 7.316 -6.737 -4.481 . . . 1.0 . . . . . . . . . . . . A . 17 HIS ND1 . . . . . . . . . c30225_5ug3 1 . 11 . 3107 . 1 1 17 HIS NE2 N 7.846 -4.940 -5.521 . . . 1.0 . . . . . . . . . . . . A . 17 HIS NE2 . . . . . . . . . c30225_5ug3 1 . 11 . 3108 . 1 1 17 HIS O O 2.152 -7.156 -3.850 . . . 1.0 . . . . . . . . . . . . A . 17 HIS O . . . . . . . . . c30225_5ug3 1 . 11 . 3109 . 1 1 18 VAL C C -0.239 -5.122 -2.041 . . . 1.0 . . . . . . . . . . . . A . 18 VAL C . . . . . . . . . c30225_5ug3 1 . 11 . 3110 . 1 1 18 VAL CA C 0.662 -6.290 -1.668 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CA . . . . . . . . . c30225_5ug3 1 . 11 . 3111 . 1 1 18 VAL CB C 0.470 -6.607 -0.170 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CB . . . . . . . . . c30225_5ug3 1 . 11 . 3112 . 1 1 18 VAL CG1 C -0.862 -7.294 0.071 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CG1 . . . . . . . . . c30225_5ug3 1 . 11 . 3113 . 1 1 18 VAL CG2 C 1.620 -7.448 0.359 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CG2 . . . . . . . . . c30225_5ug3 1 . 11 . 3114 . 1 1 18 VAL H H 2.533 -5.361 -1.336 . . . 1.0 . . . . . . . . . . . . A . 18 VAL H . . . . . . . . . c30225_5ug3 1 . 11 . 3115 . 1 1 18 VAL HA H 0.392 -7.158 -2.251 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HA . . . . . . . . . c30225_5ug3 1 . 11 . 3116 . 1 1 18 VAL HB H 0.463 -5.671 0.371 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HB . . . . . . . . . c30225_5ug3 1 . 11 . 3117 . 1 1 18 VAL HG11 H -0.975 -7.503 1.124 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG11 . . . . . . . . . c30225_5ug3 1 . 11 . 3118 . 1 1 18 VAL HG12 H -0.894 -8.221 -0.483 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG12 . . . . . . . . . c30225_5ug3 1 . 11 . 3119 . 1 1 18 VAL HG13 H -1.664 -6.651 -0.256 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG13 . . . . . . . . . c30225_5ug3 1 . 11 . 3120 . 1 1 18 VAL HG21 H 1.425 -7.714 1.386 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG21 . . . . . . . . . c30225_5ug3 1 . 11 . 3121 . 1 1 18 VAL HG22 H 2.536 -6.878 0.304 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG22 . . . . . . . . . c30225_5ug3 1 . 11 . 3122 . 1 1 18 VAL HG23 H 1.714 -8.343 -0.235 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG23 . . . . . . . . . c30225_5ug3 1 . 11 . 3123 . 1 1 18 VAL N N 2.045 -5.937 -1.966 . . . 1.0 . . . . . . . . . . . . A . 18 VAL N . . . . . . . . . c30225_5ug3 1 . 11 . 3124 . 1 1 18 VAL O O -1.316 -5.294 -2.618 . . . 1.0 . . . . . . . . . . . . A . 18 VAL O . . . . . . . . . c30225_5ug3 1 . 11 . 3125 . 1 1 19 CYS C C 0.613 -1.583 -2.055 . . . 1.0 . . . . . . . . . . . . A . 19 CYS C . . . . . . . . . c30225_5ug3 1 . 11 . 3126 . 1 1 19 CYS CA C -0.433 -2.690 -2.047 . . . 1.0 . . . . . . . . . . . . A . 19 CYS CA . . . . . . . . . c30225_5ug3 1 . 11 . 3127 . 1 1 19 CYS CB C -1.556 -2.375 -1.051 . . . 1.0 . . . . . . . . . . . . A . 19 CYS CB . . . . . . . . . c30225_5ug3 1 . 11 . 3128 . 1 1 19 CYS H H 1.058 -3.887 -1.173 . . . 1.0 . . . . . . . . . . . . A . 19 CYS H . . . . . . . . . c30225_5ug3 1 . 11 . 3129 . 1 1 19 CYS HA H -0.847 -2.796 -3.038 . . . 1.0 . . . . . . . . . . . . A . 19 CYS HA . . . . . . . . . c30225_5ug3 1 . 11 . 3130 . 1 1 19 CYS HB2 H -2.208 -3.232 -0.979 . . . 1.0 . . . . . . . . . . . . A . 19 CYS HB2 . . . . . . . . . c30225_5ug3 1 . 11 . 3131 . 1 1 19 CYS HB3 H -1.118 -2.188 -0.082 . . . 1.0 . . . . . . . . . . . . A . 19 CYS HB3 . . . . . . . . . c30225_5ug3 1 . 11 . 3132 . 1 1 19 CYS N N 0.226 -3.933 -1.693 . . . 1.0 . . . . . . . . . . . . A . 19 CYS N . . . . . . . . . c30225_5ug3 1 . 11 . 3133 . 1 1 19 CYS O O 0.678 -0.811 -1.080 . . . 1.0 . . . . . . . . . . . . A . 19 CYS O . . . . . . . . . c30225_5ug3 1 . 11 . 3134 . 1 1 19 CYS OXT O 1.409 -1.541 -3.018 . . . 1.0 . . . . . . . . . . . . A . 19 CYS OXT . . . . . . . . . c30225_5ug3 1 . 11 . 3135 . 1 1 19 CYS SG S -2.595 -0.931 -1.478 . . . 1.0 . . . . . . . . . . . . A . 19 CYS SG . . . . . . . . . c30225_5ug3 1 . 12 . 3136 . 1 1 1 ILE C C -10.155 -4.129 0.043 . . . 1.0 . . . . . . . . . . . . A . 1 ILE C . . . . . . . . . c30225_5ug3 1 . 12 . 3137 . 1 1 1 ILE CA C -9.887 -5.598 -0.256 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CA . . . . . . . . . c30225_5ug3 1 . 12 . 3138 . 1 1 1 ILE CB C -8.969 -5.706 -1.492 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CB . . . . . . . . . c30225_5ug3 1 . 12 . 3139 . 1 1 1 ILE CD1 C -7.890 -7.375 -3.094 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CD1 . . . . . . . . . c30225_5ug3 1 . 12 . 3140 . 1 1 1 ILE CG1 C -8.727 -7.177 -1.848 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CG1 . . . . . . . . . c30225_5ug3 1 . 12 . 3141 . 1 1 1 ILE CG2 C -7.648 -4.994 -1.237 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CG2 . . . . . . . . . c30225_5ug3 1 . 12 . 3142 . 1 1 1 ILE H1 H -10.985 -7.311 -0.673 . . . 1.0 . . . . . . . . . . . . A . 1 ILE H1 . . . . . . . . . c30225_5ug3 1 . 12 . 3143 . 1 1 1 ILE H2 H -11.679 -5.890 -1.266 . . . 1.0 . . . . . . . . . . . . A . 1 ILE H2 . . . . . . . . . c30225_5ug3 1 . 12 . 3144 . 1 1 1 ILE H3 H -11.755 -6.243 0.383 . . . 1.0 . . . . . . . . . . . . A . 1 ILE H3 . . . . . . . . . c30225_5ug3 1 . 12 . 3145 . 1 1 1 ILE HA H -9.382 -6.042 0.589 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HA . . . . . . . . . c30225_5ug3 1 . 12 . 3146 . 1 1 1 ILE HB H -9.458 -5.218 -2.320 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HB . . . . . . . . . c30225_5ug3 1 . 12 . 3147 . 1 1 1 ILE HD11 H -6.924 -6.912 -2.956 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HD11 . . . . . . . . . c30225_5ug3 1 . 12 . 3148 . 1 1 1 ILE HD12 H -8.388 -6.922 -3.938 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HD12 . . . . . . . . . c30225_5ug3 1 . 12 . 3149 . 1 1 1 ILE HD13 H -7.759 -8.431 -3.277 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HD13 . . . . . . . . . c30225_5ug3 1 . 12 . 3150 . 1 1 1 ILE HG12 H -8.216 -7.659 -1.029 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG12 . . . . . . . . . c30225_5ug3 1 . 12 . 3151 . 1 1 1 ILE HG13 H -9.678 -7.662 -2.007 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG13 . . . . . . . . . c30225_5ug3 1 . 12 . 3152 . 1 1 1 ILE HG21 H -7.019 -5.078 -2.111 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG21 . . . . . . . . . c30225_5ug3 1 . 12 . 3153 . 1 1 1 ILE HG22 H -7.151 -5.448 -0.391 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG22 . . . . . . . . . c30225_5ug3 1 . 12 . 3154 . 1 1 1 ILE HG23 H -7.836 -3.951 -1.027 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG23 . . . . . . . . . c30225_5ug3 1 . 12 . 3155 . 1 1 1 ILE N N -11.163 -6.311 -0.469 . . . 1.0 . . . . . . . . . . . . A . 1 ILE N . . . . . . . . . c30225_5ug3 1 . 12 . 3156 . 1 1 1 ILE O O -10.848 -3.452 -0.718 . . . 1.0 . . . . . . . . . . . . A . 1 ILE O . . . . . . . . . c30225_5ug3 1 . 12 . 3157 . 1 1 2 ARG C C -8.477 -1.601 1.871 . . . 1.0 . . . . . . . . . . . . A . 2 ARG C . . . . . . . . . c30225_5ug3 1 . 12 . 3158 . 1 1 2 ARG CA C -9.810 -2.267 1.563 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CA . . . . . . . . . c30225_5ug3 1 . 12 . 3159 . 1 1 2 ARG CB C -10.736 -2.190 2.779 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CB . . . . . . . . . c30225_5ug3 1 . 12 . 3160 . 1 1 2 ARG CD C -12.857 -1.889 1.471 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CD . . . . . . . . . c30225_5ug3 1 . 12 . 3161 . 1 1 2 ARG CG C -12.134 -2.721 2.515 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CG . . . . . . . . . c30225_5ug3 1 . 12 . 3162 . 1 1 2 ARG CZ C -15.129 -1.783 0.515 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CZ . . . . . . . . . c30225_5ug3 1 . 12 . 3163 . 1 1 2 ARG H H -9.078 -4.234 1.720 . . . 1.0 . . . . . . . . . . . . A . 2 ARG H . . . . . . . . . c30225_5ug3 1 . 12 . 3164 . 1 1 2 ARG HA H -10.266 -1.755 0.740 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HA . . . . . . . . . c30225_5ug3 1 . 12 . 3165 . 1 1 2 ARG HB2 H -10.303 -2.765 3.585 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB2 . . . . . . . . . c30225_5ug3 1 . 12 . 3166 . 1 1 2 ARG HB3 H -10.818 -1.159 3.089 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB3 . . . . . . . . . c30225_5ug3 1 . 12 . 3167 . 1 1 2 ARG HD2 H -13.010 -0.897 1.864 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD2 . . . . . . . . . c30225_5ug3 1 . 12 . 3168 . 1 1 2 ARG HD3 H -12.243 -1.832 0.584 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD3 . . . . . . . . . c30225_5ug3 1 . 12 . 3169 . 1 1 2 ARG HE H -14.296 -3.414 1.326 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HE . . . . . . . . . c30225_5ug3 1 . 12 . 3170 . 1 1 2 ARG HG2 H -12.061 -3.737 2.159 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG2 . . . . . . . . . c30225_5ug3 1 . 12 . 3171 . 1 1 2 ARG HG3 H -12.699 -2.697 3.435 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG3 . . . . . . . . . c30225_5ug3 1 . 12 . 3172 . 1 1 2 ARG HH11 H -14.100 -0.037 0.431 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH11 . . . . . . . . . c30225_5ug3 1 . 12 . 3173 . 1 1 2 ARG HH12 H -15.701 0.009 -0.236 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH12 . . . . . . . . . c30225_5ug3 1 . 12 . 3174 . 1 1 2 ARG HH21 H -16.401 -3.359 0.448 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH21 . . . . . . . . . c30225_5ug3 1 . 12 . 3175 . 1 1 2 ARG HH22 H -17.008 -1.884 -0.236 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH22 . . . . . . . . . c30225_5ug3 1 . 12 . 3176 . 1 1 2 ARG N N -9.617 -3.647 1.156 . . . 1.0 . . . . . . . . . . . . A . 2 ARG N . . . . . . . . . c30225_5ug3 1 . 12 . 3177 . 1 1 2 ARG NE N -14.151 -2.463 1.114 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NE . . . . . . . . . c30225_5ug3 1 . 12 . 3178 . 1 1 2 ARG NH1 N -14.965 -0.502 0.212 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH1 . . . . . . . . . c30225_5ug3 1 . 12 . 3179 . 1 1 2 ARG NH2 N -16.271 -2.390 0.220 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH2 . . . . . . . . . c30225_5ug3 1 . 12 . 3180 . 1 1 2 ARG O O -8.398 -0.689 2.693 . . . 1.0 . . . . . . . . . . . . A . 2 ARG O . . . . . . . . . c30225_5ug3 1 . 12 . 3181 . 1 1 3 ASP C C -5.830 -0.393 0.411 . . . 1.0 . . . . . . . . . . . . A . 3 ASP C . . . . . . . . . c30225_5ug3 1 . 12 . 3182 . 1 1 3 ASP CA C -6.103 -1.517 1.391 . . . 1.0 . . . . . . . . . . . . A . 3 ASP CA . . . . . . . . . c30225_5ug3 1 . 12 . 3183 . 1 1 3 ASP CB C -5.047 -2.613 1.245 . . . 1.0 . . . . . . . . . . . . A . 3 ASP CB . . . . . . . . . c30225_5ug3 1 . 12 . 3184 . 1 1 3 ASP CG C -5.095 -3.612 2.381 . . . 1.0 . . . . . . . . . . . . A . 3 ASP CG . . . . . . . . . c30225_5ug3 1 . 12 . 3185 . 1 1 3 ASP H H -7.578 -2.732 0.510 . . . 1.0 . . . . . . . . . . . . A . 3 ASP H . . . . . . . . . c30225_5ug3 1 . 12 . 3186 . 1 1 3 ASP HA H -6.058 -1.120 2.393 . . . 1.0 . . . . . . . . . . . . A . 3 ASP HA . . . . . . . . . c30225_5ug3 1 . 12 . 3187 . 1 1 3 ASP HB2 H -5.211 -3.143 0.319 . . . 1.0 . . . . . . . . . . . . A . 3 ASP HB2 . . . . . . . . . c30225_5ug3 1 . 12 . 3188 . 1 1 3 ASP HB3 H -4.066 -2.161 1.227 . . . 1.0 . . . . . . . . . . . . A . 3 ASP HB3 . . . . . . . . . c30225_5ug3 1 . 12 . 3189 . 1 1 3 ASP N N -7.440 -2.047 1.187 . . . 1.0 . . . . . . . . . . . . A . 3 ASP N . . . . . . . . . c30225_5ug3 1 . 12 . 3190 . 1 1 3 ASP O O -5.500 -0.629 -0.750 . . . 1.0 . . . . . . . . . . . . A . 3 ASP O . . . . . . . . . c30225_5ug3 1 . 12 . 3191 . 1 1 3 ASP OD1 O -5.611 -4.728 2.175 . . . 1.0 . . . . . . . . . . . . A . 3 ASP OD1 . . . . . . . . . c30225_5ug3 1 . 12 . 3192 . 1 1 3 ASP OD2 O -4.624 -3.282 3.492 . . . 1.0 . . . . . . . . . . . . A . 3 ASP OD2 . . . . . . . . . c30225_5ug3 1 . 12 . 3193 . 1 1 4 GLU C C -4.417 2.629 0.309 . . . 1.0 . . . . . . . . . . . . A . 4 GLU C . . . . . . . . . c30225_5ug3 1 . 12 . 3194 . 1 1 4 GLU CA C -5.789 2.012 0.063 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CA . . . . . . . . . c30225_5ug3 1 . 12 . 3195 . 1 1 4 GLU CB C -6.872 3.045 0.352 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CB . . . . . . . . . c30225_5ug3 1 . 12 . 3196 . 1 1 4 GLU CD C -8.018 4.481 2.084 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CD . . . . . . . . . c30225_5ug3 1 . 12 . 3197 . 1 1 4 GLU CG C -7.046 3.349 1.832 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CG . . . . . . . . . c30225_5ug3 1 . 12 . 3198 . 1 1 4 GLU H H -6.257 0.937 1.825 . . . 1.0 . . . . . . . . . . . . A . 4 GLU H . . . . . . . . . c30225_5ug3 1 . 12 . 3199 . 1 1 4 GLU HA H -5.856 1.713 -0.972 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HA . . . . . . . . . c30225_5ug3 1 . 12 . 3200 . 1 1 4 GLU HB2 H -6.609 3.960 -0.149 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HB2 . . . . . . . . . c30225_5ug3 1 . 12 . 3201 . 1 1 4 GLU HB3 H -7.813 2.685 -0.035 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HB3 . . . . . . . . . c30225_5ug3 1 . 12 . 3202 . 1 1 4 GLU HG2 H -7.412 2.463 2.329 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HG2 . . . . . . . . . c30225_5ug3 1 . 12 . 3203 . 1 1 4 GLU HG3 H -6.084 3.620 2.246 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HG3 . . . . . . . . . c30225_5ug3 1 . 12 . 3204 . 1 1 4 GLU N N -5.989 0.827 0.886 . . . 1.0 . . . . . . . . . . . . A . 4 GLU N . . . . . . . . . c30225_5ug3 1 . 12 . 3205 . 1 1 4 GLU O O -4.131 3.743 -0.136 . . . 1.0 . . . . . . . . . . . . A . 4 GLU O . . . . . . . . . c30225_5ug3 1 . 12 . 3206 . 1 1 4 GLU OE1 O -7.565 5.636 2.223 . . . 1.0 . . . . . . . . . . . . A . 4 GLU OE1 . . . . . . . . . c30225_5ug3 1 . 12 . 3207 . 1 1 4 GLU OE2 O -9.238 4.226 2.138 . . . 1.0 . . . . . . . . . . . . A . 4 GLU OE2 . . . . . . . . . c30225_5ug3 1 . 12 . 3208 . 1 1 5 CYS C C -1.354 2.527 0.114 . . . 1.0 . . . . . . . . . . . . A . 5 CYS C . . . . . . . . . c30225_5ug3 1 . 12 . 3209 . 1 1 5 CYS CA C -2.248 2.393 1.352 . . . 1.0 . . . . . . . . . . . . A . 5 CYS CA . . . . . . . . . c30225_5ug3 1 . 12 . 3210 . 1 1 5 CYS CB C -1.599 1.496 2.403 . . . 1.0 . . . . . . . . . . . . A . 5 CYS CB . . . . . . . . . c30225_5ug3 1 . 12 . 3211 . 1 1 5 CYS H H -3.834 1.014 1.314 . . . 1.0 . . . . . . . . . . . . A . 5 CYS H . . . . . . . . . c30225_5ug3 1 . 12 . 3212 . 1 1 5 CYS HA H -2.380 3.376 1.780 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HA . . . . . . . . . c30225_5ug3 1 . 12 . 3213 . 1 1 5 CYS HB2 H -0.961 2.094 3.018 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HB2 . . . . . . . . . c30225_5ug3 1 . 12 . 3214 . 1 1 5 CYS HB3 H -2.373 1.064 3.017 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HB3 . . . . . . . . . c30225_5ug3 1 . 12 . 3215 . 1 1 5 CYS N N -3.564 1.898 1.005 . . . 1.0 . . . . . . . . . . . . A . 5 CYS N . . . . . . . . . c30225_5ug3 1 . 12 . 3216 . 1 1 5 CYS O O -0.245 3.042 0.199 . . . 1.0 . . . . . . . . . . . . A . 5 CYS O . . . . . . . . . c30225_5ug3 1 . 12 . 3217 . 1 1 5 CYS SG S -0.597 0.134 1.736 . . . 1.0 . . . . . . . . . . . . A . 5 CYS SG . . . . . . . . . c30225_5ug3 1 . 12 . 3218 . 1 1 6 CYS C C -0.989 3.746 -2.614 . . . 1.0 . . . . . . . . . . . . A . 6 CYS C . . . . . . . . . c30225_5ug3 1 . 12 . 3219 . 1 1 6 CYS CA C -1.147 2.259 -2.299 . . . 1.0 . . . . . . . . . . . . A . 6 CYS CA . . . . . . . . . c30225_5ug3 1 . 12 . 3220 . 1 1 6 CYS CB C -1.909 1.572 -3.427 . . . 1.0 . . . . . . . . . . . . A . 6 CYS CB . . . . . . . . . c30225_5ug3 1 . 12 . 3221 . 1 1 6 CYS H H -2.682 1.564 -1.032 . . . 1.0 . . . . . . . . . . . . A . 6 CYS H . . . . . . . . . c30225_5ug3 1 . 12 . 3222 . 1 1 6 CYS HA H -0.167 1.814 -2.215 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HA . . . . . . . . . c30225_5ug3 1 . 12 . 3223 . 1 1 6 CYS HB2 H -2.959 1.786 -3.312 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HB2 . . . . . . . . . c30225_5ug3 1 . 12 . 3224 . 1 1 6 CYS HB3 H -1.570 1.969 -4.367 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HB3 . . . . . . . . . c30225_5ug3 1 . 12 . 3225 . 1 1 6 CYS N N -1.839 2.062 -1.033 . . . 1.0 . . . . . . . . . . . . A . 6 CYS N . . . . . . . . . c30225_5ug3 1 . 12 . 3226 . 1 1 6 CYS O O -0.060 4.145 -3.313 . . . 1.0 . . . . . . . . . . . . A . 6 CYS O . . . . . . . . . c30225_5ug3 1 . 12 . 3227 . 1 1 6 CYS SG S -1.716 -0.239 -3.480 . . . 1.0 . . . . . . . . . . . . A . 6 CYS SG . . . . . . . . . c30225_5ug3 1 . 12 . 3228 . 1 1 7 SER C C -0.910 6.611 -1.187 . . . 1.0 . . . . . . . . . . . . A . 7 SER C . . . . . . . . . c30225_5ug3 1 . 12 . 3229 . 1 1 7 SER CA C -1.809 6.009 -2.265 . . . 1.0 . . . . . . . . . . . . A . 7 SER CA . . . . . . . . . c30225_5ug3 1 . 12 . 3230 . 1 1 7 SER CB C -3.209 6.626 -2.212 . . . 1.0 . . . . . . . . . . . . A . 7 SER CB . . . . . . . . . c30225_5ug3 1 . 12 . 3231 . 1 1 7 SER H H -2.618 4.194 -1.536 . . . 1.0 . . . . . . . . . . . . A . 7 SER H . . . . . . . . . c30225_5ug3 1 . 12 . 3232 . 1 1 7 SER HA H -1.370 6.198 -3.235 . . . 1.0 . . . . . . . . . . . . A . 7 SER HA . . . . . . . . . c30225_5ug3 1 . 12 . 3233 . 1 1 7 SER HB2 H -3.854 6.111 -2.909 . . . 1.0 . . . . . . . . . . . . A . 7 SER HB2 . . . . . . . . . c30225_5ug3 1 . 12 . 3234 . 1 1 7 SER HB3 H -3.608 6.523 -1.214 . . . 1.0 . . . . . . . . . . . . A . 7 SER HB3 . . . . . . . . . c30225_5ug3 1 . 12 . 3235 . 1 1 7 SER HG H -2.579 8.464 -1.949 . . . 1.0 . . . . . . . . . . . . A . 7 SER HG . . . . . . . . . c30225_5ug3 1 . 12 . 3236 . 1 1 7 SER N N -1.886 4.567 -2.077 . . . 1.0 . . . . . . . . . . . . A . 7 SER N . . . . . . . . . c30225_5ug3 1 . 12 . 3237 . 1 1 7 SER O O -0.914 7.817 -0.936 . . . 1.0 . . . . . . . . . . . . A . 7 SER O . . . . . . . . . c30225_5ug3 1 . 12 . 3238 . 1 1 7 SER OG O -3.179 8.003 -2.553 . . . 1.0 . . . . . . . . . . . . A . 7 SER OG . . . . . . . . . c30225_5ug3 1 . 12 . 3239 . 1 1 8 ASN C C 2.114 5.496 0.182 . . . 1.0 . . . . . . . . . . . . A . 8 ASN C . . . . . . . . . c30225_5ug3 1 . 12 . 3240 . 1 1 8 ASN CA C 0.774 6.110 0.499 . . . 1.0 . . . . . . . . . . . . A . 8 ASN CA . . . . . . . . . c30225_5ug3 1 . 12 . 3241 . 1 1 8 ASN CB C 0.289 5.571 1.839 . . . 1.0 . . . . . . . . . . . . A . 8 ASN CB . . . . . . . . . c30225_5ug3 1 . 12 . 3242 . 1 1 8 ASN CG C -1.057 6.131 2.247 . . . 1.0 . . . . . . . . . . . . A . 8 ASN CG . . . . . . . . . c30225_5ug3 1 . 12 . 3243 . 1 1 8 ASN H H -0.208 4.795 -0.805 . . . 1.0 . . . . . . . . . . . . A . 8 ASN H . . . . . . . . . c30225_5ug3 1 . 12 . 3244 . 1 1 8 ASN HA H 0.856 7.184 0.537 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HA . . . . . . . . . c30225_5ug3 1 . 12 . 3245 . 1 1 8 ASN HB2 H 0.201 4.497 1.755 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HB2 . . . . . . . . . c30225_5ug3 1 . 12 . 3246 . 1 1 8 ASN HB3 H 1.012 5.808 2.603 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HB3 . . . . . . . . . c30225_5ug3 1 . 12 . 3247 . 1 1 8 ASN HD21 H -1.950 4.825 1.062 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HD21 . . . . . . . . . c30225_5ug3 1 . 12 . 3248 . 1 1 8 ASN HD22 H -3.003 5.884 1.940 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HD22 . . . . . . . . . c30225_5ug3 1 . 12 . 3249 . 1 1 8 ASN N N -0.151 5.739 -0.551 . . . 1.0 . . . . . . . . . . . . A . 8 ASN N . . . . . . . . . c30225_5ug3 1 . 12 . 3250 . 1 1 8 ASN ND2 N -2.109 5.557 1.695 . . . 1.0 . . . . . . . . . . . . A . 8 ASN ND2 . . . . . . . . . c30225_5ug3 1 . 12 . 3251 . 1 1 8 ASN O O 2.334 4.314 0.456 . . . 1.0 . . . . . . . . . . . . A . 8 ASN O . . . . . . . . . c30225_5ug3 1 . 12 . 3252 . 1 1 8 ASN OD1 O -1.149 7.085 3.017 . . . 1.0 . . . . . . . . . . . . A . 8 ASN OD1 . . . . . . . . . c30225_5ug3 1 . 12 . 3253 . 1 1 9 PRO C C 5.073 5.037 0.240 . . . 1.0 . . . . . . . . . . . . A . 9 PRO C . . . . . . . . . c30225_5ug3 1 . 12 . 3254 . 1 1 9 PRO CA C 4.306 5.745 -0.865 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CA . . . . . . . . . c30225_5ug3 1 . 12 . 3255 . 1 1 9 PRO CB C 5.054 6.995 -1.332 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CB . . . . . . . . . c30225_5ug3 1 . 12 . 3256 . 1 1 9 PRO CD C 2.880 7.705 -0.699 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CD . . . . . . . . . c30225_5ug3 1 . 12 . 3257 . 1 1 9 PRO CG C 3.985 7.964 -1.679 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CG . . . . . . . . . c30225_5ug3 1 . 12 . 3258 . 1 1 9 PRO HA H 4.174 5.065 -1.693 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HA . . . . . . . . . c30225_5ug3 1 . 12 . 3259 . 1 1 9 PRO HB2 H 5.669 7.364 -0.528 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HB2 . . . . . . . . . c30225_5ug3 1 . 12 . 3260 . 1 1 9 PRO HB3 H 5.668 6.757 -2.188 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HB3 . . . . . . . . . c30225_5ug3 1 . 12 . 3261 . 1 1 9 PRO HD2 H 3.020 8.293 0.195 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HD2 . . . . . . . . . c30225_5ug3 1 . 12 . 3262 . 1 1 9 PRO HD3 H 1.925 7.917 -1.146 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HD3 . . . . . . . . . c30225_5ug3 1 . 12 . 3263 . 1 1 9 PRO HG2 H 4.354 8.974 -1.573 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HG2 . . . . . . . . . c30225_5ug3 1 . 12 . 3264 . 1 1 9 PRO HG3 H 3.641 7.791 -2.687 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HG3 . . . . . . . . . c30225_5ug3 1 . 12 . 3265 . 1 1 9 PRO N N 3.022 6.266 -0.413 . . . 1.0 . . . . . . . . . . . . A . 9 PRO N . . . . . . . . . c30225_5ug3 1 . 12 . 3266 . 1 1 9 PRO O O 5.850 4.130 -0.030 . . . 1.0 . . . . . . . . . . . . A . 9 PRO O . . . . . . . . . c30225_5ug3 1 . 12 . 3267 . 1 1 10 VAL C C 5.089 3.400 2.866 . . . 1.0 . . . . . . . . . . . . A . 10 VAL C . . . . . . . . . c30225_5ug3 1 . 12 . 3268 . 1 1 10 VAL CA C 5.538 4.836 2.611 . . . 1.0 . . . . . . . . . . . . A . 10 VAL CA . . . . . . . . . c30225_5ug3 1 . 12 . 3269 . 1 1 10 VAL CB C 5.368 5.682 3.893 . . . 1.0 . . . . . . . . . . . . A . 10 VAL CB . . . . . . . . . c30225_5ug3 1 . 12 . 3270 . 1 1 10 VAL CG1 C 6.115 5.052 5.061 . . . 1.0 . . . . . . . . . . . . A . 10 VAL CG1 . . . . . . . . . c30225_5ug3 1 . 12 . 3271 . 1 1 10 VAL CG2 C 5.858 7.104 3.660 . . . 1.0 . . . . . . . . . . . . A . 10 VAL CG2 . . . . . . . . . c30225_5ug3 1 . 12 . 3272 . 1 1 10 VAL H H 4.076 6.049 1.654 . . . 1.0 . . . . . . . . . . . . A . 10 VAL H . . . . . . . . . c30225_5ug3 1 . 12 . 3273 . 1 1 10 VAL HA H 6.588 4.828 2.348 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HA . . . . . . . . . c30225_5ug3 1 . 12 . 3274 . 1 1 10 VAL HB H 4.318 5.719 4.142 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HB . . . . . . . . . c30225_5ug3 1 . 12 . 3275 . 1 1 10 VAL HG11 H 5.721 4.063 5.248 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HG11 . . . . . . . . . c30225_5ug3 1 . 12 . 3276 . 1 1 10 VAL HG12 H 5.990 5.664 5.941 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HG12 . . . . . . . . . c30225_5ug3 1 . 12 . 3277 . 1 1 10 VAL HG13 H 7.165 4.981 4.818 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HG13 . . . . . . . . . c30225_5ug3 1 . 12 . 3278 . 1 1 10 VAL HG21 H 6.911 7.088 3.427 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HG21 . . . . . . . . . c30225_5ug3 1 . 12 . 3279 . 1 1 10 VAL HG22 H 5.694 7.692 4.549 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HG22 . . . . . . . . . c30225_5ug3 1 . 12 . 3280 . 1 1 10 VAL HG23 H 5.316 7.542 2.835 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HG23 . . . . . . . . . c30225_5ug3 1 . 12 . 3281 . 1 1 10 VAL N N 4.806 5.405 1.486 . . . 1.0 . . . . . . . . . . . . A . 10 VAL N . . . . . . . . . c30225_5ug3 1 . 12 . 3282 . 1 1 10 VAL O O 5.896 2.535 3.212 . . . 1.0 . . . . . . . . . . . . A . 10 VAL O . . . . . . . . . c30225_5ug3 1 . 12 . 3283 . 1 1 11 CYS C C 3.840 0.851 1.786 . . . 1.0 . . . . . . . . . . . . A . 11 CYS C . . . . . . . . . c30225_5ug3 1 . 12 . 3284 . 1 1 11 CYS CA C 3.280 1.796 2.842 . . . 1.0 . . . . . . . . . . . . A . 11 CYS CA . . . . . . . . . c30225_5ug3 1 . 12 . 3285 . 1 1 11 CYS CB C 1.750 1.785 2.777 . . . 1.0 . . . . . . . . . . . . A . 11 CYS CB . . . . . . . . . c30225_5ug3 1 . 12 . 3286 . 1 1 11 CYS H H 3.210 3.855 2.363 . . . 1.0 . . . . . . . . . . . . A . 11 CYS H . . . . . . . . . c30225_5ug3 1 . 12 . 3287 . 1 1 11 CYS HA H 3.590 1.455 3.816 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HA . . . . . . . . . c30225_5ug3 1 . 12 . 3288 . 1 1 11 CYS HB2 H 1.357 2.407 3.566 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HB2 . . . . . . . . . c30225_5ug3 1 . 12 . 3289 . 1 1 11 CYS HB3 H 1.434 2.179 1.822 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HB3 . . . . . . . . . c30225_5ug3 1 . 12 . 3290 . 1 1 11 CYS N N 3.809 3.136 2.655 . . . 1.0 . . . . . . . . . . . . A . 11 CYS N . . . . . . . . . c30225_5ug3 1 . 12 . 3291 . 1 1 11 CYS O O 4.203 -0.288 2.083 . . . 1.0 . . . . . . . . . . . . A . 11 CYS O . . . . . . . . . c30225_5ug3 1 . 12 . 3292 . 1 1 11 CYS SG S 1.020 0.122 2.964 . . . 1.0 . . . . . . . . . . . . A . 11 CYS SG . . . . . . . . . c30225_5ug3 1 . 12 . 3293 . 1 1 12 ARG C C 5.776 0.245 -0.717 . . . 1.0 . . . . . . . . . . . . A . 12 ARG C . . . . . . . . . c30225_5ug3 1 . 12 . 3294 . 1 1 12 ARG CA C 4.280 0.492 -0.570 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CA . . . . . . . . . c30225_5ug3 1 . 12 . 3295 . 1 1 12 ARG CB C 3.671 1.026 -1.866 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CB . . . . . . . . . c30225_5ug3 1 . 12 . 3296 . 1 1 12 ARG CD C 2.949 3.051 -3.145 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CD . . . . . . . . . c30225_5ug3 1 . 12 . 3297 . 1 1 12 ARG CG C 3.826 2.511 -2.027 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CG . . . . . . . . . c30225_5ug3 1 . 12 . 3298 . 1 1 12 ARG CZ C 2.494 2.567 -5.523 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CZ . . . . . . . . . c30225_5ug3 1 . 12 . 3299 . 1 1 12 ARG H H 3.781 2.299 0.414 . . . 1.0 . . . . . . . . . . . . A . 12 ARG H . . . . . . . . . c30225_5ug3 1 . 12 . 3300 . 1 1 12 ARG HA H 3.832 -0.437 -0.364 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HA . . . . . . . . . c30225_5ug3 1 . 12 . 3301 . 1 1 12 ARG HB2 H 4.155 0.549 -2.702 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HB2 . . . . . . . . . c30225_5ug3 1 . 12 . 3302 . 1 1 12 ARG HB3 H 2.618 0.790 -1.883 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HB3 . . . . . . . . . c30225_5ug3 1 . 12 . 3303 . 1 1 12 ARG HD2 H 1.917 2.864 -2.891 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HD2 . . . . . . . . . c30225_5ug3 1 . 12 . 3304 . 1 1 12 ARG HD3 H 3.111 4.114 -3.230 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HD3 . . . . . . . . . c30225_5ug3 1 . 12 . 3305 . 1 1 12 ARG HE H 4.050 1.864 -4.485 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HE . . . . . . . . . c30225_5ug3 1 . 12 . 3306 . 1 1 12 ARG HG2 H 3.542 2.975 -1.102 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HG2 . . . . . . . . . c30225_5ug3 1 . 12 . 3307 . 1 1 12 ARG HG3 H 4.858 2.730 -2.243 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HG3 . . . . . . . . . c30225_5ug3 1 . 12 . 3308 . 1 1 12 ARG HH11 H 1.120 3.779 -4.648 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH11 . . . . . . . . . c30225_5ug3 1 . 12 . 3309 . 1 1 12 ARG HH12 H 0.839 3.420 -6.323 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH12 . . . . . . . . . c30225_5ug3 1 . 12 . 3310 . 1 1 12 ARG HH21 H 3.679 1.396 -6.675 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH21 . . . . . . . . . c30225_5ug3 1 . 12 . 3311 . 1 1 12 ARG HH22 H 2.289 2.061 -7.475 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH22 . . . . . . . . . c30225_5ug3 1 . 12 . 3312 . 1 1 12 ARG N N 3.941 1.345 0.559 . . . 1.0 . . . . . . . . . . . . A . 12 ARG N . . . . . . . . . c30225_5ug3 1 . 12 . 3313 . 1 1 12 ARG NE N 3.242 2.422 -4.431 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NE . . . . . . . . . c30225_5ug3 1 . 12 . 3314 . 1 1 12 ARG NH1 N 1.396 3.313 -5.496 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NH1 . . . . . . . . . c30225_5ug3 1 . 12 . 3315 . 1 1 12 ARG NH2 N 2.848 1.961 -6.648 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NH2 . . . . . . . . . c30225_5ug3 1 . 12 . 3316 . 1 1 12 ARG O O 6.187 -0.840 -1.124 . . . 1.0 . . . . . . . . . . . . A . 12 ARG O . . . . . . . . . c30225_5ug3 1 . 12 . 3317 . 1 1 13 VAL C C 8.526 -0.080 0.411 . . . 1.0 . . . . . . . . . . . . A . 13 VAL C . . . . . . . . . c30225_5ug3 1 . 12 . 3318 . 1 1 13 VAL CA C 8.032 1.075 -0.460 . . . 1.0 . . . . . . . . . . . . A . 13 VAL CA . . . . . . . . . c30225_5ug3 1 . 12 . 3319 . 1 1 13 VAL CB C 8.747 2.370 -0.051 . . . 1.0 . . . . . . . . . . . . A . 13 VAL CB . . . . . . . . . c30225_5ug3 1 . 12 . 3320 . 1 1 13 VAL CG1 C 8.592 3.433 -1.125 . . . 1.0 . . . . . . . . . . . . A . 13 VAL CG1 . . . . . . . . . c30225_5ug3 1 . 12 . 3321 . 1 1 13 VAL CG2 C 8.212 2.866 1.281 . . . 1.0 . . . . . . . . . . . . A . 13 VAL CG2 . . . . . . . . . c30225_5ug3 1 . 12 . 3322 . 1 1 13 VAL H H 6.226 2.088 -0.092 . . . 1.0 . . . . . . . . . . . . A . 13 VAL H . . . . . . . . . c30225_5ug3 1 . 12 . 3323 . 1 1 13 VAL HA H 8.285 0.864 -1.488 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HA . . . . . . . . . c30225_5ug3 1 . 12 . 3324 . 1 1 13 VAL HB H 9.787 2.156 0.066 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HB . . . . . . . . . c30225_5ug3 1 . 12 . 3325 . 1 1 13 VAL HG11 H 9.011 3.070 -2.053 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HG11 . . . . . . . . . c30225_5ug3 1 . 12 . 3326 . 1 1 13 VAL HG12 H 9.111 4.329 -0.821 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HG12 . . . . . . . . . c30225_5ug3 1 . 12 . 3327 . 1 1 13 VAL HG13 H 7.543 3.652 -1.264 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HG13 . . . . . . . . . c30225_5ug3 1 . 12 . 3328 . 1 1 13 VAL HG21 H 8.602 2.250 2.076 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HG21 . . . . . . . . . c30225_5ug3 1 . 12 . 3329 . 1 1 13 VAL HG22 H 7.130 2.794 1.277 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HG22 . . . . . . . . . c30225_5ug3 1 . 12 . 3330 . 1 1 13 VAL HG23 H 8.510 3.892 1.434 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HG23 . . . . . . . . . c30225_5ug3 1 . 12 . 3331 . 1 1 13 VAL N N 6.592 1.230 -0.381 . . . 1.0 . . . . . . . . . . . . A . 13 VAL N . . . . . . . . . c30225_5ug3 1 . 12 . 3332 . 1 1 13 VAL O O 9.274 -0.939 -0.057 . . . 1.0 . . . . . . . . . . . . A . 13 VAL O . . . . . . . . . c30225_5ug3 1 . 12 . 3333 . 1 1 14 ASN C C 7.680 -2.384 2.582 . . . 1.0 . . . . . . . . . . . . A . 14 ASN C . . . . . . . . . c30225_5ug3 1 . 12 . 3334 . 1 1 14 ASN CA C 8.568 -1.146 2.588 . . . 1.0 . . . . . . . . . . . . A . 14 ASN CA . . . . . . . . . c30225_5ug3 1 . 12 . 3335 . 1 1 14 ASN CB C 8.722 -0.587 4.014 . . . 1.0 . . . . . . . . . . . . A . 14 ASN CB . . . . . . . . . c30225_5ug3 1 . 12 . 3336 . 1 1 14 ASN CG C 7.506 0.149 4.547 . . . 1.0 . . . . . . . . . . . . A . 14 ASN CG . . . . . . . . . c30225_5ug3 1 . 12 . 3337 . 1 1 14 ASN H H 7.432 0.546 1.975 . . . 1.0 . . . . . . . . . . . . A . 14 ASN H . . . . . . . . . c30225_5ug3 1 . 12 . 3338 . 1 1 14 ASN HA H 9.544 -1.444 2.238 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HA . . . . . . . . . c30225_5ug3 1 . 12 . 3339 . 1 1 14 ASN HB2 H 8.934 -1.404 4.684 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HB2 . . . . . . . . . c30225_5ug3 1 . 12 . 3340 . 1 1 14 ASN HB3 H 9.549 0.098 4.027 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HB3 . . . . . . . . . c30225_5ug3 1 . 12 . 3341 . 1 1 14 ASN HD21 H 6.264 -1.045 3.568 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HD21 . . . . . . . . . c30225_5ug3 1 . 12 . 3342 . 1 1 14 ASN HD22 H 5.540 0.205 4.501 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HD22 . . . . . . . . . c30225_5ug3 1 . 12 . 3343 . 1 1 14 ASN N N 8.086 -0.124 1.664 . . . 1.0 . . . . . . . . . . . . A . 14 ASN N . . . . . . . . . c30225_5ug3 1 . 12 . 3344 . 1 1 14 ASN ND2 N 6.319 -0.276 4.169 . . . 1.0 . . . . . . . . . . . . A . 14 ASN ND2 . . . . . . . . . c30225_5ug3 1 . 12 . 3345 . 1 1 14 ASN O O 7.977 -3.369 3.258 . . . 1.0 . . . . . . . . . . . . A . 14 ASN O . . . . . . . . . c30225_5ug3 1 . 12 . 3346 . 1 1 14 ASN OD1 O 7.642 1.097 5.319 . . . 1.0 . . . . . . . . . . . . A . 14 ASN OD1 . . . . . . . . . c30225_5ug3 1 . 12 . 3347 . 1 1 15 ASN C C 4.852 -3.381 0.452 . . . 1.0 . . . . . . . . . . . . A . 15 ASN C . . . . . . . . . c30225_5ug3 1 . 12 . 3348 . 1 1 15 ASN CA C 5.686 -3.472 1.721 . . . 1.0 . . . . . . . . . . . . A . 15 ASN CA . . . . . . . . . c30225_5ug3 1 . 12 . 3349 . 1 1 15 ASN CB C 4.758 -3.523 2.929 . . . 1.0 . . . . . . . . . . . . A . 15 ASN CB . . . . . . . . . c30225_5ug3 1 . 12 . 3350 . 1 1 15 ASN CG C 3.941 -4.804 2.995 . . . 1.0 . . . . . . . . . . . . A . 15 ASN CG . . . . . . . . . c30225_5ug3 1 . 12 . 3351 . 1 1 15 ASN H H 6.407 -1.529 1.293 . . . 1.0 . . . . . . . . . . . . A . 15 ASN H . . . . . . . . . c30225_5ug3 1 . 12 . 3352 . 1 1 15 ASN HA H 6.276 -4.373 1.690 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HA . . . . . . . . . c30225_5ug3 1 . 12 . 3353 . 1 1 15 ASN HB2 H 5.346 -3.445 3.831 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HB2 . . . . . . . . . c30225_5ug3 1 . 12 . 3354 . 1 1 15 ASN HB3 H 4.080 -2.688 2.871 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HB3 . . . . . . . . . c30225_5ug3 1 . 12 . 3355 . 1 1 15 ASN HD21 H 3.715 -4.585 4.950 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HD21 . . . . . . . . . c30225_5ug3 1 . 12 . 3356 . 1 1 15 ASN HD22 H 2.965 -5.979 4.258 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HD22 . . . . . . . . . c30225_5ug3 1 . 12 . 3357 . 1 1 15 ASN N N 6.597 -2.339 1.816 . . . 1.0 . . . . . . . . . . . . A . 15 ASN N . . . . . . . . . c30225_5ug3 1 . 12 . 3358 . 1 1 15 ASN ND2 N 3.498 -5.159 4.186 . . . 1.0 . . . . . . . . . . . . A . 15 ASN ND2 . . . . . . . . . c30225_5ug3 1 . 12 . 3359 . 1 1 15 ASN O O 3.792 -2.762 0.431 . . . 1.0 . . . . . . . . . . . . A . 15 ASN O . . . . . . . . . c30225_5ug3 1 . 12 . 3360 . 1 1 15 ASN OD1 O 3.690 -5.457 1.981 . . . 1.0 . . . . . . . . . . . . A . 15 ASN OD1 . . . . . . . . . c30225_5ug3 1 . 12 . 3361 . 1 1 16 HYP C C 3.678 -5.180 -2.066 . . . 1.0 . . . . . . . . . . . . A . 16 HYP C . . . . . . . . . c30225_5ug3 1 . 12 . 3362 . 1 1 16 HYP CA C 4.636 -4.001 -1.919 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CA . . . . . . . . . c30225_5ug3 1 . 12 . 3363 . 1 1 16 HYP CB C 5.826 -4.134 -2.852 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CB . . . . . . . . . c30225_5ug3 1 . 12 . 3364 . 1 1 16 HYP CD C 6.628 -4.708 -0.702 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CD . . . . . . . . . c30225_5ug3 1 . 12 . 3365 . 1 1 16 HYP CG C 7.105 -4.324 -2.060 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CG . . . . . . . . . c30225_5ug3 1 . 12 . 3366 . 1 1 16 HYP HA H 4.118 -3.072 -2.107 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HA . . . . . . . . . c30225_5ug3 1 . 12 . 3367 . 1 1 16 HYP HB2 H 5.915 -3.240 -3.448 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HB2 . . . . . . . . . c30225_5ug3 1 . 12 . 3368 . 1 1 16 HYP HB3 H 5.673 -4.987 -3.500 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HB3 . . . . . . . . . c30225_5ug3 1 . 12 . 3369 . 1 1 16 HYP HD1 H 7.584 -2.766 -1.020 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HD1 . . . . . . . . . c30225_5ug3 1 . 12 . 3370 . 1 1 16 HYP HD22 H 6.502 -5.761 -0.634 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HD22 . . . . . . . . . c30225_5ug3 1 . 12 . 3371 . 1 1 16 HYP HD23 H 7.309 -4.352 0.055 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HD23 . . . . . . . . . c30225_5ug3 1 . 12 . 3372 . 1 1 16 HYP HG H 7.741 -5.076 -2.508 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HG . . . . . . . . . c30225_5ug3 1 . 12 . 3373 . 1 1 16 HYP N N 5.330 -3.996 -0.624 . . . 1.0 . . . . . . . . . . . . A . 16 HYP N . . . . . . . . . c30225_5ug3 1 . 12 . 3374 . 1 1 16 HYP O O 3.273 -5.527 -3.175 . . . 1.0 . . . . . . . . . . . . A . 16 HYP O . . . . . . . . . c30225_5ug3 1 . 12 . 3375 . 1 1 16 HYP OD1 O 7.794 -3.098 -1.907 . . . 1.0 . . . . . . . . . . . . A . 16 HYP OD1 . . . . . . . . . c30225_5ug3 1 . 12 . 3376 . 1 1 17 HIS C C 1.126 -6.673 -0.205 . . . 1.0 . . . . . . . . . . . . A . 17 HIS C . . . . . . . . . c30225_5ug3 1 . 12 . 3377 . 1 1 17 HIS CA C 2.418 -6.945 -0.962 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CA . . . . . . . . . c30225_5ug3 1 . 12 . 3378 . 1 1 17 HIS CB C 3.100 -8.186 -0.385 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CB . . . . . . . . . c30225_5ug3 1 . 12 . 3379 . 1 1 17 HIS CD2 C 3.889 -9.400 -2.530 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CD2 . . . . . . . . . c30225_5ug3 1 . 12 . 3380 . 1 1 17 HIS CE1 C 6.022 -9.530 -2.064 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CE1 . . . . . . . . . c30225_5ug3 1 . 12 . 3381 . 1 1 17 HIS CG C 4.077 -8.820 -1.323 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CG . . . . . . . . . c30225_5ug3 1 . 12 . 3382 . 1 1 17 HIS H H 3.660 -5.465 -0.083 . . . 1.0 . . . . . . . . . . . . A . 17 HIS H . . . . . . . . . c30225_5ug3 1 . 12 . 3383 . 1 1 17 HIS HA H 2.172 -7.140 -1.994 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HA . . . . . . . . . c30225_5ug3 1 . 12 . 3384 . 1 1 17 HIS HB2 H 3.632 -7.911 0.513 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HB2 . . . . . . . . . c30225_5ug3 1 . 12 . 3385 . 1 1 17 HIS HB3 H 2.347 -8.921 -0.142 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HB3 . . . . . . . . . c30225_5ug3 1 . 12 . 3386 . 1 1 17 HIS HD1 H 5.878 -8.595 -0.249 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HD1 . . . . . . . . . c30225_5ug3 1 . 12 . 3387 . 1 1 17 HIS HD2 H 2.948 -9.506 -3.051 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HD2 . . . . . . . . . c30225_5ug3 1 . 12 . 3388 . 1 1 17 HIS HE1 H 7.077 -9.749 -2.132 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HE1 . . . . . . . . . c30225_5ug3 1 . 12 . 3389 . 1 1 17 HIS HE2 H 5.305 -10.172 -3.870 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HE2 . . . . . . . . . c30225_5ug3 1 . 12 . 3390 . 1 1 17 HIS N N 3.316 -5.794 -0.943 . . . 1.0 . . . . . . . . . . . . A . 17 HIS N . . . . . . . . . c30225_5ug3 1 . 12 . 3391 . 1 1 17 HIS ND1 N 5.425 -8.918 -1.060 . . . 1.0 . . . . . . . . . . . . A . 17 HIS ND1 . . . . . . . . . c30225_5ug3 1 . 12 . 3392 . 1 1 17 HIS NE2 N 5.112 -9.833 -2.967 . . . 1.0 . . . . . . . . . . . . A . 17 HIS NE2 . . . . . . . . . c30225_5ug3 1 . 12 . 3393 . 1 1 17 HIS O O 0.078 -7.208 -0.563 . . . 1.0 . . . . . . . . . . . . A . 17 HIS O . . . . . . . . . c30225_5ug3 1 . 12 . 3394 . 1 1 18 VAL C C -1.058 -4.858 0.757 . . . 1.0 . . . . . . . . . . . . A . 18 VAL C . . . . . . . . . c30225_5ug3 1 . 12 . 3395 . 1 1 18 VAL CA C 0.012 -5.519 1.630 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CA . . . . . . . . . c30225_5ug3 1 . 12 . 3396 . 1 1 18 VAL CB C 0.365 -4.595 2.822 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CB . . . . . . . . . c30225_5ug3 1 . 12 . 3397 . 1 1 18 VAL CG1 C 0.919 -3.263 2.341 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CG1 . . . . . . . . . c30225_5ug3 1 . 12 . 3398 . 1 1 18 VAL CG2 C -0.844 -4.382 3.722 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CG2 . . . . . . . . . c30225_5ug3 1 . 12 . 3399 . 1 1 18 VAL H H 2.071 -5.489 1.114 . . . 1.0 . . . . . . . . . . . . A . 18 VAL H . . . . . . . . . c30225_5ug3 1 . 12 . 3400 . 1 1 18 VAL HA H -0.391 -6.440 2.028 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HA . . . . . . . . . c30225_5ug3 1 . 12 . 3401 . 1 1 18 VAL HB H 1.133 -5.081 3.406 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HB . . . . . . . . . c30225_5ug3 1 . 12 . 3402 . 1 1 18 VAL HG11 H 0.187 -2.771 1.719 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG11 . . . . . . . . . c30225_5ug3 1 . 12 . 3403 . 1 1 18 VAL HG12 H 1.819 -3.433 1.769 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG12 . . . . . . . . . c30225_5ug3 1 . 12 . 3404 . 1 1 18 VAL HG13 H 1.147 -2.639 3.191 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG13 . . . . . . . . . c30225_5ug3 1 . 12 . 3405 . 1 1 18 VAL HG21 H -1.638 -3.919 3.155 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG21 . . . . . . . . . c30225_5ug3 1 . 12 . 3406 . 1 1 18 VAL HG22 H -0.570 -3.743 4.548 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG22 . . . . . . . . . c30225_5ug3 1 . 12 . 3407 . 1 1 18 VAL HG23 H -1.181 -5.335 4.101 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG23 . . . . . . . . . c30225_5ug3 1 . 12 . 3408 . 1 1 18 VAL N N 1.197 -5.857 0.844 . . . 1.0 . . . . . . . . . . . . A . 18 VAL N . . . . . . . . . c30225_5ug3 1 . 12 . 3409 . 1 1 18 VAL O O -2.256 -5.046 0.973 . . . 1.0 . . . . . . . . . . . . A . 18 VAL O . . . . . . . . . c30225_5ug3 1 . 12 . 3410 . 1 1 19 CYS C C -1.319 -3.849 -2.570 . . . 1.0 . . . . . . . . . . . . A . 19 CYS C . . . . . . . . . c30225_5ug3 1 . 12 . 3411 . 1 1 19 CYS CA C -1.535 -3.410 -1.125 . . . 1.0 . . . . . . . . . . . . A . 19 CYS CA . . . . . . . . . c30225_5ug3 1 . 12 . 3412 . 1 1 19 CYS CB C -1.336 -1.901 -0.979 . . . 1.0 . . . . . . . . . . . . A . 19 CYS CB . . . . . . . . . c30225_5ug3 1 . 12 . 3413 . 1 1 19 CYS H H 0.340 -4.049 -0.411 . . . 1.0 . . . . . . . . . . . . A . 19 CYS H . . . . . . . . . c30225_5ug3 1 . 12 . 3414 . 1 1 19 CYS HA H -2.542 -3.664 -0.829 . . . 1.0 . . . . . . . . . . . . A . 19 CYS HA . . . . . . . . . c30225_5ug3 1 . 12 . 3415 . 1 1 19 CYS HB2 H -1.336 -1.646 0.070 . . . 1.0 . . . . . . . . . . . . A . 19 CYS HB2 . . . . . . . . . c30225_5ug3 1 . 12 . 3416 . 1 1 19 CYS HB3 H -0.382 -1.630 -1.408 . . . 1.0 . . . . . . . . . . . . A . 19 CYS HB3 . . . . . . . . . c30225_5ug3 1 . 12 . 3417 . 1 1 19 CYS N N -0.621 -4.117 -0.249 . . . 1.0 . . . . . . . . . . . . A . 19 CYS N . . . . . . . . . c30225_5ug3 1 . 12 . 3418 . 1 1 19 CYS O O -0.320 -3.421 -3.188 . . . 1.0 . . . . . . . . . . . . A . 19 CYS O . . . . . . . . . c30225_5ug3 1 . 12 . 3419 . 1 1 19 CYS OXT O -2.142 -4.639 -3.081 . . . 1.0 . . . . . . . . . . . . A . 19 CYS OXT . . . . . . . . . c30225_5ug3 1 . 12 . 3420 . 1 1 19 CYS SG S -2.620 -0.892 -1.789 . . . 1.0 . . . . . . . . . . . . A . 19 CYS SG . . . . . . . . . c30225_5ug3 1 . 13 . 3421 . 1 1 1 ILE C C -7.748 -1.863 5.676 . . . 1.0 . . . . . . . . . . . . A . 1 ILE C . . . . . . . . . c30225_5ug3 1 . 13 . 3422 . 1 1 1 ILE CA C -8.784 -2.977 5.616 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CA . . . . . . . . . c30225_5ug3 1 . 13 . 3423 . 1 1 1 ILE CB C -9.995 -2.534 4.752 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CB . . . . . . . . . c30225_5ug3 1 . 13 . 3424 . 1 1 1 ILE CD1 C -10.435 -0.108 5.465 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CD1 . . . . . . . . . c30225_5ug3 1 . 13 . 3425 . 1 1 1 ILE CG1 C -10.906 -1.548 5.501 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CG1 . . . . . . . . . c30225_5ug3 1 . 13 . 3426 . 1 1 1 ILE CG2 C -10.793 -3.749 4.305 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CG2 . . . . . . . . . c30225_5ug3 1 . 13 . 3427 . 1 1 1 ILE H1 H -8.372 -3.718 7.513 . . . 1.0 . . . . . . . . . . . . A . 1 ILE H1 . . . . . . . . . c30225_5ug3 1 . 13 . 3428 . 1 1 1 ILE H2 H -9.900 -4.147 6.929 . . . 1.0 . . . . . . . . . . . . A . 1 ILE H2 . . . . . . . . . c30225_5ug3 1 . 13 . 3429 . 1 1 1 ILE H3 H -9.616 -2.575 7.480 . . . 1.0 . . . . . . . . . . . . A . 1 ILE H3 . . . . . . . . . c30225_5ug3 1 . 13 . 3430 . 1 1 1 ILE HA H -8.332 -3.835 5.141 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HA . . . . . . . . . c30225_5ug3 1 . 13 . 3431 . 1 1 1 ILE HB H -9.611 -2.050 3.865 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HB . . . . . . . . . c30225_5ug3 1 . 13 . 3432 . 1 1 1 ILE HD11 H -10.418 0.240 4.443 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HD11 . . . . . . . . . c30225_5ug3 1 . 13 . 3433 . 1 1 1 ILE HD12 H -9.440 -0.046 5.882 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HD12 . . . . . . . . . c30225_5ug3 1 . 13 . 3434 . 1 1 1 ILE HD13 H -11.107 0.505 6.045 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HD13 . . . . . . . . . c30225_5ug3 1 . 13 . 3435 . 1 1 1 ILE HG12 H -11.892 -1.581 5.065 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG12 . . . . . . . . . c30225_5ug3 1 . 13 . 3436 . 1 1 1 ILE HG13 H -10.970 -1.848 6.537 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG13 . . . . . . . . . c30225_5ug3 1 . 13 . 3437 . 1 1 1 ILE HG21 H -11.637 -3.427 3.713 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG21 . . . . . . . . . c30225_5ug3 1 . 13 . 3438 . 1 1 1 ILE HG22 H -11.146 -4.284 5.173 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG22 . . . . . . . . . c30225_5ug3 1 . 13 . 3439 . 1 1 1 ILE HG23 H -10.164 -4.396 3.714 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG23 . . . . . . . . . c30225_5ug3 1 . 13 . 3440 . 1 1 1 ILE N N -9.198 -3.382 6.977 . . . 1.0 . . . . . . . . . . . . A . 1 ILE N . . . . . . . . . c30225_5ug3 1 . 13 . 3441 . 1 1 1 ILE O O -7.689 -1.112 6.651 . . . 1.0 . . . . . . . . . . . . A . 1 ILE O . . . . . . . . . c30225_5ug3 1 . 13 . 3442 . 1 1 2 ARG C C -5.469 -0.586 3.100 . . . 1.0 . . . . . . . . . . . . A . 2 ARG C . . . . . . . . . c30225_5ug3 1 . 13 . 3443 . 1 1 2 ARG CA C -5.906 -0.746 4.556 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CA . . . . . . . . . c30225_5ug3 1 . 13 . 3444 . 1 1 2 ARG CB C -4.711 -1.102 5.452 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CB . . . . . . . . . c30225_5ug3 1 . 13 . 3445 . 1 1 2 ARG CD C -4.425 1.186 6.467 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CD . . . . . . . . . c30225_5ug3 1 . 13 . 3446 . 1 1 2 ARG CG C -3.753 0.054 5.703 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CG . . . . . . . . . c30225_5ug3 1 . 13 . 3447 . 1 1 2 ARG CZ C -5.596 1.533 8.615 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CZ . . . . . . . . . c30225_5ug3 1 . 13 . 3448 . 1 1 2 ARG H H -7.005 -2.423 3.911 . . . 1.0 . . . . . . . . . . . . A . 2 ARG H . . . . . . . . . c30225_5ug3 1 . 13 . 3449 . 1 1 2 ARG HA H -6.343 0.176 4.892 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HA . . . . . . . . . c30225_5ug3 1 . 13 . 3450 . 1 1 2 ARG HB2 H -5.085 -1.442 6.407 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB2 . . . . . . . . . c30225_5ug3 1 . 13 . 3451 . 1 1 2 ARG HB3 H -4.158 -1.904 4.989 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB3 . . . . . . . . . c30225_5ug3 1 . 13 . 3452 . 1 1 2 ARG HD2 H -3.726 2.002 6.563 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD2 . . . . . . . . . c30225_5ug3 1 . 13 . 3453 . 1 1 2 ARG HD3 H -5.286 1.519 5.908 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD3 . . . . . . . . . c30225_5ug3 1 . 13 . 3454 . 1 1 2 ARG HE H -4.569 -0.114 8.118 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HE . . . . . . . . . c30225_5ug3 1 . 13 . 3455 . 1 1 2 ARG HG2 H -2.913 -0.306 6.278 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG2 . . . . . . . . . c30225_5ug3 1 . 13 . 3456 . 1 1 2 ARG HG3 H -3.404 0.431 4.752 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG3 . . . . . . . . . c30225_5ug3 1 . 13 . 3457 . 1 1 2 ARG HH11 H -5.801 3.068 7.292 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH11 . . . . . . . . . c30225_5ug3 1 . 13 . 3458 . 1 1 2 ARG HH12 H -6.583 3.291 8.828 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH12 . . . . . . . . . c30225_5ug3 1 . 13 . 3459 . 1 1 2 ARG HH21 H -5.606 0.185 10.127 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH21 . . . . . . . . . c30225_5ug3 1 . 13 . 3460 . 1 1 2 ARG HH22 H -6.468 1.658 10.441 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH22 . . . . . . . . . c30225_5ug3 1 . 13 . 3461 . 1 1 2 ARG N N -6.925 -1.774 4.642 . . . 1.0 . . . . . . . . . . . . A . 2 ARG N . . . . . . . . . c30225_5ug3 1 . 13 . 3462 . 1 1 2 ARG NE N -4.858 0.775 7.803 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NE . . . . . . . . . c30225_5ug3 1 . 13 . 3463 . 1 1 2 ARG NH1 N -6.027 2.725 8.214 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH1 . . . . . . . . . c30225_5ug3 1 . 13 . 3464 . 1 1 2 ARG NH2 N -5.917 1.090 9.823 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH2 . . . . . . . . . c30225_5ug3 1 . 13 . 3465 . 1 1 2 ARG O O -4.278 -0.534 2.786 . . . 1.0 . . . . . . . . . . . . A . 2 ARG O . . . . . . . . . c30225_5ug3 1 . 13 . 3466 . 1 1 3 ASP C C -5.713 1.012 0.419 . . . 1.0 . . . . . . . . . . . . A . 3 ASP C . . . . . . . . . c30225_5ug3 1 . 13 . 3467 . 1 1 3 ASP CA C -6.196 -0.384 0.775 . . . 1.0 . . . . . . . . . . . . A . 3 ASP CA . . . . . . . . . c30225_5ug3 1 . 13 . 3468 . 1 1 3 ASP CB C -7.456 -0.724 -0.034 . . . 1.0 . . . . . . . . . . . . A . 3 ASP CB . . . . . . . . . c30225_5ug3 1 . 13 . 3469 . 1 1 3 ASP CG C -8.468 0.409 -0.057 . . . 1.0 . . . . . . . . . . . . A . 3 ASP CG . . . . . . . . . c30225_5ug3 1 . 13 . 3470 . 1 1 3 ASP H H -7.383 -0.478 2.528 . . . 1.0 . . . . . . . . . . . . A . 3 ASP H . . . . . . . . . c30225_5ug3 1 . 13 . 3471 . 1 1 3 ASP HA H -5.420 -1.081 0.536 . . . 1.0 . . . . . . . . . . . . A . 3 ASP HA . . . . . . . . . c30225_5ug3 1 . 13 . 3472 . 1 1 3 ASP HB2 H -7.172 -0.946 -1.050 . . . 1.0 . . . . . . . . . . . . A . 3 ASP HB2 . . . . . . . . . c30225_5ug3 1 . 13 . 3473 . 1 1 3 ASP HB3 H -7.928 -1.593 0.400 . . . 1.0 . . . . . . . . . . . . A . 3 ASP HB3 . . . . . . . . . c30225_5ug3 1 . 13 . 3474 . 1 1 3 ASP N N -6.455 -0.489 2.211 . . . 1.0 . . . . . . . . . . . . A . 3 ASP N . . . . . . . . . c30225_5ug3 1 . 13 . 3475 . 1 1 3 ASP O O -5.362 1.299 -0.724 . . . 1.0 . . . . . . . . . . . . A . 3 ASP O . . . . . . . . . c30225_5ug3 1 . 13 . 3476 . 1 1 3 ASP OD1 O -9.048 0.726 1.004 . . . 1.0 . . . . . . . . . . . . A . 3 ASP OD1 . . . . . . . . . c30225_5ug3 1 . 13 . 3477 . 1 1 3 ASP OD2 O -8.699 0.987 -1.143 . . . 1.0 . . . . . . . . . . . . A . 3 ASP OD2 . . . . . . . . . c30225_5ug3 1 . 13 . 3478 . 1 1 4 GLU C C -3.728 3.305 1.105 . . . 1.0 . . . . . . . . . . . . A . 4 GLU C . . . . . . . . . c30225_5ug3 1 . 13 . 3479 . 1 1 4 GLU CA C -5.241 3.238 1.282 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CA . . . . . . . . . c30225_5ug3 1 . 13 . 3480 . 1 1 4 GLU CB C -5.637 4.044 2.521 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CB . . . . . . . . . c30225_5ug3 1 . 13 . 3481 . 1 1 4 GLU CD C -5.322 4.361 5.014 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CD . . . . . . . . . c30225_5ug3 1 . 13 . 3482 . 1 1 4 GLU CG C -5.005 3.516 3.801 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CG . . . . . . . . . c30225_5ug3 1 . 13 . 3483 . 1 1 4 GLU H H -5.971 1.537 2.303 . . . 1.0 . . . . . . . . . . . . A . 4 GLU H . . . . . . . . . c30225_5ug3 1 . 13 . 3484 . 1 1 4 GLU HA H -5.720 3.660 0.414 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HA . . . . . . . . . c30225_5ug3 1 . 13 . 3485 . 1 1 4 GLU HB2 H -5.329 5.069 2.385 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HB2 . . . . . . . . . c30225_5ug3 1 . 13 . 3486 . 1 1 4 GLU HB3 H -6.711 4.009 2.633 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HB3 . . . . . . . . . c30225_5ug3 1 . 13 . 3487 . 1 1 4 GLU HG2 H -5.367 2.515 3.977 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HG2 . . . . . . . . . c30225_5ug3 1 . 13 . 3488 . 1 1 4 GLU HG3 H -3.933 3.490 3.669 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HG3 . . . . . . . . . c30225_5ug3 1 . 13 . 3489 . 1 1 4 GLU N N -5.683 1.858 1.426 . . . 1.0 . . . . . . . . . . . . A . 4 GLU N . . . . . . . . . c30225_5ug3 1 . 13 . 3490 . 1 1 4 GLU O O -3.201 4.254 0.530 . . . 1.0 . . . . . . . . . . . . A . 4 GLU O . . . . . . . . . c30225_5ug3 1 . 13 . 3491 . 1 1 4 GLU OE1 O -4.653 5.396 5.212 . . . 1.0 . . . . . . . . . . . . A . 4 GLU OE1 . . . . . . . . . c30225_5ug3 1 . 13 . 3492 . 1 1 4 GLU OE2 O -6.221 3.978 5.790 . . . 1.0 . . . . . . . . . . . . A . 4 GLU OE2 . . . . . . . . . c30225_5ug3 1 . 13 . 3493 . 1 1 5 CYS C C -0.949 2.327 0.252 . . . 1.0 . . . . . . . . . . . . A . 5 CYS C . . . . . . . . . c30225_5ug3 1 . 13 . 3494 . 1 1 5 CYS CA C -1.587 2.279 1.640 . . . 1.0 . . . . . . . . . . . . A . 5 CYS CA . . . . . . . . . c30225_5ug3 1 . 13 . 3495 . 1 1 5 CYS CB C -1.096 1.062 2.418 . . . 1.0 . . . . . . . . . . . . A . 5 CYS CB . . . . . . . . . c30225_5ug3 1 . 13 . 3496 . 1 1 5 CYS H H -3.523 1.484 1.902 . . . 1.0 . . . . . . . . . . . . A . 5 CYS H . . . . . . . . . c30225_5ug3 1 . 13 . 3497 . 1 1 5 CYS HA H -1.291 3.166 2.176 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HA . . . . . . . . . c30225_5ug3 1 . 13 . 3498 . 1 1 5 CYS HB2 H -1.882 0.321 2.445 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HB2 . . . . . . . . . c30225_5ug3 1 . 13 . 3499 . 1 1 5 CYS HB3 H -0.237 0.649 1.921 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HB3 . . . . . . . . . c30225_5ug3 1 . 13 . 3500 . 1 1 5 CYS N N -3.039 2.277 1.584 . . . 1.0 . . . . . . . . . . . . A . 5 CYS N . . . . . . . . . c30225_5ug3 1 . 13 . 3501 . 1 1 5 CYS O O 0.236 2.615 0.123 . . . 1.0 . . . . . . . . . . . . A . 5 CYS O . . . . . . . . . c30225_5ug3 1 . 13 . 3502 . 1 1 5 CYS SG S -0.629 1.432 4.141 . . . 1.0 . . . . . . . . . . . . A . 5 CYS SG . . . . . . . . . c30225_5ug3 1 . 13 . 3503 . 1 1 6 CYS C C -0.998 3.637 -2.509 . . . 1.0 . . . . . . . . . . . . A . 6 CYS C . . . . . . . . . c30225_5ug3 1 . 13 . 3504 . 1 1 6 CYS CA C -1.251 2.174 -2.148 . . . 1.0 . . . . . . . . . . . . A . 6 CYS CA . . . . . . . . . c30225_5ug3 1 . 13 . 3505 . 1 1 6 CYS CB C -2.277 1.573 -3.099 . . . 1.0 . . . . . . . . . . . . A . 6 CYS CB . . . . . . . . . c30225_5ug3 1 . 13 . 3506 . 1 1 6 CYS H H -2.650 1.764 -0.617 . . . 1.0 . . . . . . . . . . . . A . 6 CYS H . . . . . . . . . c30225_5ug3 1 . 13 . 3507 . 1 1 6 CYS HA H -0.320 1.628 -2.229 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HA . . . . . . . . . c30225_5ug3 1 . 13 . 3508 . 1 1 6 CYS HB2 H -2.438 0.537 -2.838 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HB2 . . . . . . . . . c30225_5ug3 1 . 13 . 3509 . 1 1 6 CYS HB3 H -3.203 2.116 -2.984 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HB3 . . . . . . . . . c30225_5ug3 1 . 13 . 3510 . 1 1 6 CYS N N -1.730 2.060 -0.778 . . . 1.0 . . . . . . . . . . . . A . 6 CYS N . . . . . . . . . c30225_5ug3 1 . 13 . 3511 . 1 1 6 CYS O O -0.028 3.961 -3.191 . . . 1.0 . . . . . . . . . . . . A . 6 CYS O . . . . . . . . . c30225_5ug3 1 . 13 . 3512 . 1 1 6 CYS SG S -1.806 1.634 -4.859 . . . 1.0 . . . . . . . . . . . . A . 6 CYS SG . . . . . . . . . c30225_5ug3 1 . 13 . 3513 . 1 1 7 SER C C -0.719 6.556 -1.290 . . . 1.0 . . . . . . . . . . . . A . 7 SER C . . . . . . . . . c30225_5ug3 1 . 13 . 3514 . 1 1 7 SER CA C -1.717 5.952 -2.277 . . . 1.0 . . . . . . . . . . . . A . 7 SER CA . . . . . . . . . c30225_5ug3 1 . 13 . 3515 . 1 1 7 SER CB C -3.082 6.646 -2.167 . . . 1.0 . . . . . . . . . . . . A . 7 SER CB . . . . . . . . . c30225_5ug3 1 . 13 . 3516 . 1 1 7 SER H H -2.617 4.211 -1.475 . . . 1.0 . . . . . . . . . . . . A . 7 SER H . . . . . . . . . c30225_5ug3 1 . 13 . 3517 . 1 1 7 SER HA H -1.336 6.075 -3.281 . . . 1.0 . . . . . . . . . . . . A . 7 SER HA . . . . . . . . . c30225_5ug3 1 . 13 . 3518 . 1 1 7 SER HB2 H -3.800 6.118 -2.775 . . . 1.0 . . . . . . . . . . . . A . 7 SER HB2 . . . . . . . . . c30225_5ug3 1 . 13 . 3519 . 1 1 7 SER HB3 H -3.405 6.633 -1.136 . . . 1.0 . . . . . . . . . . . . A . 7 SER HB3 . . . . . . . . . c30225_5ug3 1 . 13 . 3520 . 1 1 7 SER HG H -2.291 8.087 -3.238 . . . 1.0 . . . . . . . . . . . . A . 7 SER HG . . . . . . . . . c30225_5ug3 1 . 13 . 3521 . 1 1 7 SER N N -1.861 4.524 -2.022 . . . 1.0 . . . . . . . . . . . . A . 7 SER N . . . . . . . . . c30225_5ug3 1 . 13 . 3522 . 1 1 7 SER O O -0.497 7.767 -1.255 . . . 1.0 . . . . . . . . . . . . A . 7 SER O . . . . . . . . . c30225_5ug3 1 . 13 . 3523 . 1 1 7 SER OG O -3.018 7.992 -2.607 . . . 1.0 . . . . . . . . . . . . A . 7 SER OG . . . . . . . . . c30225_5ug3 1 . 13 . 3524 . 1 1 8 ASN C C 2.197 5.468 0.161 . . . 1.0 . . . . . . . . . . . . A . 8 ASN C . . . . . . . . . c30225_5ug3 1 . 13 . 3525 . 1 1 8 ASN CA C 0.860 6.079 0.502 . . . 1.0 . . . . . . . . . . . . A . 8 ASN CA . . . . . . . . . c30225_5ug3 1 . 13 . 3526 . 1 1 8 ASN CB C 0.436 5.591 1.875 . . . 1.0 . . . . . . . . . . . . A . 8 ASN CB . . . . . . . . . c30225_5ug3 1 . 13 . 3527 . 1 1 8 ASN CG C -0.731 6.374 2.435 . . . 1.0 . . . . . . . . . . . . A . 8 ASN CG . . . . . . . . . c30225_5ug3 1 . 13 . 3528 . 1 1 8 ASN H H -0.335 4.733 -0.593 . . . 1.0 . . . . . . . . . . . . A . 8 ASN H . . . . . . . . . c30225_5ug3 1 . 13 . 3529 . 1 1 8 ASN HA H 0.940 7.155 0.505 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HA . . . . . . . . . c30225_5ug3 1 . 13 . 3530 . 1 1 8 ASN HB2 H 0.157 4.554 1.794 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HB2 . . . . . . . . . c30225_5ug3 1 . 13 . 3531 . 1 1 8 ASN HB3 H 1.270 5.679 2.556 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HB3 . . . . . . . . . c30225_5ug3 1 . 13 . 3532 . 1 1 8 ASN HD21 H -1.999 5.317 1.325 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HD21 . . . . . . . . . c30225_5ug3 1 . 13 . 3533 . 1 1 8 ASN HD22 H -2.707 6.546 2.329 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HD22 . . . . . . . . . c30225_5ug3 1 . 13 . 3534 . 1 1 8 ASN N N -0.120 5.686 -0.494 . . . 1.0 . . . . . . . . . . . . A . 8 ASN N . . . . . . . . . c30225_5ug3 1 . 13 . 3535 . 1 1 8 ASN ND2 N -1.930 6.046 1.991 . . . 1.0 . . . . . . . . . . . . A . 8 ASN ND2 . . . . . . . . . c30225_5ug3 1 . 13 . 3536 . 1 1 8 ASN O O 2.398 4.267 0.333 . . . 1.0 . . . . . . . . . . . . A . 8 ASN O . . . . . . . . . c30225_5ug3 1 . 13 . 3537 . 1 1 8 ASN OD1 O -0.551 7.287 3.240 . . . 1.0 . . . . . . . . . . . . A . 8 ASN OD1 . . . . . . . . . c30225_5ug3 1 . 13 . 3538 . 1 1 9 PRO C C 5.193 5.074 0.350 . . . 1.0 . . . . . . . . . . . . A . 9 PRO C . . . . . . . . . c30225_5ug3 1 . 13 . 3539 . 1 1 9 PRO CA C 4.420 5.764 -0.763 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CA . . . . . . . . . c30225_5ug3 1 . 13 . 3540 . 1 1 9 PRO CB C 5.151 7.011 -1.262 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CB . . . . . . . . . c30225_5ug3 1 . 13 . 3541 . 1 1 9 PRO CD C 3.065 7.741 -0.393 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CD . . . . . . . . . c30225_5ug3 1 . 13 . 3542 . 1 1 9 PRO CG C 4.500 8.142 -0.553 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CG . . . . . . . . . c30225_5ug3 1 . 13 . 3543 . 1 1 9 PRO HA H 4.277 5.069 -1.575 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HA . . . . . . . . . c30225_5ug3 1 . 13 . 3544 . 1 1 9 PRO HB2 H 6.201 6.941 -1.019 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HB2 . . . . . . . . . c30225_5ug3 1 . 13 . 3545 . 1 1 9 PRO HB3 H 5.027 7.099 -2.327 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HB3 . . . . . . . . . c30225_5ug3 1 . 13 . 3546 . 1 1 9 PRO HD2 H 2.659 8.164 0.507 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HD2 . . . . . . . . . c30225_5ug3 1 . 13 . 3547 . 1 1 9 PRO HD3 H 2.487 8.043 -1.252 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HD3 . . . . . . . . . c30225_5ug3 1 . 13 . 3548 . 1 1 9 PRO HG2 H 4.962 8.287 0.413 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HG2 . . . . . . . . . c30225_5ug3 1 . 13 . 3549 . 1 1 9 PRO HG3 H 4.575 9.040 -1.146 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HG3 . . . . . . . . . c30225_5ug3 1 . 13 . 3550 . 1 1 9 PRO N N 3.143 6.275 -0.300 . . . 1.0 . . . . . . . . . . . . A . 9 PRO N . . . . . . . . . c30225_5ug3 1 . 13 . 3551 . 1 1 9 PRO O O 6.040 4.234 0.095 . . . 1.0 . . . . . . . . . . . . A . 9 PRO O . . . . . . . . . c30225_5ug3 1 . 13 . 3552 . 1 1 10 VAL C C 5.158 3.349 2.889 . . . 1.0 . . . . . . . . . . . . A . 10 VAL C . . . . . . . . . c30225_5ug3 1 . 13 . 3553 . 1 1 10 VAL CA C 5.557 4.811 2.721 . . . 1.0 . . . . . . . . . . . . A . 10 VAL CA . . . . . . . . . c30225_5ug3 1 . 13 . 3554 . 1 1 10 VAL CB C 5.274 5.590 4.022 . . . 1.0 . . . . . . . . . . . . A . 10 VAL CB . . . . . . . . . c30225_5ug3 1 . 13 . 3555 . 1 1 10 VAL CG1 C 6.069 5.014 5.181 . . . 1.0 . . . . . . . . . . . . A . 10 VAL CG1 . . . . . . . . . c30225_5ug3 1 . 13 . 3556 . 1 1 10 VAL CG2 C 5.594 7.067 3.837 . . . 1.0 . . . . . . . . . . . . A . 10 VAL CG2 . . . . . . . . . c30225_5ug3 1 . 13 . 3557 . 1 1 10 VAL H H 4.084 5.982 1.740 . . . 1.0 . . . . . . . . . . . . A . 10 VAL H . . . . . . . . . c30225_5ug3 1 . 13 . 3558 . 1 1 10 VAL HA H 6.620 4.860 2.511 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HA . . . . . . . . . c30225_5ug3 1 . 13 . 3559 . 1 1 10 VAL HB H 4.223 5.498 4.252 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HB . . . . . . . . . c30225_5ug3 1 . 13 . 3560 . 1 1 10 VAL HG11 H 5.801 3.978 5.322 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HG11 . . . . . . . . . c30225_5ug3 1 . 13 . 3561 . 1 1 10 VAL HG12 H 5.847 5.569 6.080 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HG12 . . . . . . . . . c30225_5ug3 1 . 13 . 3562 . 1 1 10 VAL HG13 H 7.124 5.088 4.965 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HG13 . . . . . . . . . c30225_5ug3 1 . 13 . 3563 . 1 1 10 VAL HG21 H 6.632 7.178 3.566 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HG21 . . . . . . . . . c30225_5ug3 1 . 13 . 3564 . 1 1 10 VAL HG22 H 5.405 7.594 4.761 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HG22 . . . . . . . . . c30225_5ug3 1 . 13 . 3565 . 1 1 10 VAL HG23 H 4.973 7.476 3.056 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HG23 . . . . . . . . . c30225_5ug3 1 . 13 . 3566 . 1 1 10 VAL N N 4.850 5.383 1.588 . . . 1.0 . . . . . . . . . . . . A . 10 VAL N . . . . . . . . . c30225_5ug3 1 . 13 . 3567 . 1 1 10 VAL O O 5.957 2.510 3.304 . . . 1.0 . . . . . . . . . . . . A . 10 VAL O . . . . . . . . . c30225_5ug3 1 . 13 . 3568 . 1 1 11 CYS C C 3.996 0.866 1.428 . . . 1.0 . . . . . . . . . . . . A . 11 CYS C . . . . . . . . . c30225_5ug3 1 . 13 . 3569 . 1 1 11 CYS CA C 3.438 1.687 2.584 . . . 1.0 . . . . . . . . . . . . A . 11 CYS CA . . . . . . . . . c30225_5ug3 1 . 13 . 3570 . 1 1 11 CYS CB C 1.919 1.669 2.539 . . . 1.0 . . . . . . . . . . . . A . 11 CYS CB . . . . . . . . . c30225_5ug3 1 . 13 . 3571 . 1 1 11 CYS H H 3.325 3.743 2.201 . . . 1.0 . . . . . . . . . . . . A . 11 CYS H . . . . . . . . . c30225_5ug3 1 . 13 . 3572 . 1 1 11 CYS HA H 3.769 1.256 3.515 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HA . . . . . . . . . c30225_5ug3 1 . 13 . 3573 . 1 1 11 CYS HB2 H 1.590 2.166 1.639 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HB2 . . . . . . . . . c30225_5ug3 1 . 13 . 3574 . 1 1 11 CYS HB3 H 1.592 0.649 2.516 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HB3 . . . . . . . . . c30225_5ug3 1 . 13 . 3575 . 1 1 11 CYS N N 3.924 3.043 2.524 . . . 1.0 . . . . . . . . . . . . A . 11 CYS N . . . . . . . . . c30225_5ug3 1 . 13 . 3576 . 1 1 11 CYS O O 4.659 -0.145 1.644 . . . 1.0 . . . . . . . . . . . . A . 11 CYS O . . . . . . . . . c30225_5ug3 1 . 13 . 3577 . 1 1 11 CYS SG S 1.098 2.484 3.946 . . . 1.0 . . . . . . . . . . . . A . 11 CYS SG . . . . . . . . . c30225_5ug3 1 . 13 . 3578 . 1 1 12 ARG C C 5.622 0.348 -1.125 . . . 1.0 . . . . . . . . . . . . A . 12 ARG C . . . . . . . . . c30225_5ug3 1 . 13 . 3579 . 1 1 12 ARG CA C 4.123 0.569 -0.993 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CA . . . . . . . . . c30225_5ug3 1 . 13 . 3580 . 1 1 12 ARG CB C 3.557 1.225 -2.246 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CB . . . . . . . . . c30225_5ug3 1 . 13 . 3581 . 1 1 12 ARG CD C 3.158 3.336 -3.524 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CD . . . . . . . . . c30225_5ug3 1 . 13 . 3582 . 1 1 12 ARG CG C 3.845 2.693 -2.328 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CG . . . . . . . . . c30225_5ug3 1 . 13 . 3583 . 1 1 12 ARG CZ C 3.593 2.637 -5.864 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CZ . . . . . . . . . c30225_5ug3 1 . 13 . 3584 . 1 1 12 ARG H H 3.335 2.209 0.096 . . . 1.0 . . . . . . . . . . . . A . 12 ARG H . . . . . . . . . c30225_5ug3 1 . 13 . 3585 . 1 1 12 ARG HA H 3.671 -0.374 -0.895 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HA . . . . . . . . . c30225_5ug3 1 . 13 . 3586 . 1 1 12 ARG HB2 H 3.984 0.751 -3.114 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HB2 . . . . . . . . . c30225_5ug3 1 . 13 . 3587 . 1 1 12 ARG HB3 H 2.485 1.088 -2.260 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HB3 . . . . . . . . . c30225_5ug3 1 . 13 . 3588 . 1 1 12 ARG HD2 H 2.162 3.624 -3.230 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HD2 . . . . . . . . . c30225_5ug3 1 . 13 . 3589 . 1 1 12 ARG HD3 H 3.715 4.212 -3.819 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HD3 . . . . . . . . . c30225_5ug3 1 . 13 . 3590 . 1 1 12 ARG HE H 2.565 1.574 -4.512 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HE . . . . . . . . . c30225_5ug3 1 . 13 . 3591 . 1 1 12 ARG HG2 H 3.474 3.141 -1.424 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HG2 . . . . . . . . . c30225_5ug3 1 . 13 . 3592 . 1 1 12 ARG HG3 H 4.912 2.843 -2.403 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HG3 . . . . . . . . . c30225_5ug3 1 . 13 . 3593 . 1 1 12 ARG HH11 H 4.344 4.473 -5.431 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH11 . . . . . . . . . c30225_5ug3 1 . 13 . 3594 . 1 1 12 ARG HH12 H 4.623 3.920 -7.052 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH12 . . . . . . . . . c30225_5ug3 1 . 13 . 3595 . 1 1 12 ARG HH21 H 2.949 0.857 -6.609 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH21 . . . . . . . . . c30225_5ug3 1 . 13 . 3596 . 1 1 12 ARG HH22 H 3.840 1.860 -7.722 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH22 . . . . . . . . . c30225_5ug3 1 . 13 . 3597 . 1 1 12 ARG N N 3.763 1.332 0.202 . . . 1.0 . . . . . . . . . . . . A . 12 ARG N . . . . . . . . . c30225_5ug3 1 . 13 . 3598 . 1 1 12 ARG NE N 3.067 2.421 -4.660 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NE . . . . . . . . . c30225_5ug3 1 . 13 . 3599 . 1 1 12 ARG NH1 N 4.241 3.766 -6.135 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NH1 . . . . . . . . . c30225_5ug3 1 . 13 . 3600 . 1 1 12 ARG NH2 N 3.453 1.715 -6.808 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NH2 . . . . . . . . . c30225_5ug3 1 . 13 . 3601 . 1 1 12 ARG O O 6.065 -0.535 -1.861 . . . 1.0 . . . . . . . . . . . . A . 12 ARG O . . . . . . . . . c30225_5ug3 1 . 13 . 3602 . 1 1 13 VAL C C 8.354 0.092 0.631 . . . 1.0 . . . . . . . . . . . . A . 13 VAL C . . . . . . . . . c30225_5ug3 1 . 13 . 3603 . 1 1 13 VAL CA C 7.833 1.034 -0.454 . . . 1.0 . . . . . . . . . . . . A . 13 VAL CA . . . . . . . . . c30225_5ug3 1 . 13 . 3604 . 1 1 13 VAL CB C 8.450 2.430 -0.354 . . . 1.0 . . . . . . . . . . . . A . 13 VAL CB . . . . . . . . . c30225_5ug3 1 . 13 . 3605 . 1 1 13 VAL CG1 C 9.946 2.374 -0.125 . . . 1.0 . . . . . . . . . . . . A . 13 VAL CG1 . . . . . . . . . c30225_5ug3 1 . 13 . 3606 . 1 1 13 VAL CG2 C 8.111 3.178 -1.628 . . . 1.0 . . . . . . . . . . . . A . 13 VAL CG2 . . . . . . . . . c30225_5ug3 1 . 13 . 3607 . 1 1 13 VAL H H 5.994 1.863 0.108 . . . 1.0 . . . . . . . . . . . . A . 13 VAL H . . . . . . . . . c30225_5ug3 1 . 13 . 3608 . 1 1 13 VAL HA H 8.105 0.624 -1.416 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HA . . . . . . . . . c30225_5ug3 1 . 13 . 3609 . 1 1 13 VAL HB H 7.995 2.950 0.474 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HB . . . . . . . . . c30225_5ug3 1 . 13 . 3610 . 1 1 13 VAL HG11 H 10.145 1.809 0.771 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HG11 . . . . . . . . . c30225_5ug3 1 . 13 . 3611 . 1 1 13 VAL HG12 H 10.325 3.378 -0.008 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HG12 . . . . . . . . . c30225_5ug3 1 . 13 . 3612 . 1 1 13 VAL HG13 H 10.423 1.901 -0.967 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HG13 . . . . . . . . . c30225_5ug3 1 . 13 . 3613 . 1 1 13 VAL HG21 H 8.341 4.226 -1.510 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HG21 . . . . . . . . . c30225_5ug3 1 . 13 . 3614 . 1 1 13 VAL HG22 H 7.049 3.054 -1.833 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HG22 . . . . . . . . . c30225_5ug3 1 . 13 . 3615 . 1 1 13 VAL HG23 H 8.682 2.768 -2.447 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HG23 . . . . . . . . . c30225_5ug3 1 . 13 . 3616 . 1 1 13 VAL N N 6.397 1.155 -0.431 . . . 1.0 . . . . . . . . . . . . A . 13 VAL N . . . . . . . . . c30225_5ug3 1 . 13 . 3617 . 1 1 13 VAL O O 9.315 -0.643 0.406 . . . 1.0 . . . . . . . . . . . . A . 13 VAL O . . . . . . . . . c30225_5ug3 1 . 13 . 3618 . 1 1 14 ASN C C 7.625 -2.212 2.628 . . . 1.0 . . . . . . . . . . . . A . 14 ASN C . . . . . . . . . c30225_5ug3 1 . 13 . 3619 . 1 1 14 ASN CA C 8.154 -0.806 2.869 . . . 1.0 . . . . . . . . . . . . A . 14 ASN CA . . . . . . . . . c30225_5ug3 1 . 13 . 3620 . 1 1 14 ASN CB C 7.729 -0.306 4.261 . . . 1.0 . . . . . . . . . . . . A . 14 ASN CB . . . . . . . . . c30225_5ug3 1 . 13 . 3621 . 1 1 14 ASN CG C 6.361 -0.799 4.705 . . . 1.0 . . . . . . . . . . . . A . 14 ASN CG . . . . . . . . . c30225_5ug3 1 . 13 . 3622 . 1 1 14 ASN H H 6.949 0.679 1.939 . . . 1.0 . . . . . . . . . . . . A . 14 ASN H . . . . . . . . . c30225_5ug3 1 . 13 . 3623 . 1 1 14 ASN HA H 9.232 -0.843 2.831 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HA . . . . . . . . . c30225_5ug3 1 . 13 . 3624 . 1 1 14 ASN HB2 H 8.453 -0.642 4.987 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HB2 . . . . . . . . . c30225_5ug3 1 . 13 . 3625 . 1 1 14 ASN HB3 H 7.713 0.773 4.254 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HB3 . . . . . . . . . c30225_5ug3 1 . 13 . 3626 . 1 1 14 ASN HD21 H 5.502 0.827 3.966 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HD21 . . . . . . . . . c30225_5ug3 1 . 13 . 3627 . 1 1 14 ASN HD22 H 4.440 -0.315 4.718 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HD22 . . . . . . . . . c30225_5ug3 1 . 13 . 3628 . 1 1 14 ASN N N 7.715 0.085 1.798 . . . 1.0 . . . . . . . . . . . . A . 14 ASN N . . . . . . . . . c30225_5ug3 1 . 13 . 3629 . 1 1 14 ASN ND2 N 5.333 -0.019 4.435 . . . 1.0 . . . . . . . . . . . . A . 14 ASN ND2 . . . . . . . . . c30225_5ug3 1 . 13 . 3630 . 1 1 14 ASN O O 8.263 -3.198 3.005 . . . 1.0 . . . . . . . . . . . . A . 14 ASN O . . . . . . . . . c30225_5ug3 1 . 13 . 3631 . 1 1 14 ASN OD1 O 6.233 -1.867 5.304 . . . 1.0 . . . . . . . . . . . . A . 14 ASN OD1 . . . . . . . . . c30225_5ug3 1 . 13 . 3632 . 1 1 15 ASN C C 6.476 -4.023 0.313 . . . 1.0 . . . . . . . . . . . . A . 15 ASN C . . . . . . . . . c30225_5ug3 1 . 13 . 3633 . 1 1 15 ASN CA C 5.892 -3.565 1.646 . . . 1.0 . . . . . . . . . . . . A . 15 ASN CA . . . . . . . . . c30225_5ug3 1 . 13 . 3634 . 1 1 15 ASN CB C 4.350 -3.440 1.625 . . . 1.0 . . . . . . . . . . . . A . 15 ASN CB . . . . . . . . . c30225_5ug3 1 . 13 . 3635 . 1 1 15 ASN CG C 3.735 -2.751 0.403 . . . 1.0 . . . . . . . . . . . . A . 15 ASN CG . . . . . . . . . c30225_5ug3 1 . 13 . 3636 . 1 1 15 ASN H H 5.959 -1.503 1.781 . . . 1.0 . . . . . . . . . . . . A . 15 ASN H . . . . . . . . . c30225_5ug3 1 . 13 . 3637 . 1 1 15 ASN HA H 6.177 -4.283 2.406 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HA . . . . . . . . . c30225_5ug3 1 . 13 . 3638 . 1 1 15 ASN HB2 H 3.934 -4.419 1.687 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HB2 . . . . . . . . . c30225_5ug3 1 . 13 . 3639 . 1 1 15 ASN HB3 H 4.051 -2.883 2.503 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HB3 . . . . . . . . . c30225_5ug3 1 . 13 . 3640 . 1 1 15 ASN HD21 H 2.238 -2.092 1.532 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HD21 . . . . . . . . . c30225_5ug3 1 . 13 . 3641 . 1 1 15 ASN HD22 H 2.168 -1.652 -0.139 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HD22 . . . . . . . . . c30225_5ug3 1 . 13 . 3642 . 1 1 15 ASN N N 6.459 -2.304 2.002 . . . 1.0 . . . . . . . . . . . . A . 15 ASN N . . . . . . . . . c30225_5ug3 1 . 13 . 3643 . 1 1 15 ASN ND2 N 2.603 -2.096 0.619 . . . 1.0 . . . . . . . . . . . . A . 15 ASN ND2 . . . . . . . . . c30225_5ug3 1 . 13 . 3644 . 1 1 15 ASN O O 7.046 -3.226 -0.439 . . . 1.0 . . . . . . . . . . . . A . 15 ASN O . . . . . . . . . c30225_5ug3 1 . 13 . 3645 . 1 1 15 ASN OD1 O 4.238 -2.820 -0.716 . . . 1.0 . . . . . . . . . . . . A . 15 ASN OD1 . . . . . . . . . c30225_5ug3 1 . 13 . 3646 . 1 1 16 HYP C C 6.165 -5.584 -2.446 . . . 1.0 . . . . . . . . . . . . A . 16 HYP C . . . . . . . . . c30225_5ug3 1 . 13 . 3647 . 1 1 16 HYP CA C 6.942 -5.935 -1.180 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CA . . . . . . . . . c30225_5ug3 1 . 13 . 3648 . 1 1 16 HYP CB C 6.822 -7.406 -0.864 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CB . . . . . . . . . c30225_5ug3 1 . 13 . 3649 . 1 1 16 HYP CD C 5.707 -6.290 0.942 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CD . . . . . . . . . c30225_5ug3 1 . 13 . 3650 . 1 1 16 HYP CG C 6.007 -7.643 0.385 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CG . . . . . . . . . c30225_5ug3 1 . 13 . 3651 . 1 1 16 HYP HA H 7.981 -5.674 -1.310 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HA . . . . . . . . . c30225_5ug3 1 . 13 . 3652 . 1 1 16 HYP HB2 H 7.809 -7.816 -0.716 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HB2 . . . . . . . . . c30225_5ug3 1 . 13 . 3653 . 1 1 16 HYP HB3 H 6.350 -7.906 -1.698 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HB3 . . . . . . . . . c30225_5ug3 1 . 13 . 3654 . 1 1 16 HYP HD1 H 6.800 -7.729 2.142 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HD1 . . . . . . . . . c30225_5ug3 1 . 13 . 3655 . 1 1 16 HYP HD22 H 4.658 -6.117 0.972 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HD22 . . . . . . . . . c30225_5ug3 1 . 13 . 3656 . 1 1 16 HYP HD23 H 6.115 -6.210 1.938 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HD23 . . . . . . . . . c30225_5ug3 1 . 13 . 3657 . 1 1 16 HYP HG H 5.106 -8.197 0.156 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HG . . . . . . . . . c30225_5ug3 1 . 13 . 3658 . 1 1 16 HYP N N 6.377 -5.321 0.038 . . . 1.0 . . . . . . . . . . . . A . 16 HYP N . . . . . . . . . c30225_5ug3 1 . 13 . 3659 . 1 1 16 HYP O O 5.823 -6.461 -3.239 . . . 1.0 . . . . . . . . . . . . A . 16 HYP O . . . . . . . . . c30225_5ug3 1 . 13 . 3660 . 1 1 16 HYP OD1 O 6.759 -8.316 1.371 . . . 1.0 . . . . . . . . . . . . A . 16 HYP OD1 . . . . . . . . . c30225_5ug3 1 . 13 . 3661 . 1 1 17 HIS C C 3.819 -4.407 -3.920 . . . 1.0 . . . . . . . . . . . . A . 17 HIS C . . . . . . . . . c30225_5ug3 1 . 13 . 3662 . 1 1 17 HIS CA C 5.199 -3.768 -3.785 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CA . . . . . . . . . c30225_5ug3 1 . 13 . 3663 . 1 1 17 HIS CB C 6.029 -3.987 -5.059 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CB . . . . . . . . . c30225_5ug3 1 . 13 . 3664 . 1 1 17 HIS CD2 C 5.510 -1.929 -6.553 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CD2 . . . . . . . . . c30225_5ug3 1 . 13 . 3665 . 1 1 17 HIS CE1 C 4.570 -2.975 -8.229 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CE1 . . . . . . . . . c30225_5ug3 1 . 13 . 3666 . 1 1 17 HIS CG C 5.509 -3.250 -6.258 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CG . . . . . . . . . c30225_5ug3 1 . 13 . 3667 . 1 1 17 HIS H H 6.173 -3.665 -1.909 . . . 1.0 . . . . . . . . . . . . A . 17 HIS H . . . . . . . . . c30225_5ug3 1 . 13 . 3668 . 1 1 17 HIS HA H 5.068 -2.706 -3.634 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HA . . . . . . . . . c30225_5ug3 1 . 13 . 3669 . 1 1 17 HIS HB2 H 7.040 -3.654 -4.881 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HB2 . . . . . . . . . c30225_5ug3 1 . 13 . 3670 . 1 1 17 HIS HB3 H 6.039 -5.040 -5.295 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HB3 . . . . . . . . . c30225_5ug3 1 . 13 . 3671 . 1 1 17 HIS HD1 H 4.760 -4.845 -7.417 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HD1 . . . . . . . . . c30225_5ug3 1 . 13 . 3672 . 1 1 17 HIS HD2 H 5.903 -1.136 -5.933 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HD2 . . . . . . . . . c30225_5ug3 1 . 13 . 3673 . 1 1 17 HIS HE1 H 4.085 -3.177 -9.172 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HE1 . . . . . . . . . c30225_5ug3 1 . 13 . 3674 . 1 1 17 HIS HE2 H 4.963 -0.971 -8.336 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HE2 . . . . . . . . . c30225_5ug3 1 . 13 . 3675 . 1 1 17 HIS N N 5.897 -4.294 -2.616 . . . 1.0 . . . . . . . . . . . . A . 17 HIS N . . . . . . . . . c30225_5ug3 1 . 13 . 3676 . 1 1 17 HIS ND1 N 4.911 -3.877 -7.329 . . . 1.0 . . . . . . . . . . . . A . 17 HIS ND1 . . . . . . . . . c30225_5ug3 1 . 13 . 3677 . 1 1 17 HIS NE2 N 4.922 -1.784 -7.783 . . . 1.0 . . . . . . . . . . . . A . 17 HIS NE2 . . . . . . . . . c30225_5ug3 1 . 13 . 3678 . 1 1 17 HIS O O 3.499 -5.030 -4.932 . . . 1.0 . . . . . . . . . . . . A . 17 HIS O . . . . . . . . . c30225_5ug3 1 . 13 . 3679 . 1 1 18 VAL C C 0.791 -3.915 -3.854 . . . 1.0 . . . . . . . . . . . . A . 18 VAL C . . . . . . . . . c30225_5ug3 1 . 13 . 3680 . 1 1 18 VAL CA C 1.642 -4.758 -2.904 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CA . . . . . . . . . c30225_5ug3 1 . 13 . 3681 . 1 1 18 VAL CB C 1.019 -4.761 -1.488 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CB . . . . . . . . . c30225_5ug3 1 . 13 . 3682 . 1 1 18 VAL CG1 C -0.419 -5.262 -1.520 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CG1 . . . . . . . . . c30225_5ug3 1 . 13 . 3683 . 1 1 18 VAL CG2 C 1.855 -5.610 -0.542 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CG2 . . . . . . . . . c30225_5ug3 1 . 13 . 3684 . 1 1 18 VAL H H 3.351 -3.812 -2.072 . . . 1.0 . . . . . . . . . . . . A . 18 VAL H . . . . . . . . . c30225_5ug3 1 . 13 . 3685 . 1 1 18 VAL HA H 1.666 -5.776 -3.268 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HA . . . . . . . . . c30225_5ug3 1 . 13 . 3686 . 1 1 18 VAL HB H 1.016 -3.747 -1.117 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HB . . . . . . . . . c30225_5ug3 1 . 13 . 3687 . 1 1 18 VAL HG11 H -0.441 -6.273 -1.896 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG11 . . . . . . . . . c30225_5ug3 1 . 13 . 3688 . 1 1 18 VAL HG12 H -1.008 -4.625 -2.165 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG12 . . . . . . . . . c30225_5ug3 1 . 13 . 3689 . 1 1 18 VAL HG13 H -0.830 -5.240 -0.522 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG13 . . . . . . . . . c30225_5ug3 1 . 13 . 3690 . 1 1 18 VAL HG21 H 1.906 -6.621 -0.916 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG21 . . . . . . . . . c30225_5ug3 1 . 13 . 3691 . 1 1 18 VAL HG22 H 1.401 -5.612 0.438 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG22 . . . . . . . . . c30225_5ug3 1 . 13 . 3692 . 1 1 18 VAL HG23 H 2.851 -5.200 -0.476 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG23 . . . . . . . . . c30225_5ug3 1 . 13 . 3693 . 1 1 18 VAL N N 3.011 -4.260 -2.880 . . . 1.0 . . . . . . . . . . . . A . 18 VAL N . . . . . . . . . c30225_5ug3 1 . 13 . 3694 . 1 1 18 VAL O O -0.131 -4.417 -4.502 . . . 1.0 . . . . . . . . . . . . A . 18 VAL O . . . . . . . . . c30225_5ug3 1 . 13 . 3695 . 1 1 19 CYS C C 1.396 -0.596 -5.237 . . . 1.0 . . . . . . . . . . . . A . 19 CYS C . . . . . . . . . c30225_5ug3 1 . 13 . 3696 . 1 1 19 CYS CA C 0.456 -1.737 -4.875 . . . 1.0 . . . . . . . . . . . . A . 19 CYS CA . . . . . . . . . c30225_5ug3 1 . 13 . 3697 . 1 1 19 CYS CB C -0.843 -1.192 -4.272 . . . 1.0 . . . . . . . . . . . . A . 19 CYS CB . . . . . . . . . c30225_5ug3 1 . 13 . 3698 . 1 1 19 CYS H H 1.829 -2.280 -3.373 . . . 1.0 . . . . . . . . . . . . A . 19 CYS H . . . . . . . . . c30225_5ug3 1 . 13 . 3699 . 1 1 19 CYS HA H 0.225 -2.296 -5.770 . . . 1.0 . . . . . . . . . . . . A . 19 CYS HA . . . . . . . . . c30225_5ug3 1 . 13 . 3700 . 1 1 19 CYS HB2 H -1.418 -2.014 -3.875 . . . 1.0 . . . . . . . . . . . . A . 19 CYS HB2 . . . . . . . . . c30225_5ug3 1 . 13 . 3701 . 1 1 19 CYS HB3 H -0.603 -0.508 -3.469 . . . 1.0 . . . . . . . . . . . . A . 19 CYS HB3 . . . . . . . . . c30225_5ug3 1 . 13 . 3702 . 1 1 19 CYS N N 1.120 -2.635 -3.946 . . . 1.0 . . . . . . . . . . . . A . 19 CYS N . . . . . . . . . c30225_5ug3 1 . 13 . 3703 . 1 1 19 CYS O O 2.029 -0.658 -6.313 . . . 1.0 . . . . . . . . . . . . A . 19 CYS O . . . . . . . . . c30225_5ug3 1 . 13 . 3704 . 1 1 19 CYS OXT O 1.528 0.335 -4.427 . . . 1.0 . . . . . . . . . . . . A . 19 CYS OXT . . . . . . . . . c30225_5ug3 1 . 13 . 3705 . 1 1 19 CYS SG S -1.904 -0.301 -5.461 . . . 1.0 . . . . . . . . . . . . A . 19 CYS SG . . . . . . . . . c30225_5ug3 1 . 14 . 3706 . 1 1 1 ILE C C -7.095 -5.516 1.543 . . . 1.0 . . . . . . . . . . . . A . 1 ILE C . . . . . . . . . c30225_5ug3 1 . 14 . 3707 . 1 1 1 ILE CA C -6.999 -6.784 2.378 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CA . . . . . . . . . c30225_5ug3 1 . 14 . 3708 . 1 1 1 ILE CB C -5.599 -6.863 3.033 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CB . . . . . . . . . c30225_5ug3 1 . 14 . 3709 . 1 1 1 ILE CD1 C -3.101 -7.029 2.536 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CD1 . . . . . . . . . c30225_5ug3 1 . 14 . 3710 . 1 1 1 ILE CG1 C -4.505 -7.012 1.971 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CG1 . . . . . . . . . c30225_5ug3 1 . 14 . 3711 . 1 1 1 ILE CG2 C -5.548 -8.017 4.023 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CG2 . . . . . . . . . c30225_5ug3 1 . 14 . 3712 . 1 1 1 ILE H1 H -6.602 -8.010 0.748 . . . 1.0 . . . . . . . . . . . . A . 1 ILE H1 . . . . . . . . . c30225_5ug3 1 . 14 . 3713 . 1 1 1 ILE H2 H -8.240 -7.907 1.149 . . . 1.0 . . . . . . . . . . . . A . 1 ILE H2 . . . . . . . . . c30225_5ug3 1 . 14 . 3714 . 1 1 1 ILE H3 H -7.196 -8.838 2.097 . . . 1.0 . . . . . . . . . . . . A . 1 ILE H3 . . . . . . . . . c30225_5ug3 1 . 14 . 3715 . 1 1 1 ILE HA H -7.742 -6.742 3.162 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HA . . . . . . . . . c30225_5ug3 1 . 14 . 3716 . 1 1 1 ILE HB H -5.434 -5.948 3.582 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HB . . . . . . . . . c30225_5ug3 1 . 14 . 3717 . 1 1 1 ILE HD11 H -2.391 -7.143 1.732 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HD11 . . . . . . . . . c30225_5ug3 1 . 14 . 3718 . 1 1 1 ILE HD12 H -3.000 -7.854 3.226 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HD12 . . . . . . . . . c30225_5ug3 1 . 14 . 3719 . 1 1 1 ILE HD13 H -2.911 -6.101 3.054 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HD13 . . . . . . . . . c30225_5ug3 1 . 14 . 3720 . 1 1 1 ILE HG12 H -4.656 -7.936 1.437 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG12 . . . . . . . . . c30225_5ug3 1 . 14 . 3721 . 1 1 1 ILE HG13 H -4.574 -6.186 1.278 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG13 . . . . . . . . . c30225_5ug3 1 . 14 . 3722 . 1 1 1 ILE HG21 H -5.743 -8.944 3.505 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG21 . . . . . . . . . c30225_5ug3 1 . 14 . 3723 . 1 1 1 ILE HG22 H -6.296 -7.870 4.788 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG22 . . . . . . . . . c30225_5ug3 1 . 14 . 3724 . 1 1 1 ILE HG23 H -4.570 -8.058 4.480 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG23 . . . . . . . . . c30225_5ug3 1 . 14 . 3725 . 1 1 1 ILE N N -7.277 -7.967 1.537 . . . 1.0 . . . . . . . . . . . . A . 1 ILE N . . . . . . . . . c30225_5ug3 1 . 14 . 3726 . 1 1 1 ILE O O -6.855 -5.541 0.336 . . . 1.0 . . . . . . . . . . . . A . 1 ILE O . . . . . . . . . c30225_5ug3 1 . 14 . 3727 . 1 1 2 ARG C C -6.160 -2.616 1.218 . . . 1.0 . . . . . . . . . . . . A . 2 ARG C . . . . . . . . . c30225_5ug3 1 . 14 . 3728 . 1 1 2 ARG CA C -7.557 -3.133 1.521 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CA . . . . . . . . . c30225_5ug3 1 . 14 . 3729 . 1 1 2 ARG CB C -8.310 -2.122 2.389 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CB . . . . . . . . . c30225_5ug3 1 . 14 . 3730 . 1 1 2 ARG CD C -10.435 -1.438 3.518 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CD . . . . . . . . . c30225_5ug3 1 . 14 . 3731 . 1 1 2 ARG CG C -9.742 -2.523 2.713 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CG . . . . . . . . . c30225_5ug3 1 . 14 . 3732 . 1 1 2 ARG CZ C -12.715 -0.892 4.282 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CZ . . . . . . . . . c30225_5ug3 1 . 14 . 3733 . 1 1 2 ARG H H -7.680 -4.476 3.141 . . . 1.0 . . . . . . . . . . . . A . 2 ARG H . . . . . . . . . c30225_5ug3 1 . 14 . 3734 . 1 1 2 ARG HA H -8.089 -3.276 0.596 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HA . . . . . . . . . c30225_5ug3 1 . 14 . 3735 . 1 1 2 ARG HB2 H -7.777 -1.999 3.320 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB2 . . . . . . . . . c30225_5ug3 1 . 14 . 3736 . 1 1 2 ARG HB3 H -8.336 -1.173 1.873 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB3 . . . . . . . . . c30225_5ug3 1 . 14 . 3737 . 1 1 2 ARG HD2 H -9.876 -1.270 4.424 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD2 . . . . . . . . . c30225_5ug3 1 . 14 . 3738 . 1 1 2 ARG HD3 H -10.442 -0.531 2.932 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD3 . . . . . . . . . c30225_5ug3 1 . 14 . 3739 . 1 1 2 ARG HE H -12.075 -2.730 3.796 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HE . . . . . . . . . c30225_5ug3 1 . 14 . 3740 . 1 1 2 ARG HG2 H -10.282 -2.681 1.792 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG2 . . . . . . . . . c30225_5ug3 1 . 14 . 3741 . 1 1 2 ARG HG3 H -9.731 -3.437 3.289 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG3 . . . . . . . . . c30225_5ug3 1 . 14 . 3742 . 1 1 2 ARG HH11 H -11.449 0.689 4.171 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH11 . . . . . . . . . c30225_5ug3 1 . 14 . 3743 . 1 1 2 ARG HH12 H -13.061 1.061 4.692 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH12 . . . . . . . . . c30225_5ug3 1 . 14 . 3744 . 1 1 2 ARG HH21 H -14.207 -2.247 4.514 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH21 . . . . . . . . . c30225_5ug3 1 . 14 . 3745 . 1 1 2 ARG HH22 H -14.625 -0.608 4.903 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH22 . . . . . . . . . c30225_5ug3 1 . 14 . 3746 . 1 1 2 ARG N N -7.468 -4.419 2.188 . . . 1.0 . . . . . . . . . . . . A . 2 ARG N . . . . . . . . . c30225_5ug3 1 . 14 . 3747 . 1 1 2 ARG NE N -11.812 -1.783 3.868 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NE . . . . . . . . . c30225_5ug3 1 . 14 . 3748 . 1 1 2 ARG NH1 N -12.381 0.388 4.394 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH1 . . . . . . . . . c30225_5ug3 1 . 14 . 3749 . 1 1 2 ARG NH2 N -13.947 -1.280 4.590 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH2 . . . . . . . . . c30225_5ug3 1 . 14 . 3750 . 1 1 2 ARG O O -5.302 -2.582 2.099 . . . 1.0 . . . . . . . . . . . . A . 2 ARG O . . . . . . . . . c30225_5ug3 1 . 14 . 3751 . 1 1 3 ASP C C -4.491 -0.275 -0.510 . . . 1.0 . . . . . . . . . . . . A . 3 ASP C . . . . . . . . . c30225_5ug3 1 . 14 . 3752 . 1 1 3 ASP CA C -4.609 -1.790 -0.456 . . . 1.0 . . . . . . . . . . . . A . 3 ASP CA . . . . . . . . . c30225_5ug3 1 . 14 . 3753 . 1 1 3 ASP CB C -4.271 -2.384 -1.819 . . . 1.0 . . . . . . . . . . . . A . 3 ASP CB . . . . . . . . . c30225_5ug3 1 . 14 . 3754 . 1 1 3 ASP CG C -5.246 -1.990 -2.912 . . . 1.0 . . . . . . . . . . . . A . 3 ASP CG . . . . . . . . . c30225_5ug3 1 . 14 . 3755 . 1 1 3 ASP H H -6.673 -2.207 -0.668 . . . 1.0 . . . . . . . . . . . . A . 3 ASP H . . . . . . . . . c30225_5ug3 1 . 14 . 3756 . 1 1 3 ASP HA H -3.898 -2.160 0.265 . . . 1.0 . . . . . . . . . . . . A . 3 ASP HA . . . . . . . . . c30225_5ug3 1 . 14 . 3757 . 1 1 3 ASP HB2 H -3.295 -2.043 -2.102 . . . 1.0 . . . . . . . . . . . . A . 3 ASP HB2 . . . . . . . . . c30225_5ug3 1 . 14 . 3758 . 1 1 3 ASP HB3 H -4.264 -3.459 -1.736 . . . 1.0 . . . . . . . . . . . . A . 3 ASP HB3 . . . . . . . . . c30225_5ug3 1 . 14 . 3759 . 1 1 3 ASP N N -5.933 -2.214 -0.022 . . . 1.0 . . . . . . . . . . . . A . 3 ASP N . . . . . . . . . c30225_5ug3 1 . 14 . 3760 . 1 1 3 ASP O O -3.857 0.285 -1.406 . . . 1.0 . . . . . . . . . . . . A . 3 ASP O . . . . . . . . . c30225_5ug3 1 . 14 . 3761 . 1 1 3 ASP OD1 O -6.325 -2.604 -3.008 . . . 1.0 . . . . . . . . . . . . A . 3 ASP OD1 . . . . . . . . . c30225_5ug3 1 . 14 . 3762 . 1 1 3 ASP OD2 O -4.943 -1.048 -3.677 . . . 1.0 . . . . . . . . . . . . A . 3 ASP OD2 . . . . . . . . . c30225_5ug3 1 . 14 . 3763 . 1 1 4 GLU C C -3.597 2.352 0.649 . . . 1.0 . . . . . . . . . . . . A . 4 GLU C . . . . . . . . . c30225_5ug3 1 . 14 . 3764 . 1 1 4 GLU CA C -5.035 1.838 0.566 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CA . . . . . . . . . c30225_5ug3 1 . 14 . 3765 . 1 1 4 GLU CB C -5.848 2.343 1.763 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CB . . . . . . . . . c30225_5ug3 1 . 14 . 3766 . 1 1 4 GLU CD C -5.979 2.574 4.270 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CD . . . . . . . . . c30225_5ug3 1 . 14 . 3767 . 1 1 4 GLU CG C -5.376 1.813 3.107 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CG . . . . . . . . . c30225_5ug3 1 . 14 . 3768 . 1 1 4 GLU H H -5.505 -0.137 1.184 . . . 1.0 . . . . . . . . . . . . A . 4 GLU H . . . . . . . . . c30225_5ug3 1 . 14 . 3769 . 1 1 4 GLU HA H -5.481 2.220 -0.342 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HA . . . . . . . . . c30225_5ug3 1 . 14 . 3770 . 1 1 4 GLU HB2 H -5.791 3.421 1.788 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HB2 . . . . . . . . . c30225_5ug3 1 . 14 . 3771 . 1 1 4 GLU HB3 H -6.879 2.052 1.629 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HB3 . . . . . . . . . c30225_5ug3 1 . 14 . 3772 . 1 1 4 GLU HG2 H -5.657 0.774 3.191 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HG2 . . . . . . . . . c30225_5ug3 1 . 14 . 3773 . 1 1 4 GLU HG3 H -4.300 1.901 3.157 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HG3 . . . . . . . . . c30225_5ug3 1 . 14 . 3774 . 1 1 4 GLU N N -5.062 0.378 0.485 . . . 1.0 . . . . . . . . . . . . A . 4 GLU N . . . . . . . . . c30225_5ug3 1 . 14 . 3775 . 1 1 4 GLU O O -3.319 3.507 0.326 . . . 1.0 . . . . . . . . . . . . A . 4 GLU O . . . . . . . . . c30225_5ug3 1 . 14 . 3776 . 1 1 4 GLU OE1 O -5.310 3.485 4.799 . . . 1.0 . . . . . . . . . . . . A . 4 GLU OE1 . . . . . . . . . c30225_5ug3 1 . 14 . 3777 . 1 1 4 GLU OE2 O -7.129 2.276 4.659 . . . 1.0 . . . . . . . . . . . . A . 4 GLU OE2 . . . . . . . . . c30225_5ug3 1 . 14 . 3778 . 1 1 5 CYS C C -0.695 2.150 -0.251 . . . 1.0 . . . . . . . . . . . . A . 5 CYS C . . . . . . . . . c30225_5ug3 1 . 14 . 3779 . 1 1 5 CYS CA C -1.267 1.791 1.118 . . . 1.0 . . . . . . . . . . . . A . 5 CYS CA . . . . . . . . . c30225_5ug3 1 . 14 . 3780 . 1 1 5 CYS CB C -0.499 0.611 1.703 . . . 1.0 . . . . . . . . . . . . A . 5 CYS CB . . . . . . . . . c30225_5ug3 1 . 14 . 3781 . 1 1 5 CYS H H -2.969 0.576 1.320 . . . 1.0 . . . . . . . . . . . . A . 5 CYS H . . . . . . . . . c30225_5ug3 1 . 14 . 3782 . 1 1 5 CYS HA H -1.150 2.639 1.776 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HA . . . . . . . . . c30225_5ug3 1 . 14 . 3783 . 1 1 5 CYS HB2 H -0.919 -0.306 1.318 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HB2 . . . . . . . . . c30225_5ug3 1 . 14 . 3784 . 1 1 5 CYS HB3 H 0.526 0.679 1.399 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HB3 . . . . . . . . . c30225_5ug3 1 . 14 . 3785 . 1 1 5 CYS N N -2.682 1.473 1.052 . . . 1.0 . . . . . . . . . . . . A . 5 CYS N . . . . . . . . . c30225_5ug3 1 . 14 . 3786 . 1 1 5 CYS O O 0.446 2.583 -0.356 . . . 1.0 . . . . . . . . . . . . A . 5 CYS O . . . . . . . . . c30225_5ug3 1 . 14 . 3787 . 1 1 5 CYS SG S -0.543 0.517 3.519 . . . 1.0 . . . . . . . . . . . . A . 5 CYS SG . . . . . . . . . c30225_5ug3 1 . 14 . 3788 . 1 1 6 CYS C C -0.999 3.876 -2.742 . . . 1.0 . . . . . . . . . . . . A . 6 CYS C . . . . . . . . . c30225_5ug3 1 . 14 . 3789 . 1 1 6 CYS CA C -1.062 2.356 -2.632 . . . 1.0 . . . . . . . . . . . . A . 6 CYS CA . . . . . . . . . c30225_5ug3 1 . 14 . 3790 . 1 1 6 CYS CB C -2.031 1.805 -3.669 . . . 1.0 . . . . . . . . . . . . A . 6 CYS CB . . . . . . . . . c30225_5ug3 1 . 14 . 3791 . 1 1 6 CYS H H -2.365 1.550 -1.173 . . . 1.0 . . . . . . . . . . . . A . 6 CYS H . . . . . . . . . c30225_5ug3 1 . 14 . 3792 . 1 1 6 CYS HA H -0.074 1.948 -2.808 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HA . . . . . . . . . c30225_5ug3 1 . 14 . 3793 . 1 1 6 CYS HB2 H -2.184 0.752 -3.486 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HB2 . . . . . . . . . c30225_5ug3 1 . 14 . 3794 . 1 1 6 CYS HB3 H -2.973 2.326 -3.567 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HB3 . . . . . . . . . c30225_5ug3 1 . 14 . 3795 . 1 1 6 CYS N N -1.480 1.966 -1.298 . . . 1.0 . . . . . . . . . . . . A . 6 CYS N . . . . . . . . . c30225_5ug3 1 . 14 . 3796 . 1 1 6 CYS O O -0.146 4.426 -3.437 . . . 1.0 . . . . . . . . . . . . A . 6 CYS O . . . . . . . . . c30225_5ug3 1 . 14 . 3797 . 1 1 6 CYS SG S -1.460 2.000 -5.387 . . . 1.0 . . . . . . . . . . . . A . 6 CYS SG . . . . . . . . . c30225_5ug3 1 . 14 . 3798 . 1 1 7 SER C C -0.954 6.537 -0.978 . . . 1.0 . . . . . . . . . . . . A . 7 SER C . . . . . . . . . c30225_5ug3 1 . 14 . 3799 . 1 1 7 SER CA C -1.932 6.004 -2.016 . . . 1.0 . . . . . . . . . . . . A . 7 SER CA . . . . . . . . . c30225_5ug3 1 . 14 . 3800 . 1 1 7 SER CB C -3.350 6.488 -1.711 . . . 1.0 . . . . . . . . . . . . A . 7 SER CB . . . . . . . . . c30225_5ug3 1 . 14 . 3801 . 1 1 7 SER H H -2.541 4.053 -1.477 . . . 1.0 . . . . . . . . . . . . A . 7 SER H . . . . . . . . . c30225_5ug3 1 . 14 . 3802 . 1 1 7 SER HA H -1.636 6.355 -2.993 . . . 1.0 . . . . . . . . . . . . A . 7 SER HA . . . . . . . . . c30225_5ug3 1 . 14 . 3803 . 1 1 7 SER HB2 H -3.614 6.213 -0.700 . . . 1.0 . . . . . . . . . . . . A . 7 SER HB2 . . . . . . . . . c30225_5ug3 1 . 14 . 3804 . 1 1 7 SER HB3 H -3.394 7.561 -1.816 . . . 1.0 . . . . . . . . . . . . A . 7 SER HB3 . . . . . . . . . c30225_5ug3 1 . 14 . 3805 . 1 1 7 SER HG H -3.838 5.681 -3.432 . . . 1.0 . . . . . . . . . . . . A . 7 SER HG . . . . . . . . . c30225_5ug3 1 . 14 . 3806 . 1 1 7 SER N N -1.894 4.548 -2.025 . . . 1.0 . . . . . . . . . . . . A . 7 SER N . . . . . . . . . c30225_5ug3 1 . 14 . 3807 . 1 1 7 SER O O -0.818 7.743 -0.778 . . . 1.0 . . . . . . . . . . . . A . 7 SER O . . . . . . . . . c30225_5ug3 1 . 14 . 3808 . 1 1 7 SER OG O -4.284 5.902 -2.602 . . . 1.0 . . . . . . . . . . . . A . 7 SER OG . . . . . . . . . c30225_5ug3 1 . 14 . 3809 . 1 1 8 ASN C C 2.050 5.383 0.261 . . . 1.0 . . . . . . . . . . . . A . 8 ASN C . . . . . . . . . c30225_5ug3 1 . 14 . 3810 . 1 1 8 ASN CA C 0.705 5.915 0.695 . . . 1.0 . . . . . . . . . . . . A . 8 ASN CA . . . . . . . . . c30225_5ug3 1 . 14 . 3811 . 1 1 8 ASN CB C 0.318 5.252 2.011 . . . 1.0 . . . . . . . . . . . . A . 8 ASN CB . . . . . . . . . c30225_5ug3 1 . 14 . 3812 . 1 1 8 ASN CG C -0.991 5.763 2.563 . . . 1.0 . . . . . . . . . . . . A . 8 ASN CG . . . . . . . . . c30225_5ug3 1 . 14 . 3813 . 1 1 8 ASN H H -0.420 4.669 -0.571 . . . 1.0 . . . . . . . . . . . . A . 8 ASN H . . . . . . . . . c30225_5ug3 1 . 14 . 3814 . 1 1 8 ASN HA H 0.753 6.985 0.821 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HA . . . . . . . . . c30225_5ug3 1 . 14 . 3815 . 1 1 8 ASN HB2 H 0.226 4.190 1.843 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HB2 . . . . . . . . . c30225_5ug3 1 . 14 . 3816 . 1 1 8 ASN HB3 H 1.093 5.432 2.741 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HB3 . . . . . . . . . c30225_5ug3 1 . 14 . 3817 . 1 1 8 ASN HD21 H -1.967 4.571 1.321 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HD21 . . . . . . . . . c30225_5ug3 1 . 14 . 3818 . 1 1 8 ASN HD22 H -2.952 5.548 2.359 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HD22 . . . . . . . . . c30225_5ug3 1 . 14 . 3819 . 1 1 8 ASN N N -0.273 5.606 -0.332 . . . 1.0 . . . . . . . . . . . . A . 8 ASN N . . . . . . . . . c30225_5ug3 1 . 14 . 3820 . 1 1 8 ASN ND2 N -2.078 5.242 2.032 . . . 1.0 . . . . . . . . . . . . A . 8 ASN ND2 . . . . . . . . . c30225_5ug3 1 . 14 . 3821 . 1 1 8 ASN O O 2.384 4.231 0.549 . . . 1.0 . . . . . . . . . . . . A . 8 ASN O . . . . . . . . . c30225_5ug3 1 . 14 . 3822 . 1 1 8 ASN OD1 O -1.025 6.635 3.432 . . . 1.0 . . . . . . . . . . . . A . 8 ASN OD1 . . . . . . . . . c30225_5ug3 1 . 14 . 3823 . 1 1 9 PRO C C 5.046 5.164 0.041 . . . 1.0 . . . . . . . . . . . . A . 9 PRO C . . . . . . . . . c30225_5ug3 1 . 14 . 3824 . 1 1 9 PRO CA C 4.107 5.743 -1.008 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CA . . . . . . . . . c30225_5ug3 1 . 14 . 3825 . 1 1 9 PRO CB C 4.695 7.010 -1.641 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CB . . . . . . . . . c30225_5ug3 1 . 14 . 3826 . 1 1 9 PRO CD C 2.595 7.616 -0.724 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CD . . . . . . . . . c30225_5ug3 1 . 14 . 3827 . 1 1 9 PRO CG C 3.972 8.136 -0.994 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CG . . . . . . . . . c30225_5ug3 1 . 14 . 3828 . 1 1 9 PRO HA H 3.937 4.997 -1.772 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HA . . . . . . . . . c30225_5ug3 1 . 14 . 3829 . 1 1 9 PRO HB2 H 5.754 7.055 -1.449 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HB2 . . . . . . . . . c30225_5ug3 1 . 14 . 3830 . 1 1 9 PRO HB3 H 4.515 6.995 -2.702 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HB3 . . . . . . . . . c30225_5ug3 1 . 14 . 3831 . 1 1 9 PRO HD2 H 2.167 8.115 0.125 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HD2 . . . . . . . . . c30225_5ug3 1 . 14 . 3832 . 1 1 9 PRO HD3 H 1.966 7.731 -1.594 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HD3 . . . . . . . . . c30225_5ug3 1 . 14 . 3833 . 1 1 9 PRO HG2 H 4.462 8.408 -0.070 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HG2 . . . . . . . . . c30225_5ug3 1 . 14 . 3834 . 1 1 9 PRO HG3 H 3.930 8.982 -1.663 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HG3 . . . . . . . . . c30225_5ug3 1 . 14 . 3835 . 1 1 9 PRO N N 2.843 6.195 -0.437 . . . 1.0 . . . . . . . . . . . . A . 9 PRO N . . . . . . . . . c30225_5ug3 1 . 14 . 3836 . 1 1 9 PRO O O 5.896 4.344 -0.274 . . . 1.0 . . . . . . . . . . . . A . 9 PRO O . . . . . . . . . c30225_5ug3 1 . 14 . 3837 . 1 1 10 VAL C C 5.343 3.668 2.796 . . . 1.0 . . . . . . . . . . . . A . 10 VAL C . . . . . . . . . c30225_5ug3 1 . 14 . 3838 . 1 1 10 VAL CA C 5.726 5.081 2.366 . . . 1.0 . . . . . . . . . . . . A . 10 VAL CA . . . . . . . . . c30225_5ug3 1 . 14 . 3839 . 1 1 10 VAL CB C 5.689 6.034 3.582 . . . 1.0 . . . . . . . . . . . . A . 10 VAL CB . . . . . . . . . c30225_5ug3 1 . 14 . 3840 . 1 1 10 VAL CG1 C 6.620 5.550 4.686 . . . 1.0 . . . . . . . . . . . . A . 10 VAL CG1 . . . . . . . . . c30225_5ug3 1 . 14 . 3841 . 1 1 10 VAL CG2 C 6.060 7.448 3.161 . . . 1.0 . . . . . . . . . . . . A . 10 VAL CG2 . . . . . . . . . c30225_5ug3 1 . 14 . 3842 . 1 1 10 VAL H H 4.060 6.099 1.514 . . . 1.0 . . . . . . . . . . . . A . 10 VAL H . . . . . . . . . c30225_5ug3 1 . 14 . 3843 . 1 1 10 VAL HA H 6.734 5.063 1.975 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HA . . . . . . . . . c30225_5ug3 1 . 14 . 3844 . 1 1 10 VAL HB H 4.682 6.050 3.974 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HB . . . . . . . . . c30225_5ug3 1 . 14 . 3845 . 1 1 10 VAL HG11 H 6.572 6.229 5.524 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HG11 . . . . . . . . . c30225_5ug3 1 . 14 . 3846 . 1 1 10 VAL HG12 H 7.632 5.511 4.311 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HG12 . . . . . . . . . c30225_5ug3 1 . 14 . 3847 . 1 1 10 VAL HG13 H 6.317 4.563 5.006 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HG13 . . . . . . . . . c30225_5ug3 1 . 14 . 3848 . 1 1 10 VAL HG21 H 7.064 7.454 2.765 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HG21 . . . . . . . . . c30225_5ug3 1 . 14 . 3849 . 1 1 10 VAL HG22 H 6.006 8.103 4.015 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HG22 . . . . . . . . . c30225_5ug3 1 . 14 . 3850 . 1 1 10 VAL HG23 H 5.373 7.789 2.402 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HG23 . . . . . . . . . c30225_5ug3 1 . 14 . 3851 . 1 1 10 VAL N N 4.843 5.536 1.298 . . . 1.0 . . . . . . . . . . . . A . 10 VAL N . . . . . . . . . c30225_5ug3 1 . 14 . 3852 . 1 1 10 VAL O O 6.192 2.855 3.168 . . . 1.0 . . . . . . . . . . . . A . 10 VAL O . . . . . . . . . c30225_5ug3 1 . 14 . 3853 . 1 1 11 CYS C C 3.923 1.031 1.977 . . . 1.0 . . . . . . . . . . . . A . 11 CYS C . . . . . . . . . c30225_5ug3 1 . 14 . 3854 . 1 1 11 CYS CA C 3.589 2.041 3.074 . . . 1.0 . . . . . . . . . . . . A . 11 CYS CA . . . . . . . . . c30225_5ug3 1 . 14 . 3855 . 1 1 11 CYS CB C 2.079 2.061 3.346 . . . 1.0 . . . . . . . . . . . . A . 11 CYS CB . . . . . . . . . c30225_5ug3 1 . 14 . 3856 . 1 1 11 CYS H H 3.426 4.032 2.380 . . . 1.0 . . . . . . . . . . . . A . 11 CYS H . . . . . . . . . c30225_5ug3 1 . 14 . 3857 . 1 1 11 CYS HA H 4.102 1.751 3.978 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HA . . . . . . . . . c30225_5ug3 1 . 14 . 3858 . 1 1 11 CYS HB2 H 1.859 2.850 4.050 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HB2 . . . . . . . . . c30225_5ug3 1 . 14 . 3859 . 1 1 11 CYS HB3 H 1.558 2.258 2.421 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HB3 . . . . . . . . . c30225_5ug3 1 . 14 . 3860 . 1 1 11 CYS N N 4.063 3.360 2.704 . . . 1.0 . . . . . . . . . . . . A . 11 CYS N . . . . . . . . . c30225_5ug3 1 . 14 . 3861 . 1 1 11 CYS O O 4.207 -0.133 2.259 . . . 1.0 . . . . . . . . . . . . A . 11 CYS O . . . . . . . . . c30225_5ug3 1 . 14 . 3862 . 1 1 11 CYS SG S 1.420 0.503 4.035 . . . 1.0 . . . . . . . . . . . . A . 11 CYS SG . . . . . . . . . c30225_5ug3 1 . 14 . 3863 . 1 1 12 ARG C C 5.610 0.274 -0.660 . . . 1.0 . . . . . . . . . . . . A . 12 ARG C . . . . . . . . . c30225_5ug3 1 . 14 . 3864 . 1 1 12 ARG CA C 4.139 0.556 -0.385 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CA . . . . . . . . . c30225_5ug3 1 . 14 . 3865 . 1 1 12 ARG CB C 3.425 1.023 -1.648 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CB . . . . . . . . . c30225_5ug3 1 . 14 . 3866 . 1 1 12 ARG CD C 2.834 2.952 -3.120 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CD . . . . . . . . . c30225_5ug3 1 . 14 . 3867 . 1 1 12 ARG CG C 3.718 2.451 -1.991 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CG . . . . . . . . . c30225_5ug3 1 . 14 . 3868 . 1 1 12 ARG CZ C 2.749 2.430 -5.536 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CZ . . . . . . . . . c30225_5ug3 1 . 14 . 3869 . 1 1 12 ARG H H 3.756 2.427 0.542 . . . 1.0 . . . . . . . . . . . . A . 12 ARG H . . . . . . . . . c30225_5ug3 1 . 14 . 3870 . 1 1 12 ARG HA H 3.703 -0.352 -0.084 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HA . . . . . . . . . c30225_5ug3 1 . 14 . 3871 . 1 1 12 ARG HB2 H 3.738 0.409 -2.475 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HB2 . . . . . . . . . c30225_5ug3 1 . 14 . 3872 . 1 1 12 ARG HB3 H 2.359 0.917 -1.510 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HB3 . . . . . . . . . c30225_5ug3 1 . 14 . 3873 . 1 1 12 ARG HD2 H 1.829 3.056 -2.743 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HD2 . . . . . . . . . c30225_5ug3 1 . 14 . 3874 . 1 1 12 ARG HD3 H 3.198 3.916 -3.444 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HD3 . . . . . . . . . c30225_5ug3 1 . 14 . 3875 . 1 1 12 ARG HE H 2.855 1.070 -4.074 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HE . . . . . . . . . c30225_5ug3 1 . 14 . 3876 . 1 1 12 ARG HG2 H 3.534 3.036 -1.110 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HG2 . . . . . . . . . c30225_5ug3 1 . 14 . 3877 . 1 1 12 ARG HG3 H 4.754 2.538 -2.281 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HG3 . . . . . . . . . c30225_5ug3 1 . 14 . 3878 . 1 1 12 ARG HH11 H 2.777 4.413 -5.125 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH11 . . . . . . . . . c30225_5ug3 1 . 14 . 3879 . 1 1 12 ARG HH12 H 2.679 4.004 -6.807 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH12 . . . . . . . . . c30225_5ug3 1 . 14 . 3880 . 1 1 12 ARG HH21 H 2.720 0.544 -6.270 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH21 . . . . . . . . . c30225_5ug3 1 . 14 . 3881 . 1 1 12 ARG HH22 H 2.649 1.809 -7.462 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH22 . . . . . . . . . c30225_5ug3 1 . 14 . 3882 . 1 1 12 ARG N N 3.921 1.476 0.722 . . . 1.0 . . . . . . . . . . . . A . 12 ARG N . . . . . . . . . c30225_5ug3 1 . 14 . 3883 . 1 1 12 ARG NE N 2.822 2.037 -4.266 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NE . . . . . . . . . c30225_5ug3 1 . 14 . 3884 . 1 1 12 ARG NH1 N 2.733 3.717 -5.845 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NH1 . . . . . . . . . c30225_5ug3 1 . 14 . 3885 . 1 1 12 ARG NH2 N 2.702 1.524 -6.500 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NH2 . . . . . . . . . c30225_5ug3 1 . 14 . 3886 . 1 1 12 ARG O O 5.943 -0.744 -1.262 . . . 1.0 . . . . . . . . . . . . A . 12 ARG O . . . . . . . . . c30225_5ug3 1 . 14 . 3887 . 1 1 13 VAL C C 8.436 -0.139 0.547 . . . 1.0 . . . . . . . . . . . . A . 13 VAL C . . . . . . . . . c30225_5ug3 1 . 14 . 3888 . 1 1 13 VAL CA C 7.914 0.949 -0.387 . . . 1.0 . . . . . . . . . . . . A . 13 VAL CA . . . . . . . . . c30225_5ug3 1 . 14 . 3889 . 1 1 13 VAL CB C 8.690 2.246 -0.138 . . . 1.0 . . . . . . . . . . . . A . 13 VAL CB . . . . . . . . . c30225_5ug3 1 . 14 . 3890 . 1 1 13 VAL CG1 C 8.431 3.246 -1.246 . . . 1.0 . . . . . . . . . . . . A . 13 VAL CG1 . . . . . . . . . c30225_5ug3 1 . 14 . 3891 . 1 1 13 VAL CG2 C 8.319 2.827 1.208 . . . 1.0 . . . . . . . . . . . . A . 13 VAL CG2 . . . . . . . . . c30225_5ug3 1 . 14 . 3892 . 1 1 13 VAL H H 6.176 1.982 0.194 . . . 1.0 . . . . . . . . . . . . A . 13 VAL H . . . . . . . . . c30225_5ug3 1 . 14 . 3893 . 1 1 13 VAL HA H 8.087 0.644 -1.409 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HA . . . . . . . . . c30225_5ug3 1 . 14 . 3894 . 1 1 13 VAL HB H 9.733 2.016 -0.127 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HB . . . . . . . . . c30225_5ug3 1 . 14 . 3895 . 1 1 13 VAL HG11 H 8.741 2.829 -2.190 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HG11 . . . . . . . . . c30225_5ug3 1 . 14 . 3896 . 1 1 13 VAL HG12 H 8.986 4.151 -1.050 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HG12 . . . . . . . . . c30225_5ug3 1 . 14 . 3897 . 1 1 13 VAL HG13 H 7.376 3.472 -1.279 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HG13 . . . . . . . . . c30225_5ug3 1 . 14 . 3898 . 1 1 13 VAL HG21 H 8.741 2.217 1.991 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HG21 . . . . . . . . . c30225_5ug3 1 . 14 . 3899 . 1 1 13 VAL HG22 H 7.237 2.830 1.306 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HG22 . . . . . . . . . c30225_5ug3 1 . 14 . 3900 . 1 1 13 VAL HG23 H 8.694 3.834 1.287 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HG23 . . . . . . . . . c30225_5ug3 1 . 14 . 3901 . 1 1 13 VAL N N 6.488 1.159 -0.224 . . . 1.0 . . . . . . . . . . . . A . 13 VAL N . . . . . . . . . c30225_5ug3 1 . 14 . 3902 . 1 1 13 VAL O O 9.328 -0.901 0.179 . . . 1.0 . . . . . . . . . . . . A . 13 VAL O . . . . . . . . . c30225_5ug3 1 . 14 . 3903 . 1 1 14 ASN C C 7.534 -2.525 2.506 . . . 1.0 . . . . . . . . . . . . A . 14 ASN C . . . . . . . . . c30225_5ug3 1 . 14 . 3904 . 1 1 14 ASN CA C 8.324 -1.241 2.708 . . . 1.0 . . . . . . . . . . . . A . 14 ASN CA . . . . . . . . . c30225_5ug3 1 . 14 . 3905 . 1 1 14 ASN CB C 8.173 -0.764 4.155 . . . 1.0 . . . . . . . . . . . . A . 14 ASN CB . . . . . . . . . c30225_5ug3 1 . 14 . 3906 . 1 1 14 ASN CG C 6.727 -0.694 4.602 . . . 1.0 . . . . . . . . . . . . A . 14 ASN CG . . . . . . . . . c30225_5ug3 1 . 14 . 3907 . 1 1 14 ASN H H 7.201 0.439 2.025 . . . 1.0 . . . . . . . . . . . . A . 14 ASN H . . . . . . . . . c30225_5ug3 1 . 14 . 3908 . 1 1 14 ASN HA H 9.366 -1.445 2.515 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HA . . . . . . . . . c30225_5ug3 1 . 14 . 3909 . 1 1 14 ASN HB2 H 8.693 -1.449 4.804 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HB2 . . . . . . . . . c30225_5ug3 1 . 14 . 3910 . 1 1 14 ASN HB3 H 8.609 0.220 4.253 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HB3 . . . . . . . . . c30225_5ug3 1 . 14 . 3911 . 1 1 14 ASN HD21 H 6.624 1.226 4.101 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HD21 . . . . . . . . . c30225_5ug3 1 . 14 . 3912 . 1 1 14 ASN HD22 H 5.178 0.525 4.733 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HD22 . . . . . . . . . c30225_5ug3 1 . 14 . 3913 . 1 1 14 ASN N N 7.890 -0.215 1.758 . . . 1.0 . . . . . . . . . . . . A . 14 ASN N . . . . . . . . . c30225_5ug3 1 . 14 . 3914 . 1 1 14 ASN ND2 N 6.117 0.468 4.469 . . . 1.0 . . . . . . . . . . . . A . 14 ASN ND2 . . . . . . . . . c30225_5ug3 1 . 14 . 3915 . 1 1 14 ASN O O 7.868 -3.570 3.065 . . . 1.0 . . . . . . . . . . . . A . 14 ASN O . . . . . . . . . c30225_5ug3 1 . 14 . 3916 . 1 1 14 ASN OD1 O 6.168 -1.678 5.081 . . . 1.0 . . . . . . . . . . . . A . 14 ASN OD1 . . . . . . . . . c30225_5ug3 1 . 14 . 3917 . 1 1 15 ASN C C 5.332 -3.627 -0.076 . . . 1.0 . . . . . . . . . . . . A . 15 ASN C . . . . . . . . . c30225_5ug3 1 . 14 . 3918 . 1 1 15 ASN CA C 5.632 -3.575 1.417 . . . 1.0 . . . . . . . . . . . . A . 15 ASN CA . . . . . . . . . c30225_5ug3 1 . 14 . 3919 . 1 1 15 ASN CB C 4.338 -3.449 2.210 . . . 1.0 . . . . . . . . . . . . A . 15 ASN CB . . . . . . . . . c30225_5ug3 1 . 14 . 3920 . 1 1 15 ASN CG C 3.393 -4.613 1.992 . . . 1.0 . . . . . . . . . . . . A . 15 ASN CG . . . . . . . . . c30225_5ug3 1 . 14 . 3921 . 1 1 15 ASN H H 6.297 -1.584 1.263 . . . 1.0 . . . . . . . . . . . . A . 15 ASN H . . . . . . . . . c30225_5ug3 1 . 14 . 3922 . 1 1 15 ASN HA H 6.153 -4.472 1.712 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HA . . . . . . . . . c30225_5ug3 1 . 14 . 3923 . 1 1 15 ASN HB2 H 4.566 -3.383 3.264 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HB2 . . . . . . . . . c30225_5ug3 1 . 14 . 3924 . 1 1 15 ASN HB3 H 3.842 -2.548 1.899 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HB3 . . . . . . . . . c30225_5ug3 1 . 14 . 3925 . 1 1 15 ASN HD21 H 1.840 -3.433 2.352 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HD21 . . . . . . . . . c30225_5ug3 1 . 14 . 3926 . 1 1 15 ASN HD22 H 1.466 -5.081 1.994 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HD22 . . . . . . . . . c30225_5ug3 1 . 14 . 3927 . 1 1 15 ASN N N 6.493 -2.439 1.695 . . . 1.0 . . . . . . . . . . . . A . 15 ASN N . . . . . . . . . c30225_5ug3 1 . 14 . 3928 . 1 1 15 ASN ND2 N 2.104 -4.350 2.124 . . . 1.0 . . . . . . . . . . . . A . 15 ASN ND2 . . . . . . . . . c30225_5ug3 1 . 14 . 3929 . 1 1 15 ASN O O 4.270 -3.205 -0.528 . . . 1.0 . . . . . . . . . . . . A . 15 ASN O . . . . . . . . . c30225_5ug3 1 . 14 . 3930 . 1 1 15 ASN OD1 O 3.814 -5.737 1.706 . . . 1.0 . . . . . . . . . . . . A . 15 ASN OD1 . . . . . . . . . c30225_5ug3 1 . 14 . 3931 . 1 1 16 HYP C C 5.380 -5.134 -2.996 . . . 1.0 . . . . . . . . . . . . A . 16 HYP C . . . . . . . . . c30225_5ug3 1 . 14 . 3932 . 1 1 16 HYP CA C 6.257 -4.081 -2.330 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CA . . . . . . . . . c30225_5ug3 1 . 14 . 3933 . 1 1 16 HYP CB C 7.718 -4.325 -2.642 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CB . . . . . . . . . c30225_5ug3 1 . 14 . 3934 . 1 1 16 HYP CD C 7.473 -4.868 -0.346 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CD . . . . . . . . . c30225_5ug3 1 . 14 . 3935 . 1 1 16 HYP CG C 8.505 -4.569 -1.375 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CG . . . . . . . . . c30225_5ug3 1 . 14 . 3936 . 1 1 16 HYP HA H 5.974 -3.099 -2.677 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HA . . . . . . . . . c30225_5ug3 1 . 14 . 3937 . 1 1 16 HYP HB2 H 8.126 -3.463 -3.143 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HB2 . . . . . . . . . c30225_5ug3 1 . 14 . 3938 . 1 1 16 HYP HB3 H 7.803 -5.190 -3.288 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HB3 . . . . . . . . . c30225_5ug3 1 . 14 . 3939 . 1 1 16 HYP HD1 H 8.680 -3.104 -0.142 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HD1 . . . . . . . . . c30225_5ug3 1 . 14 . 3940 . 1 1 16 HYP HD22 H 7.304 -5.907 -0.277 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HD22 . . . . . . . . . c30225_5ug3 1 . 14 . 3941 . 1 1 16 HYP HD23 H 7.773 -4.471 0.610 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HD23 . . . . . . . . . c30225_5ug3 1 . 14 . 3942 . 1 1 16 HYP HG H 9.214 -5.375 -1.499 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HG . . . . . . . . . c30225_5ug3 1 . 14 . 3943 . 1 1 16 HYP N N 6.278 -4.154 -0.853 . . . 1.0 . . . . . . . . . . . . A . 16 HYP N . . . . . . . . . c30225_5ug3 1 . 14 . 3944 . 1 1 16 HYP O O 5.740 -5.685 -4.037 . . . 1.0 . . . . . . . . . . . . A . 16 HYP O . . . . . . . . . c30225_5ug3 1 . 14 . 3945 . 1 1 16 HYP OD1 O 9.150 -3.395 -0.942 . . . 1.0 . . . . . . . . . . . . A . 16 HYP OD1 . . . . . . . . . c30225_5ug3 1 . 14 . 3946 . 1 1 17 HIS C C 1.857 -5.937 -2.689 . . . 1.0 . . . . . . . . . . . . A . 17 HIS C . . . . . . . . . c30225_5ug3 1 . 14 . 3947 . 1 1 17 HIS CA C 3.291 -6.339 -3.017 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CA . . . . . . . . . c30225_5ug3 1 . 14 . 3948 . 1 1 17 HIS CB C 3.567 -7.776 -2.566 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CB . . . . . . . . . c30225_5ug3 1 . 14 . 3949 . 1 1 17 HIS CD2 C 3.329 -9.043 -4.815 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CD2 . . . . . . . . . c30225_5ug3 1 . 14 . 3950 . 1 1 17 HIS CE1 C 1.829 -10.515 -4.204 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CE1 . . . . . . . . . c30225_5ug3 1 . 14 . 3951 . 1 1 17 HIS CG C 3.035 -8.809 -3.514 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CG . . . . . . . . . c30225_5ug3 1 . 14 . 3952 . 1 1 17 HIS H H 4.018 -4.999 -1.545 . . . 1.0 . . . . . . . . . . . . A . 17 HIS H . . . . . . . . . c30225_5ug3 1 . 14 . 3953 . 1 1 17 HIS HA H 3.426 -6.279 -4.087 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HA . . . . . . . . . c30225_5ug3 1 . 14 . 3954 . 1 1 17 HIS HB2 H 4.633 -7.921 -2.480 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HB2 . . . . . . . . . c30225_5ug3 1 . 14 . 3955 . 1 1 17 HIS HB3 H 3.107 -7.941 -1.603 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HB3 . . . . . . . . . c30225_5ug3 1 . 14 . 3956 . 1 1 17 HIS HD1 H 1.674 -9.837 -2.277 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HD1 . . . . . . . . . c30225_5ug3 1 . 14 . 3957 . 1 1 17 HIS HD2 H 4.035 -8.493 -5.422 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HD2 . . . . . . . . . c30225_5ug3 1 . 14 . 3958 . 1 1 17 HIS HE1 H 1.125 -11.335 -4.222 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HE1 . . . . . . . . . c30225_5ug3 1 . 14 . 3959 . 1 1 17 HIS HE2 H 2.691 -10.606 -6.057 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HE2 . . . . . . . . . c30225_5ug3 1 . 14 . 3960 . 1 1 17 HIS N N 4.232 -5.417 -2.405 . . . 1.0 . . . . . . . . . . . . A . 17 HIS N . . . . . . . . . c30225_5ug3 1 . 14 . 3961 . 1 1 17 HIS ND1 N 2.090 -9.746 -3.163 . . . 1.0 . . . . . . . . . . . . A . 17 HIS ND1 . . . . . . . . . c30225_5ug3 1 . 14 . 3962 . 1 1 17 HIS NE2 N 2.565 -10.108 -5.219 . . . 1.0 . . . . . . . . . . . . A . 17 HIS NE2 . . . . . . . . . c30225_5ug3 1 . 14 . 3963 . 1 1 17 HIS O O 0.917 -6.701 -2.910 . . . 1.0 . . . . . . . . . . . . A . 17 HIS O . . . . . . . . . c30225_5ug3 1 . 14 . 3964 . 1 1 18 VAL C C -0.143 -3.382 -3.064 . . . 1.0 . . . . . . . . . . . . A . 18 VAL C . . . . . . . . . c30225_5ug3 1 . 14 . 3965 . 1 1 18 VAL CA C 0.361 -4.212 -1.882 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CA . . . . . . . . . c30225_5ug3 1 . 14 . 3966 . 1 1 18 VAL CB C 0.339 -3.375 -0.576 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CB . . . . . . . . . c30225_5ug3 1 . 14 . 3967 . 1 1 18 VAL CG1 C 1.174 -2.109 -0.704 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CG1 . . . . . . . . . c30225_5ug3 1 . 14 . 3968 . 1 1 18 VAL CG2 C -1.088 -3.040 -0.170 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CG2 . . . . . . . . . c30225_5ug3 1 . 14 . 3969 . 1 1 18 VAL H H 2.474 -4.164 -1.993 . . . 1.0 . . . . . . . . . . . . A . 18 VAL H . . . . . . . . . c30225_5ug3 1 . 14 . 3970 . 1 1 18 VAL HA H -0.297 -5.061 -1.752 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HA . . . . . . . . . c30225_5ug3 1 . 14 . 3971 . 1 1 18 VAL HB H 0.773 -3.976 0.210 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HB . . . . . . . . . c30225_5ug3 1 . 14 . 3972 . 1 1 18 VAL HG11 H 1.102 -1.537 0.208 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG11 . . . . . . . . . c30225_5ug3 1 . 14 . 3973 . 1 1 18 VAL HG12 H 0.808 -1.518 -1.530 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG12 . . . . . . . . . c30225_5ug3 1 . 14 . 3974 . 1 1 18 VAL HG13 H 2.205 -2.374 -0.881 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG13 . . . . . . . . . c30225_5ug3 1 . 14 . 3975 . 1 1 18 VAL HG21 H -1.645 -3.953 -0.023 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG21 . . . . . . . . . c30225_5ug3 1 . 14 . 3976 . 1 1 18 VAL HG22 H -1.555 -2.456 -0.948 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG22 . . . . . . . . . c30225_5ug3 1 . 14 . 3977 . 1 1 18 VAL HG23 H -1.077 -2.472 0.748 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG23 . . . . . . . . . c30225_5ug3 1 . 14 . 3978 . 1 1 18 VAL N N 1.690 -4.726 -2.174 . . . 1.0 . . . . . . . . . . . . A . 18 VAL N . . . . . . . . . c30225_5ug3 1 . 14 . 3979 . 1 1 18 VAL O O -1.340 -3.345 -3.350 . . . 1.0 . . . . . . . . . . . . A . 18 VAL O . . . . . . . . . c30225_5ug3 1 . 14 . 3980 . 1 1 19 CYS C C 1.792 -1.505 -5.592 . . . 1.0 . . . . . . . . . . . . A . 19 CYS C . . . . . . . . . c30225_5ug3 1 . 14 . 3981 . 1 1 19 CYS CA C 0.489 -1.950 -4.938 . . . 1.0 . . . . . . . . . . . . A . 19 CYS CA . . . . . . . . . c30225_5ug3 1 . 14 . 3982 . 1 1 19 CYS CB C -0.365 -0.732 -4.574 . . . 1.0 . . . . . . . . . . . . A . 19 CYS CB . . . . . . . . . c30225_5ug3 1 . 14 . 3983 . 1 1 19 CYS H H 1.728 -2.829 -3.479 . . . 1.0 . . . . . . . . . . . . A . 19 CYS H . . . . . . . . . c30225_5ug3 1 . 14 . 3984 . 1 1 19 CYS HA H -0.056 -2.573 -5.634 . . . 1.0 . . . . . . . . . . . . A . 19 CYS HA . . . . . . . . . c30225_5ug3 1 . 14 . 3985 . 1 1 19 CYS HB2 H -1.160 -1.044 -3.913 . . . 1.0 . . . . . . . . . . . . A . 19 CYS HB2 . . . . . . . . . c30225_5ug3 1 . 14 . 3986 . 1 1 19 CYS HB3 H 0.254 -0.005 -4.066 . . . 1.0 . . . . . . . . . . . . A . 19 CYS HB3 . . . . . . . . . c30225_5ug3 1 . 14 . 3987 . 1 1 19 CYS N N 0.794 -2.750 -3.763 . . . 1.0 . . . . . . . . . . . . A . 19 CYS N . . . . . . . . . c30225_5ug3 1 . 14 . 3988 . 1 1 19 CYS O O 2.554 -0.743 -4.953 . . . 1.0 . . . . . . . . . . . . A . 19 CYS O . . . . . . . . . c30225_5ug3 1 . 14 . 3989 . 1 1 19 CYS OXT O 2.064 -1.928 -6.729 . . . 1.0 . . . . . . . . . . . . A . 19 CYS OXT . . . . . . . . . c30225_5ug3 1 . 14 . 3990 . 1 1 19 CYS SG S -1.130 0.096 -6.010 . . . 1.0 . . . . . . . . . . . . A . 19 CYS SG . . . . . . . . . c30225_5ug3 1 . 15 . 3991 . 1 1 1 ILE C C -6.253 -2.737 5.186 . . . 1.0 . . . . . . . . . . . . A . 1 ILE C . . . . . . . . . c30225_5ug3 1 . 15 . 3992 . 1 1 1 ILE CA C -5.830 -4.064 5.798 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CA . . . . . . . . . c30225_5ug3 1 . 15 . 3993 . 1 1 1 ILE CB C -4.894 -4.802 4.814 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CB . . . . . . . . . c30225_5ug3 1 . 15 . 3994 . 1 1 1 ILE CD1 C -4.767 -5.824 2.474 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CD1 . . . . . . . . . c30225_5ug3 1 . 15 . 3995 . 1 1 1 ILE CG1 C -5.643 -5.173 3.526 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CG1 . . . . . . . . . c30225_5ug3 1 . 15 . 3996 . 1 1 1 ILE CG2 C -4.305 -6.040 5.475 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CG2 . . . . . . . . . c30225_5ug3 1 . 15 . 3997 . 1 1 1 ILE H1 H -7.605 -4.378 6.827 . . . 1.0 . . . . . . . . . . . . A . 1 ILE H1 . . . . . . . . . c30225_5ug3 1 . 15 . 3998 . 1 1 1 ILE H2 H -6.729 -5.791 6.531 . . . 1.0 . . . . . . . . . . . . A . 1 ILE H2 . . . . . . . . . c30225_5ug3 1 . 15 . 3999 . 1 1 1 ILE H3 H -7.584 -5.049 5.276 . . . 1.0 . . . . . . . . . . . . A . 1 ILE H3 . . . . . . . . . c30225_5ug3 1 . 15 . 4000 . 1 1 1 ILE HA H -5.284 -3.871 6.711 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HA . . . . . . . . . c30225_5ug3 1 . 15 . 4001 . 1 1 1 ILE HB H -4.079 -4.137 4.566 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HB . . . . . . . . . c30225_5ug3 1 . 15 . 4002 . 1 1 1 ILE HD11 H -3.978 -5.143 2.194 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HD11 . . . . . . . . . c30225_5ug3 1 . 15 . 4003 . 1 1 1 ILE HD12 H -5.364 -6.061 1.606 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HD12 . . . . . . . . . c30225_5ug3 1 . 15 . 4004 . 1 1 1 ILE HD13 H -4.337 -6.730 2.874 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HD13 . . . . . . . . . c30225_5ug3 1 . 15 . 4005 . 1 1 1 ILE HG12 H -6.436 -5.864 3.765 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG12 . . . . . . . . . c30225_5ug3 1 . 15 . 4006 . 1 1 1 ILE HG13 H -6.069 -4.279 3.096 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG13 . . . . . . . . . c30225_5ug3 1 . 15 . 4007 . 1 1 1 ILE HG21 H -5.103 -6.703 5.775 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG21 . . . . . . . . . c30225_5ug3 1 . 15 . 4008 . 1 1 1 ILE HG22 H -3.735 -5.747 6.345 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG22 . . . . . . . . . c30225_5ug3 1 . 15 . 4009 . 1 1 1 ILE HG23 H -3.659 -6.547 4.776 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG23 . . . . . . . . . c30225_5ug3 1 . 15 . 4010 . 1 1 1 ILE N N -7.019 -4.877 6.132 . . . 1.0 . . . . . . . . . . . . A . 1 ILE N . . . . . . . . . c30225_5ug3 1 . 15 . 4011 . 1 1 1 ILE O O -7.298 -2.650 4.541 . . . 1.0 . . . . . . . . . . . . A . 1 ILE O . . . . . . . . . c30225_5ug3 1 . 15 . 4012 . 1 1 2 ARG C C -5.296 -0.340 3.393 . . . 1.0 . . . . . . . . . . . . A . 2 ARG C . . . . . . . . . c30225_5ug3 1 . 15 . 4013 . 1 1 2 ARG CA C -5.735 -0.395 4.851 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CA . . . . . . . . . c30225_5ug3 1 . 15 . 4014 . 1 1 2 ARG CB C -5.033 0.699 5.658 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CB . . . . . . . . . c30225_5ug3 1 . 15 . 4015 . 1 1 2 ARG CD C -4.702 3.163 6.051 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CD . . . . . . . . . c30225_5ug3 1 . 15 . 4016 . 1 1 2 ARG CG C -5.416 2.105 5.229 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CG . . . . . . . . . c30225_5ug3 1 . 15 . 4017 . 1 1 2 ARG CZ C -4.370 5.606 5.873 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CZ . . . . . . . . . c30225_5ug3 1 . 15 . 4018 . 1 1 2 ARG H H -4.654 -1.822 5.956 . . . 1.0 . . . . . . . . . . . . A . 2 ARG H . . . . . . . . . c30225_5ug3 1 . 15 . 4019 . 1 1 2 ARG HA H -6.798 -0.242 4.902 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HA . . . . . . . . . c30225_5ug3 1 . 15 . 4020 . 1 1 2 ARG HB2 H -5.287 0.582 6.700 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB2 . . . . . . . . . c30225_5ug3 1 . 15 . 4021 . 1 1 2 ARG HB3 H -3.965 0.589 5.542 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB3 . . . . . . . . . c30225_5ug3 1 . 15 . 4022 . 1 1 2 ARG HD2 H -4.931 3.006 7.095 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD2 . . . . . . . . . c30225_5ug3 1 . 15 . 4023 . 1 1 2 ARG HD3 H -3.637 3.063 5.896 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD3 . . . . . . . . . c30225_5ug3 1 . 15 . 4024 . 1 1 2 ARG HE H -6.000 4.613 5.241 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HE . . . . . . . . . c30225_5ug3 1 . 15 . 4025 . 1 1 2 ARG HG2 H -5.153 2.236 4.189 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG2 . . . . . . . . . c30225_5ug3 1 . 15 . 4026 . 1 1 2 ARG HG3 H -6.482 2.228 5.349 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG3 . . . . . . . . . c30225_5ug3 1 . 15 . 4027 . 1 1 2 ARG HH11 H -2.848 4.619 6.778 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH11 . . . . . . . . . c30225_5ug3 1 . 15 . 4028 . 1 1 2 ARG HH12 H -2.629 6.333 6.620 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH12 . . . . . . . . . c30225_5ug3 1 . 15 . 4029 . 1 1 2 ARG HH21 H -5.713 6.869 5.037 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH21 . . . . . . . . . c30225_5ug3 1 . 15 . 4030 . 1 1 2 ARG HH22 H -4.267 7.617 5.634 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH22 . . . . . . . . . c30225_5ug3 1 . 15 . 4031 . 1 1 2 ARG N N -5.452 -1.702 5.406 . . . 1.0 . . . . . . . . . . . . A . 2 ARG N . . . . . . . . . c30225_5ug3 1 . 15 . 4032 . 1 1 2 ARG NE N -5.112 4.514 5.673 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NE . . . . . . . . . c30225_5ug3 1 . 15 . 4033 . 1 1 2 ARG NH1 N -3.189 5.512 6.472 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH1 . . . . . . . . . c30225_5ug3 1 . 15 . 4034 . 1 1 2 ARG NH2 N -4.819 6.792 5.483 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH2 . . . . . . . . . c30225_5ug3 1 . 15 . 4035 . 1 1 2 ARG O O -4.123 -0.109 3.091 . . . 1.0 . . . . . . . . . . . . A . 2 ARG O . . . . . . . . . c30225_5ug3 1 . 15 . 4036 . 1 1 3 ASP C C -5.674 0.789 0.499 . . . 1.0 . . . . . . . . . . . . A . 3 ASP C . . . . . . . . . c30225_5ug3 1 . 15 . 4037 . 1 1 3 ASP CA C -5.952 -0.595 1.059 . . . 1.0 . . . . . . . . . . . . A . 3 ASP CA . . . . . . . . . c30225_5ug3 1 . 15 . 4038 . 1 1 3 ASP CB C -7.096 -1.256 0.284 . . . 1.0 . . . . . . . . . . . . A . 3 ASP CB . . . . . . . . . c30225_5ug3 1 . 15 . 4039 . 1 1 3 ASP CG C -8.401 -0.492 0.393 . . . 1.0 . . . . . . . . . . . . A . 3 ASP CG . . . . . . . . . c30225_5ug3 1 . 15 . 4040 . 1 1 3 ASP H H -7.174 -0.672 2.794 . . . 1.0 . . . . . . . . . . . . A . 3 ASP H . . . . . . . . . c30225_5ug3 1 . 15 . 4041 . 1 1 3 ASP HA H -5.065 -1.184 0.941 . . . 1.0 . . . . . . . . . . . . A . 3 ASP HA . . . . . . . . . c30225_5ug3 1 . 15 . 4042 . 1 1 3 ASP HB2 H -6.824 -1.312 -0.758 . . . 1.0 . . . . . . . . . . . . A . 3 ASP HB2 . . . . . . . . . c30225_5ug3 1 . 15 . 4043 . 1 1 3 ASP HB3 H -7.251 -2.254 0.664 . . . 1.0 . . . . . . . . . . . . A . 3 ASP HB3 . . . . . . . . . c30225_5ug3 1 . 15 . 4044 . 1 1 3 ASP N N -6.246 -0.545 2.490 . . . 1.0 . . . . . . . . . . . . A . 3 ASP N . . . . . . . . . c30225_5ug3 1 . 15 . 4045 . 1 1 3 ASP O O -5.387 0.951 -0.685 . . . 1.0 . . . . . . . . . . . . A . 3 ASP O . . . . . . . . . c30225_5ug3 1 . 15 . 4046 . 1 1 3 ASP OD1 O -9.177 -0.758 1.332 . . . 1.0 . . . . . . . . . . . . A . 3 ASP OD1 . . . . . . . . . c30225_5ug3 1 . 15 . 4047 . 1 1 3 ASP OD2 O -8.654 0.384 -0.461 . . . 1.0 . . . . . . . . . . . . A . 3 ASP OD2 . . . . . . . . . c30225_5ug3 1 . 15 . 4048 . 1 1 4 GLU C C -3.920 3.322 0.848 . . . 1.0 . . . . . . . . . . . . A . 4 GLU C . . . . . . . . . c30225_5ug3 1 . 15 . 4049 . 1 1 4 GLU CA C -5.422 3.149 1.000 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CA . . . . . . . . . c30225_5ug3 1 . 15 . 4050 . 1 1 4 GLU CB C -5.922 4.126 2.058 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CB . . . . . . . . . c30225_5ug3 1 . 15 . 4051 . 1 1 4 GLU CD C -7.840 5.054 3.368 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CD . . . . . . . . . c30225_5ug3 1 . 15 . 4052 . 1 1 4 GLU CG C -7.403 4.024 2.353 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CG . . . . . . . . . c30225_5ug3 1 . 15 . 4053 . 1 1 4 GLU H H -5.991 1.566 2.285 . . . 1.0 . . . . . . . . . . . . A . 4 GLU H . . . . . . . . . c30225_5ug3 1 . 15 . 4054 . 1 1 4 GLU HA H -5.902 3.365 0.058 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HA . . . . . . . . . c30225_5ug3 1 . 15 . 4055 . 1 1 4 GLU HB2 H -5.385 3.945 2.976 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HB2 . . . . . . . . . c30225_5ug3 1 . 15 . 4056 . 1 1 4 GLU HB3 H -5.713 5.132 1.724 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HB3 . . . . . . . . . c30225_5ug3 1 . 15 . 4057 . 1 1 4 GLU HG2 H -7.954 4.182 1.437 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HG2 . . . . . . . . . c30225_5ug3 1 . 15 . 4058 . 1 1 4 GLU HG3 H -7.618 3.040 2.741 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HG3 . . . . . . . . . c30225_5ug3 1 . 15 . 4059 . 1 1 4 GLU N N -5.732 1.774 1.369 . . . 1.0 . . . . . . . . . . . . A . 4 GLU N . . . . . . . . . c30225_5ug3 1 . 15 . 4060 . 1 1 4 GLU O O -3.451 4.306 0.281 . . . 1.0 . . . . . . . . . . . . A . 4 GLU O . . . . . . . . . c30225_5ug3 1 . 15 . 4061 . 1 1 4 GLU OE1 O -8.427 6.080 2.961 . . . 1.0 . . . . . . . . . . . . A . 4 GLU OE1 . . . . . . . . . c30225_5ug3 1 . 15 . 4062 . 1 1 4 GLU OE2 O -7.619 4.836 4.576 . . . 1.0 . . . . . . . . . . . . A . 4 GLU OE2 . . . . . . . . . c30225_5ug3 1 . 15 . 4063 . 1 1 5 CYS C C -1.128 2.450 -0.054 . . . 1.0 . . . . . . . . . . . . A . 5 CYS C . . . . . . . . . c30225_5ug3 1 . 15 . 4064 . 1 1 5 CYS CA C -1.718 2.416 1.357 . . . 1.0 . . . . . . . . . . . . A . 5 CYS CA . . . . . . . . . c30225_5ug3 1 . 15 . 4065 . 1 1 5 CYS CB C -1.145 1.252 2.154 . . . 1.0 . . . . . . . . . . . . A . 5 CYS CB . . . . . . . . . c30225_5ug3 1 . 15 . 4066 . 1 1 5 CYS H H -3.603 1.554 1.726 . . . 1.0 . . . . . . . . . . . . A . 5 CYS H . . . . . . . . . c30225_5ug3 1 . 15 . 4067 . 1 1 5 CYS HA H -1.447 3.333 1.856 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HA . . . . . . . . . c30225_5ug3 1 . 15 . 4068 . 1 1 5 CYS HB2 H -1.835 0.423 2.107 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HB2 . . . . . . . . . c30225_5ug3 1 . 15 . 4069 . 1 1 5 CYS HB3 H -0.210 0.955 1.717 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HB3 . . . . . . . . . c30225_5ug3 1 . 15 . 4070 . 1 1 5 CYS N N -3.168 2.349 1.349 . . . 1.0 . . . . . . . . . . . . A . 5 CYS N . . . . . . . . . c30225_5ug3 1 . 15 . 4071 . 1 1 5 CYS O O 0.072 2.649 -0.221 . . . 1.0 . . . . . . . . . . . . A . 5 CYS O . . . . . . . . . c30225_5ug3 1 . 15 . 4072 . 1 1 5 CYS SG S -0.853 1.630 3.916 . . . 1.0 . . . . . . . . . . . . A . 5 CYS SG . . . . . . . . . c30225_5ug3 1 . 15 . 4073 . 1 1 6 CYS C C -1.187 3.905 -2.678 . . . 1.0 . . . . . . . . . . . . A . 6 CYS C . . . . . . . . . c30225_5ug3 1 . 15 . 4074 . 1 1 6 CYS CA C -1.540 2.439 -2.441 . . . 1.0 . . . . . . . . . . . . A . 6 CYS CA . . . . . . . . . c30225_5ug3 1 . 15 . 4075 . 1 1 6 CYS CB C -2.660 2.044 -3.394 . . . 1.0 . . . . . . . . . . . . A . 6 CYS CB . . . . . . . . . c30225_5ug3 1 . 15 . 4076 . 1 1 6 CYS H H -2.887 1.983 -0.890 . . . 1.0 . . . . . . . . . . . . A . 6 CYS H . . . . . . . . . c30225_5ug3 1 . 15 . 4077 . 1 1 6 CYS HA H -0.670 1.822 -2.617 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HA . . . . . . . . . c30225_5ug3 1 . 15 . 4078 . 1 1 6 CYS HB2 H -3.433 2.794 -3.337 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HB2 . . . . . . . . . c30225_5ug3 1 . 15 . 4079 . 1 1 6 CYS HB3 H -2.266 2.022 -4.392 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HB3 . . . . . . . . . c30225_5ug3 1 . 15 . 4080 . 1 1 6 CYS N N -1.964 2.260 -1.067 . . . 1.0 . . . . . . . . . . . . A . 6 CYS N . . . . . . . . . c30225_5ug3 1 . 15 . 4081 . 1 1 6 CYS O O -0.231 4.222 -3.384 . . . 1.0 . . . . . . . . . . . . A . 6 CYS O . . . . . . . . . c30225_5ug3 1 . 15 . 4082 . 1 1 6 CYS SG S -3.445 0.428 -3.068 . . . 1.0 . . . . . . . . . . . . A . 6 CYS SG . . . . . . . . . c30225_5ug3 1 . 15 . 4083 . 1 1 7 SER C C -0.757 6.714 -1.154 . . . 1.0 . . . . . . . . . . . . A . 7 SER C . . . . . . . . . c30225_5ug3 1 . 15 . 4084 . 1 1 7 SER CA C -1.763 6.226 -2.188 . . . 1.0 . . . . . . . . . . . . A . 7 SER CA . . . . . . . . . c30225_5ug3 1 . 15 . 4085 . 1 1 7 SER CB C -3.100 6.950 -2.008 . . . 1.0 . . . . . . . . . . . . A . 7 SER CB . . . . . . . . . c30225_5ug3 1 . 15 . 4086 . 1 1 7 SER H H -2.682 4.466 -1.473 . . . 1.0 . . . . . . . . . . . . A . 7 SER H . . . . . . . . . c30225_5ug3 1 . 15 . 4087 . 1 1 7 SER HA H -1.379 6.423 -3.176 . . . 1.0 . . . . . . . . . . . . A . 7 SER HA . . . . . . . . . c30225_5ug3 1 . 15 . 4088 . 1 1 7 SER HB2 H -3.432 6.840 -0.985 . . . 1.0 . . . . . . . . . . . . A . 7 SER HB2 . . . . . . . . . c30225_5ug3 1 . 15 . 4089 . 1 1 7 SER HB3 H -2.975 7.998 -2.235 . . . 1.0 . . . . . . . . . . . . A . 7 SER HB3 . . . . . . . . . c30225_5ug3 1 . 15 . 4090 . 1 1 7 SER HG H -3.949 6.750 -3.766 . . . 1.0 . . . . . . . . . . . . A . 7 SER HG . . . . . . . . . c30225_5ug3 1 . 15 . 4091 . 1 1 7 SER N N -1.958 4.791 -2.053 . . . 1.0 . . . . . . . . . . . . A . 7 SER N . . . . . . . . . c30225_5ug3 1 . 15 . 4092 . 1 1 7 SER O O -0.533 7.910 -0.990 . . . 1.0 . . . . . . . . . . . . A . 7 SER O . . . . . . . . . c30225_5ug3 1 . 15 . 4093 . 1 1 7 SER OG O -4.089 6.407 -2.870 . . . 1.0 . . . . . . . . . . . . A . 7 SER OG . . . . . . . . . c30225_5ug3 1 . 15 . 4094 . 1 1 8 ASN C C 2.126 5.371 0.187 . . . 1.0 . . . . . . . . . . . . A . 8 ASN C . . . . . . . . . c30225_5ug3 1 . 15 . 4095 . 1 1 8 ASN CA C 0.833 6.046 0.561 . . . 1.0 . . . . . . . . . . . . A . 8 ASN CA . . . . . . . . . c30225_5ug3 1 . 15 . 4096 . 1 1 8 ASN CB C 0.385 5.506 1.911 . . . 1.0 . . . . . . . . . . . . A . 8 ASN CB . . . . . . . . . c30225_5ug3 1 . 15 . 4097 . 1 1 8 ASN CG C -0.809 6.243 2.480 . . . 1.0 . . . . . . . . . . . . A . 8 ASN CG . . . . . . . . . c30225_5ug3 1 . 15 . 4098 . 1 1 8 ASN H H -0.378 4.828 -0.656 . . . 1.0 . . . . . . . . . . . . A . 8 ASN H . . . . . . . . . c30225_5ug3 1 . 15 . 4099 . 1 1 8 ASN HA H 0.979 7.114 0.621 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HA . . . . . . . . . c30225_5ug3 1 . 15 . 4100 . 1 1 8 ASN HB2 H 0.127 4.467 1.789 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HB2 . . . . . . . . . c30225_5ug3 1 . 15 . 4101 . 1 1 8 ASN HB3 H 1.203 5.584 2.612 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HB3 . . . . . . . . . c30225_5ug3 1 . 15 . 4102 . 1 1 8 ASN HD21 H -2.029 5.201 1.317 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HD21 . . . . . . . . . c30225_5ug3 1 . 15 . 4103 . 1 1 8 ASN HD22 H -2.785 6.367 2.351 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HD22 . . . . . . . . . c30225_5ug3 1 . 15 . 4104 . 1 1 8 ASN N N -0.158 5.763 -0.460 . . . 1.0 . . . . . . . . . . . . A . 8 ASN N . . . . . . . . . c30225_5ug3 1 . 15 . 4105 . 1 1 8 ASN ND2 N -1.991 5.901 2.005 . . . 1.0 . . . . . . . . . . . . A . 8 ASN ND2 . . . . . . . . . c30225_5ug3 1 . 15 . 4106 . 1 1 8 ASN O O 2.322 4.194 0.501 . . . 1.0 . . . . . . . . . . . . A . 8 ASN O . . . . . . . . . c30225_5ug3 1 . 15 . 4107 . 1 1 8 ASN OD1 O -0.665 7.132 3.318 . . . 1.0 . . . . . . . . . . . . A . 8 ASN OD1 . . . . . . . . . c30225_5ug3 1 . 15 . 4108 . 1 1 9 PRO C C 5.065 4.891 0.247 . . . 1.0 . . . . . . . . . . . . A . 9 PRO C . . . . . . . . . c30225_5ug3 1 . 15 . 4109 . 1 1 9 PRO CA C 4.295 5.512 -0.916 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CA . . . . . . . . . c30225_5ug3 1 . 15 . 4110 . 1 1 9 PRO CB C 5.048 6.706 -1.504 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CB . . . . . . . . . c30225_5ug3 1 . 15 . 4111 . 1 1 9 PRO CD C 2.865 7.472 -0.958 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CD . . . . . . . . . c30225_5ug3 1 . 15 . 4112 . 1 1 9 PRO CG C 3.976 7.631 -1.955 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CG . . . . . . . . . c30225_5ug3 1 . 15 . 4113 . 1 1 9 PRO HA H 4.146 4.763 -1.676 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HA . . . . . . . . . c30225_5ug3 1 . 15 . 4114 . 1 1 9 PRO HB2 H 5.658 7.158 -0.740 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HB2 . . . . . . . . . c30225_5ug3 1 . 15 . 4115 . 1 1 9 PRO HB3 H 5.665 6.381 -2.327 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HB3 . . . . . . . . . c30225_5ug3 1 . 15 . 4116 . 1 1 9 PRO HD2 H 2.990 8.163 -0.141 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HD2 . . . . . . . . . c30225_5ug3 1 . 15 . 4117 . 1 1 9 PRO HD3 H 1.912 7.614 -1.433 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HD3 . . . . . . . . . c30225_5ug3 1 . 15 . 4118 . 1 1 9 PRO HG2 H 4.342 8.648 -1.955 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HG2 . . . . . . . . . c30225_5ug3 1 . 15 . 4119 . 1 1 9 PRO HG3 H 3.638 7.351 -2.942 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HG3 . . . . . . . . . c30225_5ug3 1 . 15 . 4120 . 1 1 9 PRO N N 3.023 6.077 -0.502 . . . 1.0 . . . . . . . . . . . . A . 9 PRO N . . . . . . . . . c30225_5ug3 1 . 15 . 4121 . 1 1 9 PRO O O 5.873 4.001 0.047 . . . 1.0 . . . . . . . . . . . . A . 9 PRO O . . . . . . . . . c30225_5ug3 1 . 15 . 4122 . 1 1 10 VAL C C 5.161 3.297 2.791 . . . 1.0 . . . . . . . . . . . . A . 10 VAL C . . . . . . . . . c30225_5ug3 1 . 15 . 4123 . 1 1 10 VAL CA C 5.465 4.785 2.633 . . . 1.0 . . . . . . . . . . . . A . 10 VAL CA . . . . . . . . . c30225_5ug3 1 . 15 . 4124 . 1 1 10 VAL CB C 5.088 5.556 3.921 . . . 1.0 . . . . . . . . . . . . A . 10 VAL CB . . . . . . . . . c30225_5ug3 1 . 15 . 4125 . 1 1 10 VAL CG1 C 3.621 5.391 4.285 . . . 1.0 . . . . . . . . . . . . A . 10 VAL CG1 . . . . . . . . . c30225_5ug3 1 . 15 . 4126 . 1 1 10 VAL CG2 C 5.983 5.147 5.081 . . . 1.0 . . . . . . . . . . . . A . 10 VAL CG2 . . . . . . . . . c30225_5ug3 1 . 15 . 4127 . 1 1 10 VAL H H 4.059 5.992 1.587 . . . 1.0 . . . . . . . . . . . . A . 10 VAL H . . . . . . . . . c30225_5ug3 1 . 15 . 4128 . 1 1 10 VAL HA H 6.528 4.902 2.464 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HA . . . . . . . . . c30225_5ug3 1 . 15 . 4129 . 1 1 10 VAL HB H 5.249 6.597 3.728 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HB . . . . . . . . . c30225_5ug3 1 . 15 . 4130 . 1 1 10 VAL HG11 H 3.410 4.347 4.462 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HG11 . . . . . . . . . c30225_5ug3 1 . 15 . 4131 . 1 1 10 VAL HG12 H 3.008 5.745 3.472 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HG12 . . . . . . . . . c30225_5ug3 1 . 15 . 4132 . 1 1 10 VAL HG13 H 3.402 5.958 5.174 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HG13 . . . . . . . . . c30225_5ug3 1 . 15 . 4133 . 1 1 10 VAL HG21 H 7.011 5.381 4.842 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HG21 . . . . . . . . . c30225_5ug3 1 . 15 . 4134 . 1 1 10 VAL HG22 H 5.885 4.086 5.252 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HG22 . . . . . . . . . c30225_5ug3 1 . 15 . 4135 . 1 1 10 VAL HG23 H 5.690 5.685 5.970 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HG23 . . . . . . . . . c30225_5ug3 1 . 15 . 4136 . 1 1 10 VAL N N 4.771 5.320 1.468 . . . 1.0 . . . . . . . . . . . . A . 10 VAL N . . . . . . . . . c30225_5ug3 1 . 15 . 4137 . 1 1 10 VAL O O 6.064 2.477 2.967 . . . 1.0 . . . . . . . . . . . . A . 10 VAL O . . . . . . . . . c30225_5ug3 1 . 15 . 4138 . 1 1 11 CYS C C 4.026 0.728 1.680 . . . 1.0 . . . . . . . . . . . . A . 11 CYS C . . . . . . . . . c30225_5ug3 1 . 15 . 4139 . 1 1 11 CYS CA C 3.427 1.591 2.785 . . . 1.0 . . . . . . . . . . . . A . 11 CYS CA . . . . . . . . . c30225_5ug3 1 . 15 . 4140 . 1 1 11 CYS CB C 1.907 1.541 2.674 . . . 1.0 . . . . . . . . . . . . A . 11 CYS CB . . . . . . . . . c30225_5ug3 1 . 15 . 4141 . 1 1 11 CYS H H 3.226 3.672 2.550 . . . 1.0 . . . . . . . . . . . . A . 11 CYS H . . . . . . . . . c30225_5ug3 1 . 15 . 4142 . 1 1 11 CYS HA H 3.726 1.202 3.745 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HA . . . . . . . . . c30225_5ug3 1 . 15 . 4143 . 1 1 11 CYS HB2 H 1.617 1.925 1.708 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HB2 . . . . . . . . . c30225_5ug3 1 . 15 . 4144 . 1 1 11 CYS HB3 H 1.594 0.518 2.748 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HB3 . . . . . . . . . c30225_5ug3 1 . 15 . 4145 . 1 1 11 CYS N N 3.886 2.961 2.685 . . . 1.0 . . . . . . . . . . . . A . 11 CYS N . . . . . . . . . c30225_5ug3 1 . 15 . 4146 . 1 1 11 CYS O O 4.678 -0.280 1.942 . . . 1.0 . . . . . . . . . . . . A . 11 CYS O . . . . . . . . . c30225_5ug3 1 . 15 . 4147 . 1 1 11 CYS SG S 0.991 2.490 3.931 . . . 1.0 . . . . . . . . . . . . A . 11 CYS SG . . . . . . . . . c30225_5ug3 1 . 15 . 4148 . 1 1 12 ARG C C 5.674 0.219 -0.930 . . . 1.0 . . . . . . . . . . . . A . 12 ARG C . . . . . . . . . c30225_5ug3 1 . 15 . 4149 . 1 1 12 ARG CA C 4.174 0.349 -0.725 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CA . . . . . . . . . c30225_5ug3 1 . 15 . 4150 . 1 1 12 ARG CB C 3.473 0.850 -1.984 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CB . . . . . . . . . c30225_5ug3 1 . 15 . 4151 . 1 1 12 ARG CD C 2.546 2.812 -3.226 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CD . . . . . . . . . c30225_5ug3 1 . 15 . 4152 . 1 1 12 ARG CG C 3.456 2.349 -2.106 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CG . . . . . . . . . c30225_5ug3 1 . 15 . 4153 . 1 1 12 ARG CZ C 2.087 2.262 -5.586 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CZ . . . . . . . . . c30225_5ug3 1 . 15 . 4154 . 1 1 12 ARG H H 3.422 2.041 0.309 . . . 1.0 . . . . . . . . . . . . A . 12 ARG H . . . . . . . . . c30225_5ug3 1 . 15 . 4155 . 1 1 12 ARG HA H 3.810 -0.615 -0.528 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HA . . . . . . . . . c30225_5ug3 1 . 15 . 4156 . 1 1 12 ARG HB2 H 3.977 0.446 -2.849 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HB2 . . . . . . . . . c30225_5ug3 1 . 15 . 4157 . 1 1 12 ARG HB3 H 2.451 0.500 -1.978 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HB3 . . . . . . . . . c30225_5ug3 1 . 15 . 4158 . 1 1 12 ARG HD2 H 1.525 2.595 -2.951 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HD2 . . . . . . . . . c30225_5ug3 1 . 15 . 4159 . 1 1 12 ARG HD3 H 2.664 3.878 -3.351 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HD3 . . . . . . . . . c30225_5ug3 1 . 15 . 4160 . 1 1 12 ARG HE H 3.647 1.588 -4.531 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HE . . . . . . . . . c30225_5ug3 1 . 15 . 4161 . 1 1 12 ARG HG2 H 3.095 2.749 -1.178 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HG2 . . . . . . . . . c30225_5ug3 1 . 15 . 4162 . 1 1 12 ARG HG3 H 4.460 2.697 -2.290 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HG3 . . . . . . . . . c30225_5ug3 1 . 15 . 4163 . 1 1 12 ARG HH11 H 0.743 3.527 -4.738 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH11 . . . . . . . . . c30225_5ug3 1 . 15 . 4164 . 1 1 12 ARG HH12 H 0.435 3.115 -6.395 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH12 . . . . . . . . . c30225_5ug3 1 . 15 . 4165 . 1 1 12 ARG HH21 H 3.243 1.033 -6.710 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH21 . . . . . . . . . c30225_5ug3 1 . 15 . 4166 . 1 1 12 ARG HH22 H 1.853 1.688 -7.517 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH22 . . . . . . . . . c30225_5ug3 1 . 15 . 4167 . 1 1 12 ARG N N 3.821 1.157 0.441 . . . 1.0 . . . . . . . . . . . . A . 12 ARG N . . . . . . . . . c30225_5ug3 1 . 15 . 4168 . 1 1 12 ARG NE N 2.842 2.150 -4.495 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NE . . . . . . . . . c30225_5ug3 1 . 15 . 4169 . 1 1 12 ARG NH1 N 1.001 3.028 -5.573 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NH1 . . . . . . . . . c30225_5ug3 1 . 15 . 4170 . 1 1 12 ARG NH2 N 2.422 1.610 -6.693 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NH2 . . . . . . . . . c30225_5ug3 1 . 15 . 4171 . 1 1 12 ARG O O 6.130 -0.655 -1.664 . . . 1.0 . . . . . . . . . . . . A . 12 ARG O . . . . . . . . . c30225_5ug3 1 . 15 . 4172 . 1 1 13 VAL C C 8.517 0.096 0.595 . . . 1.0 . . . . . . . . . . . . A . 13 VAL C . . . . . . . . . c30225_5ug3 1 . 15 . 4173 . 1 1 13 VAL CA C 7.875 1.032 -0.426 . . . 1.0 . . . . . . . . . . . . A . 13 VAL CA . . . . . . . . . c30225_5ug3 1 . 15 . 4174 . 1 1 13 VAL CB C 8.435 2.452 -0.353 . . . 1.0 . . . . . . . . . . . . A . 13 VAL CB . . . . . . . . . c30225_5ug3 1 . 15 . 4175 . 1 1 13 VAL CG1 C 9.937 2.464 -0.156 . . . 1.0 . . . . . . . . . . . . A . 13 VAL CG1 . . . . . . . . . c30225_5ug3 1 . 15 . 4176 . 1 1 13 VAL CG2 C 8.037 3.165 -1.630 . . . 1.0 . . . . . . . . . . . . A . 13 VAL CG2 . . . . . . . . . c30225_5ug3 1 . 15 . 4177 . 1 1 13 VAL H H 6.035 1.764 0.274 . . . 1.0 . . . . . . . . . . . . A . 13 VAL H . . . . . . . . . c30225_5ug3 1 . 15 . 4178 . 1 1 13 VAL HA H 8.091 0.647 -1.413 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HA . . . . . . . . . c30225_5ug3 1 . 15 . 4179 . 1 1 13 VAL HB H 7.974 2.965 0.478 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HB . . . . . . . . . c30225_5ug3 1 . 15 . 4180 . 1 1 13 VAL HG11 H 10.412 1.980 -0.994 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HG11 . . . . . . . . . c30225_5ug3 1 . 15 . 4181 . 1 1 13 VAL HG12 H 10.177 1.934 0.753 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HG12 . . . . . . . . . c30225_5ug3 1 . 15 . 4182 . 1 1 13 VAL HG13 H 10.279 3.483 -0.082 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HG13 . . . . . . . . . c30225_5ug3 1 . 15 . 4183 . 1 1 13 VAL HG21 H 8.211 4.225 -1.529 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HG21 . . . . . . . . . c30225_5ug3 1 . 15 . 4184 . 1 1 13 VAL HG22 H 6.979 2.979 -1.815 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HG22 . . . . . . . . . c30225_5ug3 1 . 15 . 4185 . 1 1 13 VAL HG23 H 8.615 2.776 -2.455 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HG23 . . . . . . . . . c30225_5ug3 1 . 15 . 4186 . 1 1 13 VAL N N 6.440 1.077 -0.295 . . . 1.0 . . . . . . . . . . . . A . 13 VAL N . . . . . . . . . c30225_5ug3 1 . 15 . 4187 . 1 1 13 VAL O O 9.435 -0.650 0.258 . . . 1.0 . . . . . . . . . . . . A . 13 VAL O . . . . . . . . . c30225_5ug3 1 . 15 . 4188 . 1 1 14 ASN C C 7.913 -2.218 2.599 . . . 1.0 . . . . . . . . . . . . A . 14 ASN C . . . . . . . . . c30225_5ug3 1 . 15 . 4189 . 1 1 14 ASN CA C 8.542 -0.851 2.820 . . . 1.0 . . . . . . . . . . . . A . 14 ASN CA . . . . . . . . . c30225_5ug3 1 . 15 . 4190 . 1 1 14 ASN CB C 8.288 -0.391 4.263 . . . 1.0 . . . . . . . . . . . . A . 14 ASN CB . . . . . . . . . c30225_5ug3 1 . 15 . 4191 . 1 1 14 ASN CG C 6.866 -0.633 4.751 . . . 1.0 . . . . . . . . . . . . A . 14 ASN CG . . . . . . . . . c30225_5ug3 1 . 15 . 4192 . 1 1 14 ASN H H 7.325 0.736 2.081 . . . 1.0 . . . . . . . . . . . . A . 14 ASN H . . . . . . . . . c30225_5ug3 1 . 15 . 4193 . 1 1 14 ASN HA H 9.607 -0.937 2.662 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HA . . . . . . . . . c30225_5ug3 1 . 15 . 4194 . 1 1 14 ASN HB2 H 8.953 -0.936 4.912 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HB2 . . . . . . . . . c30225_5ug3 1 . 15 . 4195 . 1 1 14 ASN HB3 H 8.502 0.665 4.341 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HB3 . . . . . . . . . c30225_5ug3 1 . 15 . 4196 . 1 1 14 ASN HD21 H 6.322 1.199 4.197 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HD21 . . . . . . . . . c30225_5ug3 1 . 15 . 4197 . 1 1 14 ASN HD22 H 5.086 0.225 4.918 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HD22 . . . . . . . . . c30225_5ug3 1 . 15 . 4198 . 1 1 14 ASN N N 8.027 0.096 1.831 . . . 1.0 . . . . . . . . . . . . A . 14 ASN N . . . . . . . . . c30225_5ug3 1 . 15 . 4199 . 1 1 14 ASN ND2 N 6.005 0.360 4.608 . . . 1.0 . . . . . . . . . . . . A . 14 ASN ND2 . . . . . . . . . c30225_5ug3 1 . 15 . 4200 . 1 1 14 ASN O O 8.488 -3.249 2.945 . . . 1.0 . . . . . . . . . . . . A . 14 ASN O . . . . . . . . . c30225_5ug3 1 . 15 . 4201 . 1 1 14 ASN OD1 O 6.551 -1.703 5.276 . . . 1.0 . . . . . . . . . . . . A . 14 ASN OD1 . . . . . . . . . c30225_5ug3 1 . 15 . 4202 . 1 1 15 ASN C C 5.335 -3.340 0.382 . . . 1.0 . . . . . . . . . . . . A . 15 ASN C . . . . . . . . . c30225_5ug3 1 . 15 . 4203 . 1 1 15 ASN CA C 5.989 -3.427 1.755 . . . 1.0 . . . . . . . . . . . . A . 15 ASN CA . . . . . . . . . c30225_5ug3 1 . 15 . 4204 . 1 1 15 ASN CB C 4.911 -3.607 2.818 . . . 1.0 . . . . . . . . . . . . A . 15 ASN CB . . . . . . . . . c30225_5ug3 1 . 15 . 4205 . 1 1 15 ASN CG C 4.324 -5.015 2.874 . . . 1.0 . . . . . . . . . . . . A . 15 ASN CG . . . . . . . . . c30225_5ug3 1 . 15 . 4206 . 1 1 15 ASN H H 6.358 -1.364 1.696 . . . 1.0 . . . . . . . . . . . . A . 15 ASN H . . . . . . . . . c30225_5ug3 1 . 15 . 4207 . 1 1 15 ASN HA H 6.675 -4.257 1.785 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HA . . . . . . . . . c30225_5ug3 1 . 15 . 4208 . 1 1 15 ASN HB2 H 5.329 -3.373 3.785 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HB2 . . . . . . . . . c30225_5ug3 1 . 15 . 4209 . 1 1 15 ASN HB3 H 4.117 -2.916 2.599 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HB3 . . . . . . . . . c30225_5ug3 1 . 15 . 4210 . 1 1 15 ASN HD21 H 4.821 -5.377 0.983 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HD21 . . . . . . . . . c30225_5ug3 1 . 15 . 4211 . 1 1 15 ASN HD22 H 4.027 -6.668 1.808 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HD22 . . . . . . . . . c30225_5ug3 1 . 15 . 4212 . 1 1 15 ASN N N 6.735 -2.214 1.998 . . . 1.0 . . . . . . . . . . . . A . 15 ASN N . . . . . . . . . c30225_5ug3 1 . 15 . 4213 . 1 1 15 ASN ND2 N 4.397 -5.758 1.776 . . . 1.0 . . . . . . . . . . . . A . 15 ASN ND2 . . . . . . . . . c30225_5ug3 1 . 15 . 4214 . 1 1 15 ASN O O 4.205 -2.872 0.246 . . . 1.0 . . . . . . . . . . . . A . 15 ASN O . . . . . . . . . c30225_5ug3 1 . 15 . 4215 . 1 1 15 ASN OD1 O 3.822 -5.441 3.913 . . . 1.0 . . . . . . . . . . . . A . 15 ASN OD1 . . . . . . . . . c30225_5ug3 1 . 15 . 4216 . 1 1 16 HYP C C 4.503 -4.705 -2.423 . . . 1.0 . . . . . . . . . . . . A . 16 HYP C . . . . . . . . . c30225_5ug3 1 . 15 . 4217 . 1 1 16 HYP CA C 5.587 -3.692 -2.054 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CA . . . . . . . . . c30225_5ug3 1 . 15 . 4218 . 1 1 16 HYP CB C 6.886 -3.957 -2.785 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CB . . . . . . . . . c30225_5ug3 1 . 15 . 4219 . 1 1 16 HYP CD C 7.349 -4.478 -0.528 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CD . . . . . . . . . c30225_5ug3 1 . 15 . 4220 . 1 1 16 HYP CG C 8.021 -4.103 -1.799 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CG . . . . . . . . . c30225_5ug3 1 . 15 . 4221 . 1 1 16 HYP HA H 5.239 -2.696 -2.279 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HA . . . . . . . . . c30225_5ug3 1 . 15 . 4222 . 1 1 16 HYP HB2 H 7.101 -3.132 -3.444 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HB2 . . . . . . . . . c30225_5ug3 1 . 15 . 4223 . 1 1 16 HYP HB3 H 6.791 -4.866 -3.363 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HB3 . . . . . . . . . c30225_5ug3 1 . 15 . 4224 . 1 1 16 HYP HD1 H 8.332 -2.581 -0.667 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HD1 . . . . . . . . . c30225_5ug3 1 . 15 . 4225 . 1 1 16 HYP HD22 H 7.243 -5.524 -0.454 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HD22 . . . . . . . . . c30225_5ug3 1 . 15 . 4226 . 1 1 16 HYP HD23 H 7.899 -4.092 0.315 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HD23 . . . . . . . . . c30225_5ug3 1 . 15 . 4227 . 1 1 16 HYP HG H 8.743 -4.839 -2.124 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HG . . . . . . . . . c30225_5ug3 1 . 15 . 4228 . 1 1 16 HYP N N 6.034 -3.806 -0.647 . . . 1.0 . . . . . . . . . . . . A . 16 HYP N . . . . . . . . . c30225_5ug3 1 . 15 . 4229 . 1 1 16 HYP O O 4.519 -5.304 -3.499 . . . 1.0 . . . . . . . . . . . . A . 16 HYP O . . . . . . . . . c30225_5ug3 1 . 15 . 4230 . 1 1 16 HYP OD1 O 8.634 -2.860 -1.547 . . . 1.0 . . . . . . . . . . . . A . 16 HYP OD1 . . . . . . . . . c30225_5ug3 1 . 15 . 4231 . 1 1 17 HIS C C 1.394 -5.444 -0.614 . . . 1.0 . . . . . . . . . . . . A . 17 HIS C . . . . . . . . . c30225_5ug3 1 . 15 . 4232 . 1 1 17 HIS CA C 2.424 -5.753 -1.696 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CA . . . . . . . . . c30225_5ug3 1 . 15 . 4233 . 1 1 17 HIS CB C 2.868 -7.222 -1.631 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CB . . . . . . . . . c30225_5ug3 1 . 15 . 4234 . 1 1 17 HIS CD2 C 1.162 -8.429 -3.171 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CD2 . . . . . . . . . c30225_5ug3 1 . 15 . 4235 . 1 1 17 HIS CE1 C 0.338 -9.826 -1.702 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CE1 . . . . . . . . . c30225_5ug3 1 . 15 . 4236 . 1 1 17 HIS CG C 1.793 -8.202 -1.997 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CG . . . . . . . . . c30225_5ug3 1 . 15 . 4237 . 1 1 17 HIS H H 3.622 -4.353 -0.678 . . . 1.0 . . . . . . . . . . . . A . 17 HIS H . . . . . . . . . c30225_5ug3 1 . 15 . 4238 . 1 1 17 HIS HA H 1.991 -5.549 -2.664 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HA . . . . . . . . . c30225_5ug3 1 . 15 . 4239 . 1 1 17 HIS HB2 H 3.694 -7.370 -2.310 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HB2 . . . . . . . . . c30225_5ug3 1 . 15 . 4240 . 1 1 17 HIS HB3 H 3.195 -7.445 -0.626 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HB3 . . . . . . . . . c30225_5ug3 1 . 15 . 4241 . 1 1 17 HIS HD1 H 1.497 -9.171 -0.147 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HD1 . . . . . . . . . c30225_5ug3 1 . 15 . 4242 . 1 1 17 HIS HD2 H 1.335 -7.909 -4.103 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HD2 . . . . . . . . . c30225_5ug3 1 . 15 . 4243 . 1 1 17 HIS HE1 H -0.248 -10.608 -1.245 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HE1 . . . . . . . . . c30225_5ug3 1 . 15 . 4244 . 1 1 17 HIS HE2 H -0.215 -9.931 -3.668 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HE2 . . . . . . . . . c30225_5ug3 1 . 15 . 4245 . 1 1 17 HIS N N 3.559 -4.867 -1.512 . . . 1.0 . . . . . . . . . . . . A . 17 HIS N . . . . . . . . . c30225_5ug3 1 . 15 . 4246 . 1 1 17 HIS ND1 N 1.251 -9.093 -1.096 . . . 1.0 . . . . . . . . . . . . A . 17 HIS ND1 . . . . . . . . . c30225_5ug3 1 . 15 . 4247 . 1 1 17 HIS NE2 N 0.263 -9.445 -2.961 . . . 1.0 . . . . . . . . . . . . A . 17 HIS NE2 . . . . . . . . . c30225_5ug3 1 . 15 . 4248 . 1 1 17 HIS O O 0.610 -6.298 -0.200 . . . 1.0 . . . . . . . . . . . . A . 17 HIS O . . . . . . . . . c30225_5ug3 1 . 15 . 4249 . 1 1 18 VAL C C -0.909 -3.700 0.462 . . . 1.0 . . . . . . . . . . . . A . 18 VAL C . . . . . . . . . c30225_5ug3 1 . 15 . 4250 . 1 1 18 VAL CA C 0.541 -3.771 0.929 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CA . . . . . . . . . c30225_5ug3 1 . 15 . 4251 . 1 1 18 VAL CB C 0.992 -2.409 1.504 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CB . . . . . . . . . c30225_5ug3 1 . 15 . 4252 . 1 1 18 VAL CG1 C 0.895 -1.306 0.458 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CG1 . . . . . . . . . c30225_5ug3 1 . 15 . 4253 . 1 1 18 VAL CG2 C 0.188 -2.053 2.746 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CG2 . . . . . . . . . c30225_5ug3 1 . 15 . 4254 . 1 1 18 VAL H H 1.996 -3.537 -0.587 . . . 1.0 . . . . . . . . . . . . A . 18 VAL H . . . . . . . . . c30225_5ug3 1 . 15 . 4255 . 1 1 18 VAL HA H 0.616 -4.511 1.714 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HA . . . . . . . . . c30225_5ug3 1 . 15 . 4256 . 1 1 18 VAL HB H 2.030 -2.497 1.794 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HB . . . . . . . . . c30225_5ug3 1 . 15 . 4257 . 1 1 18 VAL HG11 H -0.133 -1.193 0.148 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG11 . . . . . . . . . c30225_5ug3 1 . 15 . 4258 . 1 1 18 VAL HG12 H 1.501 -1.566 -0.396 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG12 . . . . . . . . . c30225_5ug3 1 . 15 . 4259 . 1 1 18 VAL HG13 H 1.247 -0.378 0.880 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG13 . . . . . . . . . c30225_5ug3 1 . 15 . 4260 . 1 1 18 VAL HG21 H 0.315 -2.825 3.489 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG21 . . . . . . . . . c30225_5ug3 1 . 15 . 4261 . 1 1 18 VAL HG22 H -0.857 -1.970 2.485 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG22 . . . . . . . . . c30225_5ug3 1 . 15 . 4262 . 1 1 18 VAL HG23 H 0.535 -1.112 3.143 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG23 . . . . . . . . . c30225_5ug3 1 . 15 . 4263 . 1 1 18 VAL N N 1.405 -4.197 -0.161 . . . 1.0 . . . . . . . . . . . . A . 18 VAL N . . . . . . . . . c30225_5ug3 1 . 15 . 4264 . 1 1 18 VAL O O -1.839 -3.912 1.242 . . . 1.0 . . . . . . . . . . . . A . 18 VAL O . . . . . . . . . c30225_5ug3 1 . 15 . 4265 . 1 1 19 CYS C C -2.364 -3.994 -2.822 . . . 1.0 . . . . . . . . . . . . A . 19 CYS C . . . . . . . . . c30225_5ug3 1 . 15 . 4266 . 1 1 19 CYS CA C -2.417 -3.429 -1.406 . . . 1.0 . . . . . . . . . . . . A . 19 CYS CA . . . . . . . . . c30225_5ug3 1 . 15 . 4267 . 1 1 19 CYS CB C -3.036 -2.026 -1.377 . . . 1.0 . . . . . . . . . . . . A . 19 CYS CB . . . . . . . . . c30225_5ug3 1 . 15 . 4268 . 1 1 19 CYS H H -0.320 -3.219 -1.384 . . . 1.0 . . . . . . . . . . . . A . 19 CYS H . . . . . . . . . c30225_5ug3 1 . 15 . 4269 . 1 1 19 CYS HA H -3.029 -4.087 -0.807 . . . 1.0 . . . . . . . . . . . . A . 19 CYS HA . . . . . . . . . c30225_5ug3 1 . 15 . 4270 . 1 1 19 CYS HB2 H -3.983 -2.054 -1.893 . . . 1.0 . . . . . . . . . . . . A . 19 CYS HB2 . . . . . . . . . c30225_5ug3 1 . 15 . 4271 . 1 1 19 CYS HB3 H -3.206 -1.744 -0.347 . . . 1.0 . . . . . . . . . . . . A . 19 CYS HB3 . . . . . . . . . c30225_5ug3 1 . 15 . 4272 . 1 1 19 CYS N N -1.095 -3.427 -0.819 . . . 1.0 . . . . . . . . . . . . A . 19 CYS N . . . . . . . . . c30225_5ug3 1 . 15 . 4273 . 1 1 19 CYS O O -1.912 -3.283 -3.744 . . . 1.0 . . . . . . . . . . . . A . 19 CYS O . . . . . . . . . c30225_5ug3 1 . 15 . 4274 . 1 1 19 CYS OXT O -2.749 -5.169 -2.997 . . . 1.0 . . . . . . . . . . . . A . 19 CYS OXT . . . . . . . . . c30225_5ug3 1 . 15 . 4275 . 1 1 19 CYS SG S -2.035 -0.708 -2.149 . . . 1.0 . . . . . . . . . . . . A . 19 CYS SG . . . . . . . . . c30225_5ug3 1 . 16 . 4276 . 1 1 1 ILE C C -10.319 -3.697 -1.332 . . . 1.0 . . . . . . . . . . . . A . 1 ILE C . . . . . . . . . c30225_5ug3 1 . 16 . 4277 . 1 1 1 ILE CA C -11.152 -4.976 -1.348 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CA . . . . . . . . . c30225_5ug3 1 . 16 . 4278 . 1 1 1 ILE CB C -12.516 -4.687 -2.021 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CB . . . . . . . . . c30225_5ug3 1 . 16 . 4279 . 1 1 1 ILE CD1 C -12.765 -7.078 -2.891 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CD1 . . . . . . . . . c30225_5ug3 1 . 16 . 4280 . 1 1 1 ILE CG1 C -13.376 -5.957 -2.078 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CG1 . . . . . . . . . c30225_5ug3 1 . 16 . 4281 . 1 1 1 ILE CG2 C -12.317 -4.120 -3.421 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CG2 . . . . . . . . . c30225_5ug3 1 . 16 . 4282 . 1 1 1 ILE H1 H -10.400 -5.728 0.442 . . . 1.0 . . . . . . . . . . . . A . 1 ILE H1 . . . . . . . . . c30225_5ug3 1 . 16 . 4283 . 1 1 1 ILE H2 H -11.911 -6.354 0.020 . . . 1.0 . . . . . . . . . . . . A . 1 ILE H2 . . . . . . . . . c30225_5ug3 1 . 16 . 4284 . 1 1 1 ILE H3 H -11.787 -4.782 0.624 . . . 1.0 . . . . . . . . . . . . A . 1 ILE H3 . . . . . . . . . c30225_5ug3 1 . 16 . 4285 . 1 1 1 ILE HA H -10.634 -5.723 -1.931 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HA . . . . . . . . . c30225_5ug3 1 . 16 . 4286 . 1 1 1 ILE HB H -13.029 -3.943 -1.432 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HB . . . . . . . . . c30225_5ug3 1 . 16 . 4287 . 1 1 1 ILE HD11 H -13.433 -7.927 -2.895 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HD11 . . . . . . . . . c30225_5ug3 1 . 16 . 4288 . 1 1 1 ILE HD12 H -11.821 -7.367 -2.454 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HD12 . . . . . . . . . c30225_5ug3 1 . 16 . 4289 . 1 1 1 ILE HD13 H -12.604 -6.742 -3.904 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HD13 . . . . . . . . . c30225_5ug3 1 . 16 . 4290 . 1 1 1 ILE HG12 H -13.528 -6.324 -1.075 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG12 . . . . . . . . . c30225_5ug3 1 . 16 . 4291 . 1 1 1 ILE HG13 H -14.333 -5.714 -2.515 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG13 . . . . . . . . . c30225_5ug3 1 . 16 . 4292 . 1 1 1 ILE HG21 H -11.775 -4.833 -4.025 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG21 . . . . . . . . . c30225_5ug3 1 . 16 . 4293 . 1 1 1 ILE HG22 H -11.754 -3.202 -3.358 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG22 . . . . . . . . . c30225_5ug3 1 . 16 . 4294 . 1 1 1 ILE HG23 H -13.279 -3.924 -3.870 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG23 . . . . . . . . . c30225_5ug3 1 . 16 . 4295 . 1 1 1 ILE N N -11.326 -5.497 0.028 . . . 1.0 . . . . . . . . . . . . A . 1 ILE N . . . . . . . . . c30225_5ug3 1 . 16 . 4296 . 1 1 1 ILE O O -10.658 -2.739 -0.632 . . . 1.0 . . . . . . . . . . . . A . 1 ILE O . . . . . . . . . c30225_5ug3 1 . 16 . 4297 . 1 1 2 ARG C C -7.583 -2.296 -0.884 . . . 1.0 . . . . . . . . . . . . A . 2 ARG C . . . . . . . . . c30225_5ug3 1 . 16 . 4298 . 1 1 2 ARG CA C -8.306 -2.569 -2.203 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CA . . . . . . . . . c30225_5ug3 1 . 16 . 4299 . 1 1 2 ARG CB C -9.029 -1.300 -2.645 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CB . . . . . . . . . c30225_5ug3 1 . 16 . 4300 . 1 1 2 ARG CD C -9.983 0.086 -4.492 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CD . . . . . . . . . c30225_5ug3 1 . 16 . 4301 . 1 1 2 ARG CG C -9.476 -1.293 -4.094 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CG . . . . . . . . . c30225_5ug3 1 . 16 . 4302 . 1 1 2 ARG CZ C -11.051 1.767 -3.020 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CZ . . . . . . . . . c30225_5ug3 1 . 16 . 4303 . 1 1 2 ARG H H -9.046 -4.493 -2.639 . . . 1.0 . . . . . . . . . . . . A . 2 ARG H . . . . . . . . . c30225_5ug3 1 . 16 . 4304 . 1 1 2 ARG HA H -7.569 -2.821 -2.949 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HA . . . . . . . . . c30225_5ug3 1 . 16 . 4305 . 1 1 2 ARG HB2 H -9.904 -1.184 -2.029 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB2 . . . . . . . . . c30225_5ug3 1 . 16 . 4306 . 1 1 2 ARG HB3 H -8.375 -0.455 -2.488 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB3 . . . . . . . . . c30225_5ug3 1 . 16 . 4307 . 1 1 2 ARG HD2 H -9.156 0.779 -4.463 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD2 . . . . . . . . . c30225_5ug3 1 . 16 . 4308 . 1 1 2 ARG HD3 H -10.376 0.036 -5.497 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD3 . . . . . . . . . c30225_5ug3 1 . 16 . 4309 . 1 1 2 ARG HE H -11.772 -0.062 -3.397 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HE . . . . . . . . . c30225_5ug3 1 . 16 . 4310 . 1 1 2 ARG HG2 H -8.639 -1.558 -4.723 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG2 . . . . . . . . . c30225_5ug3 1 . 16 . 4311 . 1 1 2 ARG HG3 H -10.272 -2.012 -4.223 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG3 . . . . . . . . . c30225_5ug3 1 . 16 . 4312 . 1 1 2 ARG HH11 H -9.331 2.412 -3.884 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH11 . . . . . . . . . c30225_5ug3 1 . 16 . 4313 . 1 1 2 ARG HH12 H -10.103 3.547 -2.824 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH12 . . . . . . . . . c30225_5ug3 1 . 16 . 4314 . 1 1 2 ARG HH21 H -12.776 1.441 -2.000 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH21 . . . . . . . . . c30225_5ug3 1 . 16 . 4315 . 1 1 2 ARG HH22 H -12.056 3.006 -1.768 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH22 . . . . . . . . . c30225_5ug3 1 . 16 . 4316 . 1 1 2 ARG N N -9.233 -3.699 -2.107 . . . 1.0 . . . . . . . . . . . . A . 2 ARG N . . . . . . . . . c30225_5ug3 1 . 16 . 4317 . 1 1 2 ARG NE N -11.035 0.561 -3.591 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NE . . . . . . . . . c30225_5ug3 1 . 16 . 4318 . 1 1 2 ARG NH1 N -10.084 2.645 -3.263 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH1 . . . . . . . . . c30225_5ug3 1 . 16 . 4319 . 1 1 2 ARG NH2 N -12.040 2.097 -2.197 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH2 . . . . . . . . . c30225_5ug3 1 . 16 . 4320 . 1 1 2 ARG O O -7.866 -2.906 0.152 . . . 1.0 . . . . . . . . . . . . A . 2 ARG O . . . . . . . . . c30225_5ug3 1 . 16 . 4321 . 1 1 3 ASP C C -5.527 0.532 0.047 . . . 1.0 . . . . . . . . . . . . A . 3 ASP C . . . . . . . . . c30225_5ug3 1 . 16 . 4322 . 1 1 3 ASP CA C -5.913 -0.927 0.231 . . . 1.0 . . . . . . . . . . . . A . 3 ASP CA . . . . . . . . . c30225_5ug3 1 . 16 . 4323 . 1 1 3 ASP CB C -4.662 -1.778 0.448 . . . 1.0 . . . . . . . . . . . . A . 3 ASP CB . . . . . . . . . c30225_5ug3 1 . 16 . 4324 . 1 1 3 ASP CG C -4.089 -1.605 1.838 . . . 1.0 . . . . . . . . . . . . A . 3 ASP CG . . . . . . . . . c30225_5ug3 1 . 16 . 4325 . 1 1 3 ASP H H -6.417 -0.970 -1.809 . . . 1.0 . . . . . . . . . . . . A . 3 ASP H . . . . . . . . . c30225_5ug3 1 . 16 . 4326 . 1 1 3 ASP HA H -6.566 -1.018 1.087 . . . 1.0 . . . . . . . . . . . . A . 3 ASP HA . . . . . . . . . c30225_5ug3 1 . 16 . 4327 . 1 1 3 ASP HB2 H -4.912 -2.819 0.308 . . . 1.0 . . . . . . . . . . . . A . 3 ASP HB2 . . . . . . . . . c30225_5ug3 1 . 16 . 4328 . 1 1 3 ASP HB3 H -3.910 -1.492 -0.271 . . . 1.0 . . . . . . . . . . . . A . 3 ASP HB3 . . . . . . . . . c30225_5ug3 1 . 16 . 4329 . 1 1 3 ASP N N -6.639 -1.371 -0.942 . . . 1.0 . . . . . . . . . . . . A . 3 ASP N . . . . . . . . . c30225_5ug3 1 . 16 . 4330 . 1 1 3 ASP O O -4.924 0.902 -0.963 . . . 1.0 . . . . . . . . . . . . A . 3 ASP O . . . . . . . . . c30225_5ug3 1 . 16 . 4331 . 1 1 3 ASP OD1 O -4.087 -2.578 2.612 . . . 1.0 . . . . . . . . . . . . A . 3 ASP OD1 . . . . . . . . . c30225_5ug3 1 . 16 . 4332 . 1 1 3 ASP OD2 O -3.629 -0.490 2.158 . . . 1.0 . . . . . . . . . . . . A . 3 ASP OD2 . . . . . . . . . c30225_5ug3 1 . 16 . 4333 . 1 1 4 GLU C C -4.165 3.125 1.011 . . . 1.0 . . . . . . . . . . . . A . 4 GLU C . . . . . . . . . c30225_5ug3 1 . 16 . 4334 . 1 1 4 GLU CA C -5.652 2.798 0.918 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CA . . . . . . . . . c30225_5ug3 1 . 16 . 4335 . 1 1 4 GLU CB C -6.434 3.541 2.001 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CB . . . . . . . . . c30225_5ug3 1 . 16 . 4336 . 1 1 4 GLU CD C -8.476 4.041 0.581 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CD . . . . . . . . . c30225_5ug3 1 . 16 . 4337 . 1 1 4 GLU CG C -7.943 3.408 1.854 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CG . . . . . . . . . c30225_5ug3 1 . 16 . 4338 . 1 1 4 GLU H H -6.345 1.000 1.800 . . . 1.0 . . . . . . . . . . . . A . 4 GLU H . . . . . . . . . c30225_5ug3 1 . 16 . 4339 . 1 1 4 GLU HA H -6.010 3.124 -0.047 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HA . . . . . . . . . c30225_5ug3 1 . 16 . 4340 . 1 1 4 GLU HB2 H -6.151 3.149 2.967 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HB2 . . . . . . . . . c30225_5ug3 1 . 16 . 4341 . 1 1 4 GLU HB3 H -6.181 4.590 1.959 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HB3 . . . . . . . . . c30225_5ug3 1 . 16 . 4342 . 1 1 4 GLU HG2 H -8.198 2.359 1.848 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HG2 . . . . . . . . . c30225_5ug3 1 . 16 . 4343 . 1 1 4 GLU HG3 H -8.415 3.886 2.700 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HG3 . . . . . . . . . c30225_5ug3 1 . 16 . 4344 . 1 1 4 GLU N N -5.893 1.362 1.009 . . . 1.0 . . . . . . . . . . . . A . 4 GLU N . . . . . . . . . c30225_5ug3 1 . 16 . 4345 . 1 1 4 GLU O O -3.739 4.212 0.622 . . . 1.0 . . . . . . . . . . . . A . 4 GLU O . . . . . . . . . c30225_5ug3 1 . 16 . 4346 . 1 1 4 GLU OE1 O -9.197 5.060 0.667 . . . 1.0 . . . . . . . . . . . . A . 4 GLU OE1 . . . . . . . . . c30225_5ug3 1 . 16 . 4347 . 1 1 4 GLU OE2 O -8.160 3.536 -0.515 . . . 1.0 . . . . . . . . . . . . A . 4 GLU OE2 . . . . . . . . . c30225_5ug3 1 . 16 . 4348 . 1 1 5 CYS C C -1.309 2.438 0.170 . . . 1.0 . . . . . . . . . . . . A . 5 CYS C . . . . . . . . . c30225_5ug3 1 . 16 . 4349 . 1 1 5 CYS CA C -1.923 2.349 1.563 . . . 1.0 . . . . . . . . . . . . A . 5 CYS CA . . . . . . . . . c30225_5ug3 1 . 16 . 4350 . 1 1 5 CYS CB C -1.281 1.207 2.347 . . . 1.0 . . . . . . . . . . . . A . 5 CYS CB . . . . . . . . . c30225_5ug3 1 . 16 . 4351 . 1 1 5 CYS H H -3.760 1.317 1.787 . . . 1.0 . . . . . . . . . . . . A . 5 CYS H . . . . . . . . . c30225_5ug3 1 . 16 . 4352 . 1 1 5 CYS HA H -1.736 3.278 2.083 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HA . . . . . . . . . c30225_5ug3 1 . 16 . 4353 . 1 1 5 CYS HB2 H -2.011 0.424 2.489 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HB2 . . . . . . . . . c30225_5ug3 1 . 16 . 4354 . 1 1 5 CYS HB3 H -0.449 0.816 1.782 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HB3 . . . . . . . . . c30225_5ug3 1 . 16 . 4355 . 1 1 5 CYS N N -3.368 2.171 1.484 . . . 1.0 . . . . . . . . . . . . A . 5 CYS N . . . . . . . . . c30225_5ug3 1 . 16 . 4356 . 1 1 5 CYS O O -0.136 2.775 0.017 . . . 1.0 . . . . . . . . . . . . A . 5 CYS O . . . . . . . . . c30225_5ug3 1 . 16 . 4357 . 1 1 5 CYS SG S -0.662 1.690 3.990 . . . 1.0 . . . . . . . . . . . . A . 5 CYS SG . . . . . . . . . c30225_5ug3 1 . 16 . 4358 . 1 1 6 CYS C C -1.398 3.733 -2.550 . . . 1.0 . . . . . . . . . . . . A . 6 CYS C . . . . . . . . . c30225_5ug3 1 . 16 . 4359 . 1 1 6 CYS CA C -1.688 2.269 -2.224 . . . 1.0 . . . . . . . . . . . . A . 6 CYS CA . . . . . . . . . c30225_5ug3 1 . 16 . 4360 . 1 1 6 CYS CB C -2.780 1.734 -3.145 . . . 1.0 . . . . . . . . . . . . A . 6 CYS CB . . . . . . . . . c30225_5ug3 1 . 16 . 4361 . 1 1 6 CYS H H -3.018 1.815 -0.649 . . . 1.0 . . . . . . . . . . . . A . 6 CYS H . . . . . . . . . c30225_5ug3 1 . 16 . 4362 . 1 1 6 CYS HA H -0.787 1.688 -2.361 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HA . . . . . . . . . c30225_5ug3 1 . 16 . 4363 . 1 1 6 CYS HB2 H -3.091 0.761 -2.795 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HB2 . . . . . . . . . c30225_5ug3 1 . 16 . 4364 . 1 1 6 CYS HB3 H -3.622 2.410 -3.108 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HB3 . . . . . . . . . c30225_5ug3 1 . 16 . 4365 . 1 1 6 CYS N N -2.110 2.139 -0.840 . . . 1.0 . . . . . . . . . . . . A . 6 CYS N . . . . . . . . . c30225_5ug3 1 . 16 . 4366 . 1 1 6 CYS O O -0.505 4.043 -3.334 . . . 1.0 . . . . . . . . . . . . A . 6 CYS O . . . . . . . . . c30225_5ug3 1 . 16 . 4367 . 1 1 6 CYS SG S -2.280 1.560 -4.889 . . . 1.0 . . . . . . . . . . . . A . 6 CYS SG . . . . . . . . . c30225_5ug3 1 . 16 . 4368 . 1 1 7 SER C C -0.921 6.626 -1.176 . . . 1.0 . . . . . . . . . . . . A . 7 SER C . . . . . . . . . c30225_5ug3 1 . 16 . 4369 . 1 1 7 SER CA C -1.978 6.062 -2.129 . . . 1.0 . . . . . . . . . . . . A . 7 SER CA . . . . . . . . . c30225_5ug3 1 . 16 . 4370 . 1 1 7 SER CB C -3.326 6.767 -1.922 . . . 1.0 . . . . . . . . . . . . A . 7 SER CB . . . . . . . . . c30225_5ug3 1 . 16 . 4371 . 1 1 7 SER H H -2.813 4.323 -1.265 . . . 1.0 . . . . . . . . . . . . A . 7 SER H . . . . . . . . . c30225_5ug3 1 . 16 . 4372 . 1 1 7 SER HA H -1.651 6.209 -3.147 . . . 1.0 . . . . . . . . . . . . A . 7 SER HA . . . . . . . . . c30225_5ug3 1 . 16 . 4373 . 1 1 7 SER HB2 H -4.082 6.267 -2.506 . . . 1.0 . . . . . . . . . . . . A . 7 SER HB2 . . . . . . . . . c30225_5ug3 1 . 16 . 4374 . 1 1 7 SER HB3 H -3.593 6.719 -0.875 . . . 1.0 . . . . . . . . . . . . A . 7 SER HB3 . . . . . . . . . c30225_5ug3 1 . 16 . 4375 . 1 1 7 SER HG H -2.400 8.319 -2.683 . . . 1.0 . . . . . . . . . . . . A . 7 SER HG . . . . . . . . . c30225_5ug3 1 . 16 . 4376 . 1 1 7 SER N N -2.139 4.631 -1.908 . . . 1.0 . . . . . . . . . . . . A . 7 SER N . . . . . . . . . c30225_5ug3 1 . 16 . 4377 . 1 1 7 SER O O -0.828 7.834 -0.960 . . . 1.0 . . . . . . . . . . . . A . 7 SER O . . . . . . . . . c30225_5ug3 1 . 16 . 4378 . 1 1 7 SER OG O -3.273 8.127 -2.316 . . . 1.0 . . . . . . . . . . . . A . 7 SER OG . . . . . . . . . c30225_5ug3 1 . 16 . 4379 . 1 1 8 ASN C C 2.199 5.442 0.029 . . . 1.0 . . . . . . . . . . . . A . 8 ASN C . . . . . . . . . c30225_5ug3 1 . 16 . 4380 . 1 1 8 ASN CA C 0.884 6.096 0.370 . . . 1.0 . . . . . . . . . . . . A . 8 ASN CA . . . . . . . . . c30225_5ug3 1 . 16 . 4381 . 1 1 8 ASN CB C 0.464 5.622 1.749 . . . 1.0 . . . . . . . . . . . . A . 8 ASN CB . . . . . . . . . c30225_5ug3 1 . 16 . 4382 . 1 1 8 ASN CG C -0.750 6.355 2.277 . . . 1.0 . . . . . . . . . . . . A . 8 ASN CG . . . . . . . . . c30225_5ug3 1 . 16 . 4383 . 1 1 8 ASN H H -0.203 4.792 -0.876 . . . 1.0 . . . . . . . . . . . . A . 8 ASN H . . . . . . . . . c30225_5ug3 1 . 16 . 4384 . 1 1 8 ASN HA H 0.997 7.170 0.372 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HA . . . . . . . . . c30225_5ug3 1 . 16 . 4385 . 1 1 8 ASN HB2 H 0.238 4.571 1.690 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HB2 . . . . . . . . . c30225_5ug3 1 . 16 . 4386 . 1 1 8 ASN HB3 H 1.283 5.766 2.437 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HB3 . . . . . . . . . c30225_5ug3 1 . 16 . 4387 . 1 1 8 ASN HD21 H -1.949 5.125 1.286 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HD21 . . . . . . . . . c30225_5ug3 1 . 16 . 4388 . 1 1 8 ASN HD22 H -2.731 6.353 2.220 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HD22 . . . . . . . . . c30225_5ug3 1 . 16 . 4389 . 1 1 8 ASN N N -0.122 5.732 -0.615 . . . 1.0 . . . . . . . . . . . . A . 8 ASN N . . . . . . . . . c30225_5ug3 1 . 16 . 4390 . 1 1 8 ASN ND2 N -1.926 5.899 1.889 . . . 1.0 . . . . . . . . . . . . A . 8 ASN ND2 . . . . . . . . . c30225_5ug3 1 . 16 . 4391 . 1 1 8 ASN O O 2.376 4.247 0.260 . . . 1.0 . . . . . . . . . . . . A . 8 ASN O . . . . . . . . . c30225_5ug3 1 . 16 . 4392 . 1 1 8 ASN OD1 O -0.629 7.334 3.012 . . . 1.0 . . . . . . . . . . . . A . 8 ASN OD1 . . . . . . . . . c30225_5ug3 1 . 16 . 4393 . 1 1 9 PRO C C 5.153 4.965 0.260 . . . 1.0 . . . . . . . . . . . . A . 9 PRO C . . . . . . . . . c30225_5ug3 1 . 16 . 4394 . 1 1 9 PRO CA C 4.442 5.662 -0.896 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CA . . . . . . . . . c30225_5ug3 1 . 16 . 4395 . 1 1 9 PRO CB C 5.229 6.892 -1.354 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CB . . . . . . . . . c30225_5ug3 1 . 16 . 4396 . 1 1 9 PRO CD C 3.055 7.650 -0.771 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CD . . . . . . . . . c30225_5ug3 1 . 16 . 4397 . 1 1 9 PRO CG C 4.190 7.889 -1.722 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CG . . . . . . . . . c30225_5ug3 1 . 16 . 4398 . 1 1 9 PRO HA H 4.331 4.969 -1.711 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HA . . . . . . . . . c30225_5ug3 1 . 16 . 4399 . 1 1 9 PRO HB2 H 5.839 7.250 -0.542 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HB2 . . . . . . . . . c30225_5ug3 1 . 16 . 4400 . 1 1 9 PRO HB3 H 5.850 6.637 -2.198 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HB3 . . . . . . . . . c30225_5ug3 1 . 16 . 4401 . 1 1 9 PRO HD2 H 3.189 8.225 0.134 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HD2 . . . . . . . . . c30225_5ug3 1 . 16 . 4402 . 1 1 9 PRO HD3 H 2.118 7.893 -1.239 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HD3 . . . . . . . . . c30225_5ug3 1 . 16 . 4403 . 1 1 9 PRO HG2 H 4.580 8.890 -1.601 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HG2 . . . . . . . . . c30225_5ug3 1 . 16 . 4404 . 1 1 9 PRO HG3 H 3.868 7.728 -2.740 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HG3 . . . . . . . . . c30225_5ug3 1 . 16 . 4405 . 1 1 9 PRO N N 3.152 6.206 -0.500 . . . 1.0 . . . . . . . . . . . . A . 9 PRO N . . . . . . . . . c30225_5ug3 1 . 16 . 4406 . 1 1 9 PRO O O 5.944 4.058 0.044 . . . 1.0 . . . . . . . . . . . . A . 9 PRO O . . . . . . . . . c30225_5ug3 1 . 16 . 4407 . 1 1 10 VAL C C 5.094 3.360 2.874 . . . 1.0 . . . . . . . . . . . . A . 10 VAL C . . . . . . . . . c30225_5ug3 1 . 16 . 4408 . 1 1 10 VAL CA C 5.459 4.827 2.682 . . . 1.0 . . . . . . . . . . . . A . 10 VAL CA . . . . . . . . . c30225_5ug3 1 . 16 . 4409 . 1 1 10 VAL CB C 5.046 5.626 3.938 . . . 1.0 . . . . . . . . . . . . A . 10 VAL CB . . . . . . . . . c30225_5ug3 1 . 16 . 4410 . 1 1 10 VAL CG1 C 5.739 5.091 5.181 . . . 1.0 . . . . . . . . . . . . A . 10 VAL CG1 . . . . . . . . . c30225_5ug3 1 . 16 . 4411 . 1 1 10 VAL CG2 C 5.347 7.105 3.754 . . . 1.0 . . . . . . . . . . . . A . 10 VAL CG2 . . . . . . . . . c30225_5ug3 1 . 16 . 4412 . 1 1 10 VAL H H 4.078 6.005 1.584 . . . 1.0 . . . . . . . . . . . . A . 10 VAL H . . . . . . . . . c30225_5ug3 1 . 16 . 4413 . 1 1 10 VAL HA H 6.531 4.910 2.554 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HA . . . . . . . . . c30225_5ug3 1 . 16 . 4414 . 1 1 10 VAL HB H 3.981 5.515 4.073 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HB . . . . . . . . . c30225_5ug3 1 . 16 . 4415 . 1 1 10 VAL HG11 H 5.439 5.673 6.039 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HG11 . . . . . . . . . c30225_5ug3 1 . 16 . 4416 . 1 1 10 VAL HG12 H 6.808 5.160 5.055 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HG12 . . . . . . . . . c30225_5ug3 1 . 16 . 4417 . 1 1 10 VAL HG13 H 5.461 4.058 5.332 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HG13 . . . . . . . . . c30225_5ug3 1 . 16 . 4418 . 1 1 10 VAL HG21 H 4.975 7.655 4.603 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HG21 . . . . . . . . . c30225_5ug3 1 . 16 . 4419 . 1 1 10 VAL HG22 H 4.868 7.461 2.855 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HG22 . . . . . . . . . c30225_5ug3 1 . 16 . 4420 . 1 1 10 VAL HG23 H 6.413 7.248 3.674 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HG23 . . . . . . . . . c30225_5ug3 1 . 16 . 4421 . 1 1 10 VAL N N 4.810 5.359 1.483 . . . 1.0 . . . . . . . . . . . . A . 10 VAL N . . . . . . . . . c30225_5ug3 1 . 16 . 4422 . 1 1 10 VAL O O 5.892 2.548 3.347 . . . 1.0 . . . . . . . . . . . . A . 10 VAL O . . . . . . . . . c30225_5ug3 1 . 16 . 4423 . 1 1 11 CYS C C 4.083 0.834 1.467 . . . 1.0 . . . . . . . . . . . . A . 11 CYS C . . . . . . . . . c30225_5ug3 1 . 16 . 4424 . 1 1 11 CYS CA C 3.427 1.661 2.560 . . . 1.0 . . . . . . . . . . . . A . 11 CYS CA . . . . . . . . . c30225_5ug3 1 . 16 . 4425 . 1 1 11 CYS CB C 1.920 1.640 2.389 . . . 1.0 . . . . . . . . . . . . A . 11 CYS CB . . . . . . . . . c30225_5ug3 1 . 16 . 4426 . 1 1 11 CYS H H 3.276 3.706 2.144 . . . 1.0 . . . . . . . . . . . . A . 11 CYS H . . . . . . . . . c30225_5ug3 1 . 16 . 4427 . 1 1 11 CYS HA H 3.686 1.265 3.526 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HA . . . . . . . . . c30225_5ug3 1 . 16 . 4428 . 1 1 11 CYS HB2 H 1.682 1.969 1.385 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HB2 . . . . . . . . . c30225_5ug3 1 . 16 . 4429 . 1 1 11 CYS HB3 H 1.566 0.638 2.529 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HB3 . . . . . . . . . c30225_5ug3 1 . 16 . 4430 . 1 1 11 CYS N N 3.885 3.022 2.487 . . . 1.0 . . . . . . . . . . . . A . 11 CYS N . . . . . . . . . c30225_5ug3 1 . 16 . 4431 . 1 1 11 CYS O O 4.548 -0.279 1.697 . . . 1.0 . . . . . . . . . . . . A . 11 CYS O . . . . . . . . . c30225_5ug3 1 . 16 . 4432 . 1 1 11 CYS SG S 1.033 2.721 3.563 . . . 1.0 . . . . . . . . . . . . A . 11 CYS SG . . . . . . . . . c30225_5ug3 1 . 16 . 4433 . 1 1 12 ARG C C 6.084 0.402 -0.863 . . . 1.0 . . . . . . . . . . . . A . 12 ARG C . . . . . . . . . c30225_5ug3 1 . 16 . 4434 . 1 1 12 ARG CA C 4.602 0.713 -0.905 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CA . . . . . . . . . c30225_5ug3 1 . 16 . 4435 . 1 1 12 ARG CB C 4.266 1.567 -2.108 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CB . . . . . . . . . c30225_5ug3 1 . 16 . 4436 . 1 1 12 ARG CD C 2.484 2.751 -3.307 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CD . . . . . . . . . c30225_5ug3 1 . 16 . 4437 . 1 1 12 ARG CG C 2.898 2.140 -2.009 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CG . . . . . . . . . c30225_5ug3 1 . 16 . 4438 . 1 1 12 ARG CZ C 1.379 2.034 -5.399 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CZ . . . . . . . . . c30225_5ug3 1 . 16 . 4439 . 1 1 12 ARG H H 3.825 2.343 0.182 . . . 1.0 . . . . . . . . . . . . A . 12 ARG H . . . . . . . . . c30225_5ug3 1 . 16 . 4440 . 1 1 12 ARG HA H 4.069 -0.203 -0.965 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HA . . . . . . . . . c30225_5ug3 1 . 16 . 4441 . 1 1 12 ARG HB2 H 4.955 2.387 -2.165 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HB2 . . . . . . . . . c30225_5ug3 1 . 16 . 4442 . 1 1 12 ARG HB3 H 4.319 0.983 -3.008 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HB3 . . . . . . . . . c30225_5ug3 1 . 16 . 4443 . 1 1 12 ARG HD2 H 1.712 3.440 -3.097 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HD2 . . . . . . . . . c30225_5ug3 1 . 16 . 4444 . 1 1 12 ARG HD3 H 3.327 3.275 -3.731 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HD3 . . . . . . . . . c30225_5ug3 1 . 16 . 4445 . 1 1 12 ARG HE H 2.197 0.805 -4.047 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HE . . . . . . . . . c30225_5ug3 1 . 16 . 4446 . 1 1 12 ARG HG2 H 2.216 1.356 -1.743 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HG2 . . . . . . . . . c30225_5ug3 1 . 16 . 4447 . 1 1 12 ARG HG3 H 2.891 2.902 -1.243 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HG3 . . . . . . . . . c30225_5ug3 1 . 16 . 4448 . 1 1 12 ARG HH11 H 1.363 4.039 -5.092 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH11 . . . . . . . . . c30225_5ug3 1 . 16 . 4449 . 1 1 12 ARG HH12 H 0.614 3.507 -6.563 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH12 . . . . . . . . . c30225_5ug3 1 . 16 . 4450 . 1 1 12 ARG HH21 H 1.205 0.090 -5.975 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH21 . . . . . . . . . c30225_5ug3 1 . 16 . 4451 . 1 1 12 ARG HH22 H 0.539 1.264 -7.073 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH22 . . . . . . . . . c30225_5ug3 1 . 16 . 4452 . 1 1 12 ARG N N 4.138 1.412 0.279 . . . 1.0 . . . . . . . . . . . . A . 12 ARG N . . . . . . . . . c30225_5ug3 1 . 16 . 4453 . 1 1 12 ARG NE N 2.015 1.748 -4.264 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NE . . . . . . . . . c30225_5ug3 1 . 16 . 4454 . 1 1 12 ARG NH1 N 1.098 3.293 -5.710 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NH1 . . . . . . . . . c30225_5ug3 1 . 16 . 4455 . 1 1 12 ARG NH2 N 1.010 1.054 -6.213 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NH2 . . . . . . . . . c30225_5ug3 1 . 16 . 4456 . 1 1 12 ARG O O 6.519 -0.659 -1.303 . . . 1.0 . . . . . . . . . . . . A . 12 ARG O . . . . . . . . . c30225_5ug3 1 . 16 . 4457 . 1 1 13 VAL C C 8.630 0.018 0.746 . . . 1.0 . . . . . . . . . . . . A . 13 VAL C . . . . . . . . . c30225_5ug3 1 . 16 . 4458 . 1 1 13 VAL CA C 8.277 1.158 -0.212 . . . 1.0 . . . . . . . . . . . . A . 13 VAL CA . . . . . . . . . c30225_5ug3 1 . 16 . 4459 . 1 1 13 VAL CB C 8.928 2.456 0.275 . . . 1.0 . . . . . . . . . . . . A . 13 VAL CB . . . . . . . . . c30225_5ug3 1 . 16 . 4460 . 1 1 13 VAL CG1 C 8.891 3.517 -0.810 . . . 1.0 . . . . . . . . . . . . A . 13 VAL CG1 . . . . . . . . . c30225_5ug3 1 . 16 . 4461 . 1 1 13 VAL CG2 C 8.235 2.941 1.531 . . . 1.0 . . . . . . . . . . . . A . 13 VAL CG2 . . . . . . . . . c30225_5ug3 1 . 16 . 4462 . 1 1 13 VAL H H 6.440 2.182 -0.084 . . . 1.0 . . . . . . . . . . . . A . 13 VAL H . . . . . . . . . c30225_5ug3 1 . 16 . 4463 . 1 1 13 VAL HA H 8.678 0.928 -1.188 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HA . . . . . . . . . c30225_5ug3 1 . 16 . 4464 . 1 1 13 VAL HB H 9.948 2.252 0.514 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HB . . . . . . . . . c30225_5ug3 1 . 16 . 4465 . 1 1 13 VAL HG11 H 9.330 4.429 -0.434 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HG11 . . . . . . . . . c30225_5ug3 1 . 16 . 4466 . 1 1 13 VAL HG12 H 7.866 3.703 -1.097 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HG12 . . . . . . . . . c30225_5ug3 1 . 16 . 4467 . 1 1 13 VAL HG13 H 9.450 3.175 -1.669 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HG13 . . . . . . . . . c30225_5ug3 1 . 16 . 4468 . 1 1 13 VAL HG21 H 8.512 3.964 1.729 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HG21 . . . . . . . . . c30225_5ug3 1 . 16 . 4469 . 1 1 13 VAL HG22 H 8.526 2.318 2.363 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HG22 . . . . . . . . . c30225_5ug3 1 . 16 . 4470 . 1 1 13 VAL HG23 H 7.159 2.873 1.393 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HG23 . . . . . . . . . c30225_5ug3 1 . 16 . 4471 . 1 1 13 VAL N N 6.846 1.332 -0.352 . . . 1.0 . . . . . . . . . . . . A . 13 VAL N . . . . . . . . . c30225_5ug3 1 . 16 . 4472 . 1 1 13 VAL O O 9.548 -0.759 0.476 . . . 1.0 . . . . . . . . . . . . A . 13 VAL O . . . . . . . . . c30225_5ug3 1 . 16 . 4473 . 1 1 14 ASN C C 7.593 -2.437 2.570 . . . 1.0 . . . . . . . . . . . . A . 14 ASN C . . . . . . . . . c30225_5ug3 1 . 16 . 4474 . 1 1 14 ASN CA C 8.244 -1.089 2.871 . . . 1.0 . . . . . . . . . . . . A . 14 ASN CA . . . . . . . . . c30225_5ug3 1 . 16 . 4475 . 1 1 14 ASN CB C 7.860 -0.603 4.280 . . . 1.0 . . . . . . . . . . . . A . 14 ASN CB . . . . . . . . . c30225_5ug3 1 . 16 . 4476 . 1 1 14 ASN CG C 6.473 -1.038 4.726 . . . 1.0 . . . . . . . . . . . . A . 14 ASN CG . . . . . . . . . c30225_5ug3 1 . 16 . 4477 . 1 1 14 ASN H H 7.132 0.496 1.994 . . . 1.0 . . . . . . . . . . . . A . 14 ASN H . . . . . . . . . c30225_5ug3 1 . 16 . 4478 . 1 1 14 ASN HA H 9.315 -1.221 2.837 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HA . . . . . . . . . c30225_5ug3 1 . 16 . 4479 . 1 1 14 ASN HB2 H 8.572 -0.998 4.987 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HB2 . . . . . . . . . c30225_5ug3 1 . 16 . 4480 . 1 1 14 ASN HB3 H 7.902 0.476 4.302 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HB3 . . . . . . . . . c30225_5ug3 1 . 16 . 4481 . 1 1 14 ASN HD21 H 5.663 0.611 3.973 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HD21 . . . . . . . . . c30225_5ug3 1 . 16 . 4482 . 1 1 14 ASN HD22 H 4.563 -0.498 4.720 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HD22 . . . . . . . . . c30225_5ug3 1 . 16 . 4483 . 1 1 14 ASN N N 7.902 -0.097 1.856 . . . 1.0 . . . . . . . . . . . . A . 14 ASN N . . . . . . . . . c30225_5ug3 1 . 16 . 4484 . 1 1 14 ASN ND2 N 5.468 -0.227 4.447 . . . 1.0 . . . . . . . . . . . . A . 14 ASN ND2 . . . . . . . . . c30225_5ug3 1 . 16 . 4485 . 1 1 14 ASN O O 8.174 -3.485 2.841 . . . 1.0 . . . . . . . . . . . . A . 14 ASN O . . . . . . . . . c30225_5ug3 1 . 16 . 4486 . 1 1 14 ASN OD1 O 6.315 -2.095 5.340 . . . 1.0 . . . . . . . . . . . . A . 14 ASN OD1 . . . . . . . . . c30225_5ug3 1 . 16 . 4487 . 1 1 15 ASN C C 6.079 -4.065 0.248 . . . 1.0 . . . . . . . . . . . . A . 15 ASN C . . . . . . . . . c30225_5ug3 1 . 16 . 4488 . 1 1 15 ASN CA C 5.695 -3.622 1.649 . . . 1.0 . . . . . . . . . . . . A . 15 ASN CA . . . . . . . . . c30225_5ug3 1 . 16 . 4489 . 1 1 15 ASN CB C 4.188 -3.400 1.728 . . . 1.0 . . . . . . . . . . . . A . 15 ASN CB . . . . . . . . . c30225_5ug3 1 . 16 . 4490 . 1 1 15 ASN CG C 3.611 -3.694 3.099 . . . 1.0 . . . . . . . . . . . . A . 15 ASN CG . . . . . . . . . c30225_5ug3 1 . 16 . 4491 . 1 1 15 ASN H H 5.958 -1.558 1.831 . . . 1.0 . . . . . . . . . . . . A . 15 ASN H . . . . . . . . . c30225_5ug3 1 . 16 . 4492 . 1 1 15 ASN HA H 5.980 -4.400 2.352 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HA . . . . . . . . . c30225_5ug3 1 . 16 . 4493 . 1 1 15 ASN HB2 H 3.972 -2.369 1.484 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HB2 . . . . . . . . . c30225_5ug3 1 . 16 . 4494 . 1 1 15 ASN HB3 H 3.712 -4.042 1.012 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HB3 . . . . . . . . . c30225_5ug3 1 . 16 . 4495 . 1 1 15 ASN HD21 H 3.046 -5.501 2.498 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HD21 . . . . . . . . . c30225_5ug3 1 . 16 . 4496 . 1 1 15 ASN HD22 H 2.666 -5.099 4.134 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HD22 . . . . . . . . . c30225_5ug3 1 . 16 . 4497 . 1 1 15 ASN N N 6.394 -2.412 2.007 . . . 1.0 . . . . . . . . . . . . A . 15 ASN N . . . . . . . . . c30225_5ug3 1 . 16 . 4498 . 1 1 15 ASN ND2 N 3.056 -4.885 3.260 . . . 1.0 . . . . . . . . . . . . A . 15 ASN ND2 . . . . . . . . . c30225_5ug3 1 . 16 . 4499 . 1 1 15 ASN O O 6.279 -3.260 -0.655 . . . 1.0 . . . . . . . . . . . . A . 15 ASN O . . . . . . . . . c30225_5ug3 1 . 16 . 4500 . 1 1 15 ASN OD1 O 3.627 -2.847 3.991 . . . 1.0 . . . . . . . . . . . . A . 15 ASN OD1 . . . . . . . . . c30225_5ug3 1 . 16 . 4501 . 1 1 16 HYP C C 5.586 -5.907 -2.275 . . . 1.0 . . . . . . . . . . . . A . 16 HYP C . . . . . . . . . c30225_5ug3 1 . 16 . 4502 . 1 1 16 HYP CA C 6.630 -6.003 -1.173 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CA . . . . . . . . . c30225_5ug3 1 . 16 . 4503 . 1 1 16 HYP CB C 6.824 -7.436 -0.738 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CB . . . . . . . . . c30225_5ug3 1 . 16 . 4504 . 1 1 16 HYP CD C 5.956 -6.332 1.191 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CD . . . . . . . . . c30225_5ug3 1 . 16 . 4505 . 1 1 16 HYP CG C 6.193 -7.684 0.611 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CG . . . . . . . . . c30225_5ug3 1 . 16 . 4506 . 1 1 16 HYP HA H 7.556 -5.596 -1.523 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HA . . . . . . . . . c30225_5ug3 1 . 16 . 4507 . 1 1 16 HYP HB2 H 7.880 -7.648 -0.670 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HB2 . . . . . . . . . c30225_5ug3 1 . 16 . 4508 . 1 1 16 HYP HB3 H 6.372 -8.092 -1.469 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HB3 . . . . . . . . . c30225_5ug3 1 . 16 . 4509 . 1 1 16 HYP HD1 H 7.135 -7.795 2.295 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HD1 . . . . . . . . . c30225_5ug3 1 . 16 . 4510 . 1 1 16 HYP HD22 H 4.952 -6.243 1.555 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HD22 . . . . . . . . . c30225_5ug3 1 . 16 . 4511 . 1 1 16 HYP HD23 H 6.652 -6.158 1.998 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HD23 . . . . . . . . . c30225_5ug3 1 . 16 . 4512 . 1 1 16 HYP HG H 5.275 -8.243 0.503 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HG . . . . . . . . . c30225_5ug3 1 . 16 . 4513 . 1 1 16 HYP N N 6.203 -5.371 0.089 . . . 1.0 . . . . . . . . . . . . A . 16 HYP N . . . . . . . . . c30225_5ug3 1 . 16 . 4514 . 1 1 16 HYP O O 5.919 -5.785 -3.452 . . . 1.0 . . . . . . . . . . . . A . 16 HYP O . . . . . . . . . c30225_5ug3 1 . 16 . 4515 . 1 1 16 HYP OD1 O 7.067 -8.348 1.497 . . . 1.0 . . . . . . . . . . . . A . 16 HYP OD1 . . . . . . . . . c30225_5ug3 1 . 16 . 4516 . 1 1 17 HIS C C 1.924 -5.485 -2.167 . . . 1.0 . . . . . . . . . . . . A . 17 HIS C . . . . . . . . . c30225_5ug3 1 . 16 . 4517 . 1 1 17 HIS CA C 3.227 -5.886 -2.847 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CA . . . . . . . . . c30225_5ug3 1 . 16 . 4518 . 1 1 17 HIS CB C 3.057 -7.213 -3.614 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CB . . . . . . . . . c30225_5ug3 1 . 16 . 4519 . 1 1 17 HIS CD2 C 1.939 -8.967 -2.047 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CD2 . . . . . . . . . c30225_5ug3 1 . 16 . 4520 . 1 1 17 HIS CE1 C 3.662 -10.288 -1.777 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CE1 . . . . . . . . . c30225_5ug3 1 . 16 . 4521 . 1 1 17 HIS CG C 2.971 -8.441 -2.751 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CG . . . . . . . . . c30225_5ug3 1 . 16 . 4522 . 1 1 17 HIS H H 4.125 -6.066 -0.936 . . . 1.0 . . . . . . . . . . . . A . 17 HIS H . . . . . . . . . c30225_5ug3 1 . 16 . 4523 . 1 1 17 HIS HA H 3.485 -5.114 -3.558 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HA . . . . . . . . . c30225_5ug3 1 . 16 . 4524 . 1 1 17 HIS HB2 H 2.151 -7.162 -4.196 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HB2 . . . . . . . . . c30225_5ug3 1 . 16 . 4525 . 1 1 17 HIS HB3 H 3.896 -7.338 -4.285 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HB3 . . . . . . . . . c30225_5ug3 1 . 16 . 4526 . 1 1 17 HIS HD1 H 4.928 -9.197 -2.956 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HD1 . . . . . . . . . c30225_5ug3 1 . 16 . 4527 . 1 1 17 HIS HD2 H 0.943 -8.557 -1.968 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HD2 . . . . . . . . . c30225_5ug3 1 . 16 . 4528 . 1 1 17 HIS HE1 H 4.288 -11.107 -1.455 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HE1 . . . . . . . . . c30225_5ug3 1 . 16 . 4529 . 1 1 17 HIS HE2 H 1.828 -10.797 -1.024 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HE2 . . . . . . . . . c30225_5ug3 1 . 16 . 4530 . 1 1 17 HIS N N 4.324 -5.968 -1.889 . . . 1.0 . . . . . . . . . . . . A . 17 HIS N . . . . . . . . . c30225_5ug3 1 . 16 . 4531 . 1 1 17 HIS ND1 N 4.033 -9.295 -2.560 . . . 1.0 . . . . . . . . . . . . A . 17 HIS ND1 . . . . . . . . . c30225_5ug3 1 . 16 . 4532 . 1 1 17 HIS NE2 N 2.397 -10.113 -1.449 . . . 1.0 . . . . . . . . . . . . A . 17 HIS NE2 . . . . . . . . . c30225_5ug3 1 . 16 . 4533 . 1 1 17 HIS O O 0.918 -6.183 -2.262 . . . 1.0 . . . . . . . . . . . . A . 17 HIS O . . . . . . . . . c30225_5ug3 1 . 16 . 4534 . 1 1 18 VAL C C -0.245 -3.328 -1.898 . . . 1.0 . . . . . . . . . . . . A . 18 VAL C . . . . . . . . . c30225_5ug3 1 . 16 . 4535 . 1 1 18 VAL CA C 0.735 -3.839 -0.839 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CA . . . . . . . . . c30225_5ug3 1 . 16 . 4536 . 1 1 18 VAL CB C 1.048 -2.723 0.191 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CB . . . . . . . . . c30225_5ug3 1 . 16 . 4537 . 1 1 18 VAL CG1 C 1.669 -1.507 -0.477 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CG1 . . . . . . . . . c30225_5ug3 1 . 16 . 4538 . 1 1 18 VAL CG2 C -0.202 -2.332 0.966 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CG2 . . . . . . . . . c30225_5ug3 1 . 16 . 4539 . 1 1 18 VAL H H 2.788 -3.856 -1.387 . . . 1.0 . . . . . . . . . . . . A . 18 VAL H . . . . . . . . . c30225_5ug3 1 . 16 . 4540 . 1 1 18 VAL HA H 0.269 -4.660 -0.313 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HA . . . . . . . . . c30225_5ug3 1 . 16 . 4541 . 1 1 18 VAL HB H 1.766 -3.115 0.898 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HB . . . . . . . . . c30225_5ug3 1 . 16 . 4542 . 1 1 18 VAL HG11 H 2.596 -1.792 -0.952 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG11 . . . . . . . . . c30225_5ug3 1 . 16 . 4543 . 1 1 18 VAL HG12 H 1.865 -0.747 0.265 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG12 . . . . . . . . . c30225_5ug3 1 . 16 . 4544 . 1 1 18 VAL HG13 H 0.990 -1.117 -1.219 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG13 . . . . . . . . . c30225_5ug3 1 . 16 . 4545 . 1 1 18 VAL HG21 H -0.576 -3.191 1.504 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG21 . . . . . . . . . c30225_5ug3 1 . 16 . 4546 . 1 1 18 VAL HG22 H -0.957 -1.984 0.276 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG22 . . . . . . . . . c30225_5ug3 1 . 16 . 4547 . 1 1 18 VAL HG23 H 0.037 -1.544 1.664 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG23 . . . . . . . . . c30225_5ug3 1 . 16 . 4548 . 1 1 18 VAL N N 1.945 -4.353 -1.474 . . . 1.0 . . . . . . . . . . . . A . 18 VAL N . . . . . . . . . c30225_5ug3 1 . 16 . 4549 . 1 1 18 VAL O O -1.461 -3.349 -1.704 . . . 1.0 . . . . . . . . . . . . A . 18 VAL O . . . . . . . . . c30225_5ug3 1 . 16 . 4550 . 1 1 19 CYS C C 0.334 -2.417 -5.412 . . . 1.0 . . . . . . . . . . . . A . 19 CYS C . . . . . . . . . c30225_5ug3 1 . 16 . 4551 . 1 1 19 CYS CA C -0.510 -2.436 -4.145 . . . 1.0 . . . . . . . . . . . . A . 19 CYS CA . . . . . . . . . c30225_5ug3 1 . 16 . 4552 . 1 1 19 CYS CB C -1.091 -1.047 -3.871 . . . 1.0 . . . . . . . . . . . . A . 19 CYS CB . . . . . . . . . c30225_5ug3 1 . 16 . 4553 . 1 1 19 CYS H H 1.273 -2.872 -3.111 . . . 1.0 . . . . . . . . . . . . A . 19 CYS H . . . . . . . . . c30225_5ug3 1 . 16 . 4554 . 1 1 19 CYS HA H -1.320 -3.139 -4.276 . . . 1.0 . . . . . . . . . . . . A . 19 CYS HA . . . . . . . . . c30225_5ug3 1 . 16 . 4555 . 1 1 19 CYS HB2 H -1.638 -1.071 -2.941 . . . 1.0 . . . . . . . . . . . . A . 19 CYS HB2 . . . . . . . . . c30225_5ug3 1 . 16 . 4556 . 1 1 19 CYS HB3 H -0.281 -0.336 -3.789 . . . 1.0 . . . . . . . . . . . . A . 19 CYS HB3 . . . . . . . . . c30225_5ug3 1 . 16 . 4557 . 1 1 19 CYS N N 0.297 -2.890 -3.027 . . . 1.0 . . . . . . . . . . . . A . 19 CYS N . . . . . . . . . c30225_5ug3 1 . 16 . 4558 . 1 1 19 CYS O O 0.152 -3.310 -6.263 . . . 1.0 . . . . . . . . . . . . A . 19 CYS O . . . . . . . . . c30225_5ug3 1 . 16 . 4559 . 1 1 19 CYS OXT O 1.207 -1.532 -5.535 . . . 1.0 . . . . . . . . . . . . A . 19 CYS OXT . . . . . . . . . c30225_5ug3 1 . 16 . 4560 . 1 1 19 CYS SG S -2.225 -0.449 -5.167 . . . 1.0 . . . . . . . . . . . . A . 19 CYS SG . . . . . . . . . c30225_5ug3 1 . 17 . 4561 . 1 1 1 ILE C C -7.962 -1.970 -3.378 . . . 1.0 . . . . . . . . . . . . A . 1 ILE C . . . . . . . . . c30225_5ug3 1 . 17 . 4562 . 1 1 1 ILE CA C -7.369 -2.722 -4.562 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CA . . . . . . . . . c30225_5ug3 1 . 17 . 4563 . 1 1 1 ILE CB C -5.822 -2.709 -4.447 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CB . . . . . . . . . c30225_5ug3 1 . 17 . 4564 . 1 1 1 ILE CD1 C -4.950 -2.603 -6.850 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CD1 . . . . . . . . . c30225_5ug3 1 . 17 . 4565 . 1 1 1 ILE CG1 C -5.169 -3.455 -5.617 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CG1 . . . . . . . . . c30225_5ug3 1 . 17 . 4566 . 1 1 1 ILE CG2 C -5.381 -3.326 -3.127 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CG2 . . . . . . . . . c30225_5ug3 1 . 17 . 4567 . 1 1 1 ILE H1 H -7.457 -2.632 -6.639 . . . 1.0 . . . . . . . . . . . . A . 1 ILE H1 . . . . . . . . . c30225_5ug3 1 . 17 . 4568 . 1 1 1 ILE H2 H -7.526 -1.124 -5.882 . . . 1.0 . . . . . . . . . . . . A . 1 ILE H2 . . . . . . . . . c30225_5ug3 1 . 17 . 4569 . 1 1 1 ILE H3 H -8.875 -2.137 -5.868 . . . 1.0 . . . . . . . . . . . . A . 1 ILE H3 . . . . . . . . . c30225_5ug3 1 . 17 . 4570 . 1 1 1 ILE HA H -7.708 -3.748 -4.532 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HA . . . . . . . . . c30225_5ug3 1 . 17 . 4571 . 1 1 1 ILE HB H -5.495 -1.681 -4.459 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HB . . . . . . . . . c30225_5ug3 1 . 17 . 4572 . 1 1 1 ILE HD11 H -4.296 -1.779 -6.607 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HD11 . . . . . . . . . c30225_5ug3 1 . 17 . 4573 . 1 1 1 ILE HD12 H -5.897 -2.220 -7.197 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HD12 . . . . . . . . . c30225_5ug3 1 . 17 . 4574 . 1 1 1 ILE HD13 H -4.499 -3.204 -7.626 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HD13 . . . . . . . . . c30225_5ug3 1 . 17 . 4575 . 1 1 1 ILE HG12 H -4.205 -3.828 -5.302 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG12 . . . . . . . . . c30225_5ug3 1 . 17 . 4576 . 1 1 1 ILE HG13 H -5.796 -4.288 -5.896 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG13 . . . . . . . . . c30225_5ug3 1 . 17 . 4577 . 1 1 1 ILE HG21 H -4.303 -3.302 -3.060 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG21 . . . . . . . . . c30225_5ug3 1 . 17 . 4578 . 1 1 1 ILE HG22 H -5.720 -4.350 -3.077 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG22 . . . . . . . . . c30225_5ug3 1 . 17 . 4579 . 1 1 1 ILE HG23 H -5.806 -2.766 -2.308 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG23 . . . . . . . . . c30225_5ug3 1 . 17 . 4580 . 1 1 1 ILE N N -7.838 -2.112 -5.826 . . . 1.0 . . . . . . . . . . . . A . 1 ILE N . . . . . . . . . c30225_5ug3 1 . 17 . 4581 . 1 1 1 ILE O O -7.916 -0.740 -3.334 . . . 1.0 . . . . . . . . . . . . A . 1 ILE O . . . . . . . . . c30225_5ug3 1 . 17 . 4582 . 1 1 2 ARG C C -8.074 -1.789 -0.199 . . . 1.0 . . . . . . . . . . . . A . 2 ARG C . . . . . . . . . c30225_5ug3 1 . 17 . 4583 . 1 1 2 ARG CA C -9.132 -2.104 -1.249 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CA . . . . . . . . . c30225_5ug3 1 . 17 . 4584 . 1 1 2 ARG CB C -10.199 -3.025 -0.659 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CB . . . . . . . . . c30225_5ug3 1 . 17 . 4585 . 1 1 2 ARG CD C -12.412 -4.161 -0.947 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CD . . . . . . . . . c30225_5ug3 1 . 17 . 4586 . 1 1 2 ARG CG C -11.339 -3.325 -1.615 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CG . . . . . . . . . c30225_5ug3 1 . 17 . 4587 . 1 1 2 ARG CZ C -14.750 -4.728 -1.459 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CZ . . . . . . . . . c30225_5ug3 1 . 17 . 4588 . 1 1 2 ARG H H -8.533 -3.678 -2.515 . . . 1.0 . . . . . . . . . . . . A . 2 ARG H . . . . . . . . . c30225_5ug3 1 . 17 . 4589 . 1 1 2 ARG HA H -9.596 -1.186 -1.560 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HA . . . . . . . . . c30225_5ug3 1 . 17 . 4590 . 1 1 2 ARG HB2 H -9.737 -3.960 -0.379 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB2 . . . . . . . . . c30225_5ug3 1 . 17 . 4591 . 1 1 2 ARG HB3 H -10.612 -2.559 0.224 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB3 . . . . . . . . . c30225_5ug3 1 . 17 . 4592 . 1 1 2 ARG HD2 H -11.968 -5.083 -0.602 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD2 . . . . . . . . . c30225_5ug3 1 . 17 . 4593 . 1 1 2 ARG HD3 H -12.804 -3.612 -0.104 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD3 . . . . . . . . . c30225_5ug3 1 . 17 . 4594 . 1 1 2 ARG HE H -13.299 -4.508 -2.820 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HE . . . . . . . . . c30225_5ug3 1 . 17 . 4595 . 1 1 2 ARG HG2 H -11.775 -2.395 -1.946 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG2 . . . . . . . . . c30225_5ug3 1 . 17 . 4596 . 1 1 2 ARG HG3 H -10.950 -3.865 -2.466 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG3 . . . . . . . . . c30225_5ug3 1 . 17 . 4597 . 1 1 2 ARG HH11 H -14.355 -4.461 0.512 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH11 . . . . . . . . . c30225_5ug3 1 . 17 . 4598 . 1 1 2 ARG HH12 H -15.998 -4.864 0.135 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH12 . . . . . . . . . c30225_5ug3 1 . 17 . 4599 . 1 1 2 ARG HH21 H -15.457 -5.062 -3.328 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH21 . . . . . . . . . c30225_5ug3 1 . 17 . 4600 . 1 1 2 ARG HH22 H -16.625 -5.210 -2.054 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH22 . . . . . . . . . c30225_5ug3 1 . 17 . 4601 . 1 1 2 ARG N N -8.526 -2.705 -2.426 . . . 1.0 . . . . . . . . . . . . A . 2 ARG N . . . . . . . . . c30225_5ug3 1 . 17 . 4602 . 1 1 2 ARG NE N -13.507 -4.476 -1.857 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NE . . . . . . . . . c30225_5ug3 1 . 17 . 4603 . 1 1 2 ARG NH1 N -15.059 -4.682 -0.167 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH1 . . . . . . . . . c30225_5ug3 1 . 17 . 4604 . 1 1 2 ARG NH2 N -15.685 -5.024 -2.352 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH2 . . . . . . . . . c30225_5ug3 1 . 17 . 4605 . 1 1 2 ARG O O -8.098 -2.323 0.912 . . . 1.0 . . . . . . . . . . . . A . 2 ARG O . . . . . . . . . c30225_5ug3 1 . 17 . 4606 . 1 1 3 ASP C C -5.663 0.911 0.025 . . . 1.0 . . . . . . . . . . . . A . 3 ASP C . . . . . . . . . c30225_5ug3 1 . 17 . 4607 . 1 1 3 ASP CA C -6.069 -0.523 0.319 . . . 1.0 . . . . . . . . . . . . A . 3 ASP CA . . . . . . . . . c30225_5ug3 1 . 17 . 4608 . 1 1 3 ASP CB C -4.866 -1.452 0.150 . . . 1.0 . . . . . . . . . . . . A . 3 ASP CB . . . . . . . . . c30225_5ug3 1 . 17 . 4609 . 1 1 3 ASP CG C -3.677 -0.998 0.969 . . . 1.0 . . . . . . . . . . . . A . 3 ASP CG . . . . . . . . . c30225_5ug3 1 . 17 . 4610 . 1 1 3 ASP H H -7.207 -0.512 -1.454 . . . 1.0 . . . . . . . . . . . . A . 3 ASP H . . . . . . . . . c30225_5ug3 1 . 17 . 4611 . 1 1 3 ASP HA H -6.426 -0.584 1.336 . . . 1.0 . . . . . . . . . . . . A . 3 ASP HA . . . . . . . . . c30225_5ug3 1 . 17 . 4612 . 1 1 3 ASP HB2 H -5.139 -2.448 0.467 . . . 1.0 . . . . . . . . . . . . A . 3 ASP HB2 . . . . . . . . . c30225_5ug3 1 . 17 . 4613 . 1 1 3 ASP HB3 H -4.577 -1.475 -0.890 . . . 1.0 . . . . . . . . . . . . A . 3 ASP HB3 . . . . . . . . . c30225_5ug3 1 . 17 . 4614 . 1 1 3 ASP N N -7.151 -0.918 -0.562 . . . 1.0 . . . . . . . . . . . . A . 3 ASP N . . . . . . . . . c30225_5ug3 1 . 17 . 4615 . 1 1 3 ASP O O -5.338 1.254 -1.112 . . . 1.0 . . . . . . . . . . . . A . 3 ASP O . . . . . . . . . c30225_5ug3 1 . 17 . 4616 . 1 1 3 ASP OD1 O -3.584 -1.389 2.146 . . . 1.0 . . . . . . . . . . . . A . 3 ASP OD1 . . . . . . . . . c30225_5ug3 1 . 17 . 4617 . 1 1 3 ASP OD2 O -2.814 -0.268 0.426 . . . 1.0 . . . . . . . . . . . . A . 3 ASP OD2 . . . . . . . . . c30225_5ug3 1 . 17 . 4618 . 1 1 4 GLU C C -3.863 3.369 0.978 . . . 1.0 . . . . . . . . . . . . A . 4 GLU C . . . . . . . . . c30225_5ug3 1 . 17 . 4619 . 1 1 4 GLU CA C -5.370 3.155 0.895 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CA . . . . . . . . . c30225_5ug3 1 . 17 . 4620 . 1 1 4 GLU CB C -6.079 3.981 1.964 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CB . . . . . . . . . c30225_5ug3 1 . 17 . 4621 . 1 1 4 GLU CD C -8.279 4.654 2.988 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CD . . . . . . . . . c30225_5ug3 1 . 17 . 4622 . 1 1 4 GLU CG C -7.588 3.819 1.937 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CG . . . . . . . . . c30225_5ug3 1 . 17 . 4623 . 1 1 4 GLU H H -5.969 1.409 1.926 . . . 1.0 . . . . . . . . . . . . A . 4 GLU H . . . . . . . . . c30225_5ug3 1 . 17 . 4624 . 1 1 4 GLU HA H -5.712 3.473 -0.077 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HA . . . . . . . . . c30225_5ug3 1 . 17 . 4625 . 1 1 4 GLU HB2 H -5.722 3.675 2.937 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HB2 . . . . . . . . . c30225_5ug3 1 . 17 . 4626 . 1 1 4 GLU HB3 H -5.846 5.024 1.814 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HB3 . . . . . . . . . c30225_5ug3 1 . 17 . 4627 . 1 1 4 GLU HG2 H -7.952 4.118 0.966 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HG2 . . . . . . . . . c30225_5ug3 1 . 17 . 4628 . 1 1 4 GLU HG3 H -7.829 2.781 2.107 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HG3 . . . . . . . . . c30225_5ug3 1 . 17 . 4629 . 1 1 4 GLU N N -5.704 1.747 1.045 . . . 1.0 . . . . . . . . . . . . A . 4 GLU N . . . . . . . . . c30225_5ug3 1 . 17 . 4630 . 1 1 4 GLU O O -3.341 4.374 0.496 . . . 1.0 . . . . . . . . . . . . A . 4 GLU O . . . . . . . . . c30225_5ug3 1 . 17 . 4631 . 1 1 4 GLU OE1 O -8.778 5.746 2.651 . . . 1.0 . . . . . . . . . . . . A . 4 GLU OE1 . . . . . . . . . c30225_5ug3 1 . 17 . 4632 . 1 1 4 GLU OE2 O -8.319 4.227 4.157 . . . 1.0 . . . . . . . . . . . . A . 4 GLU OE2 . . . . . . . . . c30225_5ug3 1 . 17 . 4633 . 1 1 5 CYS C C -1.053 2.452 0.311 . . . 1.0 . . . . . . . . . . . . A . 5 CYS C . . . . . . . . . c30225_5ug3 1 . 17 . 4634 . 1 1 5 CYS CA C -1.714 2.461 1.688 . . . 1.0 . . . . . . . . . . . . A . 5 CYS CA . . . . . . . . . c30225_5ug3 1 . 17 . 4635 . 1 1 5 CYS CB C -1.204 1.290 2.527 . . . 1.0 . . . . . . . . . . . . A . 5 CYS CB . . . . . . . . . c30225_5ug3 1 . 17 . 4636 . 1 1 5 CYS H H -3.639 1.619 1.918 . . . 1.0 . . . . . . . . . . . . A . 5 CYS H . . . . . . . . . c30225_5ug3 1 . 17 . 4637 . 1 1 5 CYS HA H -1.463 3.384 2.187 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HA . . . . . . . . . c30225_5ug3 1 . 17 . 4638 . 1 1 5 CYS HB2 H -1.994 0.560 2.629 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HB2 . . . . . . . . . c30225_5ug3 1 . 17 . 4639 . 1 1 5 CYS HB3 H -0.368 0.834 2.020 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HB3 . . . . . . . . . c30225_5ug3 1 . 17 . 4640 . 1 1 5 CYS N N -3.166 2.403 1.566 . . . 1.0 . . . . . . . . . . . . A . 5 CYS N . . . . . . . . . c30225_5ug3 1 . 17 . 4641 . 1 1 5 CYS O O 0.112 2.809 0.167 . . . 1.0 . . . . . . . . . . . . A . 5 CYS O . . . . . . . . . c30225_5ug3 1 . 17 . 4642 . 1 1 5 CYS SG S -0.657 1.749 4.205 . . . 1.0 . . . . . . . . . . . . A . 5 CYS SG . . . . . . . . . c30225_5ug3 1 . 17 . 4643 . 1 1 6 CYS C C -1.052 3.504 -2.517 . . . 1.0 . . . . . . . . . . . . A . 6 CYS C . . . . . . . . . c30225_5ug3 1 . 17 . 4644 . 1 1 6 CYS CA C -1.375 2.077 -2.078 . . . 1.0 . . . . . . . . . . . . A . 6 CYS CA . . . . . . . . . c30225_5ug3 1 . 17 . 4645 . 1 1 6 CYS CB C -2.482 1.505 -2.959 . . . 1.0 . . . . . . . . . . . . A . 6 CYS CB . . . . . . . . . c30225_5ug3 1 . 17 . 4646 . 1 1 6 CYS H H -2.692 1.651 -0.482 . . . 1.0 . . . . . . . . . . . . A . 6 CYS H . . . . . . . . . c30225_5ug3 1 . 17 . 4647 . 1 1 6 CYS HA H -0.487 1.468 -2.175 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HA . . . . . . . . . c30225_5ug3 1 . 17 . 4648 . 1 1 6 CYS HB2 H -2.672 0.483 -2.668 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HB2 . . . . . . . . . c30225_5ug3 1 . 17 . 4649 . 1 1 6 CYS HB3 H -3.377 2.093 -2.802 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HB3 . . . . . . . . . c30225_5ug3 1 . 17 . 4650 . 1 1 6 CYS N N -1.810 2.036 -0.689 . . . 1.0 . . . . . . . . . . . . A . 6 CYS N . . . . . . . . . c30225_5ug3 1 . 17 . 4651 . 1 1 6 CYS O O -0.117 3.730 -3.289 . . . 1.0 . . . . . . . . . . . . A . 6 CYS O . . . . . . . . . c30225_5ug3 1 . 17 . 4652 . 1 1 6 CYS SG S -2.114 1.508 -4.746 . . . 1.0 . . . . . . . . . . . . A . 6 CYS SG . . . . . . . . . c30225_5ug3 1 . 17 . 4653 . 1 1 7 SER C C -0.540 6.456 -1.433 . . . 1.0 . . . . . . . . . . . . A . 7 SER C . . . . . . . . . c30225_5ug3 1 . 17 . 4654 . 1 1 7 SER CA C -1.608 5.868 -2.350 . . . 1.0 . . . . . . . . . . . . A . 7 SER CA . . . . . . . . . c30225_5ug3 1 . 17 . 4655 . 1 1 7 SER CB C -2.922 6.648 -2.220 . . . 1.0 . . . . . . . . . . . . A . 7 SER CB . . . . . . . . . c30225_5ug3 1 . 17 . 4656 . 1 1 7 SER H H -2.558 4.226 -1.415 . . . 1.0 . . . . . . . . . . . . A . 7 SER H . . . . . . . . . c30225_5ug3 1 . 17 . 4657 . 1 1 7 SER HA H -1.262 5.922 -3.373 . . . 1.0 . . . . . . . . . . . . A . 7 SER HA . . . . . . . . . c30225_5ug3 1 . 17 . 4658 . 1 1 7 SER HB2 H -3.677 6.178 -2.830 . . . 1.0 . . . . . . . . . . . . A . 7 SER HB2 . . . . . . . . . c30225_5ug3 1 . 17 . 4659 . 1 1 7 SER HB3 H -3.241 6.640 -1.188 . . . 1.0 . . . . . . . . . . . . A . 7 SER HB3 . . . . . . . . . c30225_5ug3 1 . 17 . 4660 . 1 1 7 SER HG H -2.334 8.497 -1.946 . . . 1.0 . . . . . . . . . . . . A . 7 SER HG . . . . . . . . . c30225_5ug3 1 . 17 . 4661 . 1 1 7 SER N N -1.823 4.466 -2.021 . . . 1.0 . . . . . . . . . . . . A . 7 SER N . . . . . . . . . c30225_5ug3 1 . 17 . 4662 . 1 1 7 SER O O -0.086 7.584 -1.618 . . . 1.0 . . . . . . . . . . . . A . 7 SER O . . . . . . . . . c30225_5ug3 1 . 17 . 4663 . 1 1 7 SER OG O -2.775 7.993 -2.641 . . . 1.0 . . . . . . . . . . . . A . 7 SER OG . . . . . . . . . c30225_5ug3 1 . 17 . 4664 . 1 1 8 ASN C C 2.219 5.513 0.134 . . . 1.0 . . . . . . . . . . . . A . 8 ASN C . . . . . . . . . c30225_5ug3 1 . 17 . 4665 . 1 1 8 ASN CA C 0.871 6.076 0.510 . . . 1.0 . . . . . . . . . . . . A . 8 ASN CA . . . . . . . . . c30225_5ug3 1 . 17 . 4666 . 1 1 8 ASN CB C 0.498 5.573 1.893 . . . 1.0 . . . . . . . . . . . . A . 8 ASN CB . . . . . . . . . c30225_5ug3 1 . 17 . 4667 . 1 1 8 ASN CG C -0.666 6.333 2.493 . . . 1.0 . . . . . . . . . . . . A . 8 ASN CG . . . . . . . . . c30225_5ug3 1 . 17 . 4668 . 1 1 8 ASN H H -0.500 4.759 -0.399 . . . 1.0 . . . . . . . . . . . . A . 8 ASN H . . . . . . . . . c30225_5ug3 1 . 17 . 4669 . 1 1 8 ASN HA H 0.917 7.154 0.519 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HA . . . . . . . . . c30225_5ug3 1 . 17 . 4670 . 1 1 8 ASN HB2 H 0.235 4.531 1.815 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HB2 . . . . . . . . . c30225_5ug3 1 . 17 . 4671 . 1 1 8 ASN HB3 H 1.350 5.671 2.549 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HB3 . . . . . . . . . c30225_5ug3 1 . 17 . 4672 . 1 1 8 ASN HD21 H -1.971 5.196 1.500 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HD21 . . . . . . . . . c30225_5ug3 1 . 17 . 4673 . 1 1 8 ASN HD22 H -2.647 6.426 2.514 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HD22 . . . . . . . . . c30225_5ug3 1 . 17 . 4674 . 1 1 8 ASN N N -0.131 5.664 -0.459 . . . 1.0 . . . . . . . . . . . . A . 8 ASN N . . . . . . . . . c30225_5ug3 1 . 17 . 4675 . 1 1 8 ASN ND2 N -1.882 5.947 2.136 . . . 1.0 . . . . . . . . . . . . A . 8 ASN ND2 . . . . . . . . . c30225_5ug3 1 . 17 . 4676 . 1 1 8 ASN O O 2.437 4.305 0.228 . . . 1.0 . . . . . . . . . . . . A . 8 ASN O . . . . . . . . . c30225_5ug3 1 . 17 . 4677 . 1 1 8 ASN OD1 O -0.471 7.280 3.254 . . . 1.0 . . . . . . . . . . . . A . 8 ASN OD1 . . . . . . . . . c30225_5ug3 1 . 17 . 4678 . 1 1 9 PRO C C 5.261 5.234 0.386 . . . 1.0 . . . . . . . . . . . . A . 9 PRO C . . . . . . . . . c30225_5ug3 1 . 17 . 4679 . 1 1 9 PRO CA C 4.461 5.908 -0.723 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CA . . . . . . . . . c30225_5ug3 1 . 17 . 4680 . 1 1 9 PRO CB C 5.147 7.189 -1.201 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CB . . . . . . . . . c30225_5ug3 1 . 17 . 4681 . 1 1 9 PRO CD C 3.036 7.833 -0.316 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CD . . . . . . . . . c30225_5ug3 1 . 17 . 4682 . 1 1 9 PRO CG C 4.459 8.284 -0.466 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CG . . . . . . . . . c30225_5ug3 1 . 17 . 4683 . 1 1 9 PRO HA H 4.351 5.220 -1.543 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HA . . . . . . . . . c30225_5ug3 1 . 17 . 4684 . 1 1 9 PRO HB2 H 6.200 7.151 -0.965 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HB2 . . . . . . . . . c30225_5ug3 1 . 17 . 4685 . 1 1 9 PRO HB3 H 5.012 7.293 -2.264 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HB3 . . . . . . . . . c30225_5ug3 1 . 17 . 4686 . 1 1 9 PRO HD2 H 2.618 8.217 0.596 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HD2 . . . . . . . . . c30225_5ug3 1 . 17 . 4687 . 1 1 9 PRO HD3 H 2.449 8.144 -1.166 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HD3 . . . . . . . . . c30225_5ug3 1 . 17 . 4688 . 1 1 9 PRO HG2 H 4.914 8.419 0.505 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HG2 . . . . . . . . . c30225_5ug3 1 . 17 . 4689 . 1 1 9 PRO HG3 H 4.505 9.199 -1.036 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HG3 . . . . . . . . . c30225_5ug3 1 . 17 . 4690 . 1 1 9 PRO N N 3.157 6.365 -0.268 . . . 1.0 . . . . . . . . . . . . A . 9 PRO N . . . . . . . . . c30225_5ug3 1 . 17 . 4691 . 1 1 9 PRO O O 6.238 4.550 0.125 . . . 1.0 . . . . . . . . . . . . A . 9 PRO O . . . . . . . . . c30225_5ug3 1 . 17 . 4692 . 1 1 10 VAL C C 5.182 3.287 2.795 . . . 1.0 . . . . . . . . . . . . A . 10 VAL C . . . . . . . . . c30225_5ug3 1 . 17 . 4693 . 1 1 10 VAL CA C 5.505 4.778 2.745 . . . 1.0 . . . . . . . . . . . . A . 10 VAL CA . . . . . . . . . c30225_5ug3 1 . 17 . 4694 . 1 1 10 VAL CB C 5.126 5.467 4.077 . . . 1.0 . . . . . . . . . . . . A . 10 VAL CB . . . . . . . . . c30225_5ug3 1 . 17 . 4695 . 1 1 10 VAL CG1 C 3.680 5.205 4.471 . . . 1.0 . . . . . . . . . . . . A . 10 VAL CG1 . . . . . . . . . c30225_5ug3 1 . 17 . 4696 . 1 1 10 VAL CG2 C 6.073 5.053 5.190 . . . 1.0 . . . . . . . . . . . . A . 10 VAL CG2 . . . . . . . . . c30225_5ug3 1 . 17 . 4697 . 1 1 10 VAL H H 4.020 5.940 1.779 . . . 1.0 . . . . . . . . . . . . A . 10 VAL H . . . . . . . . . c30225_5ug3 1 . 17 . 4698 . 1 1 10 VAL HA H 6.568 4.896 2.590 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HA . . . . . . . . . c30225_5ug3 1 . 17 . 4699 . 1 1 10 VAL HB H 5.227 6.522 3.927 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HB . . . . . . . . . c30225_5ug3 1 . 17 . 4700 . 1 1 10 VAL HG11 H 3.529 4.145 4.596 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HG11 . . . . . . . . . c30225_5ug3 1 . 17 . 4701 . 1 1 10 VAL HG12 H 3.027 5.572 3.696 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HG12 . . . . . . . . . c30225_5ug3 1 . 17 . 4702 . 1 1 10 VAL HG13 H 3.462 5.713 5.398 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HG13 . . . . . . . . . c30225_5ug3 1 . 17 . 4703 . 1 1 10 VAL HG21 H 6.015 3.984 5.329 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HG21 . . . . . . . . . c30225_5ug3 1 . 17 . 4704 . 1 1 10 VAL HG22 H 5.790 5.550 6.107 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HG22 . . . . . . . . . c30225_5ug3 1 . 17 . 4705 . 1 1 10 VAL HG23 H 7.082 5.330 4.927 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HG23 . . . . . . . . . c30225_5ug3 1 . 17 . 4706 . 1 1 10 VAL N N 4.822 5.398 1.622 . . . 1.0 . . . . . . . . . . . . A . 10 VAL N . . . . . . . . . c30225_5ug3 1 . 17 . 4707 . 1 1 10 VAL O O 6.058 2.446 2.990 . . . 1.0 . . . . . . . . . . . . A . 10 VAL O . . . . . . . . . c30225_5ug3 1 . 17 . 4708 . 1 1 11 CYS C C 3.971 0.802 1.435 . . . 1.0 . . . . . . . . . . . . A . 11 CYS C . . . . . . . . . c30225_5ug3 1 . 17 . 4709 . 1 1 11 CYS CA C 3.436 1.616 2.612 . . . 1.0 . . . . . . . . . . . . A . 11 CYS CA . . . . . . . . . c30225_5ug3 1 . 17 . 4710 . 1 1 11 CYS CB C 1.912 1.614 2.595 . . . 1.0 . . . . . . . . . . . . A . 11 CYS CB . . . . . . . . . c30225_5ug3 1 . 17 . 4711 . 1 1 11 CYS H H 3.282 3.703 2.402 . . . 1.0 . . . . . . . . . . . . A . 11 CYS H . . . . . . . . . c30225_5ug3 1 . 17 . 4712 . 1 1 11 CYS HA H 3.776 1.172 3.531 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HA . . . . . . . . . c30225_5ug3 1 . 17 . 4713 . 1 1 11 CYS HB2 H 1.569 1.987 1.642 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HB2 . . . . . . . . . c30225_5ug3 1 . 17 . 4714 . 1 1 11 CYS HB3 H 1.567 0.607 2.725 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HB3 . . . . . . . . . c30225_5ug3 1 . 17 . 4715 . 1 1 11 CYS N N 3.919 2.980 2.573 . . . 1.0 . . . . . . . . . . . . A . 11 CYS N . . . . . . . . . c30225_5ug3 1 . 17 . 4716 . 1 1 11 CYS O O 4.557 -0.260 1.625 . . . 1.0 . . . . . . . . . . . . A . 11 CYS O . . . . . . . . . c30225_5ug3 1 . 17 . 4717 . 1 1 11 CYS SG S 1.144 2.634 3.897 . . . 1.0 . . . . . . . . . . . . A . 11 CYS SG . . . . . . . . . c30225_5ug3 1 . 17 . 4718 . 1 1 12 ARG C C 5.661 0.353 -1.104 . . . 1.0 . . . . . . . . . . . . A . 12 ARG C . . . . . . . . . c30225_5ug3 1 . 17 . 4719 . 1 1 12 ARG CA C 4.163 0.582 -0.991 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CA . . . . . . . . . c30225_5ug3 1 . 17 . 4720 . 1 1 12 ARG CB C 3.624 1.270 -2.240 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CB . . . . . . . . . c30225_5ug3 1 . 17 . 4721 . 1 1 12 ARG CD C 3.045 3.418 -3.371 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CD . . . . . . . . . c30225_5ug3 1 . 17 . 4722 . 1 1 12 ARG CG C 3.717 2.769 -2.178 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CG . . . . . . . . . c30225_5ug3 1 . 17 . 4723 . 1 1 12 ARG CZ C 2.858 2.743 -5.734 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CZ . . . . . . . . . c30225_5ug3 1 . 17 . 4724 . 1 1 12 ARG H H 3.377 2.202 0.138 . . . 1.0 . . . . . . . . . . . . A . 12 ARG H . . . . . . . . . c30225_5ug3 1 . 17 . 4725 . 1 1 12 ARG HA H 3.707 -0.361 -0.923 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HA . . . . . . . . . c30225_5ug3 1 . 17 . 4726 . 1 1 12 ARG HB2 H 4.186 0.931 -3.097 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HB2 . . . . . . . . . c30225_5ug3 1 . 17 . 4727 . 1 1 12 ARG HB3 H 2.587 0.997 -2.368 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HB3 . . . . . . . . . c30225_5ug3 1 . 17 . 4728 . 1 1 12 ARG HD2 H 1.989 3.196 -3.328 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HD2 . . . . . . . . . c30225_5ug3 1 . 17 . 4729 . 1 1 12 ARG HD3 H 3.191 4.487 -3.316 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HD3 . . . . . . . . . c30225_5ug3 1 . 17 . 4730 . 1 1 12 ARG HE H 4.546 2.723 -4.664 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HE . . . . . . . . . c30225_5ug3 1 . 17 . 4731 . 1 1 12 ARG HG2 H 3.219 3.089 -1.282 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HG2 . . . . . . . . . c30225_5ug3 1 . 17 . 4732 . 1 1 12 ARG HG3 H 4.755 3.058 -2.148 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HG3 . . . . . . . . . c30225_5ug3 1 . 17 . 4733 . 1 1 12 ARG HH11 H 1.118 3.374 -4.905 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH11 . . . . . . . . . c30225_5ug3 1 . 17 . 4734 . 1 1 12 ARG HH12 H 1.014 2.885 -6.565 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH12 . . . . . . . . . c30225_5ug3 1 . 17 . 4735 . 1 1 12 ARG HH21 H 4.413 2.073 -6.846 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH21 . . . . . . . . . c30225_5ug3 1 . 17 . 4736 . 1 1 12 ARG HH22 H 2.887 2.140 -7.667 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH22 . . . . . . . . . c30225_5ug3 1 . 17 . 4737 . 1 1 12 ARG N N 3.787 1.315 0.221 . . . 1.0 . . . . . . . . . . . . A . 12 ARG N . . . . . . . . . c30225_5ug3 1 . 17 . 4738 . 1 1 12 ARG NE N 3.584 2.928 -4.635 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NE . . . . . . . . . c30225_5ug3 1 . 17 . 4739 . 1 1 12 ARG NH1 N 1.559 3.022 -5.734 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NH1 . . . . . . . . . c30225_5ug3 1 . 17 . 4740 . 1 1 12 ARG NH2 N 3.433 2.284 -6.837 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NH2 . . . . . . . . . c30225_5ug3 1 . 17 . 4741 . 1 1 12 ARG O O 6.111 -0.543 -1.817 . . . 1.0 . . . . . . . . . . . . A . 12 ARG O . . . . . . . . . c30225_5ug3 1 . 17 . 4742 . 1 1 13 VAL C C 8.388 0.074 0.611 . . . 1.0 . . . . . . . . . . . . A . 13 VAL C . . . . . . . . . c30225_5ug3 1 . 17 . 4743 . 1 1 13 VAL CA C 7.865 1.047 -0.439 . . . 1.0 . . . . . . . . . . . . A . 13 VAL CA . . . . . . . . . c30225_5ug3 1 . 17 . 4744 . 1 1 13 VAL CB C 8.461 2.440 -0.277 . . . 1.0 . . . . . . . . . . . . A . 13 VAL CB . . . . . . . . . c30225_5ug3 1 . 17 . 4745 . 1 1 13 VAL CG1 C 9.935 2.389 0.063 . . . 1.0 . . . . . . . . . . . . A . 13 VAL CG1 . . . . . . . . . c30225_5ug3 1 . 17 . 4746 . 1 1 13 VAL CG2 C 8.200 3.200 -1.563 . . . 1.0 . . . . . . . . . . . . A . 13 VAL CG2 . . . . . . . . . c30225_5ug3 1 . 17 . 4747 . 1 1 13 VAL H H 6.019 1.850 0.149 . . . 1.0 . . . . . . . . . . . . A . 13 VAL H . . . . . . . . . c30225_5ug3 1 . 17 . 4748 . 1 1 13 VAL HA H 8.142 0.678 -1.416 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HA . . . . . . . . . c30225_5ug3 1 . 17 . 4749 . 1 1 13 VAL HB H 7.943 2.945 0.523 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HB . . . . . . . . . c30225_5ug3 1 . 17 . 4750 . 1 1 13 VAL HG11 H 10.470 1.880 -0.722 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HG11 . . . . . . . . . c30225_5ug3 1 . 17 . 4751 . 1 1 13 VAL HG12 H 10.060 1.852 0.995 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HG12 . . . . . . . . . c30225_5ug3 1 . 17 . 4752 . 1 1 13 VAL HG13 H 10.313 3.392 0.173 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HG13 . . . . . . . . . c30225_5ug3 1 . 17 . 4753 . 1 1 13 VAL HG21 H 8.821 2.804 -2.349 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HG21 . . . . . . . . . c30225_5ug3 1 . 17 . 4754 . 1 1 13 VAL HG22 H 8.410 4.247 -1.418 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HG22 . . . . . . . . . c30225_5ug3 1 . 17 . 4755 . 1 1 13 VAL HG23 H 7.152 3.068 -1.833 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HG23 . . . . . . . . . c30225_5ug3 1 . 17 . 4756 . 1 1 13 VAL N N 6.428 1.155 -0.405 . . . 1.0 . . . . . . . . . . . . A . 13 VAL N . . . . . . . . . c30225_5ug3 1 . 17 . 4757 . 1 1 13 VAL O O 9.317 -0.692 0.359 . . . 1.0 . . . . . . . . . . . . A . 13 VAL O . . . . . . . . . c30225_5ug3 1 . 17 . 4758 . 1 1 14 ASN C C 7.524 -2.191 2.633 . . . 1.0 . . . . . . . . . . . . A . 14 ASN C . . . . . . . . . c30225_5ug3 1 . 17 . 4759 . 1 1 14 ASN CA C 8.162 -0.820 2.848 . . . 1.0 . . . . . . . . . . . . A . 14 ASN CA . . . . . . . . . c30225_5ug3 1 . 17 . 4760 . 1 1 14 ASN CB C 7.736 -0.243 4.194 . . . 1.0 . . . . . . . . . . . . A . 14 ASN CB . . . . . . . . . c30225_5ug3 1 . 17 . 4761 . 1 1 14 ASN CG C 8.172 -1.094 5.366 . . . 1.0 . . . . . . . . . . . . A . 14 ASN CG . . . . . . . . . c30225_5ug3 1 . 17 . 4762 . 1 1 14 ASN H H 7.050 0.733 1.935 . . . 1.0 . . . . . . . . . . . . A . 14 ASN H . . . . . . . . . c30225_5ug3 1 . 17 . 4763 . 1 1 14 ASN HA H 9.236 -0.924 2.830 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HA . . . . . . . . . c30225_5ug3 1 . 17 . 4764 . 1 1 14 ASN HB2 H 8.169 0.739 4.309 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HB2 . . . . . . . . . c30225_5ug3 1 . 17 . 4765 . 1 1 14 ASN HB3 H 6.659 -0.159 4.215 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HB3 . . . . . . . . . c30225_5ug3 1 . 17 . 4766 . 1 1 14 ASN HD21 H 6.520 -0.598 6.325 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HD21 . . . . . . . . . c30225_5ug3 1 . 17 . 4767 . 1 1 14 ASN HD22 H 7.588 -1.662 7.172 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HD22 . . . . . . . . . c30225_5ug3 1 . 17 . 4768 . 1 1 14 ASN N N 7.775 0.089 1.780 . . . 1.0 . . . . . . . . . . . . A . 14 ASN N . . . . . . . . . c30225_5ug3 1 . 17 . 4769 . 1 1 14 ASN ND2 N 7.347 -1.121 6.390 . . . 1.0 . . . . . . . . . . . . A . 14 ASN ND2 . . . . . . . . . c30225_5ug3 1 . 17 . 4770 . 1 1 14 ASN O O 7.999 -3.207 3.141 . . . 1.0 . . . . . . . . . . . . A . 14 ASN O . . . . . . . . . c30225_5ug3 1 . 17 . 4771 . 1 1 14 ASN OD1 O 9.231 -1.722 5.347 . . . 1.0 . . . . . . . . . . . . A . 14 ASN OD1 . . . . . . . . . c30225_5ug3 1 . 17 . 4772 . 1 1 15 ASN C C 5.206 -3.412 0.157 . . . 1.0 . . . . . . . . . . . . A . 15 ASN C . . . . . . . . . c30225_5ug3 1 . 17 . 4773 . 1 1 15 ASN CA C 5.709 -3.431 1.595 . . . 1.0 . . . . . . . . . . . . A . 15 ASN CA . . . . . . . . . c30225_5ug3 1 . 17 . 4774 . 1 1 15 ASN CB C 4.532 -3.529 2.560 . . . 1.0 . . . . . . . . . . . . A . 15 ASN CB . . . . . . . . . c30225_5ug3 1 . 17 . 4775 . 1 1 15 ASN CG C 3.846 -4.884 2.534 . . . 1.0 . . . . . . . . . . . . A . 15 ASN CG . . . . . . . . . c30225_5ug3 1 . 17 . 4776 . 1 1 15 ASN H H 6.155 -1.380 1.438 . . . 1.0 . . . . . . . . . . . . A . 15 ASN H . . . . . . . . . c30225_5ug3 1 . 17 . 4777 . 1 1 15 ASN HA H 6.368 -4.275 1.737 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HA . . . . . . . . . c30225_5ug3 1 . 17 . 4778 . 1 1 15 ASN HB2 H 4.881 -3.339 3.565 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HB2 . . . . . . . . . c30225_5ug3 1 . 17 . 4779 . 1 1 15 ASN HB3 H 3.816 -2.776 2.285 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HB3 . . . . . . . . . c30225_5ug3 1 . 17 . 4780 . 1 1 15 ASN HD21 H 2.582 -4.256 1.140 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HD21 . . . . . . . . . c30225_5ug3 1 . 17 . 4781 . 1 1 15 ASN HD22 H 2.372 -5.890 1.662 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HD22 . . . . . . . . . c30225_5ug3 1 . 17 . 4782 . 1 1 15 ASN N N 6.456 -2.213 1.856 . . . 1.0 . . . . . . . . . . . . A . 15 ASN N . . . . . . . . . c30225_5ug3 1 . 17 . 4783 . 1 1 15 ASN ND2 N 2.832 -5.024 1.695 . . . 1.0 . . . . . . . . . . . . A . 15 ASN ND2 . . . . . . . . . c30225_5ug3 1 . 17 . 4784 . 1 1 15 ASN O O 4.080 -2.999 -0.118 . . . 1.0 . . . . . . . . . . . . A . 15 ASN O . . . . . . . . . c30225_5ug3 1 . 17 . 4785 . 1 1 15 ASN OD1 O 4.217 -5.797 3.273 . . . 1.0 . . . . . . . . . . . . A . 15 ASN OD1 . . . . . . . . . c30225_5ug3 1 . 17 . 4786 . 1 1 16 HYP C C 4.811 -4.797 -2.761 . . . 1.0 . . . . . . . . . . . . A . 16 HYP C . . . . . . . . . c30225_5ug3 1 . 17 . 4787 . 1 1 16 HYP CA C 5.793 -3.756 -2.229 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CA . . . . . . . . . c30225_5ug3 1 . 17 . 4788 . 1 1 16 HYP CB C 7.188 -3.977 -2.775 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CB . . . . . . . . . c30225_5ug3 1 . 17 . 4789 . 1 1 16 HYP CD C 7.338 -4.533 -0.481 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CD . . . . . . . . . c30225_5ug3 1 . 17 . 4790 . 1 1 16 HYP CG C 8.179 -4.158 -1.648 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CG . . . . . . . . . c30225_5ug3 1 . 17 . 4791 . 1 1 16 HYP HA H 5.451 -2.768 -2.498 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HA . . . . . . . . . c30225_5ug3 1 . 17 . 4792 . 1 1 16 HYP HB2 H 7.482 -3.121 -3.362 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HB2 . . . . . . . . . c30225_5ug3 1 . 17 . 4793 . 1 1 16 HYP HB3 H 7.189 -4.859 -3.401 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HB3 . . . . . . . . . c30225_5ug3 1 . 17 . 4794 . 1 1 16 HYP HD1 H 8.380 -2.644 -0.472 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HD1 . . . . . . . . . c30225_5ug3 1 . 17 . 4795 . 1 1 16 HYP HD22 H 7.230 -5.582 -0.422 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HD22 . . . . . . . . . c30225_5ug3 1 . 17 . 4796 . 1 1 16 HYP HD23 H 7.769 -4.146 0.429 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HD23 . . . . . . . . . c30225_5ug3 1 . 17 . 4797 . 1 1 16 HYP HG H 8.918 -4.910 -1.886 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HG . . . . . . . . . c30225_5ug3 1 . 17 . 4798 . 1 1 16 HYP N N 6.046 -3.866 -0.774 . . . 1.0 . . . . . . . . . . . . A . 16 HYP N . . . . . . . . . c30225_5ug3 1 . 17 . 4799 . 1 1 16 HYP O O 4.951 -5.293 -3.881 . . . 1.0 . . . . . . . . . . . . A . 16 HYP O . . . . . . . . . c30225_5ug3 1 . 17 . 4800 . 1 1 16 HYP OD1 O 8.792 -2.936 -1.303 . . . 1.0 . . . . . . . . . . . . A . 16 HYP OD1 . . . . . . . . . c30225_5ug3 1 . 17 . 4801 . 1 1 17 HIS C C 1.479 -5.596 -1.571 . . . 1.0 . . . . . . . . . . . . A . 17 HIS C . . . . . . . . . c30225_5ug3 1 . 17 . 4802 . 1 1 17 HIS CA C 2.729 -5.979 -2.359 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CA . . . . . . . . . c30225_5ug3 1 . 17 . 4803 . 1 1 17 HIS CB C 3.083 -7.460 -2.163 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CB . . . . . . . . . c30225_5ug3 1 . 17 . 4804 . 1 1 17 HIS CD2 C 1.322 -9.359 -2.242 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CD2 . . . . . . . . . c30225_5ug3 1 . 17 . 4805 . 1 1 17 HIS CE1 C 0.888 -9.305 -4.385 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CE1 . . . . . . . . . c30225_5ug3 1 . 17 . 4806 . 1 1 17 HIS CG C 2.100 -8.400 -2.790 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CG . . . . . . . . . c30225_5ug3 1 . 17 . 4807 . 1 1 17 HIS H H 3.845 -4.788 -1.023 . . . 1.0 . . . . . . . . . . . . A . 17 HIS H . . . . . . . . . c30225_5ug3 1 . 17 . 4808 . 1 1 17 HIS HA H 2.547 -5.794 -3.409 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HA . . . . . . . . . c30225_5ug3 1 . 17 . 4809 . 1 1 17 HIS HB2 H 4.051 -7.654 -2.600 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HB2 . . . . . . . . . c30225_5ug3 1 . 17 . 4810 . 1 1 17 HIS HB3 H 3.121 -7.676 -1.106 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HB3 . . . . . . . . . c30225_5ug3 1 . 17 . 4811 . 1 1 17 HIS HD1 H 2.212 -7.806 -4.808 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HD1 . . . . . . . . . c30225_5ug3 1 . 17 . 4812 . 1 1 17 HIS HD2 H 1.294 -9.642 -1.199 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HD2 . . . . . . . . . c30225_5ug3 1 . 17 . 4813 . 1 1 17 HIS HE1 H 0.462 -9.522 -5.353 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HE1 . . . . . . . . . c30225_5ug3 1 . 17 . 4814 . 1 1 17 HIS HE2 H -0.228 -10.459 -3.120 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HE2 . . . . . . . . . c30225_5ug3 1 . 17 . 4815 . 1 1 17 HIS N N 3.827 -5.126 -1.943 . . . 1.0 . . . . . . . . . . . . A . 17 HIS N . . . . . . . . . c30225_5ug3 1 . 17 . 4816 . 1 1 17 HIS ND1 N 1.804 -8.394 -4.134 . . . 1.0 . . . . . . . . . . . . A . 17 HIS ND1 . . . . . . . . . c30225_5ug3 1 . 17 . 4817 . 1 1 17 HIS NE2 N 0.575 -9.908 -3.253 . . . 1.0 . . . . . . . . . . . . A . 17 HIS NE2 . . . . . . . . . c30225_5ug3 1 . 17 . 4818 . 1 1 17 HIS O O 0.617 -6.425 -1.279 . . . 1.0 . . . . . . . . . . . . A . 17 HIS O . . . . . . . . . c30225_5ug3 1 . 17 . 4819 . 1 1 18 VAL C C -0.856 -3.394 -1.428 . . . 1.0 . . . . . . . . . . . . A . 18 VAL C . . . . . . . . . c30225_5ug3 1 . 17 . 4820 . 1 1 18 VAL CA C 0.259 -3.812 -0.472 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CA . . . . . . . . . c30225_5ug3 1 . 17 . 4821 . 1 1 18 VAL CB C 0.661 -2.624 0.440 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CB . . . . . . . . . c30225_5ug3 1 . 17 . 4822 . 1 1 18 VAL CG1 C 1.036 -1.393 -0.373 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CG1 . . . . . . . . . c30225_5ug3 1 . 17 . 4823 . 1 1 18 VAL CG2 C -0.447 -2.302 1.428 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CG2 . . . . . . . . . c30225_5ug3 1 . 17 . 4824 . 1 1 18 VAL H H 2.111 -3.699 -1.491 . . . 1.0 . . . . . . . . . . . . A . 18 VAL H . . . . . . . . . c30225_5ug3 1 . 17 . 4825 . 1 1 18 VAL HA H -0.105 -4.614 0.157 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HA . . . . . . . . . c30225_5ug3 1 . 17 . 4826 . 1 1 18 VAL HB H 1.533 -2.920 1.006 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HB . . . . . . . . . c30225_5ug3 1 . 17 . 4827 . 1 1 18 VAL HG11 H 1.885 -1.620 -0.997 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG11 . . . . . . . . . c30225_5ug3 1 . 17 . 4828 . 1 1 18 VAL HG12 H 1.286 -0.583 0.295 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG12 . . . . . . . . . c30225_5ug3 1 . 17 . 4829 . 1 1 18 VAL HG13 H 0.200 -1.104 -0.992 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG13 . . . . . . . . . c30225_5ug3 1 . 17 . 4830 . 1 1 18 VAL HG21 H -0.135 -1.489 2.066 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG21 . . . . . . . . . c30225_5ug3 1 . 17 . 4831 . 1 1 18 VAL HG22 H -0.656 -3.173 2.031 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG22 . . . . . . . . . c30225_5ug3 1 . 17 . 4832 . 1 1 18 VAL HG23 H -1.338 -2.015 0.889 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG23 . . . . . . . . . c30225_5ug3 1 . 17 . 4833 . 1 1 18 VAL N N 1.396 -4.318 -1.222 . . . 1.0 . . . . . . . . . . . . A . 18 VAL N . . . . . . . . . c30225_5ug3 1 . 17 . 4834 . 1 1 18 VAL O O -2.039 -3.427 -1.083 . . . 1.0 . . . . . . . . . . . . A . 18 VAL O . . . . . . . . . c30225_5ug3 1 . 17 . 4835 . 1 1 19 CYS C C -1.502 -3.656 -4.763 . . . 1.0 . . . . . . . . . . . . A . 19 CYS C . . . . . . . . . c30225_5ug3 1 . 17 . 4836 . 1 1 19 CYS CA C -1.414 -2.610 -3.654 . . . 1.0 . . . . . . . . . . . . A . 19 CYS CA . . . . . . . . . c30225_5ug3 1 . 17 . 4837 . 1 1 19 CYS CB C -0.988 -1.255 -4.221 . . . 1.0 . . . . . . . . . . . . A . 19 CYS CB . . . . . . . . . c30225_5ug3 1 . 17 . 4838 . 1 1 19 CYS H H 0.485 -3.079 -2.870 . . . 1.0 . . . . . . . . . . . . A . 19 CYS H . . . . . . . . . c30225_5ug3 1 . 17 . 4839 . 1 1 19 CYS HA H -2.382 -2.512 -3.185 . . . 1.0 . . . . . . . . . . . . A . 19 CYS HA . . . . . . . . . c30225_5ug3 1 . 17 . 4840 . 1 1 19 CYS HB2 H -0.771 -0.586 -3.402 . . . 1.0 . . . . . . . . . . . . A . 19 CYS HB2 . . . . . . . . . c30225_5ug3 1 . 17 . 4841 . 1 1 19 CYS HB3 H -0.096 -1.387 -4.815 . . . 1.0 . . . . . . . . . . . . A . 19 CYS HB3 . . . . . . . . . c30225_5ug3 1 . 17 . 4842 . 1 1 19 CYS N N -0.468 -3.041 -2.644 . . . 1.0 . . . . . . . . . . . . A . 19 CYS N . . . . . . . . . c30225_5ug3 1 . 17 . 4843 . 1 1 19 CYS O O -2.365 -4.553 -4.669 . . . 1.0 . . . . . . . . . . . . A . 19 CYS O . . . . . . . . . c30225_5ug3 1 . 17 . 4844 . 1 1 19 CYS OXT O -0.684 -3.603 -5.705 . . . 1.0 . . . . . . . . . . . . A . 19 CYS OXT . . . . . . . . . c30225_5ug3 1 . 17 . 4845 . 1 1 19 CYS SG S -2.240 -0.449 -5.272 . . . 1.0 . . . . . . . . . . . . A . 19 CYS SG . . . . . . . . . c30225_5ug3 1 . 18 . 4846 . 1 1 1 ILE C C -4.582 -4.835 -4.715 . . . 1.0 . . . . . . . . . . . . A . 1 ILE C . . . . . . . . . c30225_5ug3 1 . 18 . 4847 . 1 1 1 ILE CA C -5.213 -6.122 -5.221 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CA . . . . . . . . . c30225_5ug3 1 . 18 . 4848 . 1 1 1 ILE CB C -4.160 -6.909 -6.025 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CB . . . . . . . . . c30225_5ug3 1 . 18 . 4849 . 1 1 1 ILE CD1 C -2.798 -6.887 -8.185 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CD1 . . . . . . . . . c30225_5ug3 1 . 18 . 4850 . 1 1 1 ILE CG1 C -3.882 -6.219 -7.366 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CG1 . . . . . . . . . c30225_5ug3 1 . 18 . 4851 . 1 1 1 ILE CG2 C -4.615 -8.345 -6.240 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CG2 . . . . . . . . . c30225_5ug3 1 . 18 . 4852 . 1 1 1 ILE H1 H -6.848 -6.752 -6.341 . . . 1.0 . . . . . . . . . . . . A . 1 ILE H1 . . . . . . . . . c30225_5ug3 1 . 18 . 4853 . 1 1 1 ILE H2 H -6.184 -5.290 -6.867 . . . 1.0 . . . . . . . . . . . . A . 1 ILE H2 . . . . . . . . . c30225_5ug3 1 . 18 . 4854 . 1 1 1 ILE H3 H -7.125 -5.335 -5.466 . . . 1.0 . . . . . . . . . . . . A . 1 ILE H3 . . . . . . . . . c30225_5ug3 1 . 18 . 4855 . 1 1 1 ILE HA H -5.502 -6.713 -4.371 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HA . . . . . . . . . c30225_5ug3 1 . 18 . 4856 . 1 1 1 ILE HB H -3.252 -6.927 -5.447 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HB . . . . . . . . . c30225_5ug3 1 . 18 . 4857 . 1 1 1 ILE HD11 H -2.667 -6.351 -9.111 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HD11 . . . . . . . . . c30225_5ug3 1 . 18 . 4858 . 1 1 1 ILE HD12 H -3.083 -7.908 -8.395 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HD12 . . . . . . . . . c30225_5ug3 1 . 18 . 4859 . 1 1 1 ILE HD13 H -1.873 -6.879 -7.630 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HD13 . . . . . . . . . c30225_5ug3 1 . 18 . 4860 . 1 1 1 ILE HG12 H -4.785 -6.221 -7.955 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG12 . . . . . . . . . c30225_5ug3 1 . 18 . 4861 . 1 1 1 ILE HG13 H -3.579 -5.199 -7.181 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG13 . . . . . . . . . c30225_5ug3 1 . 18 . 4862 . 1 1 1 ILE HG21 H -4.738 -8.832 -5.283 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG21 . . . . . . . . . c30225_5ug3 1 . 18 . 4863 . 1 1 1 ILE HG22 H -3.873 -8.875 -6.821 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG22 . . . . . . . . . c30225_5ug3 1 . 18 . 4864 . 1 1 1 ILE HG23 H -5.557 -8.349 -6.768 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG23 . . . . . . . . . c30225_5ug3 1 . 18 . 4865 . 1 1 1 ILE N N -6.425 -5.855 -6.030 . . . 1.0 . . . . . . . . . . . . A . 1 ILE N . . . . . . . . . c30225_5ug3 1 . 18 . 4866 . 1 1 1 ILE O O -3.430 -4.821 -4.280 . . . 1.0 . . . . . . . . . . . . A . 1 ILE O . . . . . . . . . c30225_5ug3 1 . 18 . 4867 . 1 1 2 ARG C C -5.691 -2.036 -3.097 . . . 1.0 . . . . . . . . . . . . A . 2 ARG C . . . . . . . . . c30225_5ug3 1 . 18 . 4868 . 1 1 2 ARG CA C -4.862 -2.477 -4.292 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CA . . . . . . . . . c30225_5ug3 1 . 18 . 4869 . 1 1 2 ARG CB C -4.929 -1.416 -5.394 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CB . . . . . . . . . c30225_5ug3 1 . 18 . 4870 . 1 1 2 ARG CD C -2.766 -2.138 -6.493 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CD . . . . . . . . . c30225_5ug3 1 . 18 . 4871 . 1 1 2 ARG CG C -4.241 -1.816 -6.691 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CG . . . . . . . . . c30225_5ug3 1 . 18 . 4872 . 1 1 2 ARG CZ C -1.023 -3.206 -7.892 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CZ . . . . . . . . . c30225_5ug3 1 . 18 . 4873 . 1 1 2 ARG H H -6.239 -3.825 -5.118 . . . 1.0 . . . . . . . . . . . . A . 2 ARG H . . . . . . . . . c30225_5ug3 1 . 18 . 4874 . 1 1 2 ARG HA H -3.842 -2.603 -3.982 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HA . . . . . . . . . c30225_5ug3 1 . 18 . 4875 . 1 1 2 ARG HB2 H -5.967 -1.211 -5.612 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB2 . . . . . . . . . c30225_5ug3 1 . 18 . 4876 . 1 1 2 ARG HB3 H -4.464 -0.511 -5.030 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB3 . . . . . . . . . c30225_5ug3 1 . 18 . 4877 . 1 1 2 ARG HD2 H -2.278 -1.283 -6.048 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD2 . . . . . . . . . c30225_5ug3 1 . 18 . 4878 . 1 1 2 ARG HD3 H -2.679 -2.989 -5.832 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD3 . . . . . . . . . c30225_5ug3 1 . 18 . 4879 . 1 1 2 ARG HE H -2.519 -2.070 -8.576 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HE . . . . . . . . . c30225_5ug3 1 . 18 . 4880 . 1 1 2 ARG HG2 H -4.734 -2.689 -7.090 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG2 . . . . . . . . . c30225_5ug3 1 . 18 . 4881 . 1 1 2 ARG HG3 H -4.328 -1.002 -7.396 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG3 . . . . . . . . . c30225_5ug3 1 . 18 . 4882 . 1 1 2 ARG HH11 H -0.814 -3.580 -5.908 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH11 . . . . . . . . . c30225_5ug3 1 . 18 . 4883 . 1 1 2 ARG HH12 H 0.388 -4.297 -6.935 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH12 . . . . . . . . . c30225_5ug3 1 . 18 . 4884 . 1 1 2 ARG HH21 H -0.939 -3.025 -9.909 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH21 . . . . . . . . . c30225_5ug3 1 . 18 . 4885 . 1 1 2 ARG HH22 H 0.307 -4.002 -9.198 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH22 . . . . . . . . . c30225_5ug3 1 . 18 . 4886 . 1 1 2 ARG N N -5.337 -3.757 -4.769 . . . 1.0 . . . . . . . . . . . . A . 2 ARG N . . . . . . . . . c30225_5ug3 1 . 18 . 4887 . 1 1 2 ARG NE N -2.115 -2.452 -7.764 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NE . . . . . . . . . c30225_5ug3 1 . 18 . 4888 . 1 1 2 ARG NH1 N -0.438 -3.738 -6.827 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH1 . . . . . . . . . c30225_5ug3 1 . 18 . 4889 . 1 1 2 ARG NH2 N -0.509 -3.427 -9.096 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH2 . . . . . . . . . c30225_5ug3 1 . 18 . 4890 . 1 1 2 ARG O O -6.922 -2.046 -3.147 . . . 1.0 . . . . . . . . . . . . A . 2 ARG O . . . . . . . . . c30225_5ug3 1 . 18 . 4891 . 1 1 3 ASP C C -5.516 0.298 -0.699 . . . 1.0 . . . . . . . . . . . . A . 3 ASP C . . . . . . . . . c30225_5ug3 1 . 18 . 4892 . 1 1 3 ASP CA C -5.676 -1.211 -0.824 . . . 1.0 . . . . . . . . . . . . A . 3 ASP CA . . . . . . . . . c30225_5ug3 1 . 18 . 4893 . 1 1 3 ASP CB C -5.094 -1.931 0.402 . . . 1.0 . . . . . . . . . . . . A . 3 ASP CB . . . . . . . . . c30225_5ug3 1 . 18 . 4894 . 1 1 3 ASP CG C -5.540 -3.378 0.507 . . . 1.0 . . . . . . . . . . . . A . 3 ASP CG . . . . . . . . . c30225_5ug3 1 . 18 . 4895 . 1 1 3 ASP H H -4.041 -1.681 -2.038 . . . 1.0 . . . . . . . . . . . . A . 3 ASP H . . . . . . . . . c30225_5ug3 1 . 18 . 4896 . 1 1 3 ASP HA H -6.726 -1.446 -0.911 . . . 1.0 . . . . . . . . . . . . A . 3 ASP HA . . . . . . . . . c30225_5ug3 1 . 18 . 4897 . 1 1 3 ASP HB2 H -4.018 -1.913 0.341 . . . 1.0 . . . . . . . . . . . . A . 3 ASP HB2 . . . . . . . . . c30225_5ug3 1 . 18 . 4898 . 1 1 3 ASP HB3 H -5.405 -1.417 1.295 . . . 1.0 . . . . . . . . . . . . A . 3 ASP HB3 . . . . . . . . . c30225_5ug3 1 . 18 . 4899 . 1 1 3 ASP N N -5.017 -1.664 -2.024 . . . 1.0 . . . . . . . . . . . . A . 3 ASP N . . . . . . . . . c30225_5ug3 1 . 18 . 4900 . 1 1 3 ASP O O -5.124 0.966 -1.656 . . . 1.0 . . . . . . . . . . . . A . 3 ASP O . . . . . . . . . c30225_5ug3 1 . 18 . 4901 . 1 1 3 ASP OD1 O -6.339 -3.688 1.416 . . . 1.0 . . . . . . . . . . . . A . 3 ASP OD1 . . . . . . . . . c30225_5ug3 1 . 18 . 4902 . 1 1 3 ASP OD2 O -5.092 -4.212 -0.308 . . . 1.0 . . . . . . . . . . . . A . 3 ASP OD2 . . . . . . . . . c30225_5ug3 1 . 18 . 4903 . 1 1 4 GLU C C -4.318 2.768 0.790 . . . 1.0 . . . . . . . . . . . . A . 4 GLU C . . . . . . . . . c30225_5ug3 1 . 18 . 4904 . 1 1 4 GLU CA C -5.755 2.273 0.677 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CA . . . . . . . . . c30225_5ug3 1 . 18 . 4905 . 1 1 4 GLU CB C -6.544 2.672 1.927 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CB . . . . . . . . . c30225_5ug3 1 . 18 . 4906 . 1 1 4 GLU CD C -8.605 1.282 1.427 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CD . . . . . . . . . c30225_5ug3 1 . 18 . 4907 . 1 1 4 GLU CG C -8.056 2.657 1.740 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CG . . . . . . . . . c30225_5ug3 1 . 18 . 4908 . 1 1 4 GLU H H -6.047 0.247 1.204 . . . 1.0 . . . . . . . . . . . . A . 4 GLU H . . . . . . . . . c30225_5ug3 1 . 18 . 4909 . 1 1 4 GLU HA H -6.211 2.741 -0.183 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HA . . . . . . . . . c30225_5ug3 1 . 18 . 4910 . 1 1 4 GLU HB2 H -6.297 1.989 2.727 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HB2 . . . . . . . . . c30225_5ug3 1 . 18 . 4911 . 1 1 4 GLU HB3 H -6.250 3.670 2.218 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HB3 . . . . . . . . . c30225_5ug3 1 . 18 . 4912 . 1 1 4 GLU HG2 H -8.520 3.011 2.646 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HG2 . . . . . . . . . c30225_5ug3 1 . 18 . 4913 . 1 1 4 GLU HG3 H -8.309 3.322 0.927 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HG3 . . . . . . . . . c30225_5ug3 1 . 18 . 4914 . 1 1 4 GLU N N -5.801 0.832 0.467 . . . 1.0 . . . . . . . . . . . . A . 4 GLU N . . . . . . . . . c30225_5ug3 1 . 18 . 4915 . 1 1 4 GLU O O -3.981 3.842 0.289 . . . 1.0 . . . . . . . . . . . . A . 4 GLU O . . . . . . . . . c30225_5ug3 1 . 18 . 4916 . 1 1 4 GLU OE1 O -8.853 0.991 0.238 . . . 1.0 . . . . . . . . . . . . A . 4 GLU OE1 . . . . . . . . . c30225_5ug3 1 . 18 . 4917 . 1 1 4 GLU OE2 O -8.789 0.481 2.367 . . . 1.0 . . . . . . . . . . . . A . 4 GLU OE2 . . . . . . . . . c30225_5ug3 1 . 18 . 4918 . 1 1 5 CYS C C -1.269 2.485 0.400 . . . 1.0 . . . . . . . . . . . . A . 5 CYS C . . . . . . . . . c30225_5ug3 1 . 18 . 4919 . 1 1 5 CYS CA C -2.097 2.385 1.687 . . . 1.0 . . . . . . . . . . . . A . 5 CYS CA . . . . . . . . . c30225_5ug3 1 . 18 . 4920 . 1 1 5 CYS CB C -1.445 1.411 2.663 . . . 1.0 . . . . . . . . . . . . A . 5 CYS CB . . . . . . . . . c30225_5ug3 1 . 18 . 4921 . 1 1 5 CYS H H -3.757 1.090 1.728 . . . 1.0 . . . . . . . . . . . . A . 5 CYS H . . . . . . . . . c30225_5ug3 1 . 18 . 4922 . 1 1 5 CYS HA H -2.136 3.360 2.147 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HA . . . . . . . . . c30225_5ug3 1 . 18 . 4923 . 1 1 5 CYS HB2 H -0.704 1.934 3.230 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HB2 . . . . . . . . . c30225_5ug3 1 . 18 . 4924 . 1 1 5 CYS HB3 H -2.200 1.031 3.336 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HB3 . . . . . . . . . c30225_5ug3 1 . 18 . 4925 . 1 1 5 CYS N N -3.462 1.972 1.418 . . . 1.0 . . . . . . . . . . . . A . 5 CYS N . . . . . . . . . c30225_5ug3 1 . 18 . 4926 . 1 1 5 CYS O O -0.144 2.973 0.417 . . . 1.0 . . . . . . . . . . . . A . 5 CYS O . . . . . . . . . c30225_5ug3 1 . 18 . 4927 . 1 1 5 CYS SG S -0.640 -0.019 1.877 . . . 1.0 . . . . . . . . . . . . A . 5 CYS SG . . . . . . . . . c30225_5ug3 1 . 18 . 4928 . 1 1 6 CYS C C -1.003 3.577 -2.431 . . . 1.0 . . . . . . . . . . . . A . 6 CYS C . . . . . . . . . c30225_5ug3 1 . 18 . 4929 . 1 1 6 CYS CA C -1.175 2.124 -2.001 . . . 1.0 . . . . . . . . . . . . A . 6 CYS CA . . . . . . . . . c30225_5ug3 1 . 18 . 4930 . 1 1 6 CYS CB C -2.000 1.372 -3.035 . . . 1.0 . . . . . . . . . . . . A . 6 CYS CB . . . . . . . . . c30225_5ug3 1 . 18 . 4931 . 1 1 6 CYS H H -2.703 1.600 -0.665 . . . 1.0 . . . . . . . . . . . . A . 6 CYS H . . . . . . . . . c30225_5ug3 1 . 18 . 4932 . 1 1 6 CYS HA H -0.199 1.665 -1.918 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HA . . . . . . . . . c30225_5ug3 1 . 18 . 4933 . 1 1 6 CYS HB2 H -2.942 1.883 -3.158 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HB2 . . . . . . . . . c30225_5ug3 1 . 18 . 4934 . 1 1 6 CYS HB3 H -1.472 1.369 -3.971 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HB3 . . . . . . . . . c30225_5ug3 1 . 18 . 4935 . 1 1 6 CYS N N -1.830 2.031 -0.711 . . . 1.0 . . . . . . . . . . . . A . 6 CYS N . . . . . . . . . c30225_5ug3 1 . 18 . 4936 . 1 1 6 CYS O O -0.059 3.914 -3.143 . . . 1.0 . . . . . . . . . . . . A . 6 CYS O . . . . . . . . . c30225_5ug3 1 . 18 . 4937 . 1 1 6 CYS SG S -2.362 -0.360 -2.587 . . . 1.0 . . . . . . . . . . . . A . 6 CYS SG . . . . . . . . . c30225_5ug3 1 . 18 . 4938 . 1 1 7 SER C C -0.796 6.529 -1.362 . . . 1.0 . . . . . . . . . . . . A . 7 SER C . . . . . . . . . c30225_5ug3 1 . 18 . 4939 . 1 1 7 SER CA C -1.816 5.868 -2.280 . . . 1.0 . . . . . . . . . . . . A . 7 SER CA . . . . . . . . . c30225_5ug3 1 . 18 . 4940 . 1 1 7 SER CB C -3.190 6.527 -2.131 . . . 1.0 . . . . . . . . . . . . A . 7 SER CB . . . . . . . . . c30225_5ug3 1 . 18 . 4941 . 1 1 7 SER H H -2.641 4.119 -1.415 . . . 1.0 . . . . . . . . . . . . A . 7 SER H . . . . . . . . . c30225_5ug3 1 . 18 . 4942 . 1 1 7 SER HA H -1.483 5.967 -3.303 . . . 1.0 . . . . . . . . . . . . A . 7 SER HA . . . . . . . . . c30225_5ug3 1 . 18 . 4943 . 1 1 7 SER HB2 H -3.088 7.595 -2.249 . . . 1.0 . . . . . . . . . . . . A . 7 SER HB2 . . . . . . . . . c30225_5ug3 1 . 18 . 4944 . 1 1 7 SER HB3 H -3.854 6.144 -2.890 . . . 1.0 . . . . . . . . . . . . A . 7 SER HB3 . . . . . . . . . c30225_5ug3 1 . 18 . 4945 . 1 1 7 SER HG H -4.004 5.328 -0.802 . . . 1.0 . . . . . . . . . . . . A . 7 SER HG . . . . . . . . . c30225_5ug3 1 . 18 . 4946 . 1 1 7 SER N N -1.904 4.443 -1.974 . . . 1.0 . . . . . . . . . . . . A . 7 SER N . . . . . . . . . c30225_5ug3 1 . 18 . 4947 . 1 1 7 SER O O -0.590 7.743 -1.386 . . . 1.0 . . . . . . . . . . . . A . 7 SER O . . . . . . . . . c30225_5ug3 1 . 18 . 4948 . 1 1 7 SER OG O -3.754 6.262 -0.855 . . . 1.0 . . . . . . . . . . . . A . 7 SER OG . . . . . . . . . c30225_5ug3 1 . 18 . 4949 . 1 1 8 ASN C C 2.175 5.546 0.062 . . . 1.0 . . . . . . . . . . . . A . 8 ASN C . . . . . . . . . c30225_5ug3 1 . 18 . 4950 . 1 1 8 ASN CA C 0.825 6.126 0.414 . . . 1.0 . . . . . . . . . . . . A . 8 ASN CA . . . . . . . . . c30225_5ug3 1 . 18 . 4951 . 1 1 8 ASN CB C 0.422 5.624 1.791 . . . 1.0 . . . . . . . . . . . . A . 8 ASN CB . . . . . . . . . c30225_5ug3 1 . 18 . 4952 . 1 1 8 ASN CG C -0.871 6.238 2.286 . . . 1.0 . . . . . . . . . . . . A . 8 ASN CG . . . . . . . . . c30225_5ug3 1 . 18 . 4953 . 1 1 8 ASN H H -0.338 4.736 -0.641 . . . 1.0 . . . . . . . . . . . . A . 8 ASN H . . . . . . . . . c30225_5ug3 1 . 18 . 4954 . 1 1 8 ASN HA H 0.873 7.202 0.414 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HA . . . . . . . . . c30225_5ug3 1 . 18 . 4955 . 1 1 8 ASN HB2 H 0.297 4.554 1.729 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HB2 . . . . . . . . . c30225_5ug3 1 . 18 . 4956 . 1 1 8 ASN HB3 H 1.210 5.845 2.497 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HB3 . . . . . . . . . c30225_5ug3 1 . 18 . 4957 . 1 1 8 ASN HD21 H -1.922 4.892 1.274 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HD21 . . . . . . . . . c30225_5ug3 1 . 18 . 4958 . 1 1 8 ASN HD22 H -2.845 6.039 2.182 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HD22 . . . . . . . . . c30225_5ug3 1 . 18 . 4959 . 1 1 8 ASN N N -0.153 5.695 -0.563 . . . 1.0 . . . . . . . . . . . . A . 8 ASN N . . . . . . . . . c30225_5ug3 1 . 18 . 4960 . 1 1 8 ASN ND2 N -1.992 5.665 1.872 . . . 1.0 . . . . . . . . . . . . A . 8 ASN ND2 . . . . . . . . . c30225_5ug3 1 . 18 . 4961 . 1 1 8 ASN O O 2.406 4.348 0.247 . . . 1.0 . . . . . . . . . . . . A . 8 ASN O . . . . . . . . . c30225_5ug3 1 . 18 . 4962 . 1 1 8 ASN OD1 O -0.865 7.231 3.011 . . . 1.0 . . . . . . . . . . . . A . 8 ASN OD1 . . . . . . . . . c30225_5ug3 1 . 18 . 4963 . 1 1 9 PRO C C 5.146 5.183 0.269 . . . 1.0 . . . . . . . . . . . . A . 9 PRO C . . . . . . . . . c30225_5ug3 1 . 18 . 4964 . 1 1 9 PRO CA C 4.410 5.910 -0.852 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CA . . . . . . . . . c30225_5ug3 1 . 18 . 4965 . 1 1 9 PRO CB C 5.139 7.198 -1.235 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CB . . . . . . . . . c30225_5ug3 1 . 18 . 4966 . 1 1 9 PRO CD C 2.908 7.810 -0.705 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CD . . . . . . . . . c30225_5ug3 1 . 18 . 4967 . 1 1 9 PRO CG C 4.057 8.142 -1.612 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CG . . . . . . . . . c30225_5ug3 1 . 18 . 4968 . 1 1 9 PRO HA H 4.340 5.258 -1.704 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HA . . . . . . . . . c30225_5ug3 1 . 18 . 4969 . 1 1 9 PRO HB2 H 5.696 7.560 -0.388 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HB2 . . . . . . . . . c30225_5ug3 1 . 18 . 4970 . 1 1 9 PRO HB3 H 5.806 7.008 -2.063 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HB3 . . . . . . . . . c30225_5ug3 1 . 18 . 4971 . 1 1 9 PRO HD2 H 2.973 8.378 0.211 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HD2 . . . . . . . . . c30225_5ug3 1 . 18 . 4972 . 1 1 9 PRO HD3 H 1.974 7.999 -1.201 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HD3 . . . . . . . . . c30225_5ug3 1 . 18 . 4973 . 1 1 9 PRO HG2 H 4.383 9.160 -1.451 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HG2 . . . . . . . . . c30225_5ug3 1 . 18 . 4974 . 1 1 9 PRO HG3 H 3.777 7.993 -2.643 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HG3 . . . . . . . . . c30225_5ug3 1 . 18 . 4975 . 1 1 9 PRO N N 3.088 6.370 -0.450 . . . 1.0 . . . . . . . . . . . . A . 9 PRO N . . . . . . . . . c30225_5ug3 1 . 18 . 4976 . 1 1 9 PRO O O 5.994 4.340 0.008 . . . 1.0 . . . . . . . . . . . . A . 9 PRO O . . . . . . . . . c30225_5ug3 1 . 18 . 4977 . 1 1 10 VAL C C 5.045 3.417 2.826 . . . 1.0 . . . . . . . . . . . . A . 10 VAL C . . . . . . . . . c30225_5ug3 1 . 18 . 4978 . 1 1 10 VAL CA C 5.448 4.880 2.661 . . . 1.0 . . . . . . . . . . . . A . 10 VAL CA . . . . . . . . . c30225_5ug3 1 . 18 . 4979 . 1 1 10 VAL CB C 5.131 5.662 3.954 . . . 1.0 . . . . . . . . . . . . A . 10 VAL CB . . . . . . . . . c30225_5ug3 1 . 18 . 4980 . 1 1 10 VAL CG1 C 5.787 5.014 5.165 . . . 1.0 . . . . . . . . . . . . A . 10 VAL CG1 . . . . . . . . . c30225_5ug3 1 . 18 . 4981 . 1 1 10 VAL CG2 C 5.580 7.108 3.819 . . . 1.0 . . . . . . . . . . . . A . 10 VAL CG2 . . . . . . . . . c30225_5ug3 1 . 18 . 4982 . 1 1 10 VAL H H 4.027 6.091 1.652 . . . 1.0 . . . . . . . . . . . . A . 10 VAL H . . . . . . . . . c30225_5ug3 1 . 18 . 4983 . 1 1 10 VAL HA H 6.517 4.927 2.487 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HA . . . . . . . . . c30225_5ug3 1 . 18 . 4984 . 1 1 10 VAL HB H 4.063 5.653 4.104 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HB . . . . . . . . . c30225_5ug3 1 . 18 . 4985 . 1 1 10 VAL HG11 H 5.532 5.570 6.054 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HG11 . . . . . . . . . c30225_5ug3 1 . 18 . 4986 . 1 1 10 VAL HG12 H 6.860 5.014 5.036 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HG12 . . . . . . . . . c30225_5ug3 1 . 18 . 4987 . 1 1 10 VAL HG13 H 5.437 3.997 5.261 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HG13 . . . . . . . . . c30225_5ug3 1 . 18 . 4988 . 1 1 10 VAL HG21 H 6.653 7.145 3.724 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HG21 . . . . . . . . . c30225_5ug3 1 . 18 . 4989 . 1 1 10 VAL HG22 H 5.277 7.662 4.693 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HG22 . . . . . . . . . c30225_5ug3 1 . 18 . 4990 . 1 1 10 VAL HG23 H 5.127 7.545 2.942 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HG23 . . . . . . . . . c30225_5ug3 1 . 18 . 4991 . 1 1 10 VAL N N 4.780 5.474 1.510 . . . 1.0 . . . . . . . . . . . . A . 10 VAL N . . . . . . . . . c30225_5ug3 1 . 18 . 4992 . 1 1 10 VAL O O 5.861 2.565 3.192 . . . 1.0 . . . . . . . . . . . . A . 10 VAL O . . . . . . . . . c30225_5ug3 1 . 18 . 4993 . 1 1 11 CYS C C 3.924 0.899 1.500 . . . 1.0 . . . . . . . . . . . . A . 11 CYS C . . . . . . . . . c30225_5ug3 1 . 18 . 4994 . 1 1 11 CYS CA C 3.341 1.737 2.630 . . . 1.0 . . . . . . . . . . . . A . 11 CYS CA . . . . . . . . . c30225_5ug3 1 . 18 . 4995 . 1 1 11 CYS CB C 1.813 1.642 2.613 . . . 1.0 . . . . . . . . . . . . A . 11 CYS CB . . . . . . . . . c30225_5ug3 1 . 18 . 4996 . 1 1 11 CYS H H 3.175 3.810 2.233 . . . 1.0 . . . . . . . . . . . . A . 11 CYS H . . . . . . . . . c30225_5ug3 1 . 18 . 4997 . 1 1 11 CYS HA H 3.701 1.352 3.568 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HA . . . . . . . . . c30225_5ug3 1 . 18 . 4998 . 1 1 11 CYS HB2 H 1.414 2.215 3.435 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HB2 . . . . . . . . . c30225_5ug3 1 . 18 . 4999 . 1 1 11 CYS HB3 H 1.443 2.047 1.682 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HB3 . . . . . . . . . c30225_5ug3 1 . 18 . 5000 . 1 1 11 CYS N N 3.796 3.108 2.526 . . . 1.0 . . . . . . . . . . . . A . 11 CYS N . . . . . . . . . c30225_5ug3 1 . 18 . 5001 . 1 1 11 CYS O O 4.310 -0.251 1.701 . . . 1.0 . . . . . . . . . . . . A . 11 CYS O . . . . . . . . . c30225_5ug3 1 . 18 . 5002 . 1 1 11 CYS SG S 1.184 -0.067 2.768 . . . 1.0 . . . . . . . . . . . . A . 11 CYS SG . . . . . . . . . c30225_5ug3 1 . 18 . 5003 . 1 1 12 ARG C C 5.913 0.515 -0.997 . . . 1.0 . . . . . . . . . . . . A . 12 ARG C . . . . . . . . . c30225_5ug3 1 . 18 . 5004 . 1 1 12 ARG CA C 4.413 0.718 -0.862 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CA . . . . . . . . . c30225_5ug3 1 . 18 . 5005 . 1 1 12 ARG CB C 3.809 1.300 -2.134 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CB . . . . . . . . . c30225_5ug3 1 . 18 . 5006 . 1 1 12 ARG CD C 3.050 3.369 -3.312 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CD . . . . . . . . . c30225_5ug3 1 . 18 . 5007 . 1 1 12 ARG CG C 3.920 2.794 -2.210 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CG . . . . . . . . . c30225_5ug3 1 . 18 . 5008 . 1 1 12 ARG CZ C 2.513 2.848 -5.658 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CZ . . . . . . . . . c30225_5ug3 1 . 18 . 5009 . 1 1 12 ARG H H 3.838 2.444 0.232 . . . 1.0 . . . . . . . . . . . . A . 12 ARG H . . . . . . . . . c30225_5ug3 1 . 18 . 5010 . 1 1 12 ARG HA H 3.992 -0.236 -0.717 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HA . . . . . . . . . c30225_5ug3 1 . 18 . 5011 . 1 1 12 ARG HB2 H 4.316 0.879 -2.990 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HB2 . . . . . . . . . c30225_5ug3 1 . 18 . 5012 . 1 1 12 ARG HB3 H 2.764 1.035 -2.179 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HB3 . . . . . . . . . c30225_5ug3 1 . 18 . 5013 . 1 1 12 ARG HD2 H 2.017 3.177 -3.066 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HD2 . . . . . . . . . c30225_5ug3 1 . 18 . 5014 . 1 1 12 ARG HD3 H 3.214 4.435 -3.361 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HD3 . . . . . . . . . c30225_5ug3 1 . 18 . 5015 . 1 1 12 ARG HE H 4.210 2.332 -4.727 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HE . . . . . . . . . c30225_5ug3 1 . 18 . 5016 . 1 1 12 ARG HG2 H 3.593 3.191 -1.267 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HG2 . . . . . . . . . c30225_5ug3 1 . 18 . 5017 . 1 1 12 ARG HG3 H 4.949 3.061 -2.386 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HG3 . . . . . . . . . c30225_5ug3 1 . 18 . 5018 . 1 1 12 ARG HH11 H 1.030 3.785 -4.637 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH11 . . . . . . . . . c30225_5ug3 1 . 18 . 5019 . 1 1 12 ARG HH12 H 0.694 3.468 -6.309 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH12 . . . . . . . . . c30225_5ug3 1 . 18 . 5020 . 1 1 12 ARG HH21 H 3.764 1.896 -6.937 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH21 . . . . . . . . . c30225_5ug3 1 . 18 . 5021 . 1 1 12 ARG HH22 H 2.246 2.390 -7.614 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH22 . . . . . . . . . c30225_5ug3 1 . 18 . 5022 . 1 1 12 ARG N N 4.029 1.485 0.315 . . . 1.0 . . . . . . . . . . . . A . 12 ARG N . . . . . . . . . c30225_5ug3 1 . 18 . 5023 . 1 1 12 ARG NE N 3.342 2.783 -4.617 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NE . . . . . . . . . c30225_5ug3 1 . 18 . 5024 . 1 1 12 ARG NH1 N 1.318 3.410 -5.523 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NH1 . . . . . . . . . c30225_5ug3 1 . 18 . 5025 . 1 1 12 ARG NH2 N 2.869 2.337 -6.830 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NH2 . . . . . . . . . c30225_5ug3 1 . 18 . 5026 . 1 1 12 ARG O O 6.357 -0.376 -1.718 . . . 1.0 . . . . . . . . . . . . A . 12 ARG O . . . . . . . . . c30225_5ug3 1 . 18 . 5027 . 1 1 13 VAL C C 8.544 0.013 0.645 . . . 1.0 . . . . . . . . . . . . A . 13 VAL C . . . . . . . . . c30225_5ug3 1 . 18 . 5028 . 1 1 13 VAL CA C 8.125 1.149 -0.287 . . . 1.0 . . . . . . . . . . . . A . 13 VAL CA . . . . . . . . . c30225_5ug3 1 . 18 . 5029 . 1 1 13 VAL CB C 8.827 2.440 0.150 . . . 1.0 . . . . . . . . . . . . A . 13 VAL CB . . . . . . . . . c30225_5ug3 1 . 18 . 5030 . 1 1 13 VAL CG1 C 8.757 3.495 -0.942 . . . 1.0 . . . . . . . . . . . . A . 13 VAL CG1 . . . . . . . . . c30225_5ug3 1 . 18 . 5031 . 1 1 13 VAL CG2 C 8.221 2.954 1.440 . . . 1.0 . . . . . . . . . . . . A . 13 VAL CG2 . . . . . . . . . c30225_5ug3 1 . 18 . 5032 . 1 1 13 VAL H H 6.292 2.057 0.191 . . . 1.0 . . . . . . . . . . . . A . 13 VAL H . . . . . . . . . c30225_5ug3 1 . 18 . 5033 . 1 1 13 VAL HA H 8.444 0.914 -1.291 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HA . . . . . . . . . c30225_5ug3 1 . 18 . 5034 . 1 1 13 VAL HB H 9.854 2.215 0.337 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HB . . . . . . . . . c30225_5ug3 1 . 18 . 5035 . 1 1 13 VAL HG11 H 7.724 3.727 -1.153 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HG11 . . . . . . . . . c30225_5ug3 1 . 18 . 5036 . 1 1 13 VAL HG12 H 9.233 3.120 -1.835 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HG12 . . . . . . . . . c30225_5ug3 1 . 18 . 5037 . 1 1 13 VAL HG13 H 9.266 4.389 -0.612 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HG13 . . . . . . . . . c30225_5ug3 1 . 18 . 5038 . 1 1 13 VAL HG21 H 7.155 3.093 1.302 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HG21 . . . . . . . . . c30225_5ug3 1 . 18 . 5039 . 1 1 13 VAL HG22 H 8.679 3.892 1.710 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HG22 . . . . . . . . . c30225_5ug3 1 . 18 . 5040 . 1 1 13 VAL HG23 H 8.383 2.230 2.225 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HG23 . . . . . . . . . c30225_5ug3 1 . 18 . 5041 . 1 1 13 VAL N N 6.688 1.319 -0.304 . . . 1.0 . . . . . . . . . . . . A . 13 VAL N . . . . . . . . . c30225_5ug3 1 . 18 . 5042 . 1 1 13 VAL O O 9.513 -0.691 0.371 . . . 1.0 . . . . . . . . . . . . A . 13 VAL O . . . . . . . . . c30225_5ug3 1 . 18 . 5043 . 1 1 14 ASN C C 7.575 -2.531 2.443 . . . 1.0 . . . . . . . . . . . . A . 14 ASN C . . . . . . . . . c30225_5ug3 1 . 18 . 5044 . 1 1 14 ASN CA C 8.205 -1.171 2.737 . . . 1.0 . . . . . . . . . . . . A . 14 ASN CA . . . . . . . . . c30225_5ug3 1 . 18 . 5045 . 1 1 14 ASN CB C 7.846 -0.713 4.161 . . . 1.0 . . . . . . . . . . . . A . 14 ASN CB . . . . . . . . . c30225_5ug3 1 . 18 . 5046 . 1 1 14 ASN CG C 6.409 -1.002 4.559 . . . 1.0 . . . . . . . . . . . . A . 14 ASN CG . . . . . . . . . c30225_5ug3 1 . 18 . 5047 . 1 1 14 ASN H H 7.012 0.376 1.894 . . . 1.0 . . . . . . . . . . . . A . 14 ASN H . . . . . . . . . c30225_5ug3 1 . 18 . 5048 . 1 1 14 ASN HA H 9.277 -1.278 2.673 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HA . . . . . . . . . c30225_5ug3 1 . 18 . 5049 . 1 1 14 ASN HB2 H 8.494 -1.216 4.861 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HB2 . . . . . . . . . c30225_5ug3 1 . 18 . 5050 . 1 1 14 ASN HB3 H 8.011 0.353 4.234 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HB3 . . . . . . . . . c30225_5ug3 1 . 18 . 5051 . 1 1 14 ASN HD21 H 5.825 0.777 3.902 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HD21 . . . . . . . . . c30225_5ug3 1 . 18 . 5052 . 1 1 14 ASN HD22 H 4.587 -0.224 4.575 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HD22 . . . . . . . . . c30225_5ug3 1 . 18 . 5053 . 1 1 14 ASN N N 7.814 -0.171 1.744 . . . 1.0 . . . . . . . . . . . . A . 14 ASN N . . . . . . . . . c30225_5ug3 1 . 18 . 5054 . 1 1 14 ASN ND2 N 5.520 -0.056 4.320 . . . 1.0 . . . . . . . . . . . . A . 14 ASN ND2 . . . . . . . . . c30225_5ug3 1 . 18 . 5055 . 1 1 14 ASN O O 8.198 -3.571 2.673 . . . 1.0 . . . . . . . . . . . . A . 14 ASN O . . . . . . . . . c30225_5ug3 1 . 18 . 5056 . 1 1 14 ASN OD1 O 6.106 -2.069 5.095 . . . 1.0 . . . . . . . . . . . . A . 14 ASN OD1 . . . . . . . . . c30225_5ug3 1 . 18 . 5057 . 1 1 15 ASN C C 6.161 -4.335 0.319 . . . 1.0 . . . . . . . . . . . . A . 15 ASN C . . . . . . . . . c30225_5ug3 1 . 18 . 5058 . 1 1 15 ASN CA C 5.648 -3.755 1.637 . . . 1.0 . . . . . . . . . . . . A . 15 ASN CA . . . . . . . . . c30225_5ug3 1 . 18 . 5059 . 1 1 15 ASN CB C 4.136 -3.483 1.589 . . . 1.0 . . . . . . . . . . . . A . 15 ASN CB . . . . . . . . . c30225_5ug3 1 . 18 . 5060 . 1 1 15 ASN CG C 3.599 -3.236 0.193 . . . 1.0 . . . . . . . . . . . . A . 15 ASN CG . . . . . . . . . c30225_5ug3 1 . 18 . 5061 . 1 1 15 ASN H H 5.881 -1.691 1.796 . . . 1.0 . . . . . . . . . . . . A . 15 ASN H . . . . . . . . . c30225_5ug3 1 . 18 . 5062 . 1 1 15 ASN HA H 5.852 -4.470 2.428 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HA . . . . . . . . . c30225_5ug3 1 . 18 . 5063 . 1 1 15 ASN HB2 H 3.619 -4.323 2.003 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HB2 . . . . . . . . . c30225_5ug3 1 . 18 . 5064 . 1 1 15 ASN HB3 H 3.926 -2.608 2.192 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HB3 . . . . . . . . . c30225_5ug3 1 . 18 . 5065 . 1 1 15 ASN HD21 H 3.558 -1.290 0.524 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HD21 . . . . . . . . . c30225_5ug3 1 . 18 . 5066 . 1 1 15 ASN HD22 H 3.017 -1.802 -1.035 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HD22 . . . . . . . . . c30225_5ug3 1 . 18 . 5067 . 1 1 15 ASN N N 6.344 -2.530 1.946 . . . 1.0 . . . . . . . . . . . . A . 15 ASN N . . . . . . . . . c30225_5ug3 1 . 18 . 5068 . 1 1 15 ASN ND2 N 3.369 -1.986 -0.142 . . . 1.0 . . . . . . . . . . . . A . 15 ASN ND2 . . . . . . . . . c30225_5ug3 1 . 18 . 5069 . 1 1 15 ASN O O 6.715 -3.620 -0.513 . . . 1.0 . . . . . . . . . . . . A . 15 ASN O . . . . . . . . . c30225_5ug3 1 . 18 . 5070 . 1 1 15 ASN OD1 O 3.352 -4.166 -0.560 . . . 1.0 . . . . . . . . . . . . A . 15 ASN OD1 . . . . . . . . . c30225_5ug3 1 . 18 . 5071 . 1 1 16 HYP C C 5.794 -6.113 -2.330 . . . 1.0 . . . . . . . . . . . . A . 16 HYP C . . . . . . . . . c30225_5ug3 1 . 18 . 5072 . 1 1 16 HYP CA C 6.503 -6.414 -1.011 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CA . . . . . . . . . c30225_5ug3 1 . 18 . 5073 . 1 1 16 HYP CB C 6.228 -7.834 -0.578 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CB . . . . . . . . . c30225_5ug3 1 . 18 . 5074 . 1 1 16 HYP CD C 5.203 -6.474 1.103 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CD . . . . . . . . . c30225_5ug3 1 . 18 . 5075 . 1 1 16 HYP CG C 5.296 -7.878 0.606 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CG . . . . . . . . . c30225_5ug3 1 . 18 . 5076 . 1 1 16 HYP HA H 7.566 -6.268 -1.129 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HA . . . . . . . . . c30225_5ug3 1 . 18 . 5077 . 1 1 16 HYP HB2 H 7.158 -8.307 -0.306 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HB2 . . . . . . . . . c30225_5ug3 1 . 18 . 5078 . 1 1 16 HYP HB3 H 5.781 -8.372 -1.404 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HB3 . . . . . . . . . c30225_5ug3 1 . 18 . 5079 . 1 1 16 HYP HD1 H 6.018 -8.010 2.391 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HD1 . . . . . . . . . c30225_5ug3 1 . 18 . 5080 . 1 1 16 HYP HD22 H 4.184 -6.158 1.149 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HD22 . . . . . . . . . c30225_5ug3 1 . 18 . 5081 . 1 1 16 HYP HD23 H 5.646 -6.408 2.085 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HD23 . . . . . . . . . c30225_5ug3 1 . 18 . 5082 . 1 1 16 HYP HG H 4.331 -8.274 0.320 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HG . . . . . . . . . c30225_5ug3 1 . 18 . 5083 . 1 1 16 HYP N N 5.970 -5.646 0.141 . . . 1.0 . . . . . . . . . . . . A . 16 HYP N . . . . . . . . . c30225_5ug3 1 . 18 . 5084 . 1 1 16 HYP O O 5.342 -7.024 -3.027 . . . 1.0 . . . . . . . . . . . . A . 16 HYP O . . . . . . . . . c30225_5ug3 1 . 18 . 5085 . 1 1 16 HYP OD1 O 5.842 -8.633 1.665 . . . 1.0 . . . . . . . . . . . . A . 16 HYP OD1 . . . . . . . . . c30225_5ug3 1 . 18 . 5086 . 1 1 17 HIS C C 3.690 -4.899 -4.101 . . . 1.0 . . . . . . . . . . . . A . 17 HIS C . . . . . . . . . c30225_5ug3 1 . 18 . 5087 . 1 1 17 HIS CA C 5.107 -4.365 -3.908 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CA . . . . . . . . . c30225_5ug3 1 . 18 . 5088 . 1 1 17 HIS CB C 5.976 -4.747 -5.113 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CB . . . . . . . . . c30225_5ug3 1 . 18 . 5089 . 1 1 17 HIS CD2 C 8.485 -4.154 -4.810 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CD2 . . . . . . . . . c30225_5ug3 1 . 18 . 5090 . 1 1 17 HIS CE1 C 8.488 -2.237 -5.869 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CE1 . . . . . . . . . c30225_5ug3 1 . 18 . 5091 . 1 1 17 HIS CG C 7.224 -3.929 -5.249 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CG . . . . . . . . . c30225_5ug3 1 . 18 . 5092 . 1 1 17 HIS H H 6.043 -4.168 -2.009 . . . 1.0 . . . . . . . . . . . . A . 17 HIS H . . . . . . . . . c30225_5ug3 1 . 18 . 5093 . 1 1 17 HIS HA H 5.054 -3.288 -3.855 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HA . . . . . . . . . c30225_5ug3 1 . 18 . 5094 . 1 1 17 HIS HB2 H 6.270 -5.782 -5.020 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HB2 . . . . . . . . . c30225_5ug3 1 . 18 . 5095 . 1 1 17 HIS HB3 H 5.397 -4.624 -6.017 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HB3 . . . . . . . . . c30225_5ug3 1 . 18 . 5096 . 1 1 17 HIS HD1 H 6.497 -2.275 -6.339 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HD1 . . . . . . . . . c30225_5ug3 1 . 18 . 5097 . 1 1 17 HIS HD2 H 8.825 -5.015 -4.253 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HD2 . . . . . . . . . c30225_5ug3 1 . 18 . 5098 . 1 1 17 HIS HE1 H 8.811 -1.302 -6.302 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HE1 . . . . . . . . . c30225_5ug3 1 . 18 . 5099 . 1 1 17 HIS HE2 H 10.144 -2.873 -4.857 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HE2 . . . . . . . . . c30225_5ug3 1 . 18 . 5100 . 1 1 17 HIS N N 5.701 -4.831 -2.654 . . . 1.0 . . . . . . . . . . . . A . 17 HIS N . . . . . . . . . c30225_5ug3 1 . 18 . 5101 . 1 1 17 HIS ND1 N 7.262 -2.719 -5.908 . . . 1.0 . . . . . . . . . . . . A . 17 HIS ND1 . . . . . . . . . c30225_5ug3 1 . 18 . 5102 . 1 1 17 HIS NE2 N 9.251 -3.085 -5.208 . . . 1.0 . . . . . . . . . . . . A . 17 HIS NE2 . . . . . . . . . c30225_5ug3 1 . 18 . 5103 . 1 1 17 HIS O O 3.339 -5.381 -5.177 . . . 1.0 . . . . . . . . . . . . A . 17 HIS O . . . . . . . . . c30225_5ug3 1 . 18 . 5104 . 1 1 18 VAL C C 0.696 -3.963 -3.633 . . . 1.0 . . . . . . . . . . . . A . 18 VAL C . . . . . . . . . c30225_5ug3 1 . 18 . 5105 . 1 1 18 VAL CA C 1.478 -5.179 -3.138 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CA . . . . . . . . . c30225_5ug3 1 . 18 . 5106 . 1 1 18 VAL CB C 0.921 -5.654 -1.772 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CB . . . . . . . . . c30225_5ug3 1 . 18 . 5107 . 1 1 18 VAL CG1 C -0.517 -6.137 -1.897 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CG1 . . . . . . . . . c30225_5ug3 1 . 18 . 5108 . 1 1 18 VAL CG2 C 1.797 -6.755 -1.195 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CG2 . . . . . . . . . c30225_5ug3 1 . 18 . 5109 . 1 1 18 VAL H H 3.254 -4.536 -2.181 . . . 1.0 . . . . . . . . . . . . A . 18 VAL H . . . . . . . . . c30225_5ug3 1 . 18 . 5110 . 1 1 18 VAL HA H 1.376 -5.982 -3.854 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HA . . . . . . . . . c30225_5ug3 1 . 18 . 5111 . 1 1 18 VAL HB H 0.939 -4.818 -1.088 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HB . . . . . . . . . c30225_5ug3 1 . 18 . 5112 . 1 1 18 VAL HG11 H -1.123 -5.351 -2.321 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG11 . . . . . . . . . c30225_5ug3 1 . 18 . 5113 . 1 1 18 VAL HG12 H -0.896 -6.395 -0.919 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG12 . . . . . . . . . c30225_5ug3 1 . 18 . 5114 . 1 1 18 VAL HG13 H -0.553 -7.005 -2.538 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG13 . . . . . . . . . c30225_5ug3 1 . 18 . 5115 . 1 1 18 VAL HG21 H 1.854 -7.573 -1.895 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG21 . . . . . . . . . c30225_5ug3 1 . 18 . 5116 . 1 1 18 VAL HG22 H 1.372 -7.105 -0.267 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG22 . . . . . . . . . c30225_5ug3 1 . 18 . 5117 . 1 1 18 VAL HG23 H 2.788 -6.367 -1.011 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG23 . . . . . . . . . c30225_5ug3 1 . 18 . 5118 . 1 1 18 VAL N N 2.887 -4.827 -3.049 . . . 1.0 . . . . . . . . . . . . A . 18 VAL N . . . . . . . . . c30225_5ug3 1 . 18 . 5119 . 1 1 18 VAL O O -0.442 -4.067 -4.097 . . . 1.0 . . . . . . . . . . . . A . 18 VAL O . . . . . . . . . c30225_5ug3 1 . 18 . 5120 . 1 1 19 CYS C C 1.714 -0.981 -5.109 . . . 1.0 . . . . . . . . . . . . A . 19 CYS C . . . . . . . . . c30225_5ug3 1 . 18 . 5121 . 1 1 19 CYS CA C 0.796 -1.565 -4.047 . . . 1.0 . . . . . . . . . . . . A . 19 CYS CA . . . . . . . . . c30225_5ug3 1 . 18 . 5122 . 1 1 19 CYS CB C 0.625 -0.569 -2.902 . . . 1.0 . . . . . . . . . . . . A . 19 CYS CB . . . . . . . . . c30225_5ug3 1 . 18 . 5123 . 1 1 19 CYS H H 2.246 -2.810 -3.174 . . . 1.0 . . . . . . . . . . . . A . 19 CYS H . . . . . . . . . c30225_5ug3 1 . 18 . 5124 . 1 1 19 CYS HA H -0.168 -1.773 -4.489 . . . 1.0 . . . . . . . . . . . . A . 19 CYS HA . . . . . . . . . c30225_5ug3 1 . 18 . 5125 . 1 1 19 CYS HB2 H 1.557 -0.488 -2.364 . . . 1.0 . . . . . . . . . . . . A . 19 CYS HB2 . . . . . . . . . c30225_5ug3 1 . 18 . 5126 . 1 1 19 CYS HB3 H 0.364 0.398 -3.307 . . . 1.0 . . . . . . . . . . . . A . 19 CYS HB3 . . . . . . . . . c30225_5ug3 1 . 18 . 5127 . 1 1 19 CYS N N 1.350 -2.815 -3.559 . . . 1.0 . . . . . . . . . . . . A . 19 CYS N . . . . . . . . . c30225_5ug3 1 . 18 . 5128 . 1 1 19 CYS O O 2.834 -0.563 -4.752 . . . 1.0 . . . . . . . . . . . . A . 19 CYS O . . . . . . . . . c30225_5ug3 1 . 18 . 5129 . 1 1 19 CYS OXT O 1.323 -0.960 -6.294 . . . 1.0 . . . . . . . . . . . . A . 19 CYS OXT . . . . . . . . . c30225_5ug3 1 . 18 . 5130 . 1 1 19 CYS SG S -0.662 -1.022 -1.701 . . . 1.0 . . . . . . . . . . . . A . 19 CYS SG . . . . . . . . . c30225_5ug3 1 . 19 . 5131 . 1 1 1 ILE C C -8.784 -2.043 -4.760 . . . 1.0 . . . . . . . . . . . . A . 1 ILE C . . . . . . . . . c30225_5ug3 1 . 19 . 5132 . 1 1 1 ILE CA C -7.961 -2.513 -5.949 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CA . . . . . . . . . c30225_5ug3 1 . 19 . 5133 . 1 1 1 ILE CB C -6.542 -1.884 -5.881 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CB . . . . . . . . . c30225_5ug3 1 . 19 . 5134 . 1 1 1 ILE CD1 C -6.882 0.474 -4.924 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CD1 . . . . . . . . . c30225_5ug3 1 . 19 . 5135 . 1 1 1 ILE CG1 C -6.572 -0.369 -6.144 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CG1 . . . . . . . . . c30225_5ug3 1 . 19 . 5136 . 1 1 1 ILE CG2 C -5.610 -2.568 -6.865 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CG2 . . . . . . . . . c30225_5ug3 1 . 19 . 5137 . 1 1 1 ILE H1 H -8.782 -1.157 -7.294 . . . 1.0 . . . . . . . . . . . . A . 1 ILE H1 . . . . . . . . . c30225_5ug3 1 . 19 . 5138 . 1 1 1 ILE H2 H -9.572 -2.646 -7.257 . . . 1.0 . . . . . . . . . . . . A . 1 ILE H2 . . . . . . . . . c30225_5ug3 1 . 19 . 5139 . 1 1 1 ILE H3 H -8.076 -2.503 -8.030 . . . 1.0 . . . . . . . . . . . . A . 1 ILE H3 . . . . . . . . . c30225_5ug3 1 . 19 . 5140 . 1 1 1 ILE HA H -7.856 -3.587 -5.894 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HA . . . . . . . . . c30225_5ug3 1 . 19 . 5141 . 1 1 1 ILE HB H -6.152 -2.053 -4.889 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HB . . . . . . . . . c30225_5ug3 1 . 19 . 5142 . 1 1 1 ILE HD11 H -7.854 0.206 -4.537 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HD11 . . . . . . . . . c30225_5ug3 1 . 19 . 5143 . 1 1 1 ILE HD12 H -6.878 1.519 -5.196 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HD12 . . . . . . . . . c30225_5ug3 1 . 19 . 5144 . 1 1 1 ILE HD13 H -6.133 0.298 -4.166 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HD13 . . . . . . . . . c30225_5ug3 1 . 19 . 5145 . 1 1 1 ILE HG12 H -5.610 -0.060 -6.520 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG12 . . . . . . . . . c30225_5ug3 1 . 19 . 5146 . 1 1 1 ILE HG13 H -7.323 -0.160 -6.890 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG13 . . . . . . . . . c30225_5ug3 1 . 19 . 5147 . 1 1 1 ILE HG21 H -5.531 -3.615 -6.618 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG21 . . . . . . . . . c30225_5ug3 1 . 19 . 5148 . 1 1 1 ILE HG22 H -4.633 -2.111 -6.813 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG22 . . . . . . . . . c30225_5ug3 1 . 19 . 5149 . 1 1 1 ILE HG23 H -6.002 -2.462 -7.867 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG23 . . . . . . . . . c30225_5ug3 1 . 19 . 5150 . 1 1 1 ILE N N -8.642 -2.182 -7.219 . . . 1.0 . . . . . . . . . . . . A . 1 ILE N . . . . . . . . . c30225_5ug3 1 . 19 . 5151 . 1 1 1 ILE O O -9.792 -1.351 -4.927 . . . 1.0 . . . . . . . . . . . . A . 1 ILE O . . . . . . . . . c30225_5ug3 1 . 19 . 5152 . 1 1 2 ARG C C -7.953 -1.949 -1.213 . . . 1.0 . . . . . . . . . . . . A . 2 ARG C . . . . . . . . . c30225_5ug3 1 . 19 . 5153 . 1 1 2 ARG CA C -8.973 -1.950 -2.345 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CA . . . . . . . . . c30225_5ug3 1 . 19 . 5154 . 1 1 2 ARG CB C -10.202 -2.790 -1.969 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CB . . . . . . . . . c30225_5ug3 1 . 19 . 5155 . 1 1 2 ARG CD C -11.323 -0.870 -0.771 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CD . . . . . . . . . c30225_5ug3 1 . 19 . 5156 . 1 1 2 ARG CG C -10.890 -2.328 -0.687 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CG . . . . . . . . . c30225_5ug3 1 . 19 . 5157 . 1 1 2 ARG CZ C -11.985 0.942 0.774 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CZ . . . . . . . . . c30225_5ug3 1 . 19 . 5158 . 1 1 2 ARG H H -7.599 -3.045 -3.504 . . . 1.0 . . . . . . . . . . . . A . 2 ARG H . . . . . . . . . c30225_5ug3 1 . 19 . 5159 . 1 1 2 ARG HA H -9.284 -0.935 -2.523 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HA . . . . . . . . . c30225_5ug3 1 . 19 . 5160 . 1 1 2 ARG HB2 H -10.918 -2.741 -2.776 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB2 . . . . . . . . . c30225_5ug3 1 . 19 . 5161 . 1 1 2 ARG HB3 H -9.893 -3.816 -1.836 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB3 . . . . . . . . . c30225_5ug3 1 . 19 . 5162 . 1 1 2 ARG HD2 H -10.496 -0.282 -1.137 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD2 . . . . . . . . . c30225_5ug3 1 . 19 . 5163 . 1 1 2 ARG HD3 H -12.152 -0.793 -1.457 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD3 . . . . . . . . . c30225_5ug3 1 . 19 . 5164 . 1 1 2 ARG HE H -11.812 -0.992 1.272 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HE . . . . . . . . . c30225_5ug3 1 . 19 . 5165 . 1 1 2 ARG HG2 H -11.762 -2.940 -0.517 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG2 . . . . . . . . . c30225_5ug3 1 . 19 . 5166 . 1 1 2 ARG HG3 H -10.202 -2.442 0.138 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG3 . . . . . . . . . c30225_5ug3 1 . 19 . 5167 . 1 1 2 ARG HH11 H -11.651 1.554 -1.129 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH11 . . . . . . . . . c30225_5ug3 1 . 19 . 5168 . 1 1 2 ARG HH12 H -12.098 2.807 -0.016 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH12 . . . . . . . . . c30225_5ug3 1 . 19 . 5169 . 1 1 2 ARG HH21 H -12.384 0.667 2.741 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH21 . . . . . . . . . c30225_5ug3 1 . 19 . 5170 . 1 1 2 ARG HH22 H -12.510 2.303 2.180 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH22 . . . . . . . . . c30225_5ug3 1 . 19 . 5171 . 1 1 2 ARG N N -8.357 -2.426 -3.567 . . . 1.0 . . . . . . . . . . . . A . 2 ARG N . . . . . . . . . c30225_5ug3 1 . 19 . 5172 . 1 1 2 ARG NE N -11.734 -0.347 0.531 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NE . . . . . . . . . c30225_5ug3 1 . 19 . 5173 . 1 1 2 ARG NH1 N -11.903 1.838 -0.203 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH1 . . . . . . . . . c30225_5ug3 1 . 19 . 5174 . 1 1 2 ARG NH2 N -12.320 1.335 1.996 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH2 . . . . . . . . . c30225_5ug3 1 . 19 . 5175 . 1 1 2 ARG O O -7.942 -2.839 -0.364 . . . 1.0 . . . . . . . . . . . . A . 2 ARG O . . . . . . . . . c30225_5ug3 1 . 19 . 5176 . 1 1 3 ASP C C -5.711 0.687 -0.116 . . . 1.0 . . . . . . . . . . . . A . 3 ASP C . . . . . . . . . c30225_5ug3 1 . 19 . 5177 . 1 1 3 ASP CA C -6.104 -0.778 -0.175 . . . 1.0 . . . . . . . . . . . . A . 3 ASP CA . . . . . . . . . c30225_5ug3 1 . 19 . 5178 . 1 1 3 ASP CB C -4.866 -1.648 -0.409 . . . 1.0 . . . . . . . . . . . . A . 3 ASP CB . . . . . . . . . c30225_5ug3 1 . 19 . 5179 . 1 1 3 ASP CG C -3.997 -1.751 0.831 . . . 1.0 . . . . . . . . . . . . A . 3 ASP CG . . . . . . . . . c30225_5ug3 1 . 19 . 5180 . 1 1 3 ASP H H -7.105 -0.310 -1.961 . . . 1.0 . . . . . . . . . . . . A . 3 ASP H . . . . . . . . . c30225_5ug3 1 . 19 . 5181 . 1 1 3 ASP HA H -6.565 -1.056 0.762 . . . 1.0 . . . . . . . . . . . . A . 3 ASP HA . . . . . . . . . c30225_5ug3 1 . 19 . 5182 . 1 1 3 ASP HB2 H -5.180 -2.642 -0.690 . . . 1.0 . . . . . . . . . . . . A . 3 ASP HB2 . . . . . . . . . c30225_5ug3 1 . 19 . 5183 . 1 1 3 ASP HB3 H -4.276 -1.221 -1.206 . . . 1.0 . . . . . . . . . . . . A . 3 ASP HB3 . . . . . . . . . c30225_5ug3 1 . 19 . 5184 . 1 1 3 ASP N N -7.085 -0.954 -1.226 . . . 1.0 . . . . . . . . . . . . A . 3 ASP N . . . . . . . . . c30225_5ug3 1 . 19 . 5185 . 1 1 3 ASP O O -5.402 1.306 -1.138 . . . 1.0 . . . . . . . . . . . . A . 3 ASP O . . . . . . . . . c30225_5ug3 1 . 19 . 5186 . 1 1 3 ASP OD1 O -3.897 -2.860 1.405 . . . 1.0 . . . . . . . . . . . . A . 3 ASP OD1 . . . . . . . . . c30225_5ug3 1 . 19 . 5187 . 1 1 3 ASP OD2 O -3.435 -0.725 1.263 . . . 1.0 . . . . . . . . . . . . A . 3 ASP OD2 . . . . . . . . . c30225_5ug3 1 . 19 . 5188 . 1 1 4 GLU C C -4.013 2.964 1.157 . . . 1.0 . . . . . . . . . . . . A . 4 GLU C . . . . . . . . . c30225_5ug3 1 . 19 . 5189 . 1 1 4 GLU CA C -5.500 2.646 1.292 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CA . . . . . . . . . c30225_5ug3 1 . 19 . 5190 . 1 1 4 GLU CB C -6.016 3.027 2.676 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CB . . . . . . . . . c30225_5ug3 1 . 19 . 5191 . 1 1 4 GLU CD C -6.348 4.815 4.405 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CD . . . . . . . . . c30225_5ug3 1 . 19 . 5192 . 1 1 4 GLU CG C -5.731 4.456 3.071 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CG . . . . . . . . . c30225_5ug3 1 . 19 . 5193 . 1 1 4 GLU H H -5.969 0.684 1.852 . . . 1.0 . . . . . . . . . . . . A . 4 GLU H . . . . . . . . . c30225_5ug3 1 . 19 . 5194 . 1 1 4 GLU HA H -6.047 3.202 0.548 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HA . . . . . . . . . c30225_5ug3 1 . 19 . 5195 . 1 1 4 GLU HB2 H -7.085 2.878 2.701 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HB2 . . . . . . . . . c30225_5ug3 1 . 19 . 5196 . 1 1 4 GLU HB3 H -5.558 2.377 3.407 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HB3 . . . . . . . . . c30225_5ug3 1 . 19 . 5197 . 1 1 4 GLU HG2 H -4.664 4.575 3.136 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HG2 . . . . . . . . . c30225_5ug3 1 . 19 . 5198 . 1 1 4 GLU HG3 H -6.127 5.116 2.313 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HG3 . . . . . . . . . c30225_5ug3 1 . 19 . 5199 . 1 1 4 GLU N N -5.755 1.241 1.079 . . . 1.0 . . . . . . . . . . . . A . 4 GLU N . . . . . . . . . c30225_5ug3 1 . 19 . 5200 . 1 1 4 GLU O O -3.636 4.068 0.763 . . . 1.0 . . . . . . . . . . . . A . 4 GLU O . . . . . . . . . c30225_5ug3 1 . 19 . 5201 . 1 1 4 GLU OE1 O -7.486 5.332 4.419 . . . 1.0 . . . . . . . . . . . . A . 4 GLU OE1 . . . . . . . . . c30225_5ug3 1 . 19 . 5202 . 1 1 4 GLU OE2 O -5.711 4.562 5.447 . . . 1.0 . . . . . . . . . . . . A . 4 GLU OE2 . . . . . . . . . c30225_5ug3 1 . 19 . 5203 . 1 1 5 CYS C C -1.156 2.337 0.051 . . . 1.0 . . . . . . . . . . . . A . 5 CYS C . . . . . . . . . c30225_5ug3 1 . 19 . 5204 . 1 1 5 CYS CA C -1.738 2.177 1.452 . . . 1.0 . . . . . . . . . . . . A . 5 CYS CA . . . . . . . . . c30225_5ug3 1 . 19 . 5205 . 1 1 5 CYS CB C -1.060 1.021 2.180 . . . 1.0 . . . . . . . . . . . . A . 5 CYS CB . . . . . . . . . c30225_5ug3 1 . 19 . 5206 . 1 1 5 CYS H H -3.529 1.070 1.597 . . . 1.0 . . . . . . . . . . . . A . 5 CYS H . . . . . . . . . c30225_5ug3 1 . 19 . 5207 . 1 1 5 CYS HA H -1.549 3.085 2.004 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HA . . . . . . . . . c30225_5ug3 1 . 19 . 5208 . 1 1 5 CYS HB2 H -1.706 0.156 2.140 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HB2 . . . . . . . . . c30225_5ug3 1 . 19 . 5209 . 1 1 5 CYS HB3 H -0.133 0.791 1.688 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HB3 . . . . . . . . . c30225_5ug3 1 . 19 . 5210 . 1 1 5 CYS N N -3.174 1.975 1.427 . . . 1.0 . . . . . . . . . . . . A . 5 CYS N . . . . . . . . . c30225_5ug3 1 . 19 . 5211 . 1 1 5 CYS O O 0.015 2.674 -0.104 . . . 1.0 . . . . . . . . . . . . A . 5 CYS O . . . . . . . . . c30225_5ug3 1 . 19 . 5212 . 1 1 5 CYS SG S -0.700 1.362 3.934 . . . 1.0 . . . . . . . . . . . . A . 5 CYS SG . . . . . . . . . c30225_5ug3 1 . 19 . 5213 . 1 1 6 CYS C C -1.253 3.781 -2.606 . . . 1.0 . . . . . . . . . . . . A . 6 CYS C . . . . . . . . . c30225_5ug3 1 . 19 . 5214 . 1 1 6 CYS CA C -1.548 2.306 -2.341 . . . 1.0 . . . . . . . . . . . . A . 6 CYS CA . . . . . . . . . c30225_5ug3 1 . 19 . 5215 . 1 1 6 CYS CB C -2.641 1.822 -3.281 . . . 1.0 . . . . . . . . . . . . A . 6 CYS CB . . . . . . . . . c30225_5ug3 1 . 19 . 5216 . 1 1 6 CYS H H -2.881 1.785 -0.795 . . . 1.0 . . . . . . . . . . . . A . 6 CYS H . . . . . . . . . c30225_5ug3 1 . 19 . 5217 . 1 1 6 CYS HA H -0.647 1.729 -2.503 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HA . . . . . . . . . c30225_5ug3 1 . 19 . 5218 . 1 1 6 CYS HB2 H -3.520 2.428 -3.123 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HB2 . . . . . . . . . c30225_5ug3 1 . 19 . 5219 . 1 1 6 CYS HB3 H -2.308 1.939 -4.294 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HB3 . . . . . . . . . c30225_5ug3 1 . 19 . 5220 . 1 1 6 CYS N N -1.972 2.108 -0.967 . . . 1.0 . . . . . . . . . . . . A . 6 CYS N . . . . . . . . . c30225_5ug3 1 . 19 . 5221 . 1 1 6 CYS O O -0.311 4.118 -3.325 . . . 1.0 . . . . . . . . . . . . A . 6 CYS O . . . . . . . . . c30225_5ug3 1 . 19 . 5222 . 1 1 6 CYS SG S -3.120 0.081 -3.047 . . . 1.0 . . . . . . . . . . . . A . 6 CYS SG . . . . . . . . . c30225_5ug3 1 . 19 . 5223 . 1 1 7 SER C C -0.886 6.580 -1.042 . . . 1.0 . . . . . . . . . . . . A . 7 SER C . . . . . . . . . c30225_5ug3 1 . 19 . 5224 . 1 1 7 SER CA C -1.831 6.098 -2.138 . . . 1.0 . . . . . . . . . . . . A . 7 SER CA . . . . . . . . . c30225_5ug3 1 . 19 . 5225 . 1 1 7 SER CB C -3.160 6.847 -2.065 . . . 1.0 . . . . . . . . . . . . A . 7 SER CB . . . . . . . . . c30225_5ug3 1 . 19 . 5226 . 1 1 7 SER H H -2.791 4.339 -1.452 . . . 1.0 . . . . . . . . . . . . A . 7 SER H . . . . . . . . . c30225_5ug3 1 . 19 . 5227 . 1 1 7 SER HA H -1.373 6.278 -3.100 . . . 1.0 . . . . . . . . . . . . A . 7 SER HA . . . . . . . . . c30225_5ug3 1 . 19 . 5228 . 1 1 7 SER HB2 H -3.598 6.702 -1.091 . . . 1.0 . . . . . . . . . . . . A . 7 SER HB2 . . . . . . . . . c30225_5ug3 1 . 19 . 5229 . 1 1 7 SER HB3 H -2.987 7.901 -2.227 . . . 1.0 . . . . . . . . . . . . A . 7 SER HB3 . . . . . . . . . c30225_5ug3 1 . 19 . 5230 . 1 1 7 SER HG H -4.086 5.410 -3.029 . . . 1.0 . . . . . . . . . . . . A . 7 SER HG . . . . . . . . . c30225_5ug3 1 . 19 . 5231 . 1 1 7 SER N N -2.047 4.661 -2.006 . . . 1.0 . . . . . . . . . . . . A . 7 SER N . . . . . . . . . c30225_5ug3 1 . 19 . 5232 . 1 1 7 SER O O -0.851 7.759 -0.686 . . . 1.0 . . . . . . . . . . . . A . 7 SER O . . . . . . . . . c30225_5ug3 1 . 19 . 5233 . 1 1 7 SER OG O -4.068 6.375 -3.048 . . . 1.0 . . . . . . . . . . . . A . 7 SER OG . . . . . . . . . c30225_5ug3 1 . 19 . 5234 . 1 1 8 ASN C C 2.181 5.347 0.105 . . . 1.0 . . . . . . . . . . . . A . 8 ASN C . . . . . . . . . c30225_5ug3 1 . 19 . 5235 . 1 1 8 ASN CA C 0.850 5.915 0.526 . . . 1.0 . . . . . . . . . . . . A . 8 ASN CA . . . . . . . . . c30225_5ug3 1 . 19 . 5236 . 1 1 8 ASN CB C 0.443 5.281 1.848 . . . 1.0 . . . . . . . . . . . . A . 8 ASN CB . . . . . . . . . c30225_5ug3 1 . 19 . 5237 . 1 1 8 ASN CG C -0.707 6.000 2.518 . . . 1.0 . . . . . . . . . . . . A . 8 ASN CG . . . . . . . . . c30225_5ug3 1 . 19 . 5238 . 1 1 8 ASN H H -0.230 4.714 -0.821 . . . 1.0 . . . . . . . . . . . . A . 8 ASN H . . . . . . . . . c30225_5ug3 1 . 19 . 5239 . 1 1 8 ASN HA H 0.931 6.984 0.645 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HA . . . . . . . . . c30225_5ug3 1 . 19 . 5240 . 1 1 8 ASN HB2 H 0.153 4.261 1.661 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HB2 . . . . . . . . . c30225_5ug3 1 . 19 . 5241 . 1 1 8 ASN HB3 H 1.290 5.290 2.519 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HB3 . . . . . . . . . c30225_5ug3 1 . 19 . 5242 . 1 1 8 ASN HD21 H -2.016 4.950 1.460 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HD21 . . . . . . . . . c30225_5ug3 1 . 19 . 5243 . 1 1 8 ASN HD22 H -2.685 6.102 2.564 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HD22 . . . . . . . . . c30225_5ug3 1 . 19 . 5244 . 1 1 8 ASN N N -0.132 5.638 -0.504 . . . 1.0 . . . . . . . . . . . . A . 8 ASN N . . . . . . . . . c30225_5ug3 1 . 19 . 5245 . 1 1 8 ASN ND2 N -1.922 5.650 2.145 . . . 1.0 . . . . . . . . . . . . A . 8 ASN ND2 . . . . . . . . . c30225_5ug3 1 . 19 . 5246 . 1 1 8 ASN O O 2.431 4.152 0.276 . . . 1.0 . . . . . . . . . . . . A . 8 ASN O . . . . . . . . . c30225_5ug3 1 . 19 . 5247 . 1 1 8 ASN OD1 O -0.498 6.881 3.351 . . . 1.0 . . . . . . . . . . . . A . 8 ASN OD1 . . . . . . . . . c30225_5ug3 1 . 19 . 5248 . 1 1 9 PRO C C 5.212 5.152 0.206 . . . 1.0 . . . . . . . . . . . . A . 9 PRO C . . . . . . . . . c30225_5ug3 1 . 19 . 5249 . 1 1 9 PRO CA C 4.355 5.710 -0.924 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CA . . . . . . . . . c30225_5ug3 1 . 19 . 5250 . 1 1 9 PRO CB C 4.985 6.962 -1.541 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CB . . . . . . . . . c30225_5ug3 1 . 19 . 5251 . 1 1 9 PRO CD C 2.889 7.624 -0.648 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CD . . . . . . . . . c30225_5ug3 1 . 19 . 5252 . 1 1 9 PRO CG C 4.291 8.098 -0.884 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CG . . . . . . . . . c30225_5ug3 1 . 19 . 5253 . 1 1 9 PRO HA H 4.227 4.950 -1.679 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HA . . . . . . . . . c30225_5ug3 1 . 19 . 5254 . 1 1 9 PRO HB2 H 6.044 6.973 -1.342 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HB2 . . . . . . . . . c30225_5ug3 1 . 19 . 5255 . 1 1 9 PRO HB3 H 4.811 6.964 -2.603 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HB3 . . . . . . . . . c30225_5ug3 1 . 19 . 5256 . 1 1 9 PRO HD2 H 2.480 8.092 0.229 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HD2 . . . . . . . . . c30225_5ug3 1 . 19 . 5257 . 1 1 9 PRO HD3 H 2.270 7.821 -1.510 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HD3 . . . . . . . . . c30225_5ug3 1 . 19 . 5258 . 1 1 9 PRO HG2 H 4.774 8.332 0.055 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HG2 . . . . . . . . . c30225_5ug3 1 . 19 . 5259 . 1 1 9 PRO HG3 H 4.293 8.959 -1.536 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HG3 . . . . . . . . . c30225_5ug3 1 . 19 . 5260 . 1 1 9 PRO N N 3.064 6.176 -0.443 . . . 1.0 . . . . . . . . . . . . A . 9 PRO N . . . . . . . . . c30225_5ug3 1 . 19 . 5261 . 1 1 9 PRO O O 6.196 4.465 -0.036 . . . 1.0 . . . . . . . . . . . . A . 9 PRO O . . . . . . . . . c30225_5ug3 1 . 19 . 5262 . 1 1 10 VAL C C 5.127 3.462 2.866 . . . 1.0 . . . . . . . . . . . . A . 10 VAL C . . . . . . . . . c30225_5ug3 1 . 19 . 5263 . 1 1 10 VAL CA C 5.499 4.923 2.618 . . . 1.0 . . . . . . . . . . . . A . 10 VAL CA . . . . . . . . . c30225_5ug3 1 . 19 . 5264 . 1 1 10 VAL CB C 5.164 5.765 3.870 . . . 1.0 . . . . . . . . . . . . A . 10 VAL CB . . . . . . . . . c30225_5ug3 1 . 19 . 5265 . 1 1 10 VAL CG1 C 5.872 5.226 5.103 . . . 1.0 . . . . . . . . . . . . A . 10 VAL CG1 . . . . . . . . . c30225_5ug3 1 . 19 . 5266 . 1 1 10 VAL CG2 C 5.532 7.222 3.644 . . . 1.0 . . . . . . . . . . . . A . 10 VAL CG2 . . . . . . . . . c30225_5ug3 1 . 19 . 5267 . 1 1 10 VAL H H 3.993 5.974 1.562 . . . 1.0 . . . . . . . . . . . . A . 10 VAL H . . . . . . . . . c30225_5ug3 1 . 19 . 5268 . 1 1 10 VAL HA H 6.566 4.986 2.431 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HA . . . . . . . . . c30225_5ug3 1 . 19 . 5269 . 1 1 10 VAL HB H 4.099 5.709 4.042 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HB . . . . . . . . . c30225_5ug3 1 . 19 . 5270 . 1 1 10 VAL HG11 H 5.587 4.197 5.263 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HG11 . . . . . . . . . c30225_5ug3 1 . 19 . 5271 . 1 1 10 VAL HG12 H 5.592 5.814 5.966 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HG12 . . . . . . . . . c30225_5ug3 1 . 19 . 5272 . 1 1 10 VAL HG13 H 6.940 5.286 4.959 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HG13 . . . . . . . . . c30225_5ug3 1 . 19 . 5273 . 1 1 10 VAL HG21 H 5.279 7.797 4.520 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HG21 . . . . . . . . . c30225_5ug3 1 . 19 . 5274 . 1 1 10 VAL HG22 H 4.989 7.603 2.793 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HG22 . . . . . . . . . c30225_5ug3 1 . 19 . 5275 . 1 1 10 VAL HG23 H 6.593 7.300 3.456 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HG23 . . . . . . . . . c30225_5ug3 1 . 19 . 5276 . 1 1 10 VAL N N 4.801 5.427 1.442 . . . 1.0 . . . . . . . . . . . . A . 10 VAL N . . . . . . . . . c30225_5ug3 1 . 19 . 5277 . 1 1 10 VAL O O 5.940 2.666 3.334 . . . 1.0 . . . . . . . . . . . . A . 10 VAL O . . . . . . . . . c30225_5ug3 1 . 19 . 5278 . 1 1 11 CYS C C 4.130 0.874 1.589 . . . 1.0 . . . . . . . . . . . . A . 11 CYS C . . . . . . . . . c30225_5ug3 1 . 19 . 5279 . 1 1 11 CYS CA C 3.472 1.733 2.658 . . . 1.0 . . . . . . . . . . . . A . 11 CYS CA . . . . . . . . . c30225_5ug3 1 . 19 . 5280 . 1 1 11 CYS CB C 1.959 1.637 2.529 . . . 1.0 . . . . . . . . . . . . A . 11 CYS CB . . . . . . . . . c30225_5ug3 1 . 19 . 5281 . 1 1 11 CYS H H 3.274 3.765 2.185 . . . 1.0 . . . . . . . . . . . . A . 11 CYS H . . . . . . . . . c30225_5ug3 1 . 19 . 5282 . 1 1 11 CYS HA H 3.769 1.376 3.631 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HA . . . . . . . . . c30225_5ug3 1 . 19 . 5283 . 1 1 11 CYS HB2 H 1.658 2.094 1.598 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HB2 . . . . . . . . . c30225_5ug3 1 . 19 . 5284 . 1 1 11 CYS HB3 H 1.681 0.602 2.515 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HB3 . . . . . . . . . c30225_5ug3 1 . 19 . 5285 . 1 1 11 CYS N N 3.903 3.102 2.531 . . . 1.0 . . . . . . . . . . . . A . 11 CYS N . . . . . . . . . c30225_5ug3 1 . 19 . 5286 . 1 1 11 CYS O O 4.746 -0.147 1.890 . . . 1.0 . . . . . . . . . . . . A . 11 CYS O . . . . . . . . . c30225_5ug3 1 . 19 . 5287 . 1 1 11 CYS SG S 1.017 2.446 3.862 . . . 1.0 . . . . . . . . . . . . A . 11 CYS SG . . . . . . . . . c30225_5ug3 1 . 19 . 5288 . 1 1 12 ARG C C 5.966 0.400 -0.929 . . . 1.0 . . . . . . . . . . . . A . 12 ARG C . . . . . . . . . c30225_5ug3 1 . 19 . 5289 . 1 1 12 ARG CA C 4.460 0.489 -0.779 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CA . . . . . . . . . c30225_5ug3 1 . 19 . 5290 . 1 1 12 ARG CB C 3.803 0.923 -2.081 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CB . . . . . . . . . c30225_5ug3 1 . 19 . 5291 . 1 1 12 ARG CD C 2.815 2.764 -3.430 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CD . . . . . . . . . c30225_5ug3 1 . 19 . 5292 . 1 1 12 ARG CG C 3.669 2.410 -2.230 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CG . . . . . . . . . c30225_5ug3 1 . 19 . 5293 . 1 1 12 ARG CZ C 3.515 2.271 -5.750 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CZ . . . . . . . . . c30225_5ug3 1 . 19 . 5294 . 1 1 12 ARG H H 3.659 2.205 0.174 . . . 1.0 . . . . . . . . . . . . A . 12 ARG H . . . . . . . . . c30225_5ug3 1 . 19 . 5295 . 1 1 12 ARG HA H 4.114 -0.482 -0.555 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HA . . . . . . . . . c30225_5ug3 1 . 19 . 5296 . 1 1 12 ARG HB2 H 4.393 0.557 -2.906 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HB2 . . . . . . . . . c30225_5ug3 1 . 19 . 5297 . 1 1 12 ARG HB3 H 2.817 0.487 -2.134 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HB3 . . . . . . . . . c30225_5ug3 1 . 19 . 5298 . 1 1 12 ARG HD2 H 1.777 2.688 -3.145 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HD2 . . . . . . . . . c30225_5ug3 1 . 19 . 5299 . 1 1 12 ARG HD3 H 3.036 3.779 -3.723 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HD3 . . . . . . . . . c30225_5ug3 1 . 19 . 5300 . 1 1 12 ARG HE H 2.886 0.909 -4.418 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HE . . . . . . . . . c30225_5ug3 1 . 19 . 5301 . 1 1 12 ARG HG2 H 3.195 2.790 -1.342 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HG2 . . . . . . . . . c30225_5ug3 1 . 19 . 5302 . 1 1 12 ARG HG3 H 4.649 2.844 -2.342 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HG3 . . . . . . . . . c30225_5ug3 1 . 19 . 5303 . 1 1 12 ARG HH11 H 3.575 4.245 -5.278 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH11 . . . . . . . . . c30225_5ug3 1 . 19 . 5304 . 1 1 12 ARG HH12 H 4.083 3.848 -6.889 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH12 . . . . . . . . . c30225_5ug3 1 . 19 . 5305 . 1 1 12 ARG HH21 H 3.553 0.406 -6.540 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH21 . . . . . . . . . c30225_5ug3 1 . 19 . 5306 . 1 1 12 ARG HH22 H 4.076 1.672 -7.600 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH22 . . . . . . . . . c30225_5ug3 1 . 19 . 5307 . 1 1 12 ARG N N 4.033 1.315 0.342 . . . 1.0 . . . . . . . . . . . . A . 12 ARG N . . . . . . . . . c30225_5ug3 1 . 19 . 5308 . 1 1 12 ARG NE N 3.065 1.872 -4.561 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NE . . . . . . . . . c30225_5ug3 1 . 19 . 5309 . 1 1 12 ARG NH1 N 3.740 3.558 -5.992 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NH1 . . . . . . . . . c30225_5ug3 1 . 19 . 5310 . 1 1 12 ARG NH2 N 3.728 1.379 -6.707 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NH2 . . . . . . . . . c30225_5ug3 1 . 19 . 5311 . 1 1 12 ARG O O 6.477 -0.489 -1.611 . . . 1.0 . . . . . . . . . . . . A . 12 ARG O . . . . . . . . . c30225_5ug3 1 . 19 . 5312 . 1 1 13 VAL C C 8.578 0.094 0.632 . . . 1.0 . . . . . . . . . . . . A . 13 VAL C . . . . . . . . . c30225_5ug3 1 . 19 . 5313 . 1 1 13 VAL CA C 8.117 1.240 -0.276 . . . 1.0 . . . . . . . . . . . . A . 13 VAL CA . . . . . . . . . c30225_5ug3 1 . 19 . 5314 . 1 1 13 VAL CB C 8.702 2.576 0.212 . . . 1.0 . . . . . . . . . . . . A . 13 VAL CB . . . . . . . . . c30225_5ug3 1 . 19 . 5315 . 1 1 13 VAL CG1 C 8.164 2.906 1.580 . . . 1.0 . . . . . . . . . . . . A . 13 VAL CG1 . . . . . . . . . c30225_5ug3 1 . 19 . 5316 . 1 1 13 VAL CG2 C 10.208 2.541 0.242 . . . 1.0 . . . . . . . . . . . . A . 13 VAL CG2 . . . . . . . . . c30225_5ug3 1 . 19 . 5317 . 1 1 13 VAL H H 6.231 2.065 0.124 . . . 1.0 . . . . . . . . . . . . A . 13 VAL H . . . . . . . . . c30225_5ug3 1 . 19 . 5318 . 1 1 13 VAL HA H 8.468 1.060 -1.281 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HA . . . . . . . . . c30225_5ug3 1 . 19 . 5319 . 1 1 13 VAL HB H 8.393 3.354 -0.470 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HB . . . . . . . . . c30225_5ug3 1 . 19 . 5320 . 1 1 13 VAL HG11 H 8.379 3.935 1.819 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HG11 . . . . . . . . . c30225_5ug3 1 . 19 . 5321 . 1 1 13 VAL HG12 H 8.626 2.259 2.313 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HG12 . . . . . . . . . c30225_5ug3 1 . 19 . 5322 . 1 1 13 VAL HG13 H 7.089 2.744 1.587 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HG13 . . . . . . . . . c30225_5ug3 1 . 19 . 5323 . 1 1 13 VAL HG21 H 10.583 2.375 -0.753 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HG21 . . . . . . . . . c30225_5ug3 1 . 19 . 5324 . 1 1 13 VAL HG22 H 10.528 1.741 0.891 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HG22 . . . . . . . . . c30225_5ug3 1 . 19 . 5325 . 1 1 13 VAL HG23 H 10.575 3.482 0.618 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HG23 . . . . . . . . . c30225_5ug3 1 . 19 . 5326 . 1 1 13 VAL N N 6.677 1.313 -0.310 . . . 1.0 . . . . . . . . . . . . A . 13 VAL N . . . . . . . . . c30225_5ug3 1 . 19 . 5327 . 1 1 13 VAL O O 9.537 -0.613 0.308 . . . 1.0 . . . . . . . . . . . . A . 13 VAL O . . . . . . . . . c30225_5ug3 1 . 19 . 5328 . 1 1 14 ASN C C 7.581 -2.447 2.539 . . . 1.0 . . . . . . . . . . . . A . 14 ASN C . . . . . . . . . c30225_5ug3 1 . 19 . 5329 . 1 1 14 ASN CA C 8.314 -1.117 2.723 . . . 1.0 . . . . . . . . . . . . A . 14 ASN CA . . . . . . . . . c30225_5ug3 1 . 19 . 5330 . 1 1 14 ASN CB C 8.154 -0.618 4.170 . . . 1.0 . . . . . . . . . . . . A . 14 ASN CB . . . . . . . . . c30225_5ug3 1 . 19 . 5331 . 1 1 14 ASN CG C 6.735 -0.732 4.702 . . . 1.0 . . . . . . . . . . . . A . 14 ASN CG . . . . . . . . . c30225_5ug3 1 . 19 . 5332 . 1 1 14 ASN H H 7.084 0.437 1.943 . . . 1.0 . . . . . . . . . . . . A . 14 ASN H . . . . . . . . . c30225_5ug3 1 . 19 . 5333 . 1 1 14 ASN HA H 9.364 -1.291 2.543 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HA . . . . . . . . . c30225_5ug3 1 . 19 . 5334 . 1 1 14 ASN HB2 H 8.799 -1.197 4.813 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HB2 . . . . . . . . . c30225_5ug3 1 . 19 . 5335 . 1 1 14 ASN HB3 H 8.452 0.419 4.216 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HB3 . . . . . . . . . c30225_5ug3 1 . 19 . 5336 . 1 1 14 ASN HD21 H 6.346 1.148 4.185 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HD21 . . . . . . . . . c30225_5ug3 1 . 19 . 5337 . 1 1 14 ASN HD22 H 5.048 0.280 4.924 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HD22 . . . . . . . . . c30225_5ug3 1 . 19 . 5338 . 1 1 14 ASN N N 7.884 -0.109 1.757 . . . 1.0 . . . . . . . . . . . . A . 14 ASN N . . . . . . . . . c30225_5ug3 1 . 19 . 5339 . 1 1 14 ASN ND2 N 5.968 0.338 4.596 . . . 1.0 . . . . . . . . . . . . A . 14 ASN ND2 . . . . . . . . . c30225_5ug3 1 . 19 . 5340 . 1 1 14 ASN O O 8.128 -3.496 2.872 . . . 1.0 . . . . . . . . . . . . A . 14 ASN O . . . . . . . . . c30225_5ug3 1 . 19 . 5341 . 1 1 14 ASN OD1 O 6.340 -1.767 5.236 . . . 1.0 . . . . . . . . . . . . A . 14 ASN OD1 . . . . . . . . . c30225_5ug3 1 . 19 . 5342 . 1 1 15 ASN C C 6.218 -4.511 0.754 . . . 1.0 . . . . . . . . . . . . A . 15 ASN C . . . . . . . . . c30225_5ug3 1 . 19 . 5343 . 1 1 15 ASN CA C 5.600 -3.642 1.845 . . . 1.0 . . . . . . . . . . . . A . 15 ASN CA . . . . . . . . . c30225_5ug3 1 . 19 . 5344 . 1 1 15 ASN CB C 4.109 -3.344 1.584 . . . 1.0 . . . . . . . . . . . . A . 15 ASN CB . . . . . . . . . c30225_5ug3 1 . 19 . 5345 . 1 1 15 ASN CG C 3.770 -2.680 0.253 . . . 1.0 . . . . . . . . . . . . A . 15 ASN CG . . . . . . . . . c30225_5ug3 1 . 19 . 5346 . 1 1 15 ASN H H 5.932 -1.580 1.783 . . . 1.0 . . . . . . . . . . . . A . 15 ASN H . . . . . . . . . c30225_5ug3 1 . 19 . 5347 . 1 1 15 ASN HA H 5.675 -4.195 2.777 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HA . . . . . . . . . c30225_5ug3 1 . 19 . 5348 . 1 1 15 ASN HB2 H 3.576 -4.265 1.629 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HB2 . . . . . . . . . c30225_5ug3 1 . 19 . 5349 . 1 1 15 ASN HB3 H 3.748 -2.703 2.375 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HB3 . . . . . . . . . c30225_5ug3 1 . 19 . 5350 . 1 1 15 ASN HD21 H 2.153 -1.870 1.069 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HD21 . . . . . . . . . c30225_5ug3 1 . 19 . 5351 . 1 1 15 ASN HD22 H 2.417 -1.483 -0.602 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HD22 . . . . . . . . . c30225_5ug3 1 . 19 . 5352 . 1 1 15 ASN N N 6.351 -2.423 2.024 . . . 1.0 . . . . . . . . . . . . A . 15 ASN N . . . . . . . . . c30225_5ug3 1 . 19 . 5353 . 1 1 15 ASN ND2 N 2.670 -1.939 0.241 . . . 1.0 . . . . . . . . . . . . A . 15 ASN ND2 . . . . . . . . . c30225_5ug3 1 . 19 . 5354 . 1 1 15 ASN O O 6.719 -4.032 -0.264 . . . 1.0 . . . . . . . . . . . . A . 15 ASN O . . . . . . . . . c30225_5ug3 1 . 19 . 5355 . 1 1 15 ASN OD1 O 4.445 -2.852 -0.754 . . . 1.0 . . . . . . . . . . . . A . 15 ASN OD1 . . . . . . . . . c30225_5ug3 1 . 19 . 5356 . 1 1 16 HYP C C 6.171 -6.965 -1.193 . . . 1.0 . . . . . . . . . . . . A . 16 HYP C . . . . . . . . . c30225_5ug3 1 . 19 . 5357 . 1 1 16 HYP CA C 6.863 -6.821 0.152 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CA . . . . . . . . . c30225_5ug3 1 . 19 . 5358 . 1 1 16 HYP CB C 6.724 -8.082 0.974 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CB . . . . . . . . . c30225_5ug3 1 . 19 . 5359 . 1 1 16 HYP CD C 5.687 -6.371 2.292 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CD . . . . . . . . . c30225_5ug3 1 . 19 . 5360 . 1 1 16 HYP CG C 5.950 -7.839 2.245 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CG . . . . . . . . . c30225_5ug3 1 . 19 . 5361 . 1 1 16 HYP HA H 7.899 -6.613 -0.011 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HA . . . . . . . . . c30225_5ug3 1 . 19 . 5362 . 1 1 16 HYP HB2 H 7.708 -8.443 1.232 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HB2 . . . . . . . . . c30225_5ug3 1 . 19 . 5363 . 1 1 16 HYP HB3 H 6.214 -8.829 0.384 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HB3 . . . . . . . . . c30225_5ug3 1 . 19 . 5364 . 1 1 16 HYP HD1 H 6.656 -7.377 3.987 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HD1 . . . . . . . . . c30225_5ug3 1 . 19 . 5365 . 1 1 16 HYP HD22 H 4.638 -6.178 2.367 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HD22 . . . . . . . . . c30225_5ug3 1 . 19 . 5366 . 1 1 16 HYP HD23 H 6.196 -5.945 3.144 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HD23 . . . . . . . . . c30225_5ug3 1 . 19 . 5367 . 1 1 16 HYP HG H 5.035 -8.411 2.248 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HG . . . . . . . . . c30225_5ug3 1 . 19 . 5368 . 1 1 16 HYP N N 6.244 -5.813 1.031 . . . 1.0 . . . . . . . . . . . . A . 16 HYP N . . . . . . . . . c30225_5ug3 1 . 19 . 5369 . 1 1 16 HYP O O 6.815 -6.891 -2.235 . . . 1.0 . . . . . . . . . . . . A . 16 HYP O . . . . . . . . . c30225_5ug3 1 . 19 . 5370 . 1 1 16 HYP OD1 O 6.718 -8.142 3.394 . . . 1.0 . . . . . . . . . . . . A . 16 HYP OD1 . . . . . . . . . c30225_5ug3 1 . 19 . 5371 . 1 1 17 HIS C C 2.625 -6.987 -2.189 . . . 1.0 . . . . . . . . . . . . A . 17 HIS C . . . . . . . . . c30225_5ug3 1 . 19 . 5372 . 1 1 17 HIS CA C 4.103 -7.311 -2.409 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CA . . . . . . . . . c30225_5ug3 1 . 19 . 5373 . 1 1 17 HIS CB C 4.267 -8.718 -3.017 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CB . . . . . . . . . c30225_5ug3 1 . 19 . 5374 . 1 1 17 HIS CD2 C 4.264 -10.507 -1.123 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CD2 . . . . . . . . . c30225_5ug3 1 . 19 . 5375 . 1 1 17 HIS CE1 C 2.312 -11.409 -1.542 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CE1 . . . . . . . . . c30225_5ug3 1 . 19 . 5376 . 1 1 17 HIS CG C 3.729 -9.847 -2.179 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CG . . . . . . . . . c30225_5ug3 1 . 19 . 5377 . 1 1 17 HIS H H 4.412 -7.253 -0.307 . . . 1.0 . . . . . . . . . . . . A . 17 HIS H . . . . . . . . . c30225_5ug3 1 . 19 . 5378 . 1 1 17 HIS HA H 4.503 -6.590 -3.107 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HA . . . . . . . . . c30225_5ug3 1 . 19 . 5379 . 1 1 17 HIS HB2 H 3.756 -8.748 -3.967 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HB2 . . . . . . . . . c30225_5ug3 1 . 19 . 5380 . 1 1 17 HIS HB3 H 5.320 -8.903 -3.182 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HB3 . . . . . . . . . c30225_5ug3 1 . 19 . 5381 . 1 1 17 HIS HD1 H 1.870 -10.181 -3.119 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HD1 . . . . . . . . . c30225_5ug3 1 . 19 . 5382 . 1 1 17 HIS HD2 H 5.223 -10.313 -0.666 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HD2 . . . . . . . . . c30225_5ug3 1 . 19 . 5383 . 1 1 17 HIS HE1 H 1.443 -12.047 -1.491 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HE1 . . . . . . . . . c30225_5ug3 1 . 19 . 5384 . 1 1 17 HIS HE2 H 3.500 -12.141 -0.044 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HE2 . . . . . . . . . c30225_5ug3 1 . 19 . 5385 . 1 1 17 HIS N N 4.867 -7.179 -1.170 . . . 1.0 . . . . . . . . . . . . A . 17 HIS N . . . . . . . . . c30225_5ug3 1 . 19 . 5386 . 1 1 17 HIS ND1 N 2.507 -10.439 -2.414 . . . 1.0 . . . . . . . . . . . . A . 17 HIS ND1 . . . . . . . . . c30225_5ug3 1 . 19 . 5387 . 1 1 17 HIS NE2 N 3.363 -11.470 -0.749 . . . 1.0 . . . . . . . . . . . . A . 17 HIS NE2 . . . . . . . . . c30225_5ug3 1 . 19 . 5388 . 1 1 17 HIS O O 1.745 -7.644 -2.747 . . . 1.0 . . . . . . . . . . . . A . 17 HIS O . . . . . . . . . c30225_5ug3 1 . 19 . 5389 . 1 1 18 VAL C C 0.428 -4.693 -2.217 . . . 1.0 . . . . . . . . . . . . A . 18 VAL C . . . . . . . . . c30225_5ug3 1 . 19 . 5390 . 1 1 18 VAL CA C 0.975 -5.581 -1.105 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CA . . . . . . . . . c30225_5ug3 1 . 19 . 5391 . 1 1 18 VAL CB C 0.846 -4.841 0.246 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CB . . . . . . . . . c30225_5ug3 1 . 19 . 5392 . 1 1 18 VAL CG1 C -0.608 -4.502 0.537 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CG1 . . . . . . . . . c30225_5ug3 1 . 19 . 5393 . 1 1 18 VAL CG2 C 1.435 -5.671 1.374 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CG2 . . . . . . . . . c30225_5ug3 1 . 19 . 5394 . 1 1 18 VAL H H 3.089 -5.459 -0.986 . . . 1.0 . . . . . . . . . . . . A . 18 VAL H . . . . . . . . . c30225_5ug3 1 . 19 . 5395 . 1 1 18 VAL HA H 0.381 -6.483 -1.056 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HA . . . . . . . . . c30225_5ug3 1 . 19 . 5396 . 1 1 18 VAL HB H 1.400 -3.917 0.181 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HB . . . . . . . . . c30225_5ug3 1 . 19 . 5397 . 1 1 18 VAL HG11 H -0.676 -3.995 1.488 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG11 . . . . . . . . . c30225_5ug3 1 . 19 . 5398 . 1 1 18 VAL HG12 H -1.191 -5.410 0.571 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG12 . . . . . . . . . c30225_5ug3 1 . 19 . 5399 . 1 1 18 VAL HG13 H -0.991 -3.860 -0.241 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG13 . . . . . . . . . c30225_5ug3 1 . 19 . 5400 . 1 1 18 VAL HG21 H 0.861 -6.576 1.491 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG21 . . . . . . . . . c30225_5ug3 1 . 19 . 5401 . 1 1 18 VAL HG22 H 1.404 -5.104 2.293 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG22 . . . . . . . . . c30225_5ug3 1 . 19 . 5402 . 1 1 18 VAL HG23 H 2.457 -5.922 1.141 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG23 . . . . . . . . . c30225_5ug3 1 . 19 . 5403 . 1 1 18 VAL N N 2.352 -5.968 -1.385 . . . 1.0 . . . . . . . . . . . . A . 18 VAL N . . . . . . . . . c30225_5ug3 1 . 19 . 5404 . 1 1 18 VAL O O -0.380 -5.130 -3.037 . . . 1.0 . . . . . . . . . . . . A . 18 VAL O . . . . . . . . . c30225_5ug3 1 . 19 . 5405 . 1 1 19 CYS C C 1.262 -1.216 -3.082 . . . 1.0 . . . . . . . . . . . . A . 19 CYS C . . . . . . . . . c30225_5ug3 1 . 19 . 5406 . 1 1 19 CYS CA C 0.417 -2.471 -3.208 . . . 1.0 . . . . . . . . . . . . A . 19 CYS CA . . . . . . . . . c30225_5ug3 1 . 19 . 5407 . 1 1 19 CYS CB C -1.062 -2.143 -2.966 . . . 1.0 . . . . . . . . . . . . A . 19 CYS CB . . . . . . . . . c30225_5ug3 1 . 19 . 5408 . 1 1 19 CYS H H 1.566 -3.180 -1.595 . . . 1.0 . . . . . . . . . . . . A . 19 CYS H . . . . . . . . . c30225_5ug3 1 . 19 . 5409 . 1 1 19 CYS HA H 0.538 -2.884 -4.200 . . . 1.0 . . . . . . . . . . . . A . 19 CYS HA . . . . . . . . . c30225_5ug3 1 . 19 . 5410 . 1 1 19 CYS HB2 H -1.638 -3.053 -3.028 . . . 1.0 . . . . . . . . . . . . A . 19 CYS HB2 . . . . . . . . . c30225_5ug3 1 . 19 . 5411 . 1 1 19 CYS HB3 H -1.168 -1.723 -1.976 . . . 1.0 . . . . . . . . . . . . A . 19 CYS HB3 . . . . . . . . . c30225_5ug3 1 . 19 . 5412 . 1 1 19 CYS N N 0.887 -3.452 -2.246 . . . 1.0 . . . . . . . . . . . . A . 19 CYS N . . . . . . . . . c30225_5ug3 1 . 19 . 5413 . 1 1 19 CYS O O 1.814 -0.752 -4.106 . . . 1.0 . . . . . . . . . . . . A . 19 CYS O . . . . . . . . . c30225_5ug3 1 . 19 . 5414 . 1 1 19 CYS OXT O 1.417 -0.739 -1.941 . . . 1.0 . . . . . . . . . . . . A . 19 CYS OXT . . . . . . . . . c30225_5ug3 1 . 19 . 5415 . 1 1 19 CYS SG S -1.775 -0.958 -4.155 . . . 1.0 . . . . . . . . . . . . A . 19 CYS SG . . . . . . . . . c30225_5ug3 1 . 20 . 5416 . 1 1 1 ILE C C -9.755 -2.657 -0.178 . . . 1.0 . . . . . . . . . . . . A . 1 ILE C . . . . . . . . . c30225_5ug3 1 . 20 . 5417 . 1 1 1 ILE CA C -10.804 -2.996 -1.229 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CA . . . . . . . . . c30225_5ug3 1 . 20 . 5418 . 1 1 1 ILE CB C -11.453 -1.685 -1.719 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CB . . . . . . . . . c30225_5ug3 1 . 20 . 5419 . 1 1 1 ILE CD1 C -13.269 -0.742 -3.237 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CD1 . . . . . . . . . c30225_5ug3 1 . 20 . 5420 . 1 1 1 ILE CG1 C -12.552 -1.979 -2.743 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CG1 . . . . . . . . . c30225_5ug3 1 . 20 . 5421 . 1 1 1 ILE CG2 C -10.397 -0.763 -2.322 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CG2 . . . . . . . . . c30225_5ug3 1 . 20 . 5422 . 1 1 1 ILE H1 H -12.545 -4.130 -1.374 . . . 1.0 . . . . . . . . . . . . A . 1 ILE H1 . . . . . . . . . c30225_5ug3 1 . 20 . 5423 . 1 1 1 ILE H2 H -12.246 -3.520 0.175 . . . 1.0 . . . . . . . . . . . . A . 1 ILE H2 . . . . . . . . . c30225_5ug3 1 . 20 . 5424 . 1 1 1 ILE H3 H -11.346 -4.826 -0.408 . . . 1.0 . . . . . . . . . . . . A . 1 ILE H3 . . . . . . . . . c30225_5ug3 1 . 20 . 5425 . 1 1 1 ILE HA H -10.321 -3.473 -2.067 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HA . . . . . . . . . c30225_5ug3 1 . 20 . 5426 . 1 1 1 ILE HB H -11.884 -1.186 -0.867 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HB . . . . . . . . . c30225_5ug3 1 . 20 . 5427 . 1 1 1 ILE HD11 H -13.718 -0.227 -2.401 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HD11 . . . . . . . . . c30225_5ug3 1 . 20 . 5428 . 1 1 1 ILE HD12 H -14.039 -1.029 -3.939 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HD12 . . . . . . . . . c30225_5ug3 1 . 20 . 5429 . 1 1 1 ILE HD13 H -12.563 -0.088 -3.726 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HD13 . . . . . . . . . c30225_5ug3 1 . 20 . 5430 . 1 1 1 ILE HG12 H -12.116 -2.472 -3.598 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG12 . . . . . . . . . c30225_5ug3 1 . 20 . 5431 . 1 1 1 ILE HG13 H -13.286 -2.630 -2.294 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG13 . . . . . . . . . c30225_5ug3 1 . 20 . 5432 . 1 1 1 ILE HG21 H -9.667 -0.511 -1.569 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG21 . . . . . . . . . c30225_5ug3 1 . 20 . 5433 . 1 1 1 ILE HG22 H -10.869 0.138 -2.683 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG22 . . . . . . . . . c30225_5ug3 1 . 20 . 5434 . 1 1 1 ILE HG23 H -9.909 -1.267 -3.143 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG23 . . . . . . . . . c30225_5ug3 1 . 20 . 5435 . 1 1 1 ILE N N -11.807 -3.931 -0.673 . . . 1.0 . . . . . . . . . . . . A . 1 ILE N . . . . . . . . . c30225_5ug3 1 . 20 . 5436 . 1 1 1 ILE O O -10.055 -2.014 0.826 . . . 1.0 . . . . . . . . . . . . A . 1 ILE O . . . . . . . . . c30225_5ug3 1 . 20 . 5437 . 1 1 2 ARG C C -6.326 -2.045 -0.160 . . . 1.0 . . . . . . . . . . . . A . 2 ARG C . . . . . . . . . c30225_5ug3 1 . 20 . 5438 . 1 1 2 ARG CA C -7.442 -2.834 0.516 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CA . . . . . . . . . c30225_5ug3 1 . 20 . 5439 . 1 1 2 ARG CB C -6.904 -4.152 1.084 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CB . . . . . . . . . c30225_5ug3 1 . 20 . 5440 . 1 1 2 ARG CD C -5.872 -6.402 0.647 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CD . . . . . . . . . c30225_5ug3 1 . 20 . 5441 . 1 1 2 ARG CG C -6.417 -5.126 0.025 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CG . . . . . . . . . c30225_5ug3 1 . 20 . 5442 . 1 1 2 ARG CZ C -6.710 -7.704 2.573 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CZ . . . . . . . . . c30225_5ug3 1 . 20 . 5443 . 1 1 2 ARG H H -8.343 -3.574 -1.236 . . . 1.0 . . . . . . . . . . . . A . 2 ARG H . . . . . . . . . c30225_5ug3 1 . 20 . 5444 . 1 1 2 ARG HA H -7.841 -2.245 1.318 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HA . . . . . . . . . c30225_5ug3 1 . 20 . 5445 . 1 1 2 ARG HB2 H -6.080 -3.933 1.747 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB2 . . . . . . . . . c30225_5ug3 1 . 20 . 5446 . 1 1 2 ARG HB3 H -7.689 -4.632 1.650 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB3 . . . . . . . . . c30225_5ug3 1 . 20 . 5447 . 1 1 2 ARG HD2 H -5.478 -7.028 -0.139 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD2 . . . . . . . . . c30225_5ug3 1 . 20 . 5448 . 1 1 2 ARG HD3 H -5.077 -6.140 1.329 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD3 . . . . . . . . . c30225_5ug3 1 . 20 . 5449 . 1 1 2 ARG HE H -7.776 -7.249 0.937 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HE . . . . . . . . . c30225_5ug3 1 . 20 . 5450 . 1 1 2 ARG HG2 H -7.241 -5.378 -0.624 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG2 . . . . . . . . . c30225_5ug3 1 . 20 . 5451 . 1 1 2 ARG HG3 H -5.634 -4.655 -0.552 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG3 . . . . . . . . . c30225_5ug3 1 . 20 . 5452 . 1 1 2 ARG HH11 H -4.806 -7.036 2.782 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH11 . . . . . . . . . c30225_5ug3 1 . 20 . 5453 . 1 1 2 ARG HH12 H -5.410 -7.981 4.103 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH12 . . . . . . . . . c30225_5ug3 1 . 20 . 5454 . 1 1 2 ARG HH21 H -8.570 -8.498 2.680 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH21 . . . . . . . . . c30225_5ug3 1 . 20 . 5455 . 1 1 2 ARG HH22 H -7.555 -8.805 4.050 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH22 . . . . . . . . . c30225_5ug3 1 . 20 . 5456 . 1 1 2 ARG N N -8.526 -3.084 -0.415 . . . 1.0 . . . . . . . . . . . . A . 2 ARG N . . . . . . . . . c30225_5ug3 1 . 20 . 5457 . 1 1 2 ARG NE N -6.899 -7.147 1.375 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NE . . . . . . . . . c30225_5ug3 1 . 20 . 5458 . 1 1 2 ARG NH1 N -5.549 -7.564 3.203 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH1 . . . . . . . . . c30225_5ug3 1 . 20 . 5459 . 1 1 2 ARG NH2 N -7.689 -8.392 3.145 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH2 . . . . . . . . . c30225_5ug3 1 . 20 . 5460 . 1 1 2 ARG O O -5.141 -2.268 0.091 . . . 1.0 . . . . . . . . . . . . A . 2 ARG O . . . . . . . . . c30225_5ug3 1 . 20 . 5461 . 1 1 3 ASP C C -5.560 1.061 -1.063 . . . 1.0 . . . . . . . . . . . . A . 3 ASP C . . . . . . . . . c30225_5ug3 1 . 20 . 5462 . 1 1 3 ASP CA C -5.750 -0.293 -1.740 . . . 1.0 . . . . . . . . . . . . A . 3 ASP CA . . . . . . . . . c30225_5ug3 1 . 20 . 5463 . 1 1 3 ASP CB C -6.196 -0.098 -3.193 . . . 1.0 . . . . . . . . . . . . A . 3 ASP CB . . . . . . . . . c30225_5ug3 1 . 20 . 5464 . 1 1 3 ASP CG C -6.116 -1.376 -4.005 . . . 1.0 . . . . . . . . . . . . A . 3 ASP CG . . . . . . . . . c30225_5ug3 1 . 20 . 5465 . 1 1 3 ASP H H -7.670 -0.960 -1.160 . . . 1.0 . . . . . . . . . . . . A . 3 ASP H . . . . . . . . . c30225_5ug3 1 . 20 . 5466 . 1 1 3 ASP HA H -4.806 -0.816 -1.733 . . . 1.0 . . . . . . . . . . . . A . 3 ASP HA . . . . . . . . . c30225_5ug3 1 . 20 . 5467 . 1 1 3 ASP HB2 H -7.219 0.247 -3.204 . . . 1.0 . . . . . . . . . . . . A . 3 ASP HB2 . . . . . . . . . c30225_5ug3 1 . 20 . 5468 . 1 1 3 ASP HB3 H -5.567 0.644 -3.657 . . . 1.0 . . . . . . . . . . . . A . 3 ASP HB3 . . . . . . . . . c30225_5ug3 1 . 20 . 5469 . 1 1 3 ASP N N -6.713 -1.109 -1.013 . . . 1.0 . . . . . . . . . . . . A . 3 ASP N . . . . . . . . . c30225_5ug3 1 . 20 . 5470 . 1 1 3 ASP O O -5.270 2.061 -1.720 . . . 1.0 . . . . . . . . . . . . A . 3 ASP O . . . . . . . . . c30225_5ug3 1 . 20 . 5471 . 1 1 3 ASP OD1 O -7.169 -2.008 -4.234 . . . 1.0 . . . . . . . . . . . . A . 3 ASP OD1 . . . . . . . . . c30225_5ug3 1 . 20 . 5472 . 1 1 3 ASP OD2 O -4.999 -1.759 -4.419 . . . 1.0 . . . . . . . . . . . . A . 3 ASP OD2 . . . . . . . . . c30225_5ug3 1 . 20 . 5473 . 1 1 4 GLU C C -4.098 2.782 0.987 . . . 1.0 . . . . . . . . . . . . A . 4 GLU C . . . . . . . . . c30225_5ug3 1 . 20 . 5474 . 1 1 4 GLU CA C -5.549 2.318 1.021 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CA . . . . . . . . . c30225_5ug3 1 . 20 . 5475 . 1 1 4 GLU CB C -5.994 2.100 2.467 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CB . . . . . . . . . c30225_5ug3 1 . 20 . 5476 . 1 1 4 GLU CD C -8.406 2.684 2.032 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CD . . . . . . . . . c30225_5ug3 1 . 20 . 5477 . 1 1 4 GLU CG C -7.442 1.663 2.593 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CG . . . . . . . . . c30225_5ug3 1 . 20 . 5478 . 1 1 4 GLU H H -5.938 0.259 0.722 . . . 1.0 . . . . . . . . . . . . A . 4 GLU H . . . . . . . . . c30225_5ug3 1 . 20 . 5479 . 1 1 4 GLU HA H -6.170 3.076 0.569 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HA . . . . . . . . . c30225_5ug3 1 . 20 . 5480 . 1 1 4 GLU HB2 H -5.371 1.341 2.913 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HB2 . . . . . . . . . c30225_5ug3 1 . 20 . 5481 . 1 1 4 GLU HB3 H -5.869 3.023 3.012 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HB3 . . . . . . . . . c30225_5ug3 1 . 20 . 5482 . 1 1 4 GLU HG2 H -7.574 0.736 2.058 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HG2 . . . . . . . . . c30225_5ug3 1 . 20 . 5483 . 1 1 4 GLU HG3 H -7.669 1.512 3.639 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HG3 . . . . . . . . . c30225_5ug3 1 . 20 . 5484 . 1 1 4 GLU N N -5.710 1.087 0.253 . . . 1.0 . . . . . . . . . . . . A . 4 GLU N . . . . . . . . . c30225_5ug3 1 . 20 . 5485 . 1 1 4 GLU O O -3.794 3.892 0.550 . . . 1.0 . . . . . . . . . . . . A . 4 GLU O . . . . . . . . . c30225_5ug3 1 . 20 . 5486 . 1 1 4 GLU OE1 O -8.807 3.601 2.773 . . . 1.0 . . . . . . . . . . . . A . 4 GLU OE1 . . . . . . . . . c30225_5ug3 1 . 20 . 5487 . 1 1 4 GLU OE2 O -8.765 2.570 0.840 . . . 1.0 . . . . . . . . . . . . A . 4 GLU OE2 . . . . . . . . . c30225_5ug3 1 . 20 . 5488 . 1 1 5 CYS C C -1.192 2.359 0.044 . . . 1.0 . . . . . . . . . . . . A . 5 CYS C . . . . . . . . . c30225_5ug3 1 . 20 . 5489 . 1 1 5 CYS CA C -1.775 2.212 1.448 . . . 1.0 . . . . . . . . . . . . A . 5 CYS CA . . . . . . . . . c30225_5ug3 1 . 20 . 5490 . 1 1 5 CYS CB C -1.028 1.140 2.224 . . . 1.0 . . . . . . . . . . . . A . 5 CYS CB . . . . . . . . . c30225_5ug3 1 . 20 . 5491 . 1 1 5 CYS H H -3.496 1.023 1.715 . . . 1.0 . . . . . . . . . . . . A . 5 CYS H . . . . . . . . . c30225_5ug3 1 . 20 . 5492 . 1 1 5 CYS HA H -1.660 3.152 1.965 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HA . . . . . . . . . c30225_5ug3 1 . 20 . 5493 . 1 1 5 CYS HB2 H -1.621 0.239 2.235 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HB2 . . . . . . . . . c30225_5ug3 1 . 20 . 5494 . 1 1 5 CYS HB3 H -0.092 0.942 1.731 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HB3 . . . . . . . . . c30225_5ug3 1 . 20 . 5495 . 1 1 5 CYS N N -3.197 1.906 1.412 . . . 1.0 . . . . . . . . . . . . A . 5 CYS N . . . . . . . . . c30225_5ug3 1 . 20 . 5496 . 1 1 5 CYS O O -0.040 2.750 -0.121 . . . 1.0 . . . . . . . . . . . . A . 5 CYS O . . . . . . . . . c30225_5ug3 1 . 20 . 5497 . 1 1 5 CYS SG S -0.671 1.593 3.955 . . . 1.0 . . . . . . . . . . . . A . 5 CYS SG . . . . . . . . . c30225_5ug3 1 . 20 . 5498 . 1 1 6 CYS C C -1.405 3.673 -2.710 . . . 1.0 . . . . . . . . . . . . A . 6 CYS C . . . . . . . . . c30225_5ug3 1 . 20 . 5499 . 1 1 6 CYS CA C -1.602 2.197 -2.356 . . . 1.0 . . . . . . . . . . . . A . 6 CYS CA . . . . . . . . . c30225_5ug3 1 . 20 . 5500 . 1 1 6 CYS CB C -2.678 1.569 -3.244 . . . 1.0 . . . . . . . . . . . . A . 6 CYS CB . . . . . . . . . c30225_5ug3 1 . 20 . 5501 . 1 1 6 CYS H H -2.901 1.731 -0.759 . . . 1.0 . . . . . . . . . . . . A . 6 CYS H . . . . . . . . . c30225_5ug3 1 . 20 . 5502 . 1 1 6 CYS HA H -0.670 1.670 -2.499 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HA . . . . . . . . . c30225_5ug3 1 . 20 . 5503 . 1 1 6 CYS HB2 H -2.816 0.541 -2.950 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HB2 . . . . . . . . . c30225_5ug3 1 . 20 . 5504 . 1 1 6 CYS HB3 H -3.602 2.106 -3.081 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HB3 . . . . . . . . . c30225_5ug3 1 . 20 . 5505 . 1 1 6 CYS N N -1.999 2.054 -0.960 . . . 1.0 . . . . . . . . . . . . A . 6 CYS N . . . . . . . . . c30225_5ug3 1 . 20 . 5506 . 1 1 6 CYS O O -0.738 4.015 -3.684 . . . 1.0 . . . . . . . . . . . . A . 6 CYS O . . . . . . . . . c30225_5ug3 1 . 20 . 5507 . 1 1 6 CYS SG S -2.332 1.582 -5.034 . . . 1.0 . . . . . . . . . . . . A . 6 CYS SG . . . . . . . . . c30225_5ug3 1 . 20 . 5508 . 1 1 7 SER C C -0.838 6.556 -1.117 . . . 1.0 . . . . . . . . . . . . A . 7 SER C . . . . . . . . . c30225_5ug3 1 . 20 . 5509 . 1 1 7 SER CA C -1.873 5.980 -2.081 . . . 1.0 . . . . . . . . . . . . A . 7 SER CA . . . . . . . . . c30225_5ug3 1 . 20 . 5510 . 1 1 7 SER CB C -3.235 6.632 -1.838 . . . 1.0 . . . . . . . . . . . . A . 7 SER CB . . . . . . . . . c30225_5ug3 1 . 20 . 5511 . 1 1 7 SER H H -2.479 4.203 -1.128 . . . 1.0 . . . . . . . . . . . . A . 7 SER H . . . . . . . . . c30225_5ug3 1 . 20 . 5512 . 1 1 7 SER HA H -1.559 6.168 -3.097 . . . 1.0 . . . . . . . . . . . . A . 7 SER HA . . . . . . . . . c30225_5ug3 1 . 20 . 5513 . 1 1 7 SER HB2 H -3.445 6.637 -0.779 . . . 1.0 . . . . . . . . . . . . A . 7 SER HB2 . . . . . . . . . c30225_5ug3 1 . 20 . 5514 . 1 1 7 SER HB3 H -3.217 7.647 -2.206 . . . 1.0 . . . . . . . . . . . . A . 7 SER HB3 . . . . . . . . . c30225_5ug3 1 . 20 . 5515 . 1 1 7 SER HG H -4.230 6.113 -3.450 . . . 1.0 . . . . . . . . . . . . A . 7 SER HG . . . . . . . . . c30225_5ug3 1 . 20 . 5516 . 1 1 7 SER N N -1.976 4.541 -1.890 . . . 1.0 . . . . . . . . . . . . A . 7 SER N . . . . . . . . . c30225_5ug3 1 . 20 . 5517 . 1 1 7 SER O O -0.663 7.770 -1.011 . . . 1.0 . . . . . . . . . . . . A . 7 SER O . . . . . . . . . c30225_5ug3 1 . 20 . 5518 . 1 1 7 SER OG O -4.267 5.921 -2.504 . . . 1.0 . . . . . . . . . . . . A . 7 SER OG . . . . . . . . . c30225_5ug3 1 . 20 . 5519 . 1 1 8 ASN C C 2.186 5.524 0.150 . . . 1.0 . . . . . . . . . . . . A . 8 ASN C . . . . . . . . . c30225_5ug3 1 . 20 . 5520 . 1 1 8 ASN CA C 0.836 6.037 0.580 . . . 1.0 . . . . . . . . . . . . A . 8 ASN CA . . . . . . . . . c30225_5ug3 1 . 20 . 5521 . 1 1 8 ASN CB C 0.491 5.428 1.934 . . . 1.0 . . . . . . . . . . . . A . 8 ASN CB . . . . . . . . . c30225_5ug3 1 . 20 . 5522 . 1 1 8 ASN CG C -0.806 5.962 2.504 . . . 1.0 . . . . . . . . . . . . A . 8 ASN CG . . . . . . . . . c30225_5ug3 1 . 20 . 5523 . 1 1 8 ASN H H -0.310 4.710 -0.593 . . . 1.0 . . . . . . . . . . . . A . 8 ASN H . . . . . . . . . c30225_5ug3 1 . 20 . 5524 . 1 1 8 ASN HA H 0.860 7.113 0.656 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HA . . . . . . . . . c30225_5ug3 1 . 20 . 5525 . 1 1 8 ASN HB2 H 0.404 4.360 1.814 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HB2 . . . . . . . . . c30225_5ug3 1 . 20 . 5526 . 1 1 8 ASN HB3 H 1.290 5.640 2.630 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HB3 . . . . . . . . . c30225_5ug3 1 . 20 . 5527 . 1 1 8 ASN HD21 H -1.845 4.709 1.374 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HD21 . . . . . . . . . c30225_5ug3 1 . 20 . 5528 . 1 1 8 ASN HD22 H -2.775 5.734 2.409 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HD22 . . . . . . . . . c30225_5ug3 1 . 20 . 5529 . 1 1 8 ASN N N -0.157 5.662 -0.417 . . . 1.0 . . . . . . . . . . . . A . 8 ASN N . . . . . . . . . c30225_5ug3 1 . 20 . 5530 . 1 1 8 ASN ND2 N -1.919 5.415 2.050 . . . 1.0 . . . . . . . . . . . . A . 8 ASN ND2 . . . . . . . . . c30225_5ug3 1 . 20 . 5531 . 1 1 8 ASN O O 2.428 4.317 0.168 . . . 1.0 . . . . . . . . . . . . A . 8 ASN O . . . . . . . . . c30225_5ug3 1 . 20 . 5532 . 1 1 8 ASN OD1 O -0.810 6.884 3.321 . . . 1.0 . . . . . . . . . . . . A . 8 ASN OD1 . . . . . . . . . c30225_5ug3 1 . 20 . 5533 . 1 1 9 PRO C C 5.214 5.193 0.158 . . . 1.0 . . . . . . . . . . . . A . 9 PRO C . . . . . . . . . c30225_5ug3 1 . 20 . 5534 . 1 1 9 PRO CA C 4.371 6.024 -0.798 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CA . . . . . . . . . c30225_5ug3 1 . 20 . 5535 . 1 1 9 PRO CB C 5.048 7.359 -1.120 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CB . . . . . . . . . c30225_5ug3 1 . 20 . 5536 . 1 1 9 PRO CD C 2.986 7.881 -0.070 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CD . . . . . . . . . c30225_5ug3 1 . 20 . 5537 . 1 1 9 PRO CG C 4.407 8.338 -0.205 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CG . . . . . . . . . c30225_5ug3 1 . 20 . 5538 . 1 1 9 PRO HA H 4.215 5.463 -1.705 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HA . . . . . . . . . c30225_5ug3 1 . 20 . 5539 . 1 1 9 PRO HB2 H 6.110 7.284 -0.939 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HB2 . . . . . . . . . c30225_5ug3 1 . 20 . 5540 . 1 1 9 PRO HB3 H 4.868 7.615 -2.150 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HB3 . . . . . . . . . c30225_5ug3 1 . 20 . 5541 . 1 1 9 PRO HD2 H 2.599 8.147 0.896 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HD2 . . . . . . . . . c30225_5ug3 1 . 20 . 5542 . 1 1 9 PRO HD3 H 2.375 8.302 -0.854 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HD3 . . . . . . . . . c30225_5ug3 1 . 20 . 5543 . 1 1 9 PRO HG2 H 4.901 8.324 0.756 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HG2 . . . . . . . . . c30225_5ug3 1 . 20 . 5544 . 1 1 9 PRO HG3 H 4.445 9.327 -0.637 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HG3 . . . . . . . . . c30225_5ug3 1 . 20 . 5545 . 1 1 9 PRO N N 3.098 6.420 -0.215 . . . 1.0 . . . . . . . . . . . . A . 9 PRO N . . . . . . . . . c30225_5ug3 1 . 20 . 5546 . 1 1 9 PRO O O 6.061 4.417 -0.268 . . . 1.0 . . . . . . . . . . . . A . 9 PRO O . . . . . . . . . c30225_5ug3 1 . 20 . 5547 . 1 1 10 VAL C C 5.305 3.176 2.583 . . . 1.0 . . . . . . . . . . . . A . 10 VAL C . . . . . . . . . c30225_5ug3 1 . 20 . 5548 . 1 1 10 VAL CA C 5.725 4.635 2.460 . . . 1.0 . . . . . . . . . . . . A . 10 VAL CA . . . . . . . . . c30225_5ug3 1 . 20 . 5549 . 1 1 10 VAL CB C 5.606 5.330 3.832 . . . 1.0 . . . . . . . . . . . . A . 10 VAL CB . . . . . . . . . c30225_5ug3 1 . 20 . 5550 . 1 1 10 VAL CG1 C 6.428 4.600 4.885 . . . 1.0 . . . . . . . . . . . . A . 10 VAL CG1 . . . . . . . . . c30225_5ug3 1 . 20 . 5551 . 1 1 10 VAL CG2 C 6.043 6.782 3.729 . . . 1.0 . . . . . . . . . . . . A . 10 VAL CG2 . . . . . . . . . c30225_5ug3 1 . 20 . 5552 . 1 1 10 VAL H H 4.153 5.846 1.716 . . . 1.0 . . . . . . . . . . . . A . 10 VAL H . . . . . . . . . c30225_5ug3 1 . 20 . 5553 . 1 1 10 VAL HA H 6.762 4.670 2.149 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HA . . . . . . . . . c30225_5ug3 1 . 20 . 5554 . 1 1 10 VAL HB H 4.570 5.308 4.137 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HB . . . . . . . . . c30225_5ug3 1 . 20 . 5555 . 1 1 10 VAL HG11 H 6.070 3.584 4.981 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HG11 . . . . . . . . . c30225_5ug3 1 . 20 . 5556 . 1 1 10 VAL HG12 H 6.330 5.108 5.832 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HG12 . . . . . . . . . c30225_5ug3 1 . 20 . 5557 . 1 1 10 VAL HG13 H 7.465 4.589 4.587 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HG13 . . . . . . . . . c30225_5ug3 1 . 20 . 5558 . 1 1 10 VAL HG21 H 7.065 6.828 3.387 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HG21 . . . . . . . . . c30225_5ug3 1 . 20 . 5559 . 1 1 10 VAL HG22 H 5.967 7.250 4.699 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HG22 . . . . . . . . . c30225_5ug3 1 . 20 . 5560 . 1 1 10 VAL HG23 H 5.406 7.301 3.029 . . . 1.0 . . . . . . . . . . . . A . 10 VAL HG23 . . . . . . . . . c30225_5ug3 1 . 20 . 5561 . 1 1 10 VAL N N 4.931 5.312 1.446 . . . 1.0 . . . . . . . . . . . . A . 10 VAL N . . . . . . . . . c30225_5ug3 1 . 20 . 5562 . 1 1 10 VAL O O 6.144 2.286 2.687 . . . 1.0 . . . . . . . . . . . . A . 10 VAL O . . . . . . . . . c30225_5ug3 1 . 20 . 5563 . 1 1 11 CYS C C 4.026 0.737 1.472 . . . 1.0 . . . . . . . . . . . . A . 11 CYS C . . . . . . . . . c30225_5ug3 1 . 20 . 5564 . 1 1 11 CYS CA C 3.482 1.584 2.612 . . . 1.0 . . . . . . . . . . . . A . 11 CYS CA . . . . . . . . . c30225_5ug3 1 . 20 . 5565 . 1 1 11 CYS CB C 1.968 1.607 2.513 . . . 1.0 . . . . . . . . . . . . A . 11 CYS CB . . . . . . . . . c30225_5ug3 1 . 20 . 5566 . 1 1 11 CYS H H 3.374 3.675 2.458 . . . 1.0 . . . . . . . . . . . . A . 11 CYS H . . . . . . . . . c30225_5ug3 1 . 20 . 5567 . 1 1 11 CYS HA H 3.773 1.155 3.555 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HA . . . . . . . . . c30225_5ug3 1 . 20 . 5568 . 1 1 11 CYS HB2 H 1.687 2.044 1.565 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HB2 . . . . . . . . . c30225_5ug3 1 . 20 . 5569 . 1 1 11 CYS HB3 H 1.612 0.599 2.551 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HB3 . . . . . . . . . c30225_5ug3 1 . 20 . 5570 . 1 1 11 CYS N N 4.003 2.933 2.540 . . . 1.0 . . . . . . . . . . . . A . 11 CYS N . . . . . . . . . c30225_5ug3 1 . 20 . 5571 . 1 1 11 CYS O O 4.365 -0.429 1.648 . . . 1.0 . . . . . . . . . . . . A . 11 CYS O . . . . . . . . . c30225_5ug3 1 . 20 . 5572 . 1 1 11 CYS SG S 1.119 2.542 3.824 . . . 1.0 . . . . . . . . . . . . A . 11 CYS SG . . . . . . . . . c30225_5ug3 1 . 20 . 5573 . 1 1 12 ARG C C 5.935 0.314 -0.976 . . . 1.0 . . . . . . . . . . . . A . 12 ARG C . . . . . . . . . c30225_5ug3 1 . 20 . 5574 . 1 1 12 ARG CA C 4.470 0.678 -0.924 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CA . . . . . . . . . c30225_5ug3 1 . 20 . 5575 . 1 1 12 ARG CB C 4.079 1.591 -2.068 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CB . . . . . . . . . c30225_5ug3 1 . 20 . 5576 . 1 1 12 ARG CD C 2.131 2.800 -3.123 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CD . . . . . . . . . c30225_5ug3 1 . 20 . 5577 . 1 1 12 ARG CG C 2.629 1.988 -1.945 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CG . . . . . . . . . c30225_5ug3 1 . 20 . 5578 . 1 1 12 ARG CZ C 2.464 2.908 -5.566 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CZ . . . . . . . . . c30225_5ug3 1 . 20 . 5579 . 1 1 12 ARG H H 3.932 2.323 0.275 . . . 1.0 . . . . . . . . . . . . A . 12 ARG H . . . . . . . . . c30225_5ug3 1 . 20 . 5580 . 1 1 12 ARG HA H 3.897 -0.218 -0.986 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HA . . . . . . . . . c30225_5ug3 1 . 20 . 5581 . 1 1 12 ARG HB2 H 4.687 2.481 -2.037 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HB2 . . . . . . . . . c30225_5ug3 1 . 20 . 5582 . 1 1 12 ARG HB3 H 4.223 1.081 -3.006 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HB3 . . . . . . . . . c30225_5ug3 1 . 20 . 5583 . 1 1 12 ARG HD2 H 1.050 2.804 -3.100 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HD2 . . . . . . . . . c30225_5ug3 1 . 20 . 5584 . 1 1 12 ARG HD3 H 2.487 3.810 -3.018 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HD3 . . . . . . . . . c30225_5ug3 1 . 20 . 5585 . 1 1 12 ARG HE H 2.947 1.340 -4.410 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HE . . . . . . . . . c30225_5ug3 1 . 20 . 5586 . 1 1 12 ARG HG2 H 2.052 1.097 -1.851 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HG2 . . . . . . . . . c30225_5ug3 1 . 20 . 5587 . 1 1 12 ARG HG3 H 2.514 2.578 -1.046 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HG3 . . . . . . . . . c30225_5ug3 1 . 20 . 5588 . 1 1 12 ARG HH11 H 1.578 4.541 -4.761 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH11 . . . . . . . . . c30225_5ug3 1 . 20 . 5589 . 1 1 12 ARG HH12 H 1.832 4.608 -6.475 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH12 . . . . . . . . . c30225_5ug3 1 . 20 . 5590 . 1 1 12 ARG HH21 H 3.288 1.421 -6.667 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH21 . . . . . . . . . c30225_5ug3 1 . 20 . 5591 . 1 1 12 ARG HH22 H 2.811 2.828 -7.563 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH22 . . . . . . . . . c30225_5ug3 1 . 20 . 5592 . 1 1 12 ARG N N 4.119 1.359 0.311 . . . 1.0 . . . . . . . . . . . . A . 12 ARG N . . . . . . . . . c30225_5ug3 1 . 20 . 5593 . 1 1 12 ARG NE N 2.567 2.255 -4.409 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NE . . . . . . . . . c30225_5ug3 1 . 20 . 5594 . 1 1 12 ARG NH1 N 1.917 4.116 -5.603 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NH1 . . . . . . . . . c30225_5ug3 1 . 20 . 5595 . 1 1 12 ARG NH2 N 2.890 2.341 -6.687 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NH2 . . . . . . . . . c30225_5ug3 1 . 20 . 5596 . 1 1 12 ARG O O 6.317 -0.728 -1.503 . . . 1.0 . . . . . . . . . . . . A . 12 ARG O . . . . . . . . . c30225_5ug3 1 . 20 . 5597 . 1 1 13 VAL C C 8.578 0.084 0.803 . . . 1.0 . . . . . . . . . . . . A . 13 VAL C . . . . . . . . . c30225_5ug3 1 . 20 . 5598 . 1 1 13 VAL CA C 8.169 0.958 -0.380 . . . 1.0 . . . . . . . . . . . . A . 13 VAL CA . . . . . . . . . c30225_5ug3 1 . 20 . 5599 . 1 1 13 VAL CB C 8.895 2.302 -0.342 . . . 1.0 . . . . . . . . . . . . A . 13 VAL CB . . . . . . . . . c30225_5ug3 1 . 20 . 5600 . 1 1 13 VAL CG1 C 8.461 3.125 -1.539 . . . 1.0 . . . . . . . . . . . . A . 13 VAL CG1 . . . . . . . . . c30225_5ug3 1 . 20 . 5601 . 1 1 13 VAL CG2 C 8.631 3.047 0.956 . . . 1.0 . . . . . . . . . . . . A . 13 VAL CG2 . . . . . . . . . c30225_5ug3 1 . 20 . 5602 . 1 1 13 VAL H H 6.369 1.993 -0.041 . . . 1.0 . . . . . . . . . . . . A . 13 VAL H . . . . . . . . . c30225_5ug3 1 . 20 . 5603 . 1 1 13 VAL HA H 8.447 0.454 -1.294 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HA . . . . . . . . . c30225_5ug3 1 . 20 . 5604 . 1 1 13 VAL HB H 9.942 2.121 -0.420 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HB . . . . . . . . . c30225_5ug3 1 . 20 . 5605 . 1 1 13 VAL HG11 H 7.381 3.054 -1.639 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HG11 . . . . . . . . . c30225_5ug3 1 . 20 . 5606 . 1 1 13 VAL HG12 H 8.932 2.740 -2.430 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HG12 . . . . . . . . . c30225_5ug3 1 . 20 . 5607 . 1 1 13 VAL HG13 H 8.743 4.155 -1.393 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HG13 . . . . . . . . . c30225_5ug3 1 . 20 . 5608 . 1 1 13 VAL HG21 H 7.570 3.205 1.068 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HG21 . . . . . . . . . c30225_5ug3 1 . 20 . 5609 . 1 1 13 VAL HG22 H 9.137 4.000 0.934 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HG22 . . . . . . . . . c30225_5ug3 1 . 20 . 5610 . 1 1 13 VAL HG23 H 8.998 2.463 1.787 . . . 1.0 . . . . . . . . . . . . A . 13 VAL HG23 . . . . . . . . . c30225_5ug3 1 . 20 . 5611 . 1 1 13 VAL N N 6.741 1.172 -0.415 . . . 1.0 . . . . . . . . . . . . A . 13 VAL N . . . . . . . . . c30225_5ug3 1 . 20 . 5612 . 1 1 13 VAL O O 9.629 -0.555 0.784 . . . 1.0 . . . . . . . . . . . . A . 13 VAL O . . . . . . . . . c30225_5ug3 1 . 20 . 5613 . 1 1 14 ASN C C 7.429 -2.195 2.761 . . . 1.0 . . . . . . . . . . . . A . 14 ASN C . . . . . . . . . c30225_5ug3 1 . 20 . 5614 . 1 1 14 ASN CA C 7.981 -0.793 2.995 . . . 1.0 . . . . . . . . . . . . A . 14 ASN CA . . . . . . . . . c30225_5ug3 1 . 20 . 5615 . 1 1 14 ASN CB C 7.330 -0.170 4.233 . . . 1.0 . . . . . . . . . . . . A . 14 ASN CB . . . . . . . . . c30225_5ug3 1 . 20 . 5616 . 1 1 14 ASN CG C 7.626 -0.936 5.507 . . . 1.0 . . . . . . . . . . . . A . 14 ASN CG . . . . . . . . . c30225_5ug3 1 . 20 . 5617 . 1 1 14 ASN H H 6.930 0.608 1.801 . . . 1.0 . . . . . . . . . . . . A . 14 ASN H . . . . . . . . . c30225_5ug3 1 . 20 . 5618 . 1 1 14 ASN HA H 9.049 -0.853 3.146 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HA . . . . . . . . . c30225_5ug3 1 . 20 . 5619 . 1 1 14 ASN HB2 H 7.694 0.839 4.353 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HB2 . . . . . . . . . c30225_5ug3 1 . 20 . 5620 . 1 1 14 ASN HB3 H 6.259 -0.145 4.092 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HB3 . . . . . . . . . c30225_5ug3 1 . 20 . 5621 . 1 1 14 ASN HD21 H 5.834 -0.471 6.223 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HD21 . . . . . . . . . c30225_5ug3 1 . 20 . 5622 . 1 1 14 ASN HD22 H 6.838 -1.423 7.259 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HD22 . . . . . . . . . c30225_5ug3 1 . 20 . 5623 . 1 1 14 ASN N N 7.734 0.046 1.825 . . . 1.0 . . . . . . . . . . . . A . 14 ASN N . . . . . . . . . c30225_5ug3 1 . 20 . 5624 . 1 1 14 ASN ND2 N 6.670 -0.946 6.421 . . . 1.0 . . . . . . . . . . . . A . 14 ASN ND2 . . . . . . . . . c30225_5ug3 1 . 20 . 5625 . 1 1 14 ASN O O 7.975 -3.187 3.244 . . . 1.0 . . . . . . . . . . . . A . 14 ASN O . . . . . . . . . c30225_5ug3 1 . 20 . 5626 . 1 1 14 ASN OD1 O 8.697 -1.522 5.664 . . . 1.0 . . . . . . . . . . . . A . 14 ASN OD1 . . . . . . . . . c30225_5ug3 1 . 20 . 5627 . 1 1 15 ASN C C 5.325 -3.546 0.218 . . . 1.0 . . . . . . . . . . . . A . 15 ASN C . . . . . . . . . c30225_5ug3 1 . 20 . 5628 . 1 1 15 ASN CA C 5.683 -3.516 1.695 . . . 1.0 . . . . . . . . . . . . A . 15 ASN CA . . . . . . . . . c30225_5ug3 1 . 20 . 5629 . 1 1 15 ASN CB C 4.422 -3.652 2.544 . . . 1.0 . . . . . . . . . . . . A . 15 ASN CB . . . . . . . . . c30225_5ug3 1 . 20 . 5630 . 1 1 15 ASN CG C 3.726 -4.991 2.374 . . . 1.0 . . . . . . . . . . . . A . 15 ASN CG . . . . . . . . . c30225_5ug3 1 . 20 . 5631 . 1 1 15 ASN H H 6.000 -1.440 1.600 . . . 1.0 . . . . . . . . . . . . A . 15 ASN H . . . . . . . . . c30225_5ug3 1 . 20 . 5632 . 1 1 15 ASN HA H 6.360 -4.327 1.917 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HA . . . . . . . . . c30225_5ug3 1 . 20 . 5633 . 1 1 15 ASN HB2 H 4.679 -3.530 3.585 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HB2 . . . . . . . . . c30225_5ug3 1 . 20 . 5634 . 1 1 15 ASN HB3 H 3.735 -2.873 2.253 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HB3 . . . . . . . . . c30225_5ug3 1 . 20 . 5635 . 1 1 15 ASN HD21 H 2.519 -4.224 0.994 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HD21 . . . . . . . . . c30225_5ug3 1 . 20 . 5636 . 1 1 15 ASN HD22 H 2.271 -5.895 1.366 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HD22 . . . . . . . . . c30225_5ug3 1 . 20 . 5637 . 1 1 15 ASN N N 6.354 -2.264 1.994 . . . 1.0 . . . . . . . . . . . . A . 15 ASN N . . . . . . . . . c30225_5ug3 1 . 20 . 5638 . 1 1 15 ASN ND2 N 2.742 -5.044 1.488 . . . 1.0 . . . . . . . . . . . . A . 15 ASN ND2 . . . . . . . . . c30225_5ug3 1 . 20 . 5639 . 1 1 15 ASN O O 4.218 -3.188 -0.178 . . . 1.0 . . . . . . . . . . . . A . 15 ASN O . . . . . . . . . c30225_5ug3 1 . 20 . 5640 . 1 1 15 ASN OD1 O 4.062 -5.969 3.045 . . . 1.0 . . . . . . . . . . . . A . 15 ASN OD1 . . . . . . . . . c30225_5ug3 1 . 20 . 5641 . 1 1 16 HYP C C 5.299 -5.086 -2.629 . . . 1.0 . . . . . . . . . . . . A . 16 HYP C . . . . . . . . . c30225_5ug3 1 . 20 . 5642 . 1 1 16 HYP CA C 6.137 -3.935 -2.081 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CA . . . . . . . . . c30225_5ug3 1 . 20 . 5643 . 1 1 16 HYP CB C 7.591 -4.044 -2.497 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CB . . . . . . . . . c30225_5ug3 1 . 20 . 5644 . 1 1 16 HYP CD C 7.580 -4.523 -0.184 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CD . . . . . . . . . c30225_5ug3 1 . 20 . 5645 . 1 1 16 HYP CG C 8.488 -4.104 -1.281 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CG . . . . . . . . . c30225_5ug3 1 . 20 . 5646 . 1 1 16 HYP HA H 5.729 -2.995 -2.420 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HA . . . . . . . . . c30225_5ug3 1 . 20 . 5647 . 1 1 16 HYP HB2 H 7.860 -3.182 -3.085 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HB2 . . . . . . . . . c30225_5ug3 1 . 20 . 5648 . 1 1 16 HYP HB3 H 7.725 -4.941 -3.087 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HB3 . . . . . . . . . c30225_5ug3 1 . 20 . 5649 . 1 1 16 HYP HD1 H 8.449 -2.563 -0.133 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HD1 . . . . . . . . . c30225_5ug3 1 . 20 . 5650 . 1 1 16 HYP HD22 H 7.551 -5.576 -0.107 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HD22 . . . . . . . . . c30225_5ug3 1 . 20 . 5651 . 1 1 16 HYP HD23 H 7.892 -4.083 0.750 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HD23 . . . . . . . . . c30225_5ug3 1 . 20 . 5652 . 1 1 16 HYP HG H 9.309 -4.790 -1.427 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HG . . . . . . . . . c30225_5ug3 1 . 20 . 5653 . 1 1 16 HYP N N 6.272 -3.971 -0.613 . . . 1.0 . . . . . . . . . . . . A . 16 HYP N . . . . . . . . . c30225_5ug3 1 . 20 . 5654 . 1 1 16 HYP O O 5.584 -5.633 -3.692 . . . 1.0 . . . . . . . . . . . . A . 16 HYP O . . . . . . . . . c30225_5ug3 1 . 20 . 5655 . 1 1 16 HYP OD1 O 8.952 -2.823 -0.921 . . . 1.0 . . . . . . . . . . . . A . 16 HYP OD1 . . . . . . . . . c30225_5ug3 1 . 20 . 5656 . 1 1 17 HIS C C 1.906 -6.007 -1.933 . . . 1.0 . . . . . . . . . . . . A . 17 HIS C . . . . . . . . . c30225_5ug3 1 . 20 . 5657 . 1 1 17 HIS CA C 3.312 -6.458 -2.301 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CA . . . . . . . . . c30225_5ug3 1 . 20 . 5658 . 1 1 17 HIS CB C 3.623 -7.814 -1.653 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CB . . . . . . . . . c30225_5ug3 1 . 20 . 5659 . 1 1 17 HIS CD2 C 5.092 -9.010 -3.420 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CD2 . . . . . . . . . c30225_5ug3 1 . 20 . 5660 . 1 1 17 HIS CE1 C 6.890 -9.302 -2.207 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CE1 . . . . . . . . . c30225_5ug3 1 . 20 . 5661 . 1 1 17 HIS CG C 4.847 -8.482 -2.199 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CG . . . . . . . . . c30225_5ug3 1 . 20 . 5662 . 1 1 17 HIS H H 4.133 -4.996 -1.021 . . . 1.0 . . . . . . . . . . . . A . 17 HIS H . . . . . . . . . c30225_5ug3 1 . 20 . 5663 . 1 1 17 HIS HA H 3.379 -6.554 -3.375 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HA . . . . . . . . . c30225_5ug3 1 . 20 . 5664 . 1 1 17 HIS HB2 H 3.769 -7.673 -0.593 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HB2 . . . . . . . . . c30225_5ug3 1 . 20 . 5665 . 1 1 17 HIS HB3 H 2.785 -8.478 -1.808 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HB3 . . . . . . . . . c30225_5ug3 1 . 20 . 5666 . 1 1 17 HIS HD1 H 6.136 -8.404 -0.530 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HD1 . . . . . . . . . c30225_5ug3 1 . 20 . 5667 . 1 1 17 HIS HD2 H 4.409 -9.030 -4.257 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HD2 . . . . . . . . . c30225_5ug3 1 . 20 . 5668 . 1 1 17 HIS HE1 H 7.882 -9.591 -1.893 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HE1 . . . . . . . . . c30225_5ug3 1 . 20 . 5669 . 1 1 17 HIS HE2 H 6.872 -9.808 -4.190 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HE2 . . . . . . . . . c30225_5ug3 1 . 20 . 5670 . 1 1 17 HIS N N 4.266 -5.443 -1.885 . . . 1.0 . . . . . . . . . . . . A . 17 HIS N . . . . . . . . . c30225_5ug3 1 . 20 . 5671 . 1 1 17 HIS ND1 N 5.995 -8.682 -1.463 . . . 1.0 . . . . . . . . . . . . A . 17 HIS ND1 . . . . . . . . . c30225_5ug3 1 . 20 . 5672 . 1 1 17 HIS NE2 N 6.368 -9.514 -3.399 . . . 1.0 . . . . . . . . . . . . A . 17 HIS NE2 . . . . . . . . . c30225_5ug3 1 . 20 . 5673 . 1 1 17 HIS O O 1.185 -6.695 -1.212 . . . 1.0 . . . . . . . . . . . . A . 17 HIS O . . . . . . . . . c30225_5ug3 1 . 20 . 5674 . 1 1 18 VAL C C -0.172 -3.221 -3.177 . . . 1.0 . . . . . . . . . . . . A . 18 VAL C . . . . . . . . . c30225_5ug3 1 . 20 . 5675 . 1 1 18 VAL CA C 0.231 -4.249 -2.114 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CA . . . . . . . . . c30225_5ug3 1 . 20 . 5676 . 1 1 18 VAL CB C 0.216 -3.588 -0.708 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CB . . . . . . . . . c30225_5ug3 1 . 20 . 5677 . 1 1 18 VAL CG1 C 1.141 -2.380 -0.647 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CG1 . . . . . . . . . c30225_5ug3 1 . 20 . 5678 . 1 1 18 VAL CG2 C -1.202 -3.203 -0.304 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CG2 . . . . . . . . . c30225_5ug3 1 . 20 . 5679 . 1 1 18 VAL H H 2.146 -4.350 -3.014 . . . 1.0 . . . . . . . . . . . . A . 18 VAL H . . . . . . . . . c30225_5ug3 1 . 20 . 5680 . 1 1 18 VAL HA H -0.494 -5.051 -2.116 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HA . . . . . . . . . c30225_5ug3 1 . 20 . 5681 . 1 1 18 VAL HB H 0.581 -4.314 0.007 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HB . . . . . . . . . c30225_5ug3 1 . 20 . 5682 . 1 1 18 VAL HG11 H 0.821 -1.647 -1.372 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG11 . . . . . . . . . c30225_5ug3 1 . 20 . 5683 . 1 1 18 VAL HG12 H 2.152 -2.687 -0.870 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG12 . . . . . . . . . c30225_5ug3 1 . 20 . 5684 . 1 1 18 VAL HG13 H 1.106 -1.948 0.340 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG13 . . . . . . . . . c30225_5ug3 1 . 20 . 5685 . 1 1 18 VAL HG21 H -1.599 -2.493 -1.017 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG21 . . . . . . . . . c30225_5ug3 1 . 20 . 5686 . 1 1 18 VAL HG22 H -1.188 -2.755 0.678 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG22 . . . . . . . . . c30225_5ug3 1 . 20 . 5687 . 1 1 18 VAL HG23 H -1.826 -4.084 -0.289 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG23 . . . . . . . . . c30225_5ug3 1 . 20 . 5688 . 1 1 18 VAL N N 1.534 -4.831 -2.418 . . . 1.0 . . . . . . . . . . . . A . 18 VAL N . . . . . . . . . c30225_5ug3 1 . 20 . 5689 . 1 1 18 VAL O O -1.352 -3.077 -3.500 . . . 1.0 . . . . . . . . . . . . A . 18 VAL O . . . . . . . . . c30225_5ug3 1 . 20 . 5690 . 1 1 19 CYS C C 1.902 -1.074 -5.363 . . . 1.0 . . . . . . . . . . . . A . 19 CYS C . . . . . . . . . c30225_5ug3 1 . 20 . 5691 . 1 1 19 CYS CA C 0.583 -1.482 -4.713 . . . 1.0 . . . . . . . . . . . . A . 19 CYS CA . . . . . . . . . c30225_5ug3 1 . 20 . 5692 . 1 1 19 CYS CB C -0.092 -0.269 -4.064 . . . 1.0 . . . . . . . . . . . . A . 19 CYS CB . . . . . . . . . c30225_5ug3 1 . 20 . 5693 . 1 1 19 CYS H H 1.742 -2.709 -3.457 . . . 1.0 . . . . . . . . . . . . A . 19 CYS H . . . . . . . . . c30225_5ug3 1 . 20 . 5694 . 1 1 19 CYS HA H -0.070 -1.886 -5.473 . . . 1.0 . . . . . . . . . . . . A . 19 CYS HA . . . . . . . . . c30225_5ug3 1 . 20 . 5695 . 1 1 19 CYS HB2 H -1.055 -0.566 -3.679 . . . 1.0 . . . . . . . . . . . . A . 19 CYS HB2 . . . . . . . . . c30225_5ug3 1 . 20 . 5696 . 1 1 19 CYS HB3 H 0.524 0.078 -3.248 . . . 1.0 . . . . . . . . . . . . A . 19 CYS HB3 . . . . . . . . . c30225_5ug3 1 . 20 . 5697 . 1 1 19 CYS N N 0.819 -2.521 -3.725 . . . 1.0 . . . . . . . . . . . . A . 19 CYS N . . . . . . . . . c30225_5ug3 1 . 20 . 5698 . 1 1 19 CYS O O 2.756 -0.482 -4.668 . . . 1.0 . . . . . . . . . . . . A . 19 CYS O . . . . . . . . . c30225_5ug3 1 . 20 . 5699 . 1 1 19 CYS OXT O 2.082 -1.352 -6.567 . . . 1.0 . . . . . . . . . . . . A . 19 CYS OXT . . . . . . . . . c30225_5ug3 1 . 20 . 5700 . 1 1 19 CYS SG S -0.357 1.139 -5.195 . . . 1.0 . . . . . . . . . . . . A . 19 CYS SG . . . . . . . . . c30225_5ug3 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 c30225_5ug3 _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 5ug3.mr . . 'MR format' 1 comment 'Not applicable' 'Not applicable' 0 c30225_5ug3 1 1 5ug3.mr . . XPLOR/CNS 2 distance NOE simple 537 c30225_5ug3 1 1 5ug3.mr . . XPLOR/CNS 3 'dihedral angle' 'Not applicable' 'Not applicable' 22 c30225_5ug3 1 1 5ug3.mr . . 'MR format' 4 'nomenclature mapping' 'Not applicable' 'Not applicable' 0 c30225_5ug3 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 c30225_5ug3 _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 . . . . c30225_5ug3 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 . . 1 1 2 2 ARG H H . . . 1 1 2 2 ARG HA H . . . . . 2.408 1.683 3.133 . . . . . A . 2 ARG H . . A . 2 ARG HA . A . 2 . HN . . . A . 2 . HA . . c30225_5ug3 1 2 1 . . 1 1 2 2 ARG H H . . . 1 1 2 2 ARG HD2 H . . . . . 4.282 1.990 6.574 . . . . . A . 2 ARG H . . A . 2 ARG HD2 . A . 2 . HN . . . A . 2 . HD2 . . c30225_5ug3 1 3 1 . . 1 1 2 2 ARG H H . . . 1 1 2 2 ARG HB2 H . . . . . 2.540 1.734 3.346 . . . . . A . 2 ARG H . . A . 2 ARG HB2 . A . 2 . HN . . . A . 2 . HB2 . . c30225_5ug3 1 4 1 . . 1 1 2 2 ARG H H . . . 1 1 2 2 ARG HB3 H . . . . . 3.143 1.908 4.378 . . . . . A . 2 ARG H . . A . 2 ARG HB3 . A . 2 . HN . . . A . 2 . HB1 . . c30225_5ug3 1 5 1 . . 1 1 2 2 ARG HA H . . . 1 1 2 2 ARG HB2 H . . . . . 2.561 1.741 3.381 . . . . . A . 2 ARG HA . . A . 2 ARG HB2 . A . 2 . HA . . . A . 2 . HB2 . . c30225_5ug3 1 6 1 . . 1 1 2 2 ARG HA H . . . 1 1 2 2 ARG HB3 H . . . . . 2.832 1.830 3.834 . . . . . A . 2 ARG HA . . A . 2 ARG HB3 . A . 2 . HA . . . A . 2 . HB1 . . c30225_5ug3 1 7 1 . . 1 1 2 2 ARG HB2 H . . . 1 1 2 2 ARG HB3 H . . . . . 2.594 1.753 3.435 . . . . . A . 2 ARG HB2 . . A . 2 ARG HB3 . A . 2 . HB2 . . . A . 2 . HB1 . . c30225_5ug3 1 8 1 . . 1 1 2 2 ARG H H . . . 1 1 2 2 ARG HA H . . . . . 2.171 1.582 2.760 . . . . . A . 2 ARG H . . A . 2 ARG HA . A . 2 . HN . . . A . 2 . HA . . c30225_5ug3 1 9 1 . . 1 1 2 2 ARG H H . . . 1 1 2 2 ARG HD2 H . . . . . 3.778 1.993 5.563 . . . . . A . 2 ARG H . . A . 2 ARG HD2 . A . 2 . HN . . . A . 2 . HD2 . . c30225_5ug3 1 10 1 . . 1 1 2 2 ARG H H . . . 1 1 2 2 ARG HB2 H . . . . . 2.705 1.790 3.620 . . . . . A . 2 ARG H . . A . 2 ARG HB2 . A . 2 . HN . . . A . 2 . HB2 . . c30225_5ug3 1 11 1 . . 1 1 2 2 ARG H H . . . 1 1 2 2 ARG HB3 H . . . . . 3.341 1.945 4.737 . . . . . A . 2 ARG H . . A . 2 ARG HB3 . A . 2 . HN . . . A . 2 . HB1 . . c30225_5ug3 1 12 1 . . 1 1 2 2 ARG H H . . . 1 1 2 2 ARG HB3 H . . . . . 3.323 1.942 4.704 . . . . . A . 2 ARG H . . A . 2 ARG HB3 . A . 2 . HN . . . A . 2 . HB1 . . c30225_5ug3 1 13 1 . . 1 1 2 2 ARG HD2 H . . . 1 1 2 2 ARG HB2 H . . . . . 2.908 1.851 3.965 . . . . . A . 2 ARG HD2 . . A . 2 ARG HB2 . A . 2 . HD2 . . . A . 2 . HB2 . . c30225_5ug3 1 14 1 . . 1 1 2 2 ARG HD2 H . . . 1 1 2 2 ARG HB3 H . . . . . 2.832 1.829 3.835 . . . . . A . 2 ARG HD2 . . A . 2 ARG HB3 . A . 2 . HD2 . . . A . 2 . HB1 . . c30225_5ug3 1 15 1 . . 1 1 2 2 ARG HD2 H . . . 1 1 2 2 ARG HB3 H . . . . . 2.879 1.843 3.915 . . . . . A . 2 ARG HD2 . . A . 2 ARG HB3 . A . 2 . HD2 . . . A . 2 . HB1 . . c30225_5ug3 1 16 1 . . 1 1 2 2 ARG HB2 H . . . 1 1 2 2 ARG HB3 H . . . . . 2.485 1.713 3.257 . . . . . A . 2 ARG HB2 . . A . 2 ARG HB3 . A . 2 . HB2 . . . A . 2 . HB1 . . c30225_5ug3 1 17 1 . . 1 1 2 2 ARG HB2 H . . . 1 1 2 2 ARG HB3 H . . . . . 2.439 1.695 3.183 . . . . . A . 2 ARG HB2 . . A . 2 ARG HB3 . A . 2 . HB2 . . . A . 2 . HB1 . . c30225_5ug3 1 18 1 . . 1 1 2 2 ARG HD2 H . . . 1 1 2 2 ARG HE H . . . . . 2.855 1.836 3.874 . . . . . A . 2 ARG HD2 . . A . 2 ARG HE . A . 2 . HD2 . . . A . 2 . HE . . c30225_5ug3 1 19 1 . . 1 1 2 2 ARG HB2 H . . . 1 1 2 2 ARG HE H . . . . . 3.637 1.984 5.290 . . . . . A . 2 ARG HB2 . . A . 2 ARG HE . A . 2 . HB2 . . . A . 2 . HE . . c30225_5ug3 1 20 1 . . 1 1 2 2 ARG HB3 H . . . 1 1 2 2 ARG HE H . . . . . 3.511 1.970 5.052 . . . . . A . 2 ARG HB3 . . A . 2 ARG HE . A . 2 . HB1 . . . A . 2 . HE . . c30225_5ug3 1 21 1 . . 1 1 2 2 ARG HA H . . . 1 1 2 2 ARG HB2 H . . . . . 2.741 1.802 3.680 . . . . . A . 2 ARG HA . . A . 2 ARG HB2 . A . 2 . HA . . . A . 2 . HB2 . . c30225_5ug3 1 22 1 . . 1 1 3 3 ASP H H . . . 1 1 3 3 ASP HA H . . . . . 2.853 1.836 3.870 . . . . . A . 3 ASP H . . A . 3 ASP HA . A . 3 . HN . . . A . 3 . HA . . c30225_5ug3 1 23 1 . . 1 1 3 3 ASP H H . . . 1 1 3 3 ASP HB2 H . . . . . 2.695 1.787 3.603 . . . . . A . 3 ASP H . . A . 3 ASP HB2 . A . 3 . HN . . . A . 3 . HB2 . . c30225_5ug3 1 24 1 . . 1 1 3 3 ASP H H . . . 1 1 3 3 ASP HB3 H . . . . . 2.711 1.792 3.630 . . . . . A . 3 ASP H . . A . 3 ASP HB3 . A . 3 . HN . . . A . 3 . HB1 . . c30225_5ug3 1 25 1 . . 1 1 3 3 ASP HA H . . . 1 1 3 3 ASP HB2 H . . . . . 2.645 1.770 3.520 . . . . . A . 3 ASP HA . . A . 3 ASP HB2 . A . 3 . HA . . . A . 3 . HB2 . . c30225_5ug3 1 26 1 . . 1 1 3 3 ASP HA H . . . 1 1 3 3 ASP HB3 H . . . . . 2.537 1.733 3.341 . . . . . A . 3 ASP HA . . A . 3 ASP HB3 . A . 3 . HA . . . A . 3 . HB1 . . c30225_5ug3 1 27 1 . . 1 1 14 14 ASN HB2 H . . . 1 1 14 14 ASN HB3 H . . . . . 2.264 1.623 2.905 . . . . . A . 14 ASN HB2 . . A . 14 ASN HB3 . A . 14 . HB2 . . . A . 14 . HB1 . . c30225_5ug3 1 28 1 . . 1 1 3 3 ASP HB2 H . . . 1 1 3 3 ASP HB3 H . . . . . 2.011 1.505 2.517 . . . . . A . 3 ASP HB2 . . A . 3 ASP HB3 . A . 3 . HB2 . . . A . 3 . HB1 . . c30225_5ug3 1 29 1 . . 1 1 3 3 ASP H H . . . 1 1 3 3 ASP HA H . . . . . 2.938 1.859 4.017 . . . . . A . 3 ASP H . . A . 3 ASP HA . A . 3 . HN . . . A . 3 . HA . . c30225_5ug3 1 30 1 . . 1 1 3 3 ASP H H . . . 1 1 3 3 ASP HB2 H . . . . . 2.866 1.839 3.893 . . . . . A . 3 ASP H . . A . 3 ASP HB2 . A . 3 . HN . . . A . 3 . HB2 . . c30225_5ug3 1 31 1 . . 1 1 3 3 ASP H H . . . 1 1 3 3 ASP HB3 H . . . . . 2.877 1.843 3.911 . . . . . A . 3 ASP H . . A . 3 ASP HB3 . A . 3 . HN . . . A . 3 . HB1 . . c30225_5ug3 1 32 1 . . 1 1 3 3 ASP HA H . . . 1 1 3 3 ASP HB2 H . . . . . 2.704 1.790 3.618 . . . . . A . 3 ASP HA . . A . 3 ASP HB2 . A . 3 . HA . . . A . 3 . HB2 . . c30225_5ug3 1 33 1 . . 1 1 3 3 ASP HA H . . . 1 1 3 3 ASP HB3 H . . . . . 2.655 1.774 3.536 . . . . . A . 3 ASP HA . . A . 3 ASP HB3 . A . 3 . HA . . . A . 3 . HB1 . . c30225_5ug3 1 34 1 . . 1 1 3 3 ASP HB2 H . . . 1 1 3 3 ASP HB3 H . . . . . 1.845 1.419 2.271 . . . . . A . 3 ASP HB2 . . A . 3 ASP HB3 . A . 3 . HB2 . . . A . 3 . HB1 . . c30225_5ug3 1 35 1 . . 1 1 4 4 GLU H H . . . 1 1 4 4 GLU HA H . . . . . 2.866 1.840 3.892 . . . . . A . 4 GLU H . . A . 4 GLU HA . A . 4 . HN . . . A . 4 . HA . . c30225_5ug3 1 36 1 . . 1 1 4 4 GLU H H . . . 1 1 4 4 GLU HG2 H . . . . . 2.990 1.873 4.107 . . . . . A . 4 GLU H . . A . 4 GLU HG2 . A . 4 . HN . . . A . 4 . HG2 . . c30225_5ug3 1 37 1 . . 1 1 4 4 GLU H H . . . 1 1 4 4 GLU HB2 H . . . . . 2.892 1.847 3.937 . . . . . A . 4 GLU H . . A . 4 GLU HB2 . A . 4 . HN . . . A . 4 . HB2 . . c30225_5ug3 1 38 1 . . 1 1 4 4 GLU H H . . . 1 1 4 4 GLU HB3 H . . . . . 2.704 1.790 3.618 . . . . . A . 4 GLU H . . A . 4 GLU HB3 . A . 4 . HN . . . A . 4 . HB1 . . c30225_5ug3 1 39 1 . . 1 1 4 4 GLU HA H . . . 1 1 4 4 GLU HG2 H . . . . . 2.927 1.856 3.998 . . . . . A . 4 GLU HA . . A . 4 GLU HG2 . A . 4 . HA . . . A . 4 . HG2 . . c30225_5ug3 1 40 1 . . 1 1 4 4 GLU HA H . . . 1 1 4 4 GLU HB2 H . . . . . 2.381 1.672 3.090 . . . . . A . 4 GLU HA . . A . 4 GLU HB2 . A . 4 . HA . . . A . 4 . HB2 . . c30225_5ug3 1 41 1 . . 1 1 4 4 GLU HA H . . . 1 1 4 4 GLU HB3 H . . . . . 2.755 1.806 3.704 . . . . . A . 4 GLU HA . . A . 4 GLU HB3 . A . 4 . HA . . . A . 4 . HB1 . . c30225_5ug3 1 42 1 . . 1 1 4 4 GLU HG2 H . . . 1 1 4 4 GLU HB2 H . . . . . 2.966 1.867 4.065 . . . . . A . 4 GLU HG2 . . A . 4 GLU HB2 . A . 4 . HG2 . . . A . 4 . HB2 . . c30225_5ug3 1 43 1 . . 1 1 4 4 GLU HG2 H . . . 1 1 4 4 GLU HB3 H . . . . . 3.020 1.880 4.160 . . . . . A . 4 GLU HG2 . . A . 4 GLU HB3 . A . 4 . HG2 . . . A . 4 . HB1 . . c30225_5ug3 1 44 1 . . 1 1 4 4 GLU HB2 H . . . 1 1 4 4 GLU HB3 H . . . . . 2.072 1.536 2.608 . . . . . A . 4 GLU HB2 . . A . 4 GLU HB3 . A . 4 . HB2 . . . A . 4 . HB1 . . c30225_5ug3 1 45 1 . . 1 1 4 4 GLU H H . . . 1 1 4 4 GLU HA H . . . . . 2.813 1.824 3.802 . . . . . A . 4 GLU H . . A . 4 GLU HA . A . 4 . HN . . . A . 4 . HA . . c30225_5ug3 1 46 1 . . 1 1 4 4 GLU H H . . . 1 1 4 4 GLU HG2 H . . . . . 3.359 1.949 4.769 . . . . . A . 4 GLU H . . A . 4 GLU HG2 . A . 4 . HN . . . A . 4 . HG2 . . c30225_5ug3 1 47 1 . . 1 1 4 4 GLU H H . . . 1 1 4 4 GLU HB2 H . . . . . 3.034 1.884 4.184 . . . . . A . 4 GLU H . . A . 4 GLU HB2 . A . 4 . HN . . . A . 4 . HB2 . . c30225_5ug3 1 48 1 . . 1 1 4 4 GLU H H . . . 1 1 4 4 GLU HB3 H . . . . . 2.907 1.851 3.963 . . . . . A . 4 GLU H . . A . 4 GLU HB3 . A . 4 . HN . . . A . 4 . HB1 . . c30225_5ug3 1 49 1 . . 1 1 4 4 GLU HA H . . . 1 1 4 4 GLU HG2 H . . . . . 3.304 1.940 4.668 . . . . . A . 4 GLU HA . . A . 4 GLU HG2 . A . 4 . HA . . . A . 4 . HG2 . . c30225_5ug3 1 50 1 . . 1 1 4 4 GLU HA H . . . 1 1 4 4 GLU HB2 H . . . . . 2.517 1.725 3.309 . . . . . A . 4 GLU HA . . A . 4 GLU HB2 . A . 4 . HA . . . A . 4 . HB2 . . c30225_5ug3 1 51 1 . . 1 1 4 4 GLU HA H . . . 1 1 4 4 GLU HB3 H . . . . . 2.837 1.831 3.843 . . . . . A . 4 GLU HA . . A . 4 GLU HB3 . A . 4 . HA . . . A . 4 . HB1 . . c30225_5ug3 1 52 1 . . 1 1 4 4 GLU HG2 H . . . 1 1 4 4 GLU HB2 H . . . . . 2.615 1.760 3.470 . . . . . A . 4 GLU HG2 . . A . 4 GLU HB2 . A . 4 . HG2 . . . A . 4 . HB2 . . c30225_5ug3 1 53 1 . . 1 1 4 4 GLU HG2 H . . . 1 1 4 4 GLU HB3 H . . . . . 2.636 1.767 3.505 . . . . . A . 4 GLU HG2 . . A . 4 GLU HB3 . A . 4 . HG2 . . . A . 4 . HB1 . . c30225_5ug3 1 54 1 . . 1 1 4 4 GLU HB2 H . . . 1 1 4 4 GLU HB3 H . . . . . 2.010 1.505 2.515 . . . . . A . 4 GLU HB2 . . A . 4 GLU HB3 . A . 4 . HB2 . . . A . 4 . HB1 . . c30225_5ug3 1 55 1 . . 1 1 5 5 CYS H H . . . 1 1 5 5 CYS HA H . . . . . 2.798 1.820 3.776 . . . . . A . 5 CYS H . . A . 5 CYS HA . A . 5 . HN . . . A . 5 . HA . . c30225_5ug3 1 56 1 . . 1 1 5 5 CYS H H . . . 1 1 5 5 CYS HB2 H . . . . . 2.416 1.686 3.146 . . . . . A . 5 CYS H . . A . 5 CYS HB2 . A . 5 . HN . . . A . 5 . HB2 . . c30225_5ug3 1 57 1 . . 1 1 5 5 CYS H H . . . 1 1 5 5 CYS HB3 H . . . . . 2.524 1.728 3.320 . . . . . A . 5 CYS H . . A . 5 CYS HB3 . A . 5 . HN . . . A . 5 . HB1 . . c30225_5ug3 1 58 1 . . 1 1 5 5 CYS HA H . . . 1 1 5 5 CYS HB2 H . . . . . 3.232 1.927 4.537 . . . . . A . 5 CYS HA . . A . 5 CYS HB2 . A . 5 . HA . . . A . 5 . HB2 . . c30225_5ug3 1 59 1 . . 1 1 5 5 CYS HA H . . . 1 1 5 5 CYS HB3 H . . . . . 2.858 1.837 3.879 . . . . . A . 5 CYS HA . . A . 5 CYS HB3 . A . 5 . HA . . . A . 5 . HB1 . . c30225_5ug3 1 60 1 . . 1 1 5 5 CYS HB2 H . . . 1 1 5 5 CYS HB3 H . . . . . 1.940 1.469 2.411 . . . . . A . 5 CYS HB2 . . A . 5 CYS HB3 . A . 5 . HB2 . . . A . 5 . HB1 . . c30225_5ug3 1 61 1 . . 1 1 5 5 CYS H H . . . 1 1 5 5 CYS HA H . . . . . 2.766 1.810 3.722 . . . . . A . 5 CYS H . . A . 5 CYS HA . A . 5 . HN . . . A . 5 . HA . . c30225_5ug3 1 62 1 . . 1 1 5 5 CYS H H . . . 1 1 5 5 CYS HB2 H . . . . . 2.492 1.716 3.268 . . . . . A . 5 CYS H . . A . 5 CYS HB2 . A . 5 . HN . . . A . 5 . HB2 . . c30225_5ug3 1 63 1 . . 1 1 5 5 CYS H H . . . 1 1 5 5 CYS HB3 H . . . . . 2.748 1.804 3.692 . . . . . A . 5 CYS H . . A . 5 CYS HB3 . A . 5 . HN . . . A . 5 . HB1 . . c30225_5ug3 1 64 1 . . 1 1 5 5 CYS HA H . . . 1 1 5 5 CYS HB2 H . . . . . 2.591 1.752 3.430 . . . . . A . 5 CYS HA . . A . 5 CYS HB2 . A . 5 . HA . . . A . 5 . HB2 . . c30225_5ug3 1 65 1 . . 1 1 5 5 CYS HA H . . . 1 1 5 5 CYS HB3 H . . . . . 3.082 1.894 4.270 . . . . . A . 5 CYS HA . . A . 5 CYS HB3 . A . 5 . HA . . . A . 5 . HB1 . . c30225_5ug3 1 66 1 . . 1 1 5 5 CYS HB2 H . . . 1 1 5 5 CYS HB3 H . . . . . 1.891 1.444 2.338 . . . . . A . 5 CYS HB2 . . A . 5 CYS HB3 . A . 5 . HB2 . . . A . 5 . HB1 . . c30225_5ug3 1 67 1 . . 1 1 6 6 CYS H H . . . 1 1 6 6 CYS HA H . . . . . 2.947 1.862 4.032 . . . . . A . 6 CYS H . . A . 6 CYS HA . A . 6 . HN . . . A . 6 . HA . . c30225_5ug3 1 68 1 . . 1 1 6 6 CYS H H . . . 1 1 6 6 CYS HB2 H . . . . . 2.648 1.772 3.524 . . . . . A . 6 CYS H . . A . 6 CYS HB2 . A . 6 . HN . . . A . 6 . HB2 . . c30225_5ug3 1 69 1 . . 1 1 6 6 CYS H H . . . 1 1 6 6 CYS HB3 H . . . . . 2.580 1.748 3.412 . . . . . A . 6 CYS H . . A . 6 CYS HB3 . A . 6 . HN . . . A . 6 . HB1 . . c30225_5ug3 1 70 1 . . 1 1 6 6 CYS HA H . . . 1 1 6 6 CYS HB2 H . . . . . 2.692 1.786 3.598 . . . . . A . 6 CYS HA . . A . 6 CYS HB2 . A . 6 . HA . . . A . 6 . HB2 . . c30225_5ug3 1 71 1 . . 1 1 6 6 CYS HA H . . . 1 1 6 6 CYS HB3 H . . . . . 2.751 1.805 3.697 . . . . . A . 6 CYS HA . . A . 6 CYS HB3 . A . 6 . HA . . . A . 6 . HB1 . . c30225_5ug3 1 72 1 . . 1 1 6 6 CYS HB2 H . . . 1 1 6 6 CYS HB3 H . . . . . 2.102 1.550 2.654 . . . . . A . 6 CYS HB2 . . A . 6 CYS HB3 . A . 6 . HB2 . . . A . 6 . HB1 . . c30225_5ug3 1 73 1 . . 1 1 6 6 CYS H H . . . 1 1 6 6 CYS HA H . . . . . 2.891 1.846 3.936 . . . . . A . 6 CYS H . . A . 6 CYS HA . A . 6 . HN . . . A . 6 . HA . . c30225_5ug3 1 74 1 . . 1 1 6 6 CYS H H . . . 1 1 6 6 CYS HB2 H . . . . . 2.821 1.826 3.816 . . . . . A . 6 CYS H . . A . 6 CYS HB2 . A . 6 . HN . . . A . 6 . HB2 . . c30225_5ug3 1 75 1 . . 1 1 6 6 CYS H H . . . 1 1 6 6 CYS HB3 H . . . . . 2.813 1.824 3.802 . . . . . A . 6 CYS H . . A . 6 CYS HB3 . A . 6 . HN . . . A . 6 . HB1 . . c30225_5ug3 1 76 1 . . 1 1 6 6 CYS HA H . . . 1 1 6 6 CYS HB2 H . . . . . 2.758 1.807 3.709 . . . . . A . 6 CYS HA . . A . 6 CYS HB2 . A . 6 . HA . . . A . 6 . HB2 . . c30225_5ug3 1 77 1 . . 1 1 6 6 CYS HA H . . . 1 1 6 6 CYS HB3 H . . . . . 3.207 1.922 4.492 . . . . . A . 6 CYS HA . . A . 6 CYS HB3 . A . 6 . HA . . . A . 6 . HB1 . . c30225_5ug3 1 78 1 . . 1 1 6 6 CYS HB2 H . . . 1 1 6 6 CYS HB3 H . . . . . 2.032 1.516 2.548 . . . . . A . 6 CYS HB2 . . A . 6 CYS HB3 . A . 6 . HB2 . . . A . 6 . HB1 . . c30225_5ug3 1 79 1 . . 1 1 7 7 SER H H . . . 1 1 7 7 SER HA H . . . . . 2.964 1.866 4.062 . . . . . A . 7 SER H . . A . 7 SER HA . A . 7 . HN . . . A . 7 . HA . . c30225_5ug3 1 80 1 . . 1 1 7 7 SER H H . . . 1 1 7 7 SER HB2 H . . . . . 2.875 1.842 3.908 . . . . . A . 7 SER H . . A . 7 SER HB2 . A . 7 . HN . . . A . 7 . HB2 . . c30225_5ug3 1 81 1 . . 1 1 7 7 SER H H . . . 1 1 7 7 SER HB3 H . . . . . 2.818 1.825 3.811 . . . . . A . 7 SER H . . A . 7 SER HB3 . A . 7 . HN . . . A . 7 . HB1 . . c30225_5ug3 1 82 1 . . 1 1 7 7 SER H H . . . 1 1 7 7 SER HA H . . . . . 2.836 1.830 3.842 . . . . . A . 7 SER H . . A . 7 SER HA . A . 7 . HN . . . A . 7 . HA . . c30225_5ug3 1 83 1 . . 1 1 7 7 SER H H . . . 1 1 7 7 SER HB2 H . . . . . 2.985 1.871 4.099 . . . . . A . 7 SER H . . A . 7 SER HB2 . A . 7 . HN . . . A . 7 . HB2 . . c30225_5ug3 1 84 1 . . 1 1 7 7 SER H H . . . 1 1 7 7 SER HB3 H . . . . . 3.044 1.885 4.203 . . . . . A . 7 SER H . . A . 7 SER HB3 . A . 7 . HN . . . A . 7 . HB1 . . c30225_5ug3 1 85 1 . . 1 1 7 7 SER HA H . . . 1 1 7 7 SER HB2 H . . . . . 2.501 1.719 3.283 . . . . . A . 7 SER HA . . A . 7 SER HB2 . A . 7 . HA . . . A . 7 . HB2 . . c30225_5ug3 1 86 1 . . 1 1 7 7 SER HA H . . . 1 1 7 7 SER HB3 H . . . . . 2.356 1.662 3.050 . . . . . A . 7 SER HA . . A . 7 SER HB3 . A . 7 . HA . . . A . 7 . HB1 . . c30225_5ug3 1 87 1 . . 1 1 7 7 SER HA H . . . 1 1 7 7 SER HB2 H . . . . . 2.934 1.858 4.010 . . . . . A . 7 SER HA . . A . 7 SER HB2 . A . 7 . HA . . . A . 7 . HB2 . . c30225_5ug3 1 88 1 . . 1 1 7 7 SER HA H . . . 1 1 7 7 SER HB3 H . . . . . 2.764 1.809 3.719 . . . . . A . 7 SER HA . . A . 7 SER HB3 . A . 7 . HA . . . A . 7 . HB1 . . c30225_5ug3 1 89 1 . . 1 1 7 7 SER HB2 H . . . 1 1 7 7 SER HB3 H . . . . . 1.849 1.422 2.276 . . . . . A . 7 SER HB2 . . A . 7 SER HB3 . A . 7 . HB2 . . . A . 7 . HB1 . . c30225_5ug3 1 90 1 . . 1 1 7 7 SER HB2 H . . . 1 1 7 7 SER HB3 H . . . . . 1.829 1.411 2.247 . . . . . A . 7 SER HB2 . . A . 7 SER HB3 . A . 7 . HB2 . . . A . 7 . HB1 . . c30225_5ug3 1 91 1 . . 1 1 8 8 ASN H H . . . 1 1 8 8 ASN HA H . . . . . 3.010 1.878 4.142 . . . . . A . 8 ASN H . . A . 8 ASN HA . A . 8 . HN . . . A . 8 . HA . . c30225_5ug3 1 92 1 . . 1 1 8 8 ASN H H . . . 1 1 8 8 ASN HB2 H . . . . . 2.766 1.810 3.722 . . . . . A . 8 ASN H . . A . 8 ASN HB2 . A . 8 . HN . . . A . 8 . HB2 . . c30225_5ug3 1 93 1 . . 1 1 8 8 ASN H H . . . 1 1 8 8 ASN HB3 H . . . . . 2.838 1.831 3.845 . . . . . A . 8 ASN H . . A . 8 ASN HB3 . A . 8 . HN . . . A . 8 . HB1 . . c30225_5ug3 1 94 1 . . 1 1 8 8 ASN HA H . . . 1 1 8 8 ASN HB2 H . . . . . 3.192 1.918 4.466 . . . . . A . 8 ASN HA . . A . 8 ASN HB2 . A . 8 . HA . . . A . 8 . HB2 . . c30225_5ug3 1 95 1 . . 1 1 8 8 ASN HA H . . . 1 1 8 8 ASN HB3 H . . . . . 2.914 1.852 3.976 . . . . . A . 8 ASN HA . . A . 8 ASN HB3 . A . 8 . HA . . . A . 8 . HB1 . . c30225_5ug3 1 96 1 . . 1 1 8 8 ASN HB2 H . . . 1 1 8 8 ASN HB3 H . . . . . 2.170 1.582 2.758 . . . . . A . 8 ASN HB2 . . A . 8 ASN HB3 . A . 8 . HB2 . . . A . 8 . HB1 . . c30225_5ug3 1 97 1 . . 1 1 8 8 ASN H H . . . 1 1 8 8 ASN HA H . . . . . 3.355 1.948 4.762 . . . . . A . 8 ASN H . . A . 8 ASN HA . A . 8 . HN . . . A . 8 . HA . . c30225_5ug3 1 98 1 . . 1 1 8 8 ASN H H . . . 1 1 8 8 ASN HB2 H . . . . . 2.879 1.843 3.915 . . . . . A . 8 ASN H . . A . 8 ASN HB2 . A . 8 . HN . . . A . 8 . HB2 . . c30225_5ug3 1 99 1 . . 1 1 8 8 ASN H H . . . 1 1 8 8 ASN HB3 H . . . . . 2.892 1.847 3.937 . . . . . A . 8 ASN H . . A . 8 ASN HB3 . A . 8 . HN . . . A . 8 . HB1 . . c30225_5ug3 1 100 1 . . 1 1 8 8 ASN HA H . . . 1 1 8 8 ASN HB2 H . . . . . 2.949 1.862 4.036 . . . . . A . 8 ASN HA . . A . 8 ASN HB2 . A . 8 . HA . . . A . 8 . HB2 . . c30225_5ug3 1 101 1 . . 1 1 8 8 ASN HA H . . . 1 1 8 8 ASN HB3 H . . . . . 2.676 1.781 3.571 . . . . . A . 8 ASN HA . . A . 8 ASN HB3 . A . 8 . HA . . . A . 8 . HB1 . . c30225_5ug3 1 102 1 . . 1 1 8 8 ASN HB2 H . . . 1 1 8 8 ASN HB3 H . . . . . 2.123 1.559 2.687 . . . . . A . 8 ASN HB2 . . A . 8 ASN HB3 . A . 8 . HB2 . . . A . 8 . HB1 . . c30225_5ug3 1 103 1 . . 1 1 18 18 VAL H H . . . 1 1 18 18 VAL HA H . . . . . 2.899 1.849 3.949 . . . . . A . 18 VAL H . . A . 18 VAL HA . A . 18 . HN . . . A . 18 . HA . . c30225_5ug3 1 104 1 . . 1 1 18 18 VAL H H . . . 1 1 18 18 VAL HB H . . . . . 2.636 1.767 3.505 . . . . . A . 18 VAL H . . A . 18 VAL HB . A . 18 . HN . . . A . 18 . HB . . c30225_5ug3 1 105 1 . . 1 1 18 18 VAL H H . . . 1 1 18 18 VAL MG1 H . . . . . 2.515 1.725 3.305 . . . . . A . 18 VAL H . . A . 18 VAL MG1 . A . 18 . HN . . . A . 18 . HG1# . . c30225_5ug3 1 106 1 . . 1 1 18 18 VAL H H . . . 1 1 18 18 VAL MG2 H . . . . . 3.141 1.908 4.374 . . . . . A . 18 VAL H . . A . 18 VAL MG2 . A . 18 . HN . . . A . 18 . HG2# . . c30225_5ug3 1 107 1 . . 1 1 18 18 VAL HA H . . . 1 1 18 18 VAL MG1 H . . . . . 2.463 1.704 3.222 . . . . . A . 18 VAL HA . . A . 18 VAL MG1 . A . 18 . HA . . . A . 18 . HG1# . . c30225_5ug3 1 108 1 . . 1 1 18 18 VAL HA H . . . 1 1 18 18 VAL MG2 H . . . . . 2.577 1.747 3.407 . . . . . A . 18 VAL HA . . A . 18 VAL MG2 . A . 18 . HA . . . A . 18 . HG2# . . c30225_5ug3 1 109 1 . . 1 1 18 18 VAL HA H . . . 1 1 18 18 VAL HB H . . . . . 2.381 1.672 3.090 . . . . . A . 18 VAL HA . . A . 18 VAL HB . A . 18 . HA . . . A . 18 . HB . . c30225_5ug3 1 110 1 . . 1 1 18 18 VAL HB H . . . 1 1 18 18 VAL MG1 H . . . . . 2.344 1.657 3.031 . . . . . A . 18 VAL HB . . A . 18 VAL MG1 . A . 18 . HB . . . A . 18 . HG1# . . c30225_5ug3 1 111 1 . . 1 1 18 18 VAL HB H . . . 1 1 18 18 VAL MG2 H . . . . . 2.561 1.741 3.381 . . . . . A . 18 VAL HB . . A . 18 VAL MG2 . A . 18 . HB . . . A . 18 . HG2# . . c30225_5ug3 1 112 1 . . 1 1 18 18 VAL H H . . . 1 1 18 18 VAL HA H . . . . . 2.833 1.830 3.836 . . . . . A . 18 VAL H . . A . 18 VAL HA . A . 18 . HN . . . A . 18 . HA . . c30225_5ug3 1 113 1 . . 1 1 18 18 VAL H H . . . 1 1 18 18 VAL HB H . . . . . 2.780 1.814 3.746 . . . . . A . 18 VAL H . . A . 18 VAL HB . A . 18 . HN . . . A . 18 . HB . . c30225_5ug3 1 114 1 . . 1 1 18 18 VAL H H . . . 1 1 18 18 VAL MG1 H . . . . . 2.608 1.758 3.458 . . . . . A . 18 VAL H . . A . 18 VAL MG1 . A . 18 . HN . . . A . 18 . HG1# . . c30225_5ug3 1 115 1 . . 1 1 18 18 VAL H H . . . 1 1 18 18 VAL MG2 H . . . . . 3.154 1.911 4.397 . . . . . A . 18 VAL H . . A . 18 VAL MG2 . A . 18 . HN . . . A . 18 . HG2# . . c30225_5ug3 1 116 1 . . 1 1 18 18 VAL HA H . . . 1 1 18 18 VAL HB H . . . . . 2.542 1.734 3.350 . . . . . A . 18 VAL HA . . A . 18 VAL HB . A . 18 . HA . . . A . 18 . HB . . c30225_5ug3 1 117 1 . . 1 1 18 18 VAL HA H . . . 1 1 18 18 VAL MG1 H . . . . . 2.674 1.780 3.568 . . . . . A . 18 VAL HA . . A . 18 VAL MG1 . A . 18 . HA . . . A . 18 . HG1# . . c30225_5ug3 1 118 1 . . 1 1 18 18 VAL HA H . . . 1 1 18 18 VAL MG2 H . . . . . 2.598 1.754 3.442 . . . . . A . 18 VAL HA . . A . 18 VAL MG2 . A . 18 . HA . . . A . 18 . HG2# . . c30225_5ug3 1 119 1 . . 1 1 18 18 VAL HB H . . . 1 1 18 18 VAL MG1 H . . . . . 2.281 1.631 2.931 . . . . . A . 18 VAL HB . . A . 18 VAL MG1 . A . 18 . HB . . . A . 18 . HG1# . . c30225_5ug3 1 120 1 . . 1 1 18 18 VAL HB H . . . 1 1 18 18 VAL MG2 H . . . . . 2.375 1.670 3.080 . . . . . A . 18 VAL HB . . A . 18 VAL MG2 . A . 18 . HB . . . A . 18 . HG2# . . c30225_5ug3 1 121 1 . . 1 1 11 11 CYS H H . . . 1 1 11 11 CYS HA H . . . . . 2.717 1.794 3.640 . . . . . A . 11 CYS H . . A . 11 CYS HA . A . 11 . HN . . . A . 11 . HA . . c30225_5ug3 1 122 1 . . 1 1 11 11 CYS H H . . . 1 1 11 11 CYS HB2 H . . . . . 2.695 1.787 3.603 . . . . . A . 11 CYS H . . A . 11 CYS HB2 . A . 11 . HN . . . A . 11 . HB2 . . c30225_5ug3 1 123 1 . . 1 1 11 11 CYS H H . . . 1 1 11 11 CYS HB3 H . . . . . 2.559 1.740 3.378 . . . . . A . 11 CYS H . . A . 11 CYS HB3 . A . 11 . HN . . . A . 11 . HB1 . . c30225_5ug3 1 124 1 . . 1 1 11 11 CYS HA H . . . 1 1 11 11 CYS HB3 H . . . . . 2.511 1.723 3.299 . . . . . A . 11 CYS HA . . A . 11 CYS HB3 . A . 11 . HA . . . A . 11 . HB1 . . c30225_5ug3 1 125 1 . . 1 1 11 11 CYS HA H . . . 1 1 11 11 CYS HB2 H . . . . . 2.425 1.690 3.160 . . . . . A . 11 CYS HA . . A . 11 CYS HB2 . A . 11 . HA . . . A . 11 . HB2 . . c30225_5ug3 1 126 1 . . 1 1 11 11 CYS HB2 H . . . 1 1 11 11 CYS HB3 H . . . . . 2.420 1.688 3.152 . . . . . A . 11 CYS HB2 . . A . 11 CYS HB3 . A . 11 . HB2 . . . A . 11 . HB1 . . c30225_5ug3 1 127 1 . . 1 1 11 11 CYS H H . . . 1 1 11 11 CYS HA H . . . . . 2.841 1.832 3.850 . . . . . A . 11 CYS H . . A . 11 CYS HA . A . 11 . HN . . . A . 11 . HA . . c30225_5ug3 1 128 1 . . 1 1 11 11 CYS H H . . . 1 1 11 11 CYS HB2 H . . . . . 2.873 1.841 3.905 . . . . . A . 11 CYS H . . A . 11 CYS HB2 . A . 11 . HN . . . A . 11 . HB2 . . c30225_5ug3 1 129 1 . . 1 1 11 11 CYS H H . . . 1 1 11 11 CYS HB3 H . . . . . 2.606 1.757 3.455 . . . . . A . 11 CYS H . . A . 11 CYS HB3 . A . 11 . HN . . . A . 11 . HB1 . . c30225_5ug3 1 130 1 . . 1 1 11 11 CYS HA H . . . 1 1 11 11 CYS HB2 H . . . . . 2.464 1.705 3.223 . . . . . A . 11 CYS HA . . A . 11 CYS HB2 . A . 11 . HA . . . A . 11 . HB2 . . c30225_5ug3 1 131 1 . . 1 1 11 11 CYS HA H . . . 1 1 11 11 CYS HB3 H . . . . . 2.365 1.666 3.064 . . . . . A . 11 CYS HA . . A . 11 CYS HB3 . A . 11 . HA . . . A . 11 . HB1 . . c30225_5ug3 1 132 1 . . 1 1 12 12 ARG H H . . . 1 1 12 12 ARG HA H . . . . . 2.832 1.830 3.834 . . . . . A . 12 ARG H . . A . 12 ARG HA . A . 12 . HN . . . A . 12 . HA . . c30225_5ug3 1 133 1 . . 1 1 12 12 ARG H H . . . 1 1 12 12 ARG HD2 H . . . . . 2.802 1.821 3.783 . . . . . A . 12 ARG H . . A . 12 ARG HD2 . A . 12 . HN . . . A . 12 . HD2 . . c30225_5ug3 1 134 1 . . 1 1 12 12 ARG H H . . . 1 1 12 12 ARG HG2 H . . . . . 2.615 1.760 3.470 . . . . . A . 12 ARG H . . A . 12 ARG HG2 . A . 12 . HN . . . A . 12 . HG2 . . c30225_5ug3 1 135 1 . . 1 1 12 12 ARG H H . . . 1 1 12 12 ARG HG3 H . . . . . 2.730 1.798 3.662 . . . . . A . 12 ARG H . . A . 12 ARG HG3 . A . 12 . HN . . . A . 12 . HG1 . . c30225_5ug3 1 136 1 . . 1 1 12 12 ARG H H . . . 1 1 12 12 ARG HB2 H . . . . . 3.066 1.891 4.241 . . . . . A . 12 ARG H . . A . 12 ARG HB2 . A . 12 . HN . . . A . 12 . HB2 . . c30225_5ug3 1 137 1 . . 1 1 12 12 ARG H H . . . 1 1 12 12 ARG HB3 H . . . . . 3.214 1.923 4.505 . . . . . A . 12 ARG H . . A . 12 ARG HB3 . A . 12 . HN . . . A . 12 . HB1 . . c30225_5ug3 1 138 1 . . 1 1 12 12 ARG HA H . . . 1 1 12 12 ARG HD2 H . . . . . 4.620 1.952 7.288 . . . . . A . 12 ARG HA . . A . 12 ARG HD2 . A . 12 . HA . . . A . 12 . HD2 . . c30225_5ug3 1 139 1 . . 1 1 12 12 ARG HA H . . . 1 1 12 12 ARG HG2 H . . . . . 2.462 1.704 3.220 . . . . . A . 12 ARG HA . . A . 12 ARG HG2 . A . 12 . HA . . . A . 12 . HG2 . . c30225_5ug3 1 140 1 . . 1 1 12 12 ARG HA H . . . 1 1 12 12 ARG HG3 H . . . . . 2.770 1.811 3.729 . . . . . A . 12 ARG HA . . A . 12 ARG HG3 . A . 12 . HA . . . A . 12 . HG1 . . c30225_5ug3 1 141 1 . . 1 1 12 12 ARG HA H . . . 1 1 12 12 ARG HB2 H . . . . . 2.904 1.850 3.958 . . . . . A . 12 ARG HA . . A . 12 ARG HB2 . A . 12 . HA . . . A . 12 . HB2 . . c30225_5ug3 1 142 1 . . 1 1 12 12 ARG HA H . . . 1 1 12 12 ARG HB3 H . . . . . 2.979 1.870 4.088 . . . . . A . 12 ARG HA . . A . 12 ARG HB3 . A . 12 . HA . . . A . 12 . HB1 . . c30225_5ug3 1 143 1 . . 1 1 12 12 ARG HD2 H . . . 1 1 12 12 ARG HG2 H . . . . . 2.778 1.813 3.743 . . . . . A . 12 ARG HD2 . . A . 12 ARG HG2 . A . 12 . HD2 . . . A . 12 . HG2 . . c30225_5ug3 1 144 1 . . 1 1 12 12 ARG HD2 H . . . 1 1 12 12 ARG HG3 H . . . . . 2.758 1.807 3.709 . . . . . A . 12 ARG HD2 . . A . 12 ARG HG3 . A . 12 . HD2 . . . A . 12 . HG1 . . c30225_5ug3 1 145 1 . . 1 1 12 12 ARG HD2 H . . . 1 1 12 12 ARG HB2 H . . . . . 2.536 1.732 3.340 . . . . . A . 12 ARG HD2 . . A . 12 ARG HB2 . A . 12 . HD2 . . . A . 12 . HB2 . . c30225_5ug3 1 146 1 . . 1 1 12 12 ARG HD2 H . . . 1 1 12 12 ARG HB3 H . . . . . 2.545 1.736 3.354 . . . . . A . 12 ARG HD2 . . A . 12 ARG HB3 . A . 12 . HD2 . . . A . 12 . HB1 . . c30225_5ug3 1 147 1 . . 1 1 12 12 ARG HG2 H . . . 1 1 12 12 ARG HG3 H . . . . . 2.297 1.638 2.956 . . . . . A . 12 ARG HG2 . . A . 12 ARG HG3 . A . 12 . HG2 . . . A . 12 . HG1 . . c30225_5ug3 1 148 1 . . 1 1 12 12 ARG HG2 H . . . 1 1 12 12 ARG HB2 H . . . . . 2.977 1.869 4.085 . . . . . A . 12 ARG HG2 . . A . 12 ARG HB2 . A . 12 . HG2 . . . A . 12 . HB2 . . c30225_5ug3 1 149 1 . . 1 1 12 12 ARG HG2 H . . . 1 1 12 12 ARG HB3 H . . . . . 3.152 1.910 4.394 . . . . . A . 12 ARG HG2 . . A . 12 ARG HB3 . A . 12 . HG2 . . . A . 12 . HB1 . . c30225_5ug3 1 150 1 . . 1 1 12 12 ARG HG3 H . . . 1 1 12 12 ARG HB2 H . . . . . 2.708 1.791 3.625 . . . . . A . 12 ARG HG3 . . A . 12 ARG HB2 . A . 12 . HG1 . . . A . 12 . HB2 . . c30225_5ug3 1 151 1 . . 1 1 12 12 ARG HG3 H . . . 1 1 12 12 ARG HB3 H . . . . . 2.846 1.833 3.859 . . . . . A . 12 ARG HG3 . . A . 12 ARG HB3 . A . 12 . HG1 . . . A . 12 . HB1 . . c30225_5ug3 1 152 1 . . 1 1 12 12 ARG HB2 H . . . 1 1 12 12 ARG HB3 H . . . . . 2.274 1.628 2.920 . . . . . A . 12 ARG HB2 . . A . 12 ARG HB3 . A . 12 . HB2 . . . A . 12 . HB1 . . c30225_5ug3 1 153 1 . . 1 1 12 12 ARG HB2 H . . . 1 1 12 12 ARG HB3 H . . . . . 2.212 1.600 2.824 . . . . . A . 12 ARG HB2 . . A . 12 ARG HB3 . A . 12 . HB2 . . . A . 12 . HB1 . . c30225_5ug3 1 154 1 . . 1 1 12 12 ARG HG3 H . . . 1 1 12 12 ARG HB2 H . . . . . 2.518 1.726 3.310 . . . . . A . 12 ARG HG3 . . A . 12 ARG HB2 . A . 12 . HG1 . . . A . 12 . HB2 . . c30225_5ug3 1 155 1 . . 1 1 12 12 ARG HG3 H . . . 1 1 12 12 ARG HB3 H . . . . . 2.646 1.771 3.521 . . . . . A . 12 ARG HG3 . . A . 12 ARG HB3 . A . 12 . HG1 . . . A . 12 . HB1 . . c30225_5ug3 1 156 1 . . 1 1 12 12 ARG HG2 H . . . 1 1 12 12 ARG HG3 H . . . . . 2.260 1.622 2.898 . . . . . A . 12 ARG HG2 . . A . 12 ARG HG3 . A . 12 . HG2 . . . A . 12 . HG1 . . c30225_5ug3 1 157 1 . . 1 1 12 12 ARG HG2 H . . . 1 1 12 12 ARG HB2 H . . . . . 2.735 1.800 3.670 . . . . . A . 12 ARG HG2 . . A . 12 ARG HB2 . A . 12 . HG2 . . . A . 12 . HB2 . . c30225_5ug3 1 158 1 . . 1 1 12 12 ARG HG2 H . . . 1 1 12 12 ARG HB3 H . . . . . 2.932 1.857 4.007 . . . . . A . 12 ARG HG2 . . A . 12 ARG HB3 . A . 12 . HG2 . . . A . 12 . HB1 . . c30225_5ug3 1 159 1 . . 1 1 12 12 ARG HD2 H . . . 1 1 12 12 ARG HG2 H . . . . . 2.797 1.819 3.775 . . . . . A . 12 ARG HD2 . . A . 12 ARG HG2 . A . 12 . HD2 . . . A . 12 . HG2 . . c30225_5ug3 1 160 1 . . 1 1 12 12 ARG HD2 H . . . 1 1 12 12 ARG HG3 H . . . . . 2.790 1.817 3.763 . . . . . A . 12 ARG HD2 . . A . 12 ARG HG3 . A . 12 . HD2 . . . A . 12 . HG1 . . c30225_5ug3 1 161 1 . . 1 1 12 12 ARG HD2 H . . . 1 1 12 12 ARG HB2 H . . . . . 2.581 1.748 3.414 . . . . . A . 12 ARG HD2 . . A . 12 ARG HB2 . A . 12 . HD2 . . . A . 12 . HB2 . . c30225_5ug3 1 162 1 . . 1 1 12 12 ARG HD2 H . . . 1 1 12 12 ARG HB3 H . . . . . 2.572 1.745 3.399 . . . . . A . 12 ARG HD2 . . A . 12 ARG HB3 . A . 12 . HD2 . . . A . 12 . HB1 . . c30225_5ug3 1 163 1 . . 1 1 12 12 ARG HA H . . . 1 1 12 12 ARG HG2 H . . . . . 2.663 1.777 3.549 . . . . . A . 12 ARG HA . . A . 12 ARG HG2 . A . 12 . HA . . . A . 12 . HG2 . . c30225_5ug3 1 164 1 . . 1 1 12 12 ARG HA H . . . 1 1 12 12 ARG HG3 H . . . . . 3.009 1.877 4.141 . . . . . A . 12 ARG HA . . A . 12 ARG HG3 . A . 12 . HA . . . A . 12 . HG1 . . c30225_5ug3 1 165 1 . . 1 1 12 12 ARG HA H . . . 1 1 12 12 ARG HB2 H . . . . . 3.096 1.898 4.294 . . . . . A . 12 ARG HA . . A . 12 ARG HB2 . A . 12 . HA . . . A . 12 . HB2 . . c30225_5ug3 1 166 1 . . 1 1 12 12 ARG HA H . . . 1 1 12 12 ARG HB3 H . . . . . 3.132 1.906 4.358 . . . . . A . 12 ARG HA . . A . 12 ARG HB3 . A . 12 . HA . . . A . 12 . HB1 . . c30225_5ug3 1 167 1 OR . 1 1 9 9 PRO HA H . . . 1 1 9 9 PRO HB2 H . . . . . 2.710 1.792 3.628 . . . . . A . 9 PRO HA . . A . 9 PRO HB2 . A . 9 . HA . . . A . 9 . HB2 . . c30225_5ug3 1 167 2 OR . 1 1 12 12 ARG HG2 H . . . 1 1 9 9 PRO HA H . . . . . 2.710 1.792 3.628 . . . . . A . 12 ARG HG2 . . A . 9 PRO HA . A . 12 . HG2 . . . A . 9 . HA . . c30225_5ug3 1 168 1 . . 1 1 2 2 ARG HD2 H . . . 1 1 2 2 ARG HE H . . . . . 2.873 1.841 3.905 . . . . . A . 2 ARG HD2 . . A . 2 ARG HE . A . 2 . HD2 . . . A . 2 . HE . . c30225_5ug3 1 169 1 . . 1 1 2 2 ARG HB2 H . . . 1 1 2 2 ARG HE H . . . . . 3.857 1.998 5.716 . . . . . A . 2 ARG HB2 . . A . 2 ARG HE . A . 2 . HB2 . . . A . 2 . HE . . c30225_5ug3 1 170 1 . . 1 1 2 2 ARG HB3 H . . . 1 1 2 2 ARG HE H . . . . . 3.642 1.984 5.300 . . . . . A . 2 ARG HB3 . . A . 2 ARG HE . A . 2 . HB1 . . . A . 2 . HE . . c30225_5ug3 1 171 1 . . 1 1 12 12 ARG HD2 H . . . 1 1 12 12 ARG HE H . . . . . 2.569 1.744 3.394 . . . . . A . 12 ARG HD2 . . A . 12 ARG HE . A . 12 . HD2 . . . A . 12 . HE . . c30225_5ug3 1 172 1 . . 1 1 12 12 ARG HG2 H . . . 1 1 12 12 ARG HE H . . . . . 3.438 1.960 4.916 . . . . . A . 12 ARG HG2 . . A . 12 ARG HE . A . 12 . HG2 . . . A . 12 . HE . . c30225_5ug3 1 173 1 . . 1 1 12 12 ARG HG3 H . . . 1 1 12 12 ARG HE H . . . . . 3.352 1.947 4.757 . . . . . A . 12 ARG HG3 . . A . 12 ARG HE . A . 12 . HG1 . . . A . 12 . HE . . c30225_5ug3 1 174 1 . . 1 1 12 12 ARG HB2 H . . . 1 1 12 12 ARG HE H . . . . . 3.260 1.931 4.589 . . . . . A . 12 ARG HB2 . . A . 12 ARG HE . A . 12 . HB2 . . . A . 12 . HE . . c30225_5ug3 1 175 1 . . 1 1 12 12 ARG HB3 H . . . 1 1 12 12 ARG HE H . . . . . 3.235 1.927 4.543 . . . . . A . 12 ARG HB3 . . A . 12 ARG HE . A . 12 . HB1 . . . A . 12 . HE . . c30225_5ug3 1 176 1 . . 1 1 12 12 ARG HD2 H . . . 1 1 12 12 ARG HE H . . . . . 2.547 1.736 3.358 . . . . . A . 12 ARG HD2 . . A . 12 ARG HE . A . 12 . HD2 . . . A . 12 . HE . . c30225_5ug3 1 177 1 . . 1 1 12 12 ARG HB2 H . . . 1 1 12 12 ARG HE H . . . . . 3.289 1.937 4.641 . . . . . A . 12 ARG HB2 . . A . 12 ARG HE . A . 12 . HB2 . . . A . 12 . HE . . c30225_5ug3 1 178 1 . . 1 1 12 12 ARG HB3 H . . . 1 1 12 12 ARG HE H . . . . . 3.248 1.929 4.567 . . . . . A . 12 ARG HB3 . . A . 12 ARG HE . A . 12 . HB1 . . . A . 12 . HE . . c30225_5ug3 1 179 1 . . 1 1 13 13 VAL H H . . . 1 1 13 13 VAL HA H . . . . . 2.840 1.832 3.848 . . . . . A . 13 VAL H . . A . 13 VAL HA . A . 13 . HN . . . A . 13 . HA . . c30225_5ug3 1 180 1 . . 1 1 13 13 VAL H H . . . 1 1 13 13 VAL HB H . . . . . 2.535 1.732 3.338 . . . . . A . 13 VAL H . . A . 13 VAL HB . A . 13 . HN . . . A . 13 . HB . . c30225_5ug3 1 181 1 . . 1 1 13 13 VAL H H . . . 1 1 13 13 VAL MG1 H . . . . . 2.895 1.847 3.943 . . . . . A . 13 VAL H . . A . 13 VAL MG1 . A . 13 . HN . . . A . 13 . HG1# . . c30225_5ug3 1 182 1 . . 1 1 13 13 VAL H H . . . 1 1 13 13 VAL MG2 H . . . . . 2.639 1.769 3.509 . . . . . A . 13 VAL H . . A . 13 VAL MG2 . A . 13 . HN . . . A . 13 . HG2# . . c30225_5ug3 1 183 1 . . 1 1 13 13 VAL HA H . . . 1 1 13 13 VAL HB H . . . . . 2.465 1.705 3.225 . . . . . A . 13 VAL HA . . A . 13 VAL HB . A . 13 . HA . . . A . 13 . HB . . c30225_5ug3 1 184 1 . . 1 1 13 13 VAL HA H . . . 1 1 13 13 VAL MG2 H . . . . . 2.619 1.762 3.476 . . . . . A . 13 VAL HA . . A . 13 VAL MG2 . A . 13 . HA . . . A . 13 . HG2# . . c30225_5ug3 1 185 1 . . 1 1 1 1 ILE HA H . . . 1 1 1 1 ILE MG H . . . . . 2.544 1.735 3.353 . . . . . A . 1 ILE HA . . A . 1 ILE MG . A . 1 . HA . . . A . 1 . HG2# . . c30225_5ug3 1 186 1 . . 1 1 13 13 VAL HA H . . . 1 1 13 13 VAL MG1 H . . . . . 2.546 1.736 3.356 . . . . . A . 13 VAL HA . . A . 13 VAL MG1 . A . 13 . HA . . . A . 13 . HG1# . . c30225_5ug3 1 187 1 . . 1 1 13 13 VAL HB H . . . 1 1 13 13 VAL MG2 H . . . . . 2.725 1.797 3.653 . . . . . A . 13 VAL HB . . A . 13 VAL MG2 . A . 13 . HB . . . A . 13 . HG2# . . c30225_5ug3 1 188 1 . . 1 1 13 13 VAL HB H . . . 1 1 13 13 VAL MG1 H . . . . . 2.477 1.710 3.244 . . . . . A . 13 VAL HB . . A . 13 VAL MG1 . A . 13 . HB . . . A . 13 . HG1# . . c30225_5ug3 1 189 1 . . 1 1 13 13 VAL H H . . . 1 1 13 13 VAL HA H . . . . . 2.638 1.768 3.508 . . . . . A . 13 VAL H . . A . 13 VAL HA . A . 13 . HN . . . A . 13 . HA . . c30225_5ug3 1 190 1 . . 1 1 13 13 VAL H H . . . 1 1 13 13 VAL HB H . . . . . 2.659 1.775 3.543 . . . . . A . 13 VAL H . . A . 13 VAL HB . A . 13 . HN . . . A . 13 . HB . . c30225_5ug3 1 191 1 . . 1 1 13 13 VAL H H . . . 1 1 13 13 VAL MG2 H . . . . . 2.700 1.789 3.611 . . . . . A . 13 VAL H . . A . 13 VAL MG2 . A . 13 . HN . . . A . 13 . HG2# . . c30225_5ug3 1 192 1 . . 1 1 13 13 VAL H H . . . 1 1 13 13 VAL MG1 H . . . . . 3.087 1.896 4.278 . . . . . A . 13 VAL H . . A . 13 VAL MG1 . A . 13 . HN . . . A . 13 . HG1# . . c30225_5ug3 1 193 1 . . 1 1 13 13 VAL HA H . . . 1 1 13 13 VAL HB H . . . . . 2.668 1.778 3.558 . . . . . A . 13 VAL HA . . A . 13 VAL HB . A . 13 . HA . . . A . 13 . HB . . c30225_5ug3 1 194 1 . . 1 1 13 13 VAL HA H . . . 1 1 13 13 VAL MG2 H . . . . . 2.720 1.795 3.645 . . . . . A . 13 VAL HA . . A . 13 VAL MG2 . A . 13 . HA . . . A . 13 . HG2# . . c30225_5ug3 1 195 1 . . 1 1 13 13 VAL HA H . . . 1 1 13 13 VAL MG1 H . . . . . 2.634 1.767 3.501 . . . . . A . 13 VAL HA . . A . 13 VAL MG1 . A . 13 . HA . . . A . 13 . HG1# . . c30225_5ug3 1 196 1 . . 1 1 13 13 VAL HB H . . . 1 1 13 13 VAL MG2 H . . . . . 2.593 1.753 3.433 . . . . . A . 13 VAL HB . . A . 13 VAL MG2 . A . 13 . HB . . . A . 13 . HG2# . . c30225_5ug3 1 197 1 . . 1 1 13 13 VAL HB H . . . 1 1 13 13 VAL MG1 H . . . . . 2.329 1.651 3.007 . . . . . A . 13 VAL HB . . A . 13 VAL MG1 . A . 13 . HB . . . A . 13 . HG1# . . c30225_5ug3 1 198 1 . . 1 1 13 13 VAL MG1 H . . . 1 1 13 13 VAL MG2 H . . . . . 2.158 1.576 2.740 . . . . . A . 13 VAL MG1 . . A . 13 VAL MG2 . A . 13 . HG1# . . . A . 13 . HG2# . . c30225_5ug3 1 199 1 . . 1 1 14 14 ASN H H . . . 1 1 14 14 ASN HA H . . . . . 2.923 1.855 3.991 . . . . . A . 14 ASN H . . A . 14 ASN HA . A . 14 . HN . . . A . 14 . HA . . c30225_5ug3 1 200 1 . . 1 1 14 14 ASN HB2 H . . . 1 1 14 14 ASN H H . . . . . 2.963 1.865 4.061 . . . . . A . 14 ASN HB2 . . A . 14 ASN H . A . 14 . HB2 . . . A . 14 . HN . . c30225_5ug3 1 201 1 . . 1 1 14 14 ASN HB3 H . . . 1 1 14 14 ASN H H . . . . . 2.757 1.807 3.707 . . . . . A . 14 ASN HB3 . . A . 14 ASN H . A . 14 . HB1 . . . A . 14 . HN . . c30225_5ug3 1 202 1 . . 1 1 14 14 ASN HB2 H . . . 1 1 14 14 ASN HA H . . . . . 2.818 1.825 3.811 . . . . . A . 14 ASN HB2 . . A . 14 ASN HA . A . 14 . HB2 . . . A . 14 . HA . . c30225_5ug3 1 203 1 . . 1 1 14 14 ASN HB3 H . . . 1 1 14 14 ASN HA H . . . . . 3.355 1.948 4.762 . . . . . A . 14 ASN HB3 . . A . 14 ASN HA . A . 14 . HB1 . . . A . 14 . HA . . c30225_5ug3 1 204 1 . . 1 1 3 3 ASP HB2 H . . . 1 1 3 3 ASP HB3 H . . . . . 2.340 1.656 3.024 . . . . . A . 3 ASP HB2 . . A . 3 ASP HB3 . A . 3 . HB2 . . . A . 3 . HB1 . . c30225_5ug3 1 205 1 . . 1 1 14 14 ASN H H . . . 1 1 14 14 ASN HA H . . . . . 3.009 1.878 4.140 . . . . . A . 14 ASN H . . A . 14 ASN HA . A . 14 . HN . . . A . 14 . HA . . c30225_5ug3 1 206 1 . . 1 1 14 14 ASN HB2 H . . . 1 1 14 14 ASN H H . . . . . 3.100 1.898 4.302 . . . . . A . 14 ASN HB2 . . A . 14 ASN H . A . 14 . HB2 . . . A . 14 . HN . . c30225_5ug3 1 207 1 . . 1 1 14 14 ASN HB3 H . . . 1 1 14 14 ASN H H . . . . . 2.875 1.842 3.908 . . . . . A . 14 ASN HB3 . . A . 14 ASN H . A . 14 . HB1 . . . A . 14 . HN . . c30225_5ug3 1 208 1 . . 1 1 14 14 ASN HB2 H . . . 1 1 14 14 ASN HA H . . . . . 2.763 1.809 3.717 . . . . . A . 14 ASN HB2 . . A . 14 ASN HA . A . 14 . HB2 . . . A . 14 . HA . . c30225_5ug3 1 209 1 . . 1 1 14 14 ASN HB2 H . . . 1 1 14 14 ASN HB3 H . . . . . 2.051 1.525 2.577 . . . . . A . 14 ASN HB2 . . A . 14 ASN HB3 . A . 14 . HB2 . . . A . 14 . HB1 . . c30225_5ug3 1 210 1 . . 1 1 15 15 ASN H H . . . 1 1 15 15 ASN HA H . . . . . 2.911 1.852 3.970 . . . . . A . 15 ASN H . . A . 15 ASN HA . A . 15 . HN . . . A . 15 . HA . . c30225_5ug3 1 211 1 . . 1 1 15 15 ASN H H . . . 1 1 15 15 ASN HB2 H . . . . . 2.892 1.846 3.938 . . . . . A . 15 ASN H . . A . 15 ASN HB2 . A . 15 . HN . . . A . 15 . HB2 . . c30225_5ug3 1 212 1 . . 1 1 15 15 ASN H H . . . 1 1 15 15 ASN HB3 H . . . . . 2.512 1.723 3.301 . . . . . A . 15 ASN H . . A . 15 ASN HB3 . A . 15 . HN . . . A . 15 . HB1 . . c30225_5ug3 1 213 1 . . 1 1 15 15 ASN H H . . . 1 1 15 15 ASN HB2 H . . . . . 2.813 1.824 3.802 . . . . . A . 15 ASN H . . A . 15 ASN HB2 . A . 15 . HN . . . A . 15 . HB2 . . c30225_5ug3 1 214 1 . . 1 1 15 15 ASN H H . . . 1 1 15 15 ASN HB3 H . . . . . 2.771 1.811 3.731 . . . . . A . 15 ASN H . . A . 15 ASN HB3 . A . 15 . HN . . . A . 15 . HB1 . . c30225_5ug3 1 215 1 . . 1 1 15 15 ASN HA H . . . 1 1 15 15 ASN HB3 H . . . . . 2.705 1.790 3.620 . . . . . A . 15 ASN HA . . A . 15 ASN HB3 . A . 15 . HA . . . A . 15 . HB1 . . c30225_5ug3 1 216 1 . . 1 1 10 10 VAL H H . . . 1 1 10 10 VAL HA H . . . . . 2.786 1.816 3.756 . . . . . A . 10 VAL H . . A . 10 VAL HA . A . 10 . HN . . . A . 10 . HA . . c30225_5ug3 1 217 1 . . 1 1 10 10 VAL H H . . . 1 1 10 10 VAL HB H . . . . . 2.333 1.653 3.013 . . . . . A . 10 VAL H . . A . 10 VAL HB . A . 10 . HN . . . A . 10 . HB . . c30225_5ug3 1 218 1 . . 1 1 10 10 VAL H H . . . 1 1 10 10 VAL MG1 H . . . . . 2.516 1.725 3.307 . . . . . A . 10 VAL H . . A . 10 VAL MG1 . A . 10 . HN . . . A . 10 . HG1# . . c30225_5ug3 1 219 1 . . 1 1 10 10 VAL H H . . . 1 1 10 10 VAL MG2 H . . . . . 3.181 1.916 4.446 . . . . . A . 10 VAL H . . A . 10 VAL MG2 . A . 10 . HN . . . A . 10 . HG2# . . c30225_5ug3 1 220 1 . . 1 1 10 10 VAL H H . . . 1 1 10 10 VAL HA H . . . . . 2.784 1.815 3.753 . . . . . A . 10 VAL H . . A . 10 VAL HA . A . 10 . HN . . . A . 10 . HA . . c30225_5ug3 1 221 1 . . 1 1 10 10 VAL H H . . . 1 1 10 10 VAL HB H . . . . . 2.509 1.722 3.296 . . . . . A . 10 VAL H . . A . 10 VAL HB . A . 10 . HN . . . A . 10 . HB . . c30225_5ug3 1 222 1 . . 1 1 10 10 VAL H H . . . 1 1 10 10 VAL MG1 H . . . . . 2.547 1.736 3.358 . . . . . A . 10 VAL H . . A . 10 VAL MG1 . A . 10 . HN . . . A . 10 . HG1# . . c30225_5ug3 1 223 1 . . 1 1 10 10 VAL H H . . . 1 1 10 10 VAL MG2 H . . . . . 3.396 1.954 4.838 . . . . . A . 10 VAL H . . A . 10 VAL MG2 . A . 10 . HN . . . A . 10 . HG2# . . c30225_5ug3 1 224 1 . . 1 1 10 10 VAL HA H . . . 1 1 10 10 VAL HB H . . . . . 2.766 1.810 3.722 . . . . . A . 10 VAL HA . . A . 10 VAL HB . A . 10 . HA . . . A . 10 . HB . . c30225_5ug3 1 225 1 . . 1 1 10 10 VAL HA H . . . 1 1 10 10 VAL MG1 H . . . . . 2.422 1.689 3.155 . . . . . A . 10 VAL HA . . A . 10 VAL MG1 . A . 10 . HA . . . A . 10 . HG1# . . c30225_5ug3 1 226 1 . . 1 1 10 10 VAL HA H . . . 1 1 10 10 VAL MG2 H . . . . . 2.636 1.767 3.505 . . . . . A . 10 VAL HA . . A . 10 VAL MG2 . A . 10 . HA . . . A . 10 . HG2# . . c30225_5ug3 1 227 1 . . 1 1 10 10 VAL HB H . . . 1 1 10 10 VAL MG1 H . . . . . 2.489 1.715 3.263 . . . . . A . 10 VAL HB . . A . 10 VAL MG1 . A . 10 . HB . . . A . 10 . HG1# . . c30225_5ug3 1 228 1 . . 1 1 10 10 VAL HB H . . . 1 1 10 10 VAL MG2 H . . . . . 2.556 1.739 3.373 . . . . . A . 10 VAL HB . . A . 10 VAL MG2 . A . 10 . HB . . . A . 10 . HG2# . . c30225_5ug3 1 229 1 . . 1 1 10 10 VAL MG1 H . . . 1 1 10 10 VAL MG2 H . . . . . 2.972 1.868 4.076 . . . . . A . 10 VAL MG1 . . A . 10 VAL MG2 . A . 10 . HG1# . . . A . 10 . HG2# . . c30225_5ug3 1 230 1 . . 1 1 10 10 VAL HA H . . . 1 1 10 10 VAL HB H . . . . . 2.907 1.851 3.963 . . . . . A . 10 VAL HA . . A . 10 VAL HB . A . 10 . HA . . . A . 10 . HB . . c30225_5ug3 1 231 1 . . 1 1 10 10 VAL HA H . . . 1 1 10 10 VAL MG1 H . . . . . 2.506 1.721 3.291 . . . . . A . 10 VAL HA . . A . 10 VAL MG1 . A . 10 . HA . . . A . 10 . HG1# . . c30225_5ug3 1 232 1 . . 1 1 10 10 VAL HA H . . . 1 1 10 10 VAL MG2 H . . . . . 2.676 1.781 3.571 . . . . . A . 10 VAL HA . . A . 10 VAL MG2 . A . 10 . HA . . . A . 10 . HG2# . . c30225_5ug3 1 233 1 . . 1 1 10 10 VAL HB H . . . 1 1 10 10 VAL MG1 H . . . . . 2.298 1.638 2.958 . . . . . A . 10 VAL HB . . A . 10 VAL MG1 . A . 10 . HB . . . A . 10 . HG1# . . c30225_5ug3 1 234 1 . . 1 1 10 10 VAL HB H . . . 1 1 10 10 VAL MG2 H . . . . . 2.389 1.676 3.102 . . . . . A . 10 VAL HB . . A . 10 VAL MG2 . A . 10 . HB . . . A . 10 . HG2# . . c30225_5ug3 1 235 1 . . 1 1 10 10 VAL MG1 H . . . 1 1 10 10 VAL MG2 H . . . . . 2.189 1.590 2.788 . . . . . A . 10 VAL MG1 . . A . 10 VAL MG2 . A . 10 . HG1# . . . A . 10 . HG2# . . c30225_5ug3 1 236 1 . . 1 1 17 17 HIS H H . . . 1 1 17 17 HIS HA H . . . . . 2.657 1.775 3.539 . . . . . A . 17 HIS H . . A . 17 HIS HA . A . 17 . HN . . . A . 17 . HA . . c30225_5ug3 1 237 1 . . 1 1 17 17 HIS H H . . . 1 1 17 17 HIS HB2 H . . . . . 3.055 1.888 4.222 . . . . . A . 17 HIS H . . A . 17 HIS HB2 . A . 17 . HN . . . A . 17 . HB2 . . c30225_5ug3 1 238 1 . . 1 1 17 17 HIS H H . . . 1 1 17 17 HIS HB3 H . . . . . 2.852 1.835 3.869 . . . . . A . 17 HIS H . . A . 17 HIS HB3 . A . 17 . HN . . . A . 17 . HB1 . . c30225_5ug3 1 239 1 . . 1 1 17 17 HIS HA H . . . 1 1 17 17 HIS HB2 H . . . . . 2.910 1.851 3.969 . . . . . A . 17 HIS HA . . A . 17 HIS HB2 . A . 17 . HA . . . A . 17 . HB2 . . c30225_5ug3 1 240 1 . . 1 1 17 17 HIS HA H . . . 1 1 17 17 HIS HB3 H . . . . . 7.625 0.358 14.892 . . . . . A . 17 HIS HA . . A . 17 HIS HB3 . A . 17 . HA . . . A . 17 . HB1 . . c30225_5ug3 1 241 1 . . 1 1 17 17 HIS HB2 H . . . 1 1 17 17 HIS HB3 H . . . . . 2.129 1.562 2.696 . . . . . A . 17 HIS HB2 . . A . 17 HIS HB3 . A . 17 . HB2 . . . A . 17 . HB1 . . c30225_5ug3 1 242 1 . . 1 1 17 17 HIS H H . . . 1 1 17 17 HIS HA H . . . . . 2.868 1.840 3.896 . . . . . A . 17 HIS H . . A . 17 HIS HA . A . 17 . HN . . . A . 17 . HA . . c30225_5ug3 1 243 1 . . 1 1 17 17 HIS H H . . . 1 1 17 17 HIS HB2 H . . . . . 3.229 1.926 4.532 . . . . . A . 17 HIS H . . A . 17 HIS HB2 . A . 17 . HN . . . A . 17 . HB2 . . c30225_5ug3 1 244 1 . . 1 1 17 17 HIS H H . . . 1 1 17 17 HIS HB3 H . . . . . 3.041 1.885 4.197 . . . . . A . 17 HIS H . . A . 17 HIS HB3 . A . 17 . HN . . . A . 17 . HB1 . . c30225_5ug3 1 245 1 . . 1 1 17 17 HIS HA H . . . 1 1 17 17 HIS HB2 H . . . . . 2.916 1.853 3.979 . . . . . A . 17 HIS HA . . A . 17 HIS HB2 . A . 17 . HA . . . A . 17 . HB2 . . c30225_5ug3 1 246 1 . . 1 1 17 17 HIS HA H . . . 1 1 17 17 HIS HB3 H . . . . . 2.957 1.864 4.050 . . . . . A . 17 HIS HA . . A . 17 HIS HB3 . A . 17 . HA . . . A . 17 . HB1 . . c30225_5ug3 1 247 1 . . 1 1 17 17 HIS HB2 H . . . 1 1 17 17 HIS HB3 H . . . . . 2.014 1.507 2.521 . . . . . A . 17 HIS HB2 . . A . 17 HIS HB3 . A . 17 . HB2 . . . A . 17 . HB1 . . c30225_5ug3 1 248 1 . . 1 1 19 19 CYS H H . . . 1 1 19 19 CYS HA H . . . . . 3.084 1.895 4.273 . . . . . A . 19 CYS H . . A . 19 CYS HA . A . 19 . HN . . . A . 19 . HA . . c30225_5ug3 1 249 1 . . 1 1 19 19 CYS H H . . . 1 1 19 19 CYS HB2 H . . . . . 3.250 1.929 4.571 . . . . . A . 19 CYS H . . A . 19 CYS HB2 . A . 19 . HN . . . A . 19 . HB2 . . c30225_5ug3 1 250 1 . . 1 1 19 19 CYS H H . . . 1 1 19 19 CYS HB3 H . . . . . 2.888 1.845 3.931 . . . . . A . 19 CYS H . . A . 19 CYS HB3 . A . 19 . HN . . . A . 19 . HB1 . . c30225_5ug3 1 251 1 . . 1 1 19 19 CYS HB2 H . . . 1 1 19 19 CYS HB3 H . . . . . 2.088 1.543 2.633 . . . . . A . 19 CYS HB2 . . A . 19 CYS HB3 . A . 19 . HB2 . . . A . 19 . HB1 . . c30225_5ug3 1 252 1 . . 1 1 19 19 CYS H H . . . 1 1 19 19 CYS HB2 H . . . . . 3.045 1.886 4.204 . . . . . A . 19 CYS H . . A . 19 CYS HB2 . A . 19 . HN . . . A . 19 . HB2 . . c30225_5ug3 1 253 1 . . 1 1 19 19 CYS H H . . . 1 1 19 19 CYS HB3 H . . . . . 2.955 1.864 4.046 . . . . . A . 19 CYS H . . A . 19 CYS HB3 . A . 19 . HN . . . A . 19 . HB1 . . c30225_5ug3 1 254 1 . . 1 1 1 1 ILE HA H . . . 1 1 1 1 ILE HB H . . . . . 2.835 1.830 3.840 . . . . . A . 1 ILE HA . . A . 1 ILE HB . A . 1 . HA . . . A . 1 . HB . . c30225_5ug3 1 255 1 . . 1 1 1 1 ILE HA H . . . 1 1 1 1 ILE HG12 H . . . . . 3.949 2.000 5.898 . . . . . A . 1 ILE HA . . A . 1 ILE HG12 . A . 1 . HA . . . A . 1 . HG12 . . c30225_5ug3 1 256 1 . . 1 1 1 1 ILE HA H . . . 1 1 1 1 ILE HG13 H . . . . . 3.913 1.999 5.827 . . . . . A . 1 ILE HA . . A . 1 ILE HG13 . A . 1 . HA . . . A . 1 . HG11 . . c30225_5ug3 1 257 1 . . 1 1 1 1 ILE HB H . . . 1 1 1 1 ILE HG13 H . . . . . 3.586 1.978 5.194 . . . . . A . 1 ILE HB . . A . 1 ILE HG13 . A . 1 . HB . . . A . 1 . HG11 . . c30225_5ug3 1 258 1 . . 1 1 1 1 ILE HA H . . . 1 1 1 1 ILE MD H . . . . . 3.521 1.972 5.070 . . . . . A . 1 ILE HA . . A . 1 ILE MD . A . 1 . HA . . . A . 1 . HD1# . . c30225_5ug3 1 259 1 . . 1 1 1 1 ILE MG H . . . 1 1 1 1 ILE HB H . . . . . 3.093 1.897 4.289 . . . . . A . 1 ILE MG . . A . 1 ILE HB . A . 1 . HG2# . . . A . 1 . HB . . c30225_5ug3 1 260 1 . . 1 1 1 1 ILE HB H . . . 1 1 1 1 ILE MD H . . . . . 3.890 1.999 5.781 . . . . . A . 1 ILE HB . . A . 1 ILE MD . A . 1 . HB . . . A . 1 . HD1# . . c30225_5ug3 1 261 1 . . 1 1 1 1 ILE HG13 H . . . 1 1 1 1 ILE MD H . . . . . 4.627 1.951 7.303 . . . . . A . 1 ILE HG13 . . A . 1 ILE MD . A . 1 . HG11 . . . A . 1 . HD1# . . c30225_5ug3 1 262 1 . . 1 1 1 1 ILE HA H . . . 1 1 1 1 ILE HB H . . . . . 2.920 1.854 3.986 . . . . . A . 1 ILE HA . . A . 1 ILE HB . A . 1 . HA . . . A . 1 . HB . . c30225_5ug3 1 263 1 . . 1 1 1 1 ILE HA H . . . 1 1 1 1 ILE HG12 H . . . . . 3.981 2.000 5.962 . . . . . A . 1 ILE HA . . A . 1 ILE HG12 . A . 1 . HA . . . A . 1 . HG12 . . c30225_5ug3 1 264 1 . . 1 1 1 1 ILE HA H . . . 1 1 1 1 ILE HG13 H . . . . . 3.738 1.992 5.484 . . . . . A . 1 ILE HA . . A . 1 ILE HG13 . A . 1 . HA . . . A . 1 . HG11 . . c30225_5ug3 1 265 1 . . 1 1 1 1 ILE HA H . . . 1 1 1 1 ILE MG H . . . . . 2.626 1.764 3.488 . . . . . A . 1 ILE HA . . A . 1 ILE MG . A . 1 . HA . . . A . 1 . HG2# . . c30225_5ug3 1 266 1 . . 1 1 1 1 ILE HB H . . . 1 1 1 1 ILE HG12 H . . . . . 3.276 1.934 4.618 . . . . . A . 1 ILE HB . . A . 1 ILE HG12 . A . 1 . HB . . . A . 1 . HG12 . . c30225_5ug3 1 267 1 . . 1 1 1 1 ILE HB H . . . 1 1 1 1 ILE HG13 H . . . . . 3.444 1.962 4.926 . . . . . A . 1 ILE HB . . A . 1 ILE HG13 . A . 1 . HB . . . A . 1 . HG11 . . c30225_5ug3 1 268 1 . . 1 1 1 1 ILE MG H . . . 1 1 1 1 ILE HB H . . . . . 2.616 1.760 3.472 . . . . . A . 1 ILE MG . . A . 1 ILE HB . A . 1 . HG2# . . . A . 1 . HB . . c30225_5ug3 1 269 1 . . 1 1 1 1 ILE HB H . . . 1 1 1 1 ILE MD H . . . . . 3.102 1.899 4.305 . . . . . A . 1 ILE HB . . A . 1 ILE MD . A . 1 . HB . . . A . 1 . HD1# . . c30225_5ug3 1 270 1 . . 1 1 1 1 ILE HG12 H . . . 1 1 1 1 ILE HG13 H . . . . . 2.538 1.733 3.343 . . . . . A . 1 ILE HG12 . . A . 1 ILE HG13 . A . 1 . HG12 . . . A . 1 . HG11 . . c30225_5ug3 1 271 1 . . 1 1 1 1 ILE HG12 H . . . 1 1 1 1 ILE HG13 H . . . . . 2.565 1.742 3.388 . . . . . A . 1 ILE HG12 . . A . 1 ILE HG13 . A . 1 . HG12 . . . A . 1 . HG11 . . c30225_5ug3 1 272 1 . . 1 1 4 4 GLU H H . . . 1 1 5 5 CYS H H . . . . . 2.886 1.845 3.927 . . . . . A . 4 GLU H . . A . 5 CYS H . A . 4 . HN . . . A . 5 . HN . . c30225_5ug3 1 273 1 . . 1 1 4 4 GLU H H . . . 1 1 6 6 CYS H H . . . . . 4.568 1.960 7.176 . . . . . A . 4 GLU H . . A . 6 CYS H . A . 4 . HN . . . A . 6 . HN . . c30225_5ug3 1 274 1 . . 1 1 17 17 HIS H H . . . 1 1 19 19 CYS H H . . . . . 4.493 1.969 7.017 . . . . . A . 17 HIS H . . A . 19 CYS H . A . 17 . HN . . . A . 19 . HN . . c30225_5ug3 1 275 1 . . 1 1 18 18 VAL H H . . . 1 1 17 17 HIS H H . . . . . 2.832 1.829 3.835 . . . . . A . 18 VAL H . . A . 17 HIS H . A . 18 . HN . . . A . 17 . HN . . c30225_5ug3 1 276 1 . . 1 1 5 5 CYS H H . . . 1 1 6 6 CYS H H . . . . . 2.850 1.834 3.866 . . . . . A . 5 CYS H . . A . 6 CYS H . A . 5 . HN . . . A . 6 . HN . . c30225_5ug3 1 277 1 . . 1 1 5 5 CYS H H . . . 1 1 7 7 SER H H . . . . . 4.102 1.999 6.205 . . . . . A . 5 CYS H . . A . 7 SER H . A . 5 . HN . . . A . 7 . HN . . c30225_5ug3 1 278 1 . . 1 1 3 3 ASP H H . . . 1 1 4 4 GLU H H . . . . . 2.938 1.859 4.017 . . . . . A . 3 ASP H . . A . 4 GLU H . A . 3 . HN . . . A . 4 . HN . . c30225_5ug3 1 279 1 . . 1 1 8 8 ASN H H . . . 1 1 12 12 ARG H H . . . . . 4.082 1.999 6.165 . . . . . A . 8 ASN H . . A . 12 ARG H . A . 8 . HN . . . A . 12 . HN . . c30225_5ug3 1 280 1 . . 1 1 11 11 CYS H H . . . 1 1 12 12 ARG H H . . . . . 2.696 1.787 3.605 . . . . . A . 11 CYS H . . A . 12 ARG H . A . 11 . HN . . . A . 12 . HN . . c30225_5ug3 1 281 1 . . 1 1 12 12 ARG H H . . . 1 1 10 10 VAL H H . . . . . 3.731 1.991 5.471 . . . . . A . 12 ARG H . . A . 10 VAL H . A . 12 . HN . . . A . 10 . HN . . c30225_5ug3 1 282 1 . . 1 1 12 12 ARG H H . . . 1 1 13 13 VAL H H . . . . . 2.845 1.833 3.857 . . . . . A . 12 ARG H . . A . 13 VAL H . A . 12 . HN . . . A . 13 . HN . . c30225_5ug3 1 283 1 . . 1 1 6 6 CYS H H . . . 1 1 7 7 SER H H . . . . . 2.824 1.827 3.821 . . . . . A . 6 CYS H . . A . 7 SER H . A . 6 . HN . . . A . 7 . HN . . c30225_5ug3 1 284 1 . . 1 1 7 7 SER H H . . . 1 1 8 8 ASN H H . . . . . 2.671 1.779 3.563 . . . . . A . 7 SER H . . A . 8 ASN H . A . 7 . HN . . . A . 8 . HN . . c30225_5ug3 1 285 1 . . 1 1 18 18 VAL H H . . . 1 1 19 19 CYS H H . . . . . 2.714 1.793 3.635 . . . . . A . 18 VAL H . . A . 19 CYS H . A . 18 . HN . . . A . 19 . HN . . c30225_5ug3 1 286 1 . . 1 1 11 11 CYS H H . . . 1 1 10 10 VAL H H . . . . . 2.515 1.725 3.305 . . . . . A . 11 CYS H . . A . 10 VAL H . A . 11 . HN . . . A . 10 . HN . . c30225_5ug3 1 287 1 . . 1 1 5 5 CYS H H . . . 1 1 6 6 CYS H H . . . . . 2.818 1.825 3.811 . . . . . A . 5 CYS H . . A . 6 CYS H . A . 5 . HN . . . A . 6 . HN . . c30225_5ug3 1 288 1 . . 1 1 4 4 GLU H H . . . 1 1 6 6 CYS H H . . . . . 3.999 2.000 5.998 . . . . . A . 4 GLU H . . A . 6 CYS H . A . 4 . HN . . . A . 6 . HN . . c30225_5ug3 1 289 1 . . 1 1 6 6 CYS H H . . . 1 1 7 7 SER H H . . . . . 2.841 1.832 3.850 . . . . . A . 6 CYS H . . A . 7 SER H . A . 6 . HN . . . A . 7 . HN . . c30225_5ug3 1 290 1 . . 1 1 7 7 SER H H . . . 1 1 8 8 ASN H H . . . . . 2.576 1.747 3.405 . . . . . A . 7 SER H . . A . 8 ASN H . A . 7 . HN . . . A . 8 . HN . . c30225_5ug3 1 291 1 . . 1 1 5 5 CYS H H . . . 1 1 7 7 SER H H . . . . . 3.810 1.996 5.624 . . . . . A . 5 CYS H . . A . 7 SER H . A . 5 . HN . . . A . 7 . HN . . c30225_5ug3 1 292 1 . . 1 1 8 8 ASN H H . . . 1 1 12 12 ARG H H . . . . . 3.672 1.987 5.357 . . . . . A . 8 ASN H . . A . 12 ARG H . A . 8 . HN . . . A . 12 . HN . . c30225_5ug3 1 293 1 . . 1 1 18 18 VAL H H . . . 1 1 19 19 CYS H H . . . . . 2.691 1.786 3.596 . . . . . A . 18 VAL H . . A . 19 CYS H . A . 18 . HN . . . A . 19 . HN . . c30225_5ug3 1 294 1 . . 1 1 6 6 CYS H H . . . 1 1 8 8 ASN H H . . . . . 3.676 1.987 5.365 . . . . . A . 6 CYS H . . A . 8 ASN H . A . 6 . HN . . . A . 8 . HN . . c30225_5ug3 1 295 1 . . 1 1 11 11 CYS H H . . . 1 1 10 10 VAL H H . . . . . 2.580 1.748 3.412 . . . . . A . 11 CYS H . . A . 10 VAL H . A . 11 . HN . . . A . 10 . HN . . c30225_5ug3 1 296 1 . . 1 1 4 4 GLU H H . . . 1 1 5 5 CYS H H . . . . . 2.785 1.815 3.755 . . . . . A . 4 GLU H . . A . 5 CYS H . A . 4 . HN . . . A . 5 . HN . . c30225_5ug3 1 297 1 . . 1 1 8 8 ASN HA H . . . 1 1 10 10 VAL H H . . . . . 3.664 1.986 5.342 . . . . . A . 8 ASN HA . . A . 10 VAL H . A . 8 . HA . . . A . 10 . HN . . c30225_5ug3 1 298 1 . . 1 1 8 8 ASN HA H . . . 1 1 9 9 PRO HD2 H . . . . . 2.372 1.668 3.076 . . . . . A . 8 ASN HA . . A . 9 PRO HD2 . A . 8 . HA . . . A . 9 . HD2 . . c30225_5ug3 1 299 1 . . 1 1 9 9 PRO HA H . . . 1 1 9 9 PRO HD2 H . . . . . 3.521 1.971 5.071 . . . . . A . 9 PRO HA . . A . 9 PRO HD2 . A . 9 . HA . . . A . 9 . HD2 . . c30225_5ug3 1 300 1 . . 1 1 9 9 PRO HA H . . . 1 1 9 9 PRO HB3 H . . . . . 2.470 1.707 3.233 . . . . . A . 9 PRO HA . . A . 9 PRO HB3 . A . 9 . HA . . . A . 9 . HB1 . . c30225_5ug3 1 301 1 OR . 1 1 11 11 CYS HB2 H . . . 1 1 12 12 ARG HG2 H . . . . . 2.587 1.750 3.424 . . . . . A . 11 CYS HB2 . . A . 12 ARG HG2 . A . 11 . HB2 . . . A . 12 . HG2 . . c30225_5ug3 1 301 2 OR . 1 1 12 12 ARG HG2 H . . . 1 1 9 9 PRO HA H . . . . . 2.587 1.750 3.424 . . . . . A . 12 ARG HG2 . . A . 9 PRO HA . A . 12 . HG2 . . . A . 9 . HA . . c30225_5ug3 1 302 1 . . 1 1 9 9 PRO HA H . . . 1 1 9 9 PRO HG2 H . . . . . 3.445 1.961 4.929 . . . . . A . 9 PRO HA . . A . 9 PRO HG2 . A . 9 . HA . . . A . 9 . HG2 . . c30225_5ug3 1 303 1 . . 1 1 9 9 PRO HA H . . . 1 1 9 9 PRO HD3 H . . . . . 3.369 1.950 4.788 . . . . . A . 9 PRO HA . . A . 9 PRO HD3 . A . 9 . HA . . . A . 9 . HD1 . . c30225_5ug3 1 304 1 . . 1 1 9 9 PRO HD2 H . . . 1 1 9 9 PRO HD3 H . . . . . 2.027 1.513 2.541 . . . . . A . 9 PRO HD2 . . A . 9 PRO HD3 . A . 9 . HD2 . . . A . 9 . HD1 . . c30225_5ug3 1 305 1 . . 1 1 9 9 PRO HD2 H . . . 1 1 9 9 PRO HB3 H . . . . . 3.459 1.963 4.955 . . . . . A . 9 PRO HD2 . . A . 9 PRO HB3 . A . 9 . HD2 . . . A . 9 . HB1 . . c30225_5ug3 1 306 1 . . 1 1 9 9 PRO HD2 H . . . 1 1 9 9 PRO HG2 H . . . . . 2.894 1.847 3.941 . . . . . A . 9 PRO HD2 . . A . 9 PRO HG2 . A . 9 . HD2 . . . A . 9 . HG2 . . c30225_5ug3 1 307 1 . . 1 1 9 9 PRO HA H . . . 1 1 9 9 PRO HB2 H . . . . . 2.787 1.816 3.758 . . . . . A . 9 PRO HA . . A . 9 PRO HB2 . A . 9 . HA . . . A . 9 . HB2 . . c30225_5ug3 1 308 1 . . 1 1 9 9 PRO HB2 H . . . 1 1 9 9 PRO HD2 H . . . . . 2.771 1.811 3.731 . . . . . A . 9 PRO HB2 . . A . 9 PRO HD2 . A . 9 . HB2 . . . A . 9 . HD2 . . c30225_5ug3 1 309 1 . . 1 1 9 9 PRO HB3 H . . . 1 1 9 9 PRO HD3 H . . . . . 3.576 1.977 5.175 . . . . . A . 9 PRO HB3 . . A . 9 PRO HD3 . A . 9 . HB1 . . . A . 9 . HD1 . . c30225_5ug3 1 310 1 . . 1 1 9 9 PRO HG2 H . . . 1 1 9 9 PRO HD3 H . . . . . 2.716 1.794 3.638 . . . . . A . 9 PRO HG2 . . A . 9 PRO HD3 . A . 9 . HG2 . . . A . 9 . HD1 . . c30225_5ug3 1 311 1 . . 1 1 9 9 PRO HB2 H . . . 1 1 9 9 PRO HD3 H . . . . . 2.706 1.791 3.621 . . . . . A . 9 PRO HB2 . . A . 9 PRO HD3 . A . 9 . HB2 . . . A . 9 . HD1 . . c30225_5ug3 1 312 1 . . 1 1 9 9 PRO HB3 H . . . 1 1 9 9 PRO HG2 H . . . . . 2.974 1.868 4.080 . . . . . A . 9 PRO HB3 . . A . 9 PRO HG2 . A . 9 . HB1 . . . A . 9 . HG2 . . c30225_5ug3 1 313 1 . . 1 1 9 9 PRO HB2 H . . . 1 1 9 9 PRO HB3 H . . . . . 2.394 1.678 3.110 . . . . . A . 9 PRO HB2 . . A . 9 PRO HB3 . A . 9 . HB2 . . . A . 9 . HB1 . . c30225_5ug3 1 314 1 . . 1 1 9 9 PRO HB2 H . . . 1 1 9 9 PRO HG2 H . . . . . 2.154 1.574 2.734 . . . . . A . 9 PRO HB2 . . A . 9 PRO HG2 . A . 9 . HB2 . . . A . 9 . HG2 . . c30225_5ug3 1 315 1 . . 1 1 11 11 CYS HB2 H . . . 1 1 11 11 CYS HB3 H . . . . . 2.244 1.615 2.873 . . . . . A . 11 CYS HB2 . . A . 11 CYS HB3 . A . 11 . HB2 . . . A . 11 . HB1 . . c30225_5ug3 1 316 1 . . 1 1 9 9 PRO HA H . . . 1 1 9 9 PRO HB3 H . . . . . 2.534 1.731 3.337 . . . . . A . 9 PRO HA . . A . 9 PRO HB3 . A . 9 . HA . . . A . 9 . HB1 . . c30225_5ug3 1 317 1 . . 1 1 9 9 PRO HA H . . . 1 1 9 9 PRO HG2 H . . . . . 3.391 1.953 4.829 . . . . . A . 9 PRO HA . . A . 9 PRO HG2 . A . 9 . HA . . . A . 9 . HG2 . . c30225_5ug3 1 318 1 . . 1 1 9 9 PRO HA H . . . 1 1 9 9 PRO HB2 H . . . . . 3.006 1.876 4.136 . . . . . A . 9 PRO HA . . A . 9 PRO HB2 . A . 9 . HA . . . A . 9 . HB2 . . c30225_5ug3 1 319 1 . . 1 1 9 9 PRO HB2 H . . . 1 1 9 9 PRO HD2 H . . . . . 2.916 1.853 3.979 . . . . . A . 9 PRO HB2 . . A . 9 PRO HD2 . A . 9 . HB2 . . . A . 9 . HD2 . . c30225_5ug3 1 320 1 . . 1 1 9 9 PRO HD2 H . . . 1 1 9 9 PRO HG2 H . . . . . 2.891 1.847 3.935 . . . . . A . 9 PRO HD2 . . A . 9 PRO HG2 . A . 9 . HD2 . . . A . 9 . HG2 . . c30225_5ug3 1 321 1 . . 1 1 9 9 PRO HD2 H . . . 1 1 9 9 PRO HB3 H . . . . . 3.765 1.993 5.537 . . . . . A . 9 PRO HD2 . . A . 9 PRO HB3 . A . 9 . HD2 . . . A . 9 . HB1 . . c30225_5ug3 1 322 1 . . 1 1 9 9 PRO HD2 H . . . 1 1 9 9 PRO HD3 H . . . . . 1.848 1.421 2.275 . . . . . A . 9 PRO HD2 . . A . 9 PRO HD3 . A . 9 . HD2 . . . A . 9 . HD1 . . c30225_5ug3 1 323 1 . . 1 1 9 9 PRO HB3 H . . . 1 1 9 9 PRO HD3 H . . . . . 3.653 1.985 5.321 . . . . . A . 9 PRO HB3 . . A . 9 PRO HD3 . A . 9 . HB1 . . . A . 9 . HD1 . . c30225_5ug3 1 324 1 . . 1 1 9 9 PRO HG2 H . . . 1 1 9 9 PRO HD3 H . . . . . 2.733 1.799 3.667 . . . . . A . 9 PRO HG2 . . A . 9 PRO HD3 . A . 9 . HG2 . . . A . 9 . HD1 . . c30225_5ug3 1 325 1 . . 1 1 9 9 PRO HB2 H . . . 1 1 9 9 PRO HD3 H . . . . . 2.942 1.860 4.024 . . . . . A . 9 PRO HB2 . . A . 9 PRO HD3 . A . 9 . HB2 . . . A . 9 . HD1 . . c30225_5ug3 1 326 1 . . 1 1 9 9 PRO HB3 H . . . 1 1 9 9 PRO HG2 H . . . . . 2.705 1.790 3.620 . . . . . A . 9 PRO HB3 . . A . 9 PRO HG2 . A . 9 . HB1 . . . A . 9 . HG2 . . c30225_5ug3 1 327 1 . . 1 1 9 9 PRO HB2 H . . . 1 1 9 9 PRO HB3 H . . . . . 2.592 1.752 3.432 . . . . . A . 9 PRO HB2 . . A . 9 PRO HB3 . A . 9 . HB2 . . . A . 9 . HB1 . . c30225_5ug3 1 328 1 . . 1 1 9 9 PRO HB2 H . . . 1 1 9 9 PRO HG2 H . . . . . 2.091 1.544 2.638 . . . . . A . 9 PRO HB2 . . A . 9 PRO HG2 . A . 9 . HB2 . . . A . 9 . HG2 . . c30225_5ug3 1 329 1 . . 1 1 16 16 HYP HA H . . . 1 1 16 16 HYP HD22 H . . . . . 3.848 1.997 5.699 . . . . . A . 16 HYP HA . . A . 16 HYP HD22 . A . 16 . HA . . . A . 16 . HD22 . . c30225_5ug3 1 330 1 . . 1 1 16 16 HYP HA H . . . 1 1 16 16 HYP HB2 H . . . . . 2.320 1.647 2.993 . . . . . A . 16 HYP HA . . A . 16 HYP HB2 . A . 16 . HA . . . A . 16 . HB2 . . c30225_5ug3 1 331 1 . . 1 1 16 16 HYP HA H . . . 1 1 16 16 HYP HB3 H . . . . . 2.611 1.759 3.463 . . . . . A . 16 HYP HA . . A . 16 HYP HB3 . A . 16 . HA . . . A . 16 . HB3 . . c30225_5ug3 1 332 1 . . 1 1 16 16 HYP HG H . . . 1 1 16 16 HYP HD1 H . . . . . 2.688 1.785 3.591 . . . . . A . 16 HYP HG . . A . 16 HYP HD1 . A . 16 . HG . . . A . 16 . HD1 . . c30225_5ug3 1 333 1 . . 1 1 16 16 HYP HD22 H . . . 1 1 16 16 HYP HG H . . . . . 2.840 1.832 3.848 . . . . . A . 16 HYP HD22 . . A . 16 HYP HG . A . 16 . HD22 . . . A . 16 . HG . . c30225_5ug3 1 334 1 . . 1 1 16 16 HYP HB2 H . . . 1 1 16 16 HYP HG H . . . . . 2.884 1.844 3.924 . . . . . A . 16 HYP HB2 . . A . 16 HYP HG . A . 16 . HB2 . . . A . 16 . HG . . c30225_5ug3 1 335 1 . . 1 1 16 16 HYP HB3 H . . . 1 1 16 16 HYP HG H . . . . . 2.632 1.766 3.498 . . . . . A . 16 HYP HB3 . . A . 16 HYP HG . A . 16 . HB3 . . . A . 16 . HG . . c30225_5ug3 1 336 1 . . 1 1 16 16 HYP HD22 H . . . 1 1 16 16 HYP HD1 H . . . . . 2.059 1.529 2.589 . . . . . A . 16 HYP HD22 . . A . 16 HYP HD1 . A . 16 . HD22 . . . A . 16 . HD1 . . c30225_5ug3 1 337 1 . . 1 1 16 16 HYP HB2 H . . . 1 1 16 16 HYP HD1 H . . . . . 3.593 1.979 5.207 . . . . . A . 16 HYP HB2 . . A . 16 HYP HD1 . A . 16 . HB2 . . . A . 16 . HD1 . . c30225_5ug3 1 338 1 . . 1 1 16 16 HYP HB3 H . . . 1 1 16 16 HYP HD1 H . . . . . 3.210 1.922 4.498 . . . . . A . 16 HYP HB3 . . A . 16 HYP HD1 . A . 16 . HB3 . . . A . 16 . HD1 . . c30225_5ug3 1 339 1 . . 1 1 16 16 HYP HD22 H . . . 1 1 16 16 HYP HB2 H . . . . . 3.404 1.956 4.852 . . . . . A . 16 HYP HD22 . . A . 16 HYP HB2 . A . 16 . HD22 . . . A . 16 . HB2 . . c30225_5ug3 1 340 1 . . 1 1 16 16 HYP HD22 H . . . 1 1 16 16 HYP HB3 H . . . . . 3.485 1.967 5.003 . . . . . A . 16 HYP HD22 . . A . 16 HYP HB3 . A . 16 . HD22 . . . A . 16 . HB3 . . c30225_5ug3 1 341 1 . . 1 1 16 16 HYP HB2 H . . . 1 1 16 16 HYP HB3 H . . . . . 2.131 1.563 2.699 . . . . . A . 16 HYP HB2 . . A . 16 HYP HB3 . A . 16 . HB2 . . . A . 16 . HB3 . . c30225_5ug3 1 342 1 . . 1 1 16 16 HYP HB2 H . . . 1 1 16 16 HYP HB3 H . . . . . 2.137 1.566 2.708 . . . . . A . 16 HYP HB2 . . A . 16 HYP HB3 . A . 16 . HB2 . . . A . 16 . HB3 . . c30225_5ug3 1 343 1 . . 1 1 16 16 HYP HD22 H . . . 1 1 16 16 HYP HB3 H . . . . . 3.669 1.986 5.352 . . . . . A . 16 HYP HD22 . . A . 16 HYP HB3 . A . 16 . HD22 . . . A . 16 . HB3 . . c30225_5ug3 1 344 1 . . 1 1 16 16 HYP HD22 H . . . 1 1 16 16 HYP HB2 H . . . . . 3.380 1.952 4.808 . . . . . A . 16 HYP HD22 . . A . 16 HYP HB2 . A . 16 . HD22 . . . A . 16 . HB2 . . c30225_5ug3 1 345 1 . . 1 1 16 16 HYP HB3 H . . . 1 1 16 16 HYP HD1 H . . . . . 3.277 1.935 4.619 . . . . . A . 16 HYP HB3 . . A . 16 HYP HD1 . A . 16 . HB3 . . . A . 16 . HD1 . . c30225_5ug3 1 346 1 . . 1 1 16 16 HYP HB2 H . . . 1 1 16 16 HYP HD1 H . . . . . 3.590 1.979 5.201 . . . . . A . 16 HYP HB2 . . A . 16 HYP HD1 . A . 16 . HB2 . . . A . 16 . HD1 . . c30225_5ug3 1 347 1 . . 1 1 16 16 HYP HD22 H . . . 1 1 16 16 HYP HD1 H . . . . . 2.146 1.570 2.722 . . . . . A . 16 HYP HD22 . . A . 16 HYP HD1 . A . 16 . HD22 . . . A . 16 . HD1 . . c30225_5ug3 1 348 1 . . 1 1 16 16 HYP HG H . . . 1 1 16 16 HYP HD1 H . . . . . 2.935 1.858 4.012 . . . . . A . 16 HYP HG . . A . 16 HYP HD1 . A . 16 . HG . . . A . 16 . HD1 . . c30225_5ug3 1 349 1 . . 1 1 16 16 HYP HD22 H . . . 1 1 16 16 HYP HG H . . . . . 3.401 1.955 4.847 . . . . . A . 16 HYP HD22 . . A . 16 HYP HG . A . 16 . HD22 . . . A . 16 . HG . . c30225_5ug3 1 350 1 . . 1 1 16 16 HYP HB2 H . . . 1 1 16 16 HYP HG H . . . . . 3.121 1.903 4.339 . . . . . A . 16 HYP HB2 . . A . 16 HYP HG . A . 16 . HB2 . . . A . 16 . HG . . c30225_5ug3 1 351 1 . . 1 1 16 16 HYP HB3 H . . . 1 1 16 16 HYP HG H . . . . . 2.815 1.825 3.805 . . . . . A . 16 HYP HB3 . . A . 16 HYP HG . A . 16 . HB3 . . . A . 16 . HG . . c30225_5ug3 1 352 1 . . 1 1 3 3 ASP HA H . . . 1 1 4 4 GLU H H . . . . . 2.355 1.662 3.048 . . . . . A . 3 ASP HA . . A . 4 GLU H . A . 3 . HA . . . A . 4 . HN . . c30225_5ug3 1 353 1 . . 1 1 2 2 ARG HA H . . . 1 1 4 4 GLU H H . . . . . 4.324 1.987 6.661 . . . . . A . 2 ARG HA . . A . 4 GLU H . A . 2 . HA . . . A . 4 . HN . . c30225_5ug3 1 354 1 . . 1 1 17 17 HIS H H . . . 1 1 16 16 HYP HA H . . . . . 2.605 1.757 3.453 . . . . . A . 17 HIS H . . A . 16 HYP HA . A . 17 . HN . . . A . 16 . HA . . c30225_5ug3 1 355 1 . . 1 1 3 3 ASP HA H . . . 1 1 5 5 CYS H H . . . . . 3.443 1.962 4.924 . . . . . A . 3 ASP HA . . A . 5 CYS H . A . 3 . HA . . . A . 5 . HN . . c30225_5ug3 1 356 1 . . 1 1 3 3 ASP HA H . . . 1 1 6 6 CYS H H . . . . . 3.812 1.996 5.628 . . . . . A . 3 ASP HA . . A . 6 CYS H . A . 3 . HA . . . A . 6 . HN . . c30225_5ug3 1 357 1 . . 1 1 4 4 GLU HA H . . . 1 1 5 5 CYS H H . . . . . 2.725 1.797 3.653 . . . . . A . 4 GLU HA . . A . 5 CYS H . A . 4 . HA . . . A . 5 . HN . . c30225_5ug3 1 358 1 . . 1 1 11 11 CYS HB2 H . . . 1 1 12 12 ARG H H . . . . . 2.871 1.841 3.901 . . . . . A . 11 CYS HB2 . . A . 12 ARG H . A . 11 . HB2 . . . A . 12 . HN . . c30225_5ug3 1 359 1 . . 1 1 11 11 CYS HA H . . . 1 1 12 12 ARG H H . . . . . 3.052 1.888 4.216 . . . . . A . 11 CYS HA . . A . 12 ARG H . A . 11 . HA . . . A . 12 . HN . . c30225_5ug3 1 360 1 . . 1 1 18 18 VAL HA H . . . 1 1 19 19 CYS H H . . . . . 2.878 1.843 3.913 . . . . . A . 18 VAL HA . . A . 19 CYS H . A . 18 . HA . . . A . 19 . HN . . c30225_5ug3 1 361 1 . . 1 1 7 7 SER HA H . . . 1 1 8 8 ASN H H . . . . . 3.318 1.942 4.694 . . . . . A . 7 SER HA . . A . 8 ASN H . A . 7 . HA . . . A . 8 . HN . . c30225_5ug3 1 362 1 . . 1 1 7 7 SER HB2 H . . . 1 1 8 8 ASN H H . . . . . 3.521 1.971 5.071 . . . . . A . 7 SER HB2 . . A . 8 ASN H . A . 7 . HB2 . . . A . 8 . HN . . c30225_5ug3 1 363 1 . . 1 1 7 7 SER HB3 H . . . 1 1 8 8 ASN H H . . . . . 3.490 1.967 5.013 . . . . . A . 7 SER HB3 . . A . 8 ASN H . A . 7 . HB1 . . . A . 8 . HN . . c30225_5ug3 1 364 1 . . 1 1 2 2 ARG H H . . . 1 1 1 1 ILE HA H . . . . . 2.389 1.676 3.102 . . . . . A . 2 ARG H . . A . 1 ILE HA . A . 2 . HN . . . A . 1 . HA . . c30225_5ug3 1 365 1 . . 1 1 12 12 ARG HG2 H . . . 1 1 13 13 VAL H H . . . . . 3.149 1.909 4.389 . . . . . A . 12 ARG HG2 . . A . 13 VAL H . A . 12 . HG2 . . . A . 13 . HN . . c30225_5ug3 1 366 1 . . 1 1 12 12 ARG HG3 H . . . 1 1 13 13 VAL H H . . . . . 2.954 1.863 4.045 . . . . . A . 12 ARG HG3 . . A . 13 VAL H . A . 12 . HG1 . . . A . 13 . HN . . c30225_5ug3 1 367 1 . . 1 1 12 12 ARG HB2 H . . . 1 1 12 12 ARG HE H . . . . . 3.620 1.982 5.258 . . . . . A . 12 ARG HB2 . . A . 12 ARG HE . A . 12 . HB2 . . . A . 12 . HE . . c30225_5ug3 1 368 1 . . 1 1 12 12 ARG HB3 H . . . 1 1 13 13 VAL H H . . . . . 3.510 1.970 5.050 . . . . . A . 12 ARG HB3 . . A . 13 VAL H . A . 12 . HB1 . . . A . 13 . HN . . c30225_5ug3 1 369 1 . . 1 1 11 11 CYS H H . . . 1 1 10 10 VAL HB H . . . . . 2.634 1.767 3.501 . . . . . A . 11 CYS H . . A . 10 VAL HB . A . 11 . HN . . . A . 10 . HB . . c30225_5ug3 1 370 1 . . 1 1 10 10 VAL H H . . . 1 1 9 9 PRO HG2 H . . . . . 3.202 1.920 4.484 . . . . . A . 10 VAL H . . A . 9 PRO HG2 . A . 10 . HN . . . A . 9 . HG2 . . c30225_5ug3 1 371 1 . . 1 1 18 18 VAL HB H . . . 1 1 19 19 CYS H H . . . . . 3.213 1.923 4.503 . . . . . A . 18 VAL HB . . A . 19 CYS H . A . 18 . HB . . . A . 19 . HN . . c30225_5ug3 1 372 1 . . 1 1 17 17 HIS H H . . . 1 1 16 16 HYP HB2 H . . . . . 3.297 1.938 4.656 . . . . . A . 17 HIS H . . A . 16 HYP HB2 . A . 17 . HN . . . A . 16 . HB2 . . c30225_5ug3 1 373 1 . . 1 1 2 2 ARG H H . . . 1 1 1 1 ILE HB H . . . . . 3.058 1.889 4.227 . . . . . A . 2 ARG H . . A . 1 ILE HB . A . 2 . HN . . . A . 1 . HB . . c30225_5ug3 1 374 1 . . 1 1 17 17 HIS H H . . . 1 1 16 16 HYP HB3 H . . . . . 3.345 1.947 4.743 . . . . . A . 17 HIS H . . A . 16 HYP HB3 . A . 17 . HN . . . A . 16 . HB3 . . c30225_5ug3 1 375 1 . . 1 1 18 18 VAL MG1 H . . . 1 1 19 19 CYS H H . . . . . 3.202 1.920 4.484 . . . . . A . 18 VAL MG1 . . A . 19 CYS H . A . 18 . HG1# . . . A . 19 . HN . . c30225_5ug3 1 376 1 . . 1 1 18 18 VAL MG1 H . . . 1 1 15 15 ASN HD21 H . . . . . 3.708 1.989 5.427 . . . . . A . 18 VAL MG1 . . A . 15 ASN HD21 . A . 18 . HG1# . . . A . 15 . HD21 . . c30225_5ug3 1 377 1 . . 1 1 17 17 HIS H H . . . 1 1 19 19 CYS H H . . . . . 4.138 1.998 6.278 . . . . . A . 17 HIS H . . A . 19 CYS H . A . 17 . HN . . . A . 19 . HN . . c30225_5ug3 1 378 1 . . 1 1 18 18 VAL H H . . . 1 1 17 17 HIS H H . . . . . 2.854 1.836 3.872 . . . . . A . 18 VAL H . . A . 17 HIS H . A . 18 . HN . . . A . 17 . HN . . c30225_5ug3 1 379 1 . . 1 1 11 11 CYS H H . . . 1 1 12 12 ARG H H . . . . . 2.682 1.783 3.581 . . . . . A . 11 CYS H . . A . 12 ARG H . A . 11 . HN . . . A . 12 . HN . . c30225_5ug3 1 380 1 . . 1 1 12 12 ARG H H . . . 1 1 10 10 VAL H H . . . . . 3.890 1.999 5.781 . . . . . A . 12 ARG H . . A . 10 VAL H . A . 12 . HN . . . A . 10 . HN . . c30225_5ug3 1 381 1 . . 1 1 12 12 ARG H H . . . 1 1 13 13 VAL H H . . . . . 2.938 1.859 4.017 . . . . . A . 12 ARG H . . A . 13 VAL H . A . 12 . HN . . . A . 13 . HN . . c30225_5ug3 1 382 1 . . 1 1 15 15 ASN HA H . . . 1 1 17 17 HIS H H . . . . . 4.004 2.000 6.008 . . . . . A . 15 ASN HA . . A . 17 HIS H . A . 15 . HA . . . A . 17 . HN . . c30225_5ug3 1 383 1 . . 1 1 10 10 VAL H H . . . 1 1 9 9 PRO HD3 H . . . . . 3.130 1.905 4.355 . . . . . A . 10 VAL H . . A . 9 PRO HD3 . A . 10 . HN . . . A . 9 . HD1 . . c30225_5ug3 1 384 1 . . 1 1 10 10 VAL H H . . . 1 1 9 9 PRO HD2 H . . . . . 3.906 1.999 5.813 . . . . . A . 10 VAL H . . A . 9 PRO HD2 . A . 10 . HN . . . A . 9 . HD2 . . c30225_5ug3 1 385 1 . . 1 1 11 11 CYS HB2 H . . . 1 1 10 10 VAL H H . . . . . 3.481 1.967 4.995 . . . . . A . 11 CYS HB2 . . A . 10 VAL H . A . 11 . HB2 . . . A . 10 . HN . . c30225_5ug3 1 386 1 . . 1 1 5 5 CYS HA H . . . 1 1 8 8 ASN HB2 H . . . . . 3.383 1.953 4.813 . . . . . A . 5 CYS HA . . A . 8 ASN HB2 . A . 5 . HA . . . A . 8 . HB2 . . c30225_5ug3 1 387 1 . . 1 1 12 12 ARG HG3 H . . . 1 1 9 9 PRO HA H . . . . . 2.947 1.861 4.033 . . . . . A . 12 ARG HG3 . . A . 9 PRO HA . A . 12 . HG1 . . . A . 9 . HA . . c30225_5ug3 1 388 1 . . 1 1 12 12 ARG HB2 H . . . 1 1 9 9 PRO HA H . . . . . 3.543 1.974 5.112 . . . . . A . 12 ARG HB2 . . A . 9 PRO HA . A . 12 . HB2 . . . A . 9 . HA . . c30225_5ug3 1 389 1 . . 1 1 12 12 ARG HB3 H . . . 1 1 9 9 PRO HA H . . . . . 3.524 1.971 5.077 . . . . . A . 12 ARG HB3 . . A . 9 PRO HA . A . 12 . HB1 . . . A . 9 . HA . . c30225_5ug3 1 390 1 . . 1 1 13 13 VAL HB H . . . 1 1 10 10 VAL HA H . . . . . 3.334 1.944 4.724 . . . . . A . 13 VAL HB . . A . 10 VAL HA . A . 13 . HB . . . A . 10 . HA . . c30225_5ug3 1 391 1 . . 1 1 15 15 ASN HB3 H . . . 1 1 16 16 HYP HD22 H . . . . . 3.653 1.985 5.321 . . . . . A . 15 ASN HB3 . . A . 16 HYP HD22 . A . 15 . HB1 . . . A . 16 . HD22 . . c30225_5ug3 1 392 1 . . 1 1 15 15 ASN HB3 H . . . 1 1 16 16 HYP HD1 H . . . . . 3.546 1.974 5.118 . . . . . A . 15 ASN HB3 . . A . 16 HYP HD1 . A . 15 . HB1 . . . A . 16 . HD1 . . c30225_5ug3 1 393 1 . . 1 1 12 12 ARG HA H . . . 1 1 15 15 ASN HB3 H . . . . . 3.423 1.958 4.888 . . . . . A . 12 ARG HA . . A . 15 ASN HB3 . A . 12 . HA . . . A . 15 . HB1 . . c30225_5ug3 1 394 1 . . 1 1 6 6 CYS HA H . . . 1 1 12 12 ARG HG2 H . . . . . 2.961 1.865 4.057 . . . . . A . 6 CYS HA . . A . 12 ARG HG2 . A . 6 . HA . . . A . 12 . HG2 . . c30225_5ug3 1 395 1 . . 1 1 18 18 VAL HB H . . . 1 1 15 15 ASN HB3 H . . . . . 2.979 1.870 4.088 . . . . . A . 18 VAL HB . . A . 15 ASN HB3 . A . 18 . HB . . . A . 15 . HB1 . . c30225_5ug3 1 396 1 . . 1 1 18 18 VAL HB H . . . 1 1 15 15 ASN HB3 H . . . . . 3.293 1.937 4.649 . . . . . A . 18 VAL HB . . A . 15 ASN HB3 . A . 18 . HB . . . A . 15 . HB1 . . c30225_5ug3 1 397 1 . . 1 1 1 1 ILE HB H . . . 1 1 1 1 ILE HG12 H . . . . . 3.368 1.950 4.786 . . . . . A . 1 ILE HB . . A . 1 ILE HG12 . A . 1 . HB . . . A . 1 . HG12 . . c30225_5ug3 1 398 1 . . 1 1 6 6 CYS HA H . . . 1 1 12 12 ARG HA H . . . . . 3.784 1.994 5.574 . . . . . A . 6 CYS HA . . A . 12 ARG HA . A . 6 . HA . . . A . 12 . HA . . c30225_5ug3 1 399 1 . . 1 1 8 8 ASN HB2 H . . . 1 1 11 11 CYS H H . . . . . 3.134 1.906 4.362 . . . . . A . 8 ASN HB2 . . A . 11 CYS H . A . 8 . HB2 . . . A . 11 . HN . . c30225_5ug3 1 400 1 . . 1 1 7 7 SER H H . . . 1 1 12 12 ARG HD2 H . . . . . 3.553 1.975 5.131 . . . . . A . 7 SER H . . A . 12 ARG HD2 . A . 7 . HN . . . A . 12 . HD2 . . c30225_5ug3 1 401 1 . . 1 1 11 11 CYS H H . . . 1 1 10 10 VAL HA H . . . . . 3.276 1.934 4.618 . . . . . A . 11 CYS H . . A . 10 VAL HA . A . 11 . HN . . . A . 10 . HA . . c30225_5ug3 1 402 1 . . 1 1 13 13 VAL H H . . . 1 1 10 10 VAL HA H . . . . . 3.715 1.989 5.441 . . . . . A . 13 VAL H . . A . 10 VAL HA . A . 13 . HN . . . A . 10 . HA . . c30225_5ug3 1 403 1 . . 1 1 13 13 VAL HA H . . . 1 1 14 14 ASN H H . . . . . 3.201 1.920 4.482 . . . . . A . 13 VAL HA . . A . 14 ASN H . A . 13 . HA . . . A . 14 . HN . . c30225_5ug3 1 404 1 . . 1 1 2 2 ARG HA H . . . 1 1 3 3 ASP H H . . . . . 2.208 1.599 2.817 . . . . . A . 2 ARG HA . . A . 3 ASP H . A . 2 . HA . . . A . 3 . HN . . c30225_5ug3 1 405 1 . . 1 1 15 15 ASN H H . . . 1 1 16 16 HYP HD22 H . . . . . 3.282 1.936 4.628 . . . . . A . 15 ASN H . . A . 16 HYP HD22 . A . 15 . HN . . . A . 16 . HD22 . . c30225_5ug3 1 406 1 . . 1 1 12 12 ARG HA H . . . 1 1 13 13 VAL H H . . . . . 3.291 1.937 4.645 . . . . . A . 12 ARG HA . . A . 13 VAL H . A . 12 . HA . . . A . 13 . HN . . c30225_5ug3 1 407 1 . . 1 1 17 17 HIS H H . . . 1 1 16 16 HYP HD1 H . . . . . 3.880 1.999 5.761 . . . . . A . 17 HIS H . . A . 16 HYP HD1 . A . 17 . HN . . . A . 16 . HD1 . . c30225_5ug3 1 408 1 . . 1 1 3 3 ASP HB2 H . . . 1 1 4 4 GLU H H . . . . . 3.216 1.923 4.509 . . . . . A . 3 ASP HB2 . . A . 4 GLU H . A . 3 . HB2 . . . A . 4 . HN . . c30225_5ug3 1 409 1 . . 1 1 3 3 ASP HB3 H . . . 1 1 4 4 GLU H H . . . . . 3.067 1.891 4.243 . . . . . A . 3 ASP HB3 . . A . 4 GLU H . A . 3 . HB1 . . . A . 4 . HN . . c30225_5ug3 1 410 1 OR . 1 1 5 5 CYS HB3 H . . . 1 1 6 6 CYS H H . . . . . 2.802 1.820 3.784 . . . . . A . 5 CYS HB3 . . A . 6 CYS H . A . 5 . HB1 . . . A . 6 . HN . . c30225_5ug3 1 410 2 OR . 1 1 6 6 CYS H H . . . 1 1 19 19 CYS HB3 H . . . . . 2.802 1.820 3.784 . . . . . A . 6 CYS H . . A . 19 CYS HB3 . A . 6 . HN . . . A . 19 . HB1 . . c30225_5ug3 1 411 1 . . 1 1 8 8 ASN HB3 H . . . 1 1 8 8 ASN HD21 H . . . . . 2.873 1.841 3.905 . . . . . A . 8 ASN HB3 . . A . 8 ASN HD21 . A . 8 . HB1 . . . A . 8 . HD21 . . c30225_5ug3 1 412 1 . . 1 1 3 3 ASP HB3 H . . . 1 1 4 4 GLU H H . . . . . 3.231 1.926 4.536 . . . . . A . 3 ASP HB3 . . A . 4 GLU H . A . 3 . HB1 . . . A . 4 . HN . . c30225_5ug3 1 413 1 . . 1 1 3 3 ASP HB2 H . . . 1 1 4 4 GLU H H . . . . . 3.390 1.953 4.827 . . . . . A . 3 ASP HB2 . . A . 4 GLU H . A . 3 . HB2 . . . A . 4 . HN . . c30225_5ug3 1 414 1 . . 1 1 2 2 ARG H H . . . 1 1 1 1 ILE HA H . . . . . 2.304 1.640 2.968 . . . . . A . 2 ARG H . . A . 1 ILE HA . A . 2 . HN . . . A . 1 . HA . . c30225_5ug3 1 415 1 . . 1 1 3 3 ASP HA H . . . 1 1 4 4 GLU H H . . . . . 2.311 1.644 2.978 . . . . . A . 3 ASP HA . . A . 4 GLU H . A . 3 . HA . . . A . 4 . HN . . c30225_5ug3 1 416 1 . . 1 1 17 17 HIS H H . . . 1 1 16 16 HYP HA H . . . . . 2.554 1.739 3.369 . . . . . A . 17 HIS H . . A . 16 HYP HA . A . 17 . HN . . . A . 16 . HA . . c30225_5ug3 1 417 1 . . 1 1 4 4 GLU H H . . . 1 1 5 5 CYS HA H . . . . . 3.763 1.993 5.533 . . . . . A . 4 GLU H . . A . 5 CYS HA . A . 4 . HN . . . A . 5 . HA . . c30225_5ug3 1 418 1 . . 1 1 4 4 GLU HA H . . . 1 1 5 5 CYS H H . . . . . 2.845 1.833 3.857 . . . . . A . 4 GLU HA . . A . 5 CYS H . A . 4 . HA . . . A . 5 . HN . . c30225_5ug3 1 419 1 . . 1 1 12 12 ARG HG3 H . . . 1 1 9 9 PRO HA H . . . . . 2.915 1.853 3.977 . . . . . A . 12 ARG HG3 . . A . 9 PRO HA . A . 12 . HG1 . . . A . 9 . HA . . c30225_5ug3 1 420 1 . . 1 1 11 11 CYS HB2 H . . . 1 1 12 12 ARG HB2 H . . . . . 3.313 1.941 4.685 . . . . . A . 11 CYS HB2 . . A . 12 ARG HB2 . A . 11 . HB2 . . . A . 12 . HB2 . . c30225_5ug3 1 421 1 . . 1 1 12 12 ARG HB3 H . . . 1 1 9 9 PRO HA H . . . . . 3.235 1.927 4.543 . . . . . A . 12 ARG HB3 . . A . 9 PRO HA . A . 12 . HB1 . . . A . 9 . HA . . c30225_5ug3 1 422 1 . . 1 1 6 6 CYS HA H . . . 1 1 12 12 ARG HG2 H . . . . . 3.065 1.891 4.239 . . . . . A . 6 CYS HA . . A . 12 ARG HG2 . A . 6 . HA . . . A . 12 . HG2 . . c30225_5ug3 1 423 1 . . 1 1 13 13 VAL HB H . . . 1 1 10 10 VAL HA H . . . . . 3.458 1.963 4.953 . . . . . A . 13 VAL HB . . A . 10 VAL HA . A . 13 . HB . . . A . 10 . HA . . c30225_5ug3 1 424 1 . . 1 1 13 13 VAL MG2 H . . . 1 1 10 10 VAL HA H . . . . . 3.053 1.888 4.218 . . . . . A . 13 VAL MG2 . . A . 10 VAL HA . A . 13 . HG2# . . . A . 10 . HA . . c30225_5ug3 1 425 1 . . 1 1 8 8 ASN HB2 H . . . 1 1 11 11 CYS HA H . . . . . 3.559 1.976 5.142 . . . . . A . 8 ASN HB2 . . A . 11 CYS HA . A . 8 . HB2 . . . A . 11 . HA . . c30225_5ug3 1 426 1 . . 1 1 8 8 ASN HB2 H . . . 1 1 11 11 CYS HB2 H . . . . . 3.227 1.925 4.529 . . . . . A . 8 ASN HB2 . . A . 11 CYS HB2 . A . 8 . HB2 . . . A . 11 . HB2 . . c30225_5ug3 1 427 1 . . 1 1 17 17 HIS H H . . . 1 1 16 16 HYP HD22 H . . . . . 4.084 1.999 6.169 . . . . . A . 17 HIS H . . A . 16 HYP HD22 . A . 17 . HN . . . A . 16 . HD22 . . c30225_5ug3 1 428 1 . . 1 1 4 4 GLU HB3 H . . . 1 1 5 5 CYS H H . . . . . 3.035 1.883 4.187 . . . . . A . 4 GLU HB3 . . A . 5 CYS H . A . 4 . HB1 . . . A . 5 . HN . . c30225_5ug3 1 429 1 . . 1 1 4 4 GLU HB2 H . . . 1 1 5 5 CYS H H . . . . . 3.219 1.923 4.515 . . . . . A . 4 GLU HB2 . . A . 5 CYS H . A . 4 . HB2 . . . A . 5 . HN . . c30225_5ug3 1 430 1 . . 1 1 4 4 GLU HG2 H . . . 1 1 5 5 CYS H H . . . . . 3.761 1.993 5.529 . . . . . A . 4 GLU HG2 . . A . 5 CYS H . A . 4 . HG2 . . . A . 5 . HN . . c30225_5ug3 1 431 1 OR . 1 1 5 5 CYS H H . . . 1 1 8 8 ASN HB3 H . . . . . 3.495 1.968 5.022 . . . . . A . 5 CYS H . . A . 8 ASN HB3 . A . 5 . HN . . . A . 8 . HB1 . . c30225_5ug3 1 431 2 OR . 1 1 8 8 ASN HB3 H . . . 1 1 12 12 ARG H H . . . . . 3.495 1.968 5.022 . . . . . A . 8 ASN HB3 . . A . 12 ARG H . A . 8 . HB1 . . . A . 12 . HN . . c30225_5ug3 1 432 1 . . 1 1 5 5 CYS HA H . . . 1 1 6 6 CYS H H . . . . . 3.523 1.972 5.074 . . . . . A . 5 CYS HA . . A . 6 CYS H . A . 5 . HA . . . A . 6 . HN . . c30225_5ug3 1 433 1 . . 1 1 8 8 ASN HB2 H . . . 1 1 8 8 ASN HD21 H . . . . . 3.155 1.911 4.399 . . . . . A . 8 ASN HB2 . . A . 8 ASN HD21 . A . 8 . HB2 . . . A . 8 . HD21 . . c30225_5ug3 1 434 1 . . 1 1 8 8 ASN HD21 H . . . 1 1 8 8 ASN HD22 H . . . . . 1.999 1.499 2.499 . . . . . A . 8 ASN HD21 . . A . 8 ASN HD22 . A . 8 . HD21 . . . A . 8 . HD22 . . c30225_5ug3 1 435 1 . . 1 1 8 8 ASN HA H . . . 1 1 8 8 ASN HD21 H . . . . . 3.528 1.972 5.084 . . . . . A . 8 ASN HA . . A . 8 ASN HD21 . A . 8 . HA . . . A . 8 . HD21 . . c30225_5ug3 1 436 1 . . 1 1 11 11 CYS HB3 H . . . 1 1 8 8 ASN HD21 H . . . . . 4.704 1.938 7.470 . . . . . A . 11 CYS HB3 . . A . 8 ASN HD21 . A . 11 . HB1 . . . A . 8 . HD21 . . c30225_5ug3 1 437 1 OR . 1 1 15 15 ASN H H . . . 1 1 16 16 HYP HA H . . . . . 3.656 1.986 5.326 . . . . . A . 15 ASN H . . A . 16 HYP HA . A . 15 . HN . . . A . 16 . HA . . c30225_5ug3 1 437 2 OR . 1 1 18 18 VAL H H . . . 1 1 16 16 HYP HA H . . . . . 3.656 1.986 5.326 . . . . . A . 18 VAL H . . A . 16 HYP HA . A . 18 . HN . . . A . 16 . HA . . c30225_5ug3 1 438 1 . . 1 1 18 18 VAL H H . . . 1 1 17 17 HIS HA H . . . . . 3.004 1.876 4.132 . . . . . A . 18 VAL H . . A . 17 HIS HA . A . 18 . HN . . . A . 17 . HA . . c30225_5ug3 1 439 1 . . 1 1 15 15 ASN HD21 H . . . 1 1 15 15 ASN HD22 H . . . . . 2.036 1.518 2.554 . . . . . A . 15 ASN HD21 . . A . 15 ASN HD22 . A . 15 . HD21 . . . A . 15 . HD22 . . c30225_5ug3 1 440 1 . . 1 1 15 15 ASN HB3 H . . . 1 1 15 15 ASN HD21 H . . . . . 2.582 1.749 3.415 . . . . . A . 15 ASN HB3 . . A . 15 ASN HD21 . A . 15 . HB1 . . . A . 15 . HD21 . . c30225_5ug3 1 441 1 . . 1 1 15 15 ASN HB2 H . . . 1 1 15 15 ASN HD21 H . . . . . 3.177 1.915 4.439 . . . . . A . 15 ASN HB2 . . A . 15 ASN HD21 . A . 15 . HB2 . . . A . 15 . HD21 . . c30225_5ug3 1 442 1 . . 1 1 7 7 SER H H . . . 1 1 8 8 ASN HB3 H . . . . . 3.079 1.894 4.264 . . . . . A . 7 SER H . . A . 8 ASN HB3 . A . 7 . HN . . . A . 8 . HB1 . . c30225_5ug3 1 443 1 . . 1 1 14 14 ASN HD21 H . . . 1 1 14 14 ASN HD22 H . . . . . 1.927 1.463 2.391 . . . . . A . 14 ASN HD21 . . A . 14 ASN HD22 . A . 14 . HD21 . . . A . 14 . HD22 . . c30225_5ug3 1 444 1 . . 1 1 18 18 VAL H H . . . 1 1 15 15 ASN HD21 H . . . . . 3.041 1.885 4.197 . . . . . A . 18 VAL H . . A . 15 ASN HD21 . A . 18 . HN . . . A . 15 . HD21 . . c30225_5ug3 1 445 1 . . 1 1 10 10 VAL H H . . . 1 1 9 9 PRO HB3 H . . . . . 3.612 1.981 5.243 . . . . . A . 10 VAL H . . A . 9 PRO HB3 . A . 10 . HN . . . A . 9 . HB1 . . c30225_5ug3 1 446 1 . . 1 1 2 2 ARG HD2 H . . . 1 1 2 2 ARG HB2 H . . . . . 2.793 1.818 3.768 . . . . . A . 2 ARG HD2 . . A . 2 ARG HB2 . A . 2 . HD2 . . . A . 2 . HB2 . . c30225_5ug3 1 447 1 . . 1 1 2 2 ARG HD2 H . . . 1 1 2 2 ARG HB3 H . . . . . 2.650 1.772 3.528 . . . . . A . 2 ARG HD2 . . A . 2 ARG HB3 . A . 2 . HD2 . . . A . 2 . HB1 . . c30225_5ug3 1 448 1 OR . 1 1 18 18 VAL MG1 H . . . 1 1 17 17 HIS H H . . . . . 3.346 1.946 4.746 . . . . . A . 18 VAL MG1 . . A . 17 HIS H . A . 18 . HG1# . . . A . 17 . HN . . c30225_5ug3 1 448 2 OR . 1 1 2 2 ARG H H . . . 1 1 1 1 ILE MG H . . . . . 3.346 1.946 4.746 . . . . . A . 2 ARG H . . A . 1 ILE MG . A . 2 . HN . . . A . 1 . HG2# . . c30225_5ug3 1 449 1 . . 1 1 13 13 VAL MG2 H . . . 1 1 10 10 VAL HA H . . . . . 2.996 1.874 4.118 . . . . . A . 13 VAL MG2 . . A . 10 VAL HA . A . 13 . HG2# . . . A . 10 . HA . . c30225_5ug3 1 450 1 . . 1 1 12 12 ARG HA H . . . 1 1 13 13 VAL MG1 H . . . . . 3.062 1.890 4.234 . . . . . A . 12 ARG HA . . A . 13 VAL MG1 . A . 12 . HA . . . A . 13 . HG1# . . c30225_5ug3 1 451 1 . . 1 1 15 15 ASN HD21 H . . . 1 1 15 15 ASN HD22 H . . . . . 2.048 1.524 2.572 . . . . . A . 15 ASN HD21 . . A . 15 ASN HD22 . A . 15 . HD21 . . . A . 15 . HD22 . . c30225_5ug3 1 452 1 . . 1 1 8 8 ASN HD21 H . . . 1 1 8 8 ASN HD22 H . . . . . 1.967 1.484 2.450 . . . . . A . 8 ASN HD21 . . A . 8 ASN HD22 . A . 8 . HD21 . . . A . 8 . HD22 . . c30225_5ug3 1 453 1 . . 1 1 14 14 ASN HD21 H . . . 1 1 14 14 ASN HD22 H . . . . . 1.915 1.457 2.373 . . . . . A . 14 ASN HD21 . . A . 14 ASN HD22 . A . 14 . HD21 . . . A . 14 . HD22 . . c30225_5ug3 1 454 1 . . 1 1 14 14 ASN HB2 H . . . 1 1 14 14 ASN HD22 H . . . . . 3.480 1.966 4.994 . . . . . A . 14 ASN HB2 . . A . 14 ASN HD22 . A . 14 . HB2 . . . A . 14 . HD22 . . c30225_5ug3 1 455 1 . . 1 1 14 14 ASN HB3 H . . . 1 1 14 14 ASN HD22 H . . . . . 3.222 1.924 4.520 . . . . . A . 14 ASN HB3 . . A . 14 ASN HD22 . A . 14 . HB1 . . . A . 14 . HD22 . . c30225_5ug3 1 456 1 OR . 1 1 15 15 ASN HB2 H . . . 1 1 15 15 ASN HD22 H . . . . . 3.256 1.931 4.581 . . . . . A . 15 ASN HB2 . . A . 15 ASN HD22 . A . 15 . HB2 . . . A . 15 . HD22 . . c30225_5ug3 1 456 2 OR . 1 1 13 13 VAL H H . . . 1 1 15 15 ASN HB2 H . . . . . 3.256 1.931 4.581 . . . . . A . 13 VAL H . . A . 15 ASN HB2 . A . 13 . HN . . . A . 15 . HB2 . . c30225_5ug3 1 456 3 OR . 1 1 14 14 ASN HB3 H . . . 1 1 13 13 VAL H H . . . . . 3.256 1.931 4.581 . . . . . A . 14 ASN HB3 . . A . 13 VAL H . A . 14 . HB1 . . . A . 13 . HN . . c30225_5ug3 1 457 1 . . 1 1 15 15 ASN HB3 H . . . 1 1 15 15 ASN HD22 H . . . . . 3.018 1.879 4.157 . . . . . A . 15 ASN HB3 . . A . 15 ASN HD22 . A . 15 . HB1 . . . A . 15 . HD22 . . c30225_5ug3 1 458 1 . . 1 1 8 8 ASN HB3 H . . . 1 1 12 12 ARG H H . . . . . 3.649 1.985 5.313 . . . . . A . 8 ASN HB3 . . A . 12 ARG H . A . 8 . HB1 . . . A . 12 . HN . . c30225_5ug3 1 459 1 OR . 1 1 6 6 CYS HB3 H . . . 1 1 12 12 ARG HE H . . . . . 3.489 1.968 5.010 . . . . . A . 6 CYS HB3 . . A . 12 ARG HE . A . 6 . HB1 . . . A . 12 . HE . . c30225_5ug3 1 459 2 OR . 1 1 8 8 ASN HB3 H . . . 1 1 13 13 VAL H H . . . . . 3.489 1.968 5.010 . . . . . A . 8 ASN HB3 . . A . 13 VAL H . A . 8 . HB1 . . . A . 13 . HN . . c30225_5ug3 1 459 3 OR . 1 1 14 14 ASN HB2 H . . . 1 1 13 13 VAL H H . . . . . 3.489 1.968 5.010 . . . . . A . 14 ASN HB2 . . A . 13 VAL H . A . 14 . HB2 . . . A . 13 . HN . . c30225_5ug3 1 459 4 OR . 1 1 8 8 ASN HB3 H . . . 1 1 12 12 ARG HE H . . . . . 3.489 1.968 5.010 . . . . . A . 8 ASN HB3 . . A . 12 ARG HE . A . 8 . HB1 . . . A . 12 . HE . . c30225_5ug3 1 460 1 . . 1 1 5 5 CYS HB3 H . . . 1 1 11 11 CYS HA H . . . . . 3.288 1.937 4.639 . . . . . A . 5 CYS HB3 . . A . 11 CYS HA . A . 5 . HB1 . . . A . 11 . HA . . c30225_5ug3 1 461 1 OR . 1 1 3 3 ASP HB2 H . . . 1 1 4 4 GLU HA H . . . . . 3.469 1.965 4.973 . . . . . A . 3 ASP HB2 . . A . 4 GLU HA . A . 3 . HB2 . . . A . 4 . HA . . c30225_5ug3 1 461 2 OR . 1 1 4 4 GLU HA H . . . 1 1 6 6 CYS HB3 H . . . . . 3.469 1.965 4.973 . . . . . A . 4 GLU HA . . A . 6 CYS HB3 . A . 4 . HA . . . A . 6 . HB1 . . c30225_5ug3 1 461 3 OR . 1 1 14 14 ASN HB2 H . . . 1 1 11 11 CYS HA H . . . . . 3.469 1.965 4.973 . . . . . A . 14 ASN HB2 . . A . 11 CYS HA . A . 14 . HB2 . . . A . 11 . HA . . c30225_5ug3 1 461 4 OR . 1 1 8 8 ASN HB3 H . . . 1 1 11 11 CYS HA H . . . . . 3.469 1.965 4.973 . . . . . A . 8 ASN HB3 . . A . 11 CYS HA . A . 8 . HB1 . . . A . 11 . HA . . c30225_5ug3 1 462 1 . . 1 1 8 8 ASN HA H . . . 1 1 9 9 PRO HD3 H . . . . . 2.508 1.722 3.294 . . . . . A . 8 ASN HA . . A . 9 PRO HD3 . A . 8 . HA . . . A . 9 . HD1 . . c30225_5ug3 1 463 1 . . 1 1 8 8 ASN HA H . . . 1 1 9 9 PRO HD2 H . . . . . 2.378 1.671 3.085 . . . . . A . 8 ASN HA . . A . 9 PRO HD2 . A . 8 . HA . . . A . 9 . HD2 . . c30225_5ug3 1 464 1 . . 1 1 8 8 ASN HA H . . . 1 1 9 9 PRO HD3 H . . . . . 2.404 1.682 3.126 . . . . . A . 8 ASN HA . . A . 9 PRO HD3 . A . 8 . HA . . . A . 9 . HD1 . . c30225_5ug3 1 465 1 . . 1 1 15 15 ASN HA H . . . 1 1 16 16 HYP HD1 H . . . . . 2.545 1.736 3.354 . . . . . A . 15 ASN HA . . A . 16 HYP HD1 . A . 15 . HA . . . A . 16 . HD1 . . c30225_5ug3 1 466 1 . . 1 1 15 15 ASN HA H . . . 1 1 16 16 HYP HD22 H . . . . . 2.748 1.804 3.692 . . . . . A . 15 ASN HA . . A . 16 HYP HD22 . A . 15 . HA . . . A . 16 . HD22 . . c30225_5ug3 1 467 1 . . 1 1 19 19 CYS HA H . . . 1 1 19 19 CYS HB2 H . . . . . 2.670 1.779 3.561 . . . . . A . 19 CYS HA . . A . 19 CYS HB2 . A . 19 . HA . . . A . 19 . HB2 . . c30225_5ug3 1 468 1 . . 1 1 14 14 ASN HB2 H . . . 1 1 15 15 ASN HA H . . . . . 3.468 1.965 4.971 . . . . . A . 14 ASN HB2 . . A . 15 ASN HA . A . 14 . HB2 . . . A . 15 . HA . . c30225_5ug3 1 469 1 . . 1 1 16 16 HYP HA H . . . 1 1 16 16 HYP HB2 H . . . . . 2.518 1.725 3.311 . . . . . A . 16 HYP HA . . A . 16 HYP HB2 . A . 16 . HA . . . A . 16 . HB2 . . c30225_5ug3 1 470 1 . . 1 1 16 16 HYP HA H . . . 1 1 16 16 HYP HB3 H . . . . . 2.816 1.825 3.807 . . . . . A . 16 HYP HA . . A . 16 HYP HB3 . A . 16 . HA . . . A . 16 . HB3 . . c30225_5ug3 1 471 1 OR . 1 1 12 12 ARG HB2 H . . . 1 1 15 15 ASN HB2 H . . . . . 3.790 1.995 5.585 . . . . . A . 12 ARG HB2 . . A . 15 ASN HB2 . A . 12 . HB2 . . . A . 15 . HB2 . . c30225_5ug3 1 471 2 OR . 1 1 12 12 ARG HB2 H . . . 1 1 19 19 CYS HB3 H . . . . . 3.790 1.995 5.585 . . . . . A . 12 ARG HB2 . . A . 19 CYS HB3 . A . 12 . HB2 . . . A . 19 . HB1 . . c30225_5ug3 1 471 3 OR . 1 1 5 5 CYS HB3 H . . . 1 1 12 12 ARG HB2 H . . . . . 3.790 1.995 5.585 . . . . . A . 5 CYS HB3 . . A . 12 ARG HB2 . A . 5 . HB1 . . . A . 12 . HB2 . . c30225_5ug3 1 472 1 OR . 1 1 5 5 CYS HB3 H . . . 1 1 12 12 ARG HB3 H . . . . . 3.898 1.999 5.797 . . . . . A . 5 CYS HB3 . . A . 12 ARG HB3 . A . 5 . HB1 . . . A . 12 . HB1 . . c30225_5ug3 1 472 2 OR . 1 1 12 12 ARG HB3 H . . . 1 1 19 19 CYS HB3 H . . . . . 3.898 1.999 5.797 . . . . . A . 12 ARG HB3 . . A . 19 CYS HB3 . A . 12 . HB1 . . . A . 19 . HB1 . . c30225_5ug3 1 472 3 OR . 1 1 12 12 ARG HB3 H . . . 1 1 15 15 ASN HB2 H . . . . . 3.898 1.999 5.797 . . . . . A . 12 ARG HB3 . . A . 15 ASN HB2 . A . 12 . HB1 . . . A . 15 . HB2 . . c30225_5ug3 1 473 1 . . 1 1 18 18 VAL MG1 H . . . 1 1 15 15 ASN HB3 H . . . . . 2.819 1.826 3.812 . . . . . A . 18 VAL MG1 . . A . 15 ASN HB3 . A . 18 . HG1# . . . A . 15 . HB1 . . c30225_5ug3 1 474 1 . . 1 1 8 8 ASN HB3 H . . . 1 1 9 9 PRO HA H . . . . . 3.557 1.976 5.138 . . . . . A . 8 ASN HB3 . . A . 9 PRO HA . A . 8 . HB1 . . . A . 9 . HA . . c30225_5ug3 1 475 1 . . 1 1 11 11 CYS H H . . . 1 1 10 10 VAL MG2 H . . . . . 3.277 1.935 4.619 . . . . . A . 11 CYS H . . A . 10 VAL MG2 . A . 11 . HN . . . A . 10 . HG2# . . c30225_5ug3 1 476 1 . . 1 1 10 10 VAL MG2 H . . . 1 1 14 14 ASN HD21 H . . . . . 3.190 1.918 4.462 . . . . . A . 10 VAL MG2 . . A . 14 ASN HD21 . A . 10 . HG2# . . . A . 14 . HD21 . . c30225_5ug3 1 477 1 . . 1 1 13 13 VAL MG2 H . . . 1 1 14 14 ASN H H . . . . . 3.536 1.973 5.099 . . . . . A . 13 VAL MG2 . . A . 14 ASN H . A . 13 . HG2# . . . A . 14 . HN . . c30225_5ug3 1 478 1 . . 1 1 13 13 VAL MG2 H . . . 1 1 14 14 ASN HD21 H . . . . . 4.089 2.000 6.178 . . . . . A . 13 VAL MG2 . . A . 14 ASN HD21 . A . 13 . HG2# . . . A . 14 . HD21 . . c30225_5ug3 1 479 1 . . 1 1 15 15 ASN HA H . . . 1 1 15 15 ASN HD21 H . . . . . 3.884 1.998 5.770 . . . . . A . 15 ASN HA . . A . 15 ASN HD21 . A . 15 . HA . . . A . 15 . HD21 . . c30225_5ug3 1 480 1 . . 1 1 12 12 ARG H H . . . 1 1 9 9 PRO HA H . . . . . 3.037 1.884 4.190 . . . . . A . 12 ARG H . . A . 9 PRO HA . A . 12 . HN . . . A . 9 . HA . . c30225_5ug3 1 481 1 . . 1 1 17 17 HIS H H . . . 1 1 16 16 HYP HD1 H . . . . . 3.852 1.997 5.707 . . . . . A . 17 HIS H . . A . 16 HYP HD1 . A . 17 . HN . . . A . 16 . HD1 . . c30225_5ug3 1 482 1 . . 1 1 17 17 HIS H H . . . 1 1 16 16 HYP HB2 H . . . . . 3.571 1.977 5.165 . . . . . A . 17 HIS H . . A . 16 HYP HB2 . A . 17 . HN . . . A . 16 . HB2 . . c30225_5ug3 1 483 1 . . 1 1 2 2 ARG H H . . . 1 1 1 1 ILE HB H . . . . . 3.138 1.907 4.369 . . . . . A . 2 ARG H . . A . 1 ILE HB . A . 2 . HN . . . A . 1 . HB . . c30225_5ug3 1 484 1 . . 1 1 17 17 HIS H H . . . 1 1 16 16 HYP HB3 H . . . . . 3.681 1.988 5.374 . . . . . A . 17 HIS H . . A . 16 HYP HB3 . A . 17 . HN . . . A . 16 . HB3 . . c30225_5ug3 1 485 1 . . 1 1 12 12 ARG H H . . . 1 1 12 12 ARG HB3 H . . . . . 3.464 1.964 4.964 . . . . . A . 12 ARG H . . A . 12 ARG HB3 . A . 12 . HN . . . A . 12 . HB1 . . c30225_5ug3 1 486 1 . . 1 1 12 12 ARG H H . . . 1 1 12 12 ARG HB2 H . . . . . 3.346 1.946 4.746 . . . . . A . 12 ARG H . . A . 12 ARG HB2 . A . 12 . HN . . . A . 12 . HB2 . . c30225_5ug3 1 487 1 . . 1 1 12 12 ARG H H . . . 1 1 12 12 ARG HG3 H . . . . . 3.021 1.880 4.162 . . . . . A . 12 ARG H . . A . 12 ARG HG3 . A . 12 . HN . . . A . 12 . HG1 . . c30225_5ug3 1 488 1 . . 1 1 12 12 ARG H H . . . 1 1 12 12 ARG HG2 H . . . . . 2.881 1.844 3.918 . . . . . A . 12 ARG H . . A . 12 ARG HG2 . A . 12 . HN . . . A . 12 . HG2 . . c30225_5ug3 1 489 1 . . 1 1 18 18 VAL HB H . . . 1 1 19 19 CYS H H . . . . . 3.271 1.933 4.609 . . . . . A . 18 VAL HB . . A . 19 CYS H . A . 18 . HB . . . A . 19 . HN . . c30225_5ug3 1 490 1 . . 1 1 4 4 GLU HB2 H . . . 1 1 5 5 CYS H H . . . . . 3.493 1.968 5.018 . . . . . A . 4 GLU HB2 . . A . 5 CYS H . A . 4 . HB2 . . . A . 5 . HN . . c30225_5ug3 1 491 1 . . 1 1 4 4 GLU HG2 H . . . 1 1 5 5 CYS H H . . . . . 4.129 1.998 6.260 . . . . . A . 4 GLU HG2 . . A . 5 CYS H . A . 4 . HG2 . . . A . 5 . HN . . c30225_5ug3 1 492 1 . . 1 1 5 5 CYS HA H . . . 1 1 6 6 CYS H H . . . . . 3.370 1.950 4.790 . . . . . A . 5 CYS HA . . A . 6 CYS H . A . 5 . HA . . . A . 6 . HN . . c30225_5ug3 1 493 1 . . 1 1 4 4 GLU HA H . . . 1 1 6 6 CYS H H . . . . . 3.866 1.998 5.734 . . . . . A . 4 GLU HA . . A . 6 CYS H . A . 4 . HA . . . A . 6 . HN . . c30225_5ug3 1 494 1 . . 1 1 6 6 CYS H H . . . 1 1 19 19 CYS HB3 H . . . . . 3.010 1.877 4.143 . . . . . A . 6 CYS H . . A . 19 CYS HB3 . A . 6 . HN . . . A . 19 . HB1 . . c30225_5ug3 1 495 1 . . 1 1 6 6 CYS HB2 H . . . 1 1 8 8 ASN HD21 H . . . . . 3.657 1.985 5.329 . . . . . A . 6 CYS HB2 . . A . 8 ASN HD21 . A . 6 . HB2 . . . A . 8 . HD21 . . c30225_5ug3 1 496 1 . . 1 1 8 8 ASN HB3 H . . . 1 1 8 8 ASN HD21 H . . . . . 2.990 1.873 4.107 . . . . . A . 8 ASN HB3 . . A . 8 ASN HD21 . A . 8 . HB1 . . . A . 8 . HD21 . . c30225_5ug3 1 497 1 . . 1 1 8 8 ASN HB2 H . . . 1 1 8 8 ASN HD21 H . . . . . 3.218 1.923 4.513 . . . . . A . 8 ASN HB2 . . A . 8 ASN HD21 . A . 8 . HB2 . . . A . 8 . HD21 . . c30225_5ug3 1 498 1 . . 1 1 7 7 SER HA H . . . 1 1 8 8 ASN H H . . . . . 3.145 1.909 4.381 . . . . . A . 7 SER HA . . A . 8 ASN H . A . 7 . HA . . . A . 8 . HN . . c30225_5ug3 1 499 1 . . 1 1 18 18 VAL HA H . . . 1 1 19 19 CYS H H . . . . . 2.793 1.818 3.768 . . . . . A . 18 VAL HA . . A . 19 CYS H . A . 18 . HA . . . A . 19 . HN . . c30225_5ug3 1 500 1 . . 1 1 6 6 CYS HA H . . . 1 1 7 7 SER H H . . . . . 3.590 1.979 5.201 . . . . . A . 6 CYS HA . . A . 7 SER H . A . 6 . HA . . . A . 7 . HN . . c30225_5ug3 1 501 1 OR . 1 1 18 18 VAL HA H . . . 1 1 15 15 ASN HD21 H . . . . . 3.248 1.930 4.566 . . . . . A . 18 VAL HA . . A . 15 ASN HD21 . A . 18 . HA . . . A . 15 . HD21 . . c30225_5ug3 1 501 2 OR . 1 1 4 4 GLU HA H . . . 1 1 7 7 SER H H . . . . . 3.248 1.930 4.566 . . . . . A . 4 GLU HA . . A . 7 SER H . A . 4 . HA . . . A . 7 . HN . . c30225_5ug3 1 502 1 . . 1 1 6 6 CYS HB2 H . . . 1 1 7 7 SER H H . . . . . 3.353 1.948 4.758 . . . . . A . 6 CYS HB2 . . A . 7 SER H . A . 6 . HB2 . . . A . 7 . HN . . c30225_5ug3 1 503 1 OR . 1 1 7 7 SER H H . . . 1 1 8 8 ASN HB3 H . . . . . 3.129 1.905 4.353 . . . . . A . 7 SER H . . A . 8 ASN HB3 . A . 7 . HN . . . A . 8 . HB1 . . c30225_5ug3 1 503 2 OR . 1 1 6 6 CYS HB3 H . . . 1 1 7 7 SER H H . . . . . 3.129 1.905 4.353 . . . . . A . 6 CYS HB3 . . A . 7 SER H . A . 6 . HB1 . . . A . 7 . HN . . c30225_5ug3 1 504 1 . . 1 1 15 15 ASN HB3 H . . . 1 1 15 15 ASN HD21 H . . . . . 2.777 1.813 3.741 . . . . . A . 15 ASN HB3 . . A . 15 ASN HD21 . A . 15 . HB1 . . . A . 15 . HD21 . . c30225_5ug3 1 505 1 . . 1 1 11 11 CYS H H . . . 1 1 10 10 VAL HB H . . . . . 2.873 1.841 3.905 . . . . . A . 11 CYS H . . A . 10 VAL HB . A . 11 . HN . . . A . 10 . HB . . c30225_5ug3 1 506 1 . . 1 1 15 15 ASN HB2 H . . . 1 1 14 14 ASN HD21 H . . . . . 3.027 1.882 4.172 . . . . . A . 15 ASN HB2 . . A . 14 ASN HD21 . A . 15 . HB2 . . . A . 14 . HD21 . . c30225_5ug3 1 507 1 . . 1 1 15 15 ASN H H . . . 1 1 16 16 HYP HD22 H . . . . . 3.338 1.945 4.731 . . . . . A . 15 ASN H . . A . 16 HYP HD22 . A . 15 . HN . . . A . 16 . HD22 . . c30225_5ug3 1 508 1 . . 1 1 11 11 CYS H H . . . 1 1 10 10 VAL HA H . . . . . 3.230 1.926 4.534 . . . . . A . 11 CYS H . . A . 10 VAL HA . A . 11 . HN . . . A . 10 . HA . . c30225_5ug3 1 509 1 OR . 1 1 12 12 ARG HA H . . . 1 1 15 15 ASN H H . . . . . 3.155 1.910 4.400 . . . . . A . 12 ARG HA . . A . 15 ASN H . A . 12 . HA . . . A . 15 . HN . . c30225_5ug3 1 509 2 OR . 1 1 12 12 ARG HA H . . . 1 1 14 14 ASN H H . . . . . 3.155 1.910 4.400 . . . . . A . 12 ARG HA . . A . 14 ASN H . A . 12 . HA . . . A . 14 . HN . . c30225_5ug3 1 510 1 . . 1 1 18 18 VAL H H . . . 1 1 16 16 HYP HA H . . . . . 3.494 1.968 5.020 . . . . . A . 18 VAL H . . A . 16 HYP HA . A . 18 . HN . . . A . 16 . HA . . c30225_5ug3 1 511 1 . . 1 1 18 18 VAL H H . . . 1 1 17 17 HIS HA H . . . . . 3.055 1.889 4.221 . . . . . A . 18 VAL H . . A . 17 HIS HA . A . 18 . HN . . . A . 17 . HA . . c30225_5ug3 1 512 1 . . 1 1 10 10 VAL H H . . . 1 1 9 9 PRO HD3 H . . . . . 3.229 1.926 4.532 . . . . . A . 10 VAL H . . A . 9 PRO HD3 . A . 10 . HN . . . A . 9 . HD1 . . c30225_5ug3 1 513 1 . . 1 1 10 10 VAL H H . . . 1 1 9 9 PRO HD2 H . . . . . 3.635 1.983 5.287 . . . . . A . 10 VAL H . . A . 9 PRO HD2 . A . 10 . HN . . . A . 9 . HD2 . . c30225_5ug3 1 514 1 . . 1 1 9 9 PRO HA H . . . 1 1 10 10 VAL H H . . . . . 3.364 1.949 4.779 . . . . . A . 9 PRO HA . . A . 10 VAL H . A . 9 . HA . . . A . 10 . HN . . c30225_5ug3 1 515 1 . . 1 1 9 9 PRO HA H . . . 1 1 13 13 VAL H H . . . . . 3.177 1.916 4.438 . . . . . A . 9 PRO HA . . A . 13 VAL H . A . 9 . HA . . . A . 13 . HN . . c30225_5ug3 1 516 1 . . 1 1 15 15 ASN HB3 H . . . 1 1 15 15 ASN HD22 H . . . . . 3.171 1.914 4.428 . . . . . A . 15 ASN HB3 . . A . 15 ASN HD22 . A . 15 . HB1 . . . A . 15 . HD22 . . c30225_5ug3 1 517 1 . . 1 1 13 13 VAL H H . . . 1 1 10 10 VAL HA H . . . . . 3.362 1.949 4.775 . . . . . A . 13 VAL H . . A . 10 VAL HA . A . 13 . HN . . . A . 10 . HA . . c30225_5ug3 1 518 1 . . 1 1 8 8 ASN HA H . . . 1 1 9 9 PRO HG2 H . . . . . 3.768 1.994 5.542 . . . . . A . 8 ASN HA . . A . 9 PRO HG2 . A . 8 . HA . . . A . 9 . HG2 . . c30225_5ug3 1 519 1 . . 1 1 8 8 ASN HA H . . . 1 1 9 9 PRO HB2 H . . . . . 3.769 1.994 5.544 . . . . . A . 8 ASN HA . . A . 9 PRO HB2 . A . 8 . HA . . . A . 9 . HB2 . . c30225_5ug3 1 520 1 . . 1 1 18 18 VAL H H . . . 1 1 17 17 HIS HB3 H . . . . . 3.563 1.977 5.149 . . . . . A . 18 VAL H . . A . 17 HIS HB3 . A . 18 . HN . . . A . 17 . HB1 . . c30225_5ug3 1 521 1 . . 1 1 18 18 VAL H H . . . 1 1 17 17 HIS HB2 H . . . . . 3.517 1.971 5.063 . . . . . A . 18 VAL H . . A . 17 HIS HB2 . A . 18 . HN . . . A . 17 . HB2 . . c30225_5ug3 1 522 1 . . 1 1 6 6 CYS HA H . . . 1 1 7 7 SER H H . . . . . 3.865 1.998 5.732 . . . . . A . 6 CYS HA . . A . 7 SER H . A . 6 . HA . . . A . 7 . HN . . c30225_5ug3 1 523 1 . . 1 1 5 5 CYS HB3 H . . . 1 1 11 11 CYS HA H . . . . . 3.381 1.952 4.810 . . . . . A . 5 CYS HB3 . . A . 11 CYS HA . A . 5 . HB1 . . . A . 11 . HA . . c30225_5ug3 1 524 1 . . 1 1 14 14 ASN HB2 H . . . 1 1 14 14 ASN HD21 H . . . . . 3.085 1.895 4.275 . . . . . A . 14 ASN HB2 . . A . 14 ASN HD21 . A . 14 . HB2 . . . A . 14 . HD21 . . c30225_5ug3 1 525 1 . . 1 1 14 14 ASN HB3 H . . . 1 1 14 14 ASN HD21 H . . . . . 2.842 1.832 3.852 . . . . . A . 14 ASN HB3 . . A . 14 ASN HD21 . A . 14 . HB1 . . . A . 14 . HD21 . . c30225_5ug3 1 526 1 . . 1 1 12 12 ARG HA H . . . 1 1 15 15 ASN HB3 H . . . . . 3.806 1.995 5.617 . . . . . A . 12 ARG HA . . A . 15 ASN HB3 . A . 12 . HA . . . A . 15 . HB1 . . c30225_5ug3 1 527 1 . . 1 1 15 15 ASN HB3 H . . . 1 1 16 16 HYP HD1 H . . . . . 3.865 1.998 5.732 . . . . . A . 15 ASN HB3 . . A . 16 HYP HD1 . A . 15 . HB1 . . . A . 16 . HD1 . . c30225_5ug3 1 528 1 . . 1 1 10 10 VAL H H . . . 1 1 8 8 ASN HD21 H . . . . . 4.002 2.000 6.004 . . . . . A . 10 VAL H . . A . 8 ASN HD21 . A . 10 . HN . . . A . 8 . HD21 . . c30225_5ug3 1 529 1 . . 1 1 15 15 ASN HB3 H . . . 1 1 16 16 HYP HD22 H . . . . . 3.609 1.981 5.237 . . . . . A . 15 ASN HB3 . . A . 16 HYP HD22 . A . 15 . HB1 . . . A . 16 . HD22 . . c30225_5ug3 1 530 1 OR . 1 1 18 18 VAL H H . . . 1 1 15 15 ASN HD22 H . . . . . 2.749 1.804 3.694 . . . . . A . 18 VAL H . . A . 15 ASN HD22 . A . 18 . HN . . . A . 15 . HD22 . . c30225_5ug3 1 530 2 OR . 1 1 13 13 VAL H H . . . 1 1 14 14 ASN H H . . . . . 2.749 1.804 3.694 . . . . . A . 13 VAL H . . A . 14 ASN H . A . 13 . HN . . . A . 14 . HN . . c30225_5ug3 1 531 1 . . 1 1 8 8 ASN H H . . . 1 1 5 5 CYS O O . . . . . 2.200 1.730 2.700 . . . . . A . 8 ASN H . . A . 5 CYS O . A . 8 . HN . . . A . 5 . O . . c30225_5ug3 1 532 1 . . 1 1 10 10 VAL H H . . . 1 1 8 8 ASN O O . . . . . 2.200 1.730 2.700 . . . . . A . 10 VAL H . . A . 8 ASN O . A . 10 . HN . . . A . 8 . O . . c30225_5ug3 1 533 1 . . 1 1 11 11 CYS H H . . . 1 1 8 8 ASN O O . . . . . 2.200 1.730 2.700 . . . . . A . 11 CYS H . . A . 8 ASN O . A . 11 . HN . . . A . 8 . O . . c30225_5ug3 1 534 1 . . 1 1 12 12 ARG H H . . . 1 1 8 8 ASN O O . . . . . 2.200 1.730 2.700 . . . . . A . 12 ARG H . . A . 8 ASN O . A . 12 . HN . . . A . 8 . O . . c30225_5ug3 1 535 1 . . 1 1 13 13 VAL H H . . . 1 1 9 9 PRO O O . . . . . 2.200 1.730 2.700 . . . . . A . 13 VAL H . . A . 9 PRO O . A . 13 . HN . . . A . 9 . O . . c30225_5ug3 1 536 1 . . 1 1 14 14 ASN H H . . . 1 1 10 10 VAL O O . . . . . 2.200 1.730 2.700 . . . . . A . 14 ASN H . . A . 10 VAL O . A . 14 . HN . . . A . 10 . O . . c30225_5ug3 1 537 1 . . 1 1 15 15 ASN H H . . . 1 1 11 11 CYS O O . . . . . 2.200 1.730 2.700 . . . . . A . 15 ASN H . . A . 11 CYS O . A . 15 . HN . . . A . 11 . O . . c30225_5ug3 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 1 2 7 2 7 c30225_5ug3 1 2 2 12 7 12 7 c30225_5ug3 1 3 3 22 7 22 7 c30225_5ug3 1 4 4 32 7 32 7 c30225_5ug3 1 5 6 42 7 42 7 c30225_5ug3 1 6 7 52 7 52 7 c30225_5ug3 1 7 9 62 7 62 7 c30225_5ug3 1 8 11 72 7 72 7 c30225_5ug3 1 9 13 82 7 82 7 c30225_5ug3 1 10 14 92 7 92 7 c30225_5ug3 1 11 15 102 7 102 7 c30225_5ug3 1 12 16 112 7 112 7 c30225_5ug3 1 13 18 122 7 122 7 c30225_5ug3 1 14 19 132 7 132 7 c30225_5ug3 1 15 20 142 7 142 7 c30225_5ug3 1 16 21 152 7 152 7 c30225_5ug3 1 17 22 162 7 162 7 c30225_5ug3 1 18 24 172 7 172 7 c30225_5ug3 1 19 25 182 7 182 7 c30225_5ug3 1 20 26 192 7 192 7 c30225_5ug3 1 21 27 202 7 202 7 c30225_5ug3 1 22 28 212 7 212 7 c30225_5ug3 1 23 29 222 7 222 7 c30225_5ug3 1 24 30 232 7 232 7 c30225_5ug3 1 25 33 242 7 242 7 c30225_5ug3 1 26 34 252 7 252 7 c30225_5ug3 1 27 36 262 7 262 7 c30225_5ug3 1 28 37 272 7 272 7 c30225_5ug3 1 29 40 282 7 282 7 c30225_5ug3 1 30 41 292 7 292 7 c30225_5ug3 1 31 42 302 7 302 7 c30225_5ug3 1 32 43 312 7 312 7 c30225_5ug3 1 33 44 322 7 322 7 c30225_5ug3 1 34 45 332 7 332 7 c30225_5ug3 1 35 46 342 7 342 7 c30225_5ug3 1 36 47 352 7 352 7 c30225_5ug3 1 37 48 362 7 362 7 c30225_5ug3 1 38 49 372 7 372 7 c30225_5ug3 1 39 52 382 7 382 7 c30225_5ug3 1 40 53 392 7 392 7 c30225_5ug3 1 41 54 402 7 402 7 c30225_5ug3 1 42 56 412 7 412 7 c30225_5ug3 1 43 57 422 7 422 7 c30225_5ug3 1 44 59 432 7 432 7 c30225_5ug3 1 45 61 442 7 442 7 c30225_5ug3 1 46 62 452 7 452 7 c30225_5ug3 1 47 63 462 7 462 7 c30225_5ug3 1 48 64 472 7 472 7 c30225_5ug3 1 49 66 482 7 482 7 c30225_5ug3 1 50 67 492 7 492 7 c30225_5ug3 1 51 68 502 7 502 7 c30225_5ug3 1 52 69 512 7 512 7 c30225_5ug3 1 53 70 522 7 522 7 c30225_5ug3 1 54 71 532 7 532 7 c30225_5ug3 1 55 72 542 7 542 7 c30225_5ug3 1 56 73 552 7 552 7 c30225_5ug3 1 57 74 562 7 562 7 c30225_5ug3 1 58 76 572 7 572 7 c30225_5ug3 1 59 79 582 7 582 7 c30225_5ug3 1 60 81 592 7 592 7 c30225_5ug3 1 61 85 602 7 602 7 c30225_5ug3 1 62 86 612 7 612 7 c30225_5ug3 1 63 87 622 7 622 7 c30225_5ug3 1 64 88 632 7 632 7 c30225_5ug3 1 65 89 642 7 642 7 c30225_5ug3 1 66 90 652 7 652 7 c30225_5ug3 1 67 92 662 7 662 7 c30225_5ug3 1 68 93 672 7 672 7 c30225_5ug3 1 69 94 682 7 682 7 c30225_5ug3 1 70 97 692 7 692 7 c30225_5ug3 1 71 98 702 7 702 7 c30225_5ug3 1 72 103 712 7 712 7 c30225_5ug3 1 73 104 722 7 722 7 c30225_5ug3 1 74 105 732 7 732 7 c30225_5ug3 1 75 106 742 7 742 7 c30225_5ug3 1 76 107 752 7 752 7 c30225_5ug3 1 77 108 762 7 762 7 c30225_5ug3 1 78 109 772 7 772 7 c30225_5ug3 1 79 110 782 7 782 7 c30225_5ug3 1 80 111 792 7 792 7 c30225_5ug3 1 81 112 802 7 802 7 c30225_5ug3 1 82 114 812 7 812 7 c30225_5ug3 1 83 115 822 7 822 7 c30225_5ug3 1 84 116 832 7 832 7 c30225_5ug3 1 85 118 842 7 842 7 c30225_5ug3 1 86 119 852 7 852 7 c30225_5ug3 1 87 120 862 7 862 7 c30225_5ug3 1 88 121 872 7 872 7 c30225_5ug3 1 89 123 882 7 882 7 c30225_5ug3 1 90 125 892 7 892 7 c30225_5ug3 1 91 126 902 7 902 7 c30225_5ug3 1 92 127 912 7 912 7 c30225_5ug3 1 93 128 922 7 922 7 c30225_5ug3 1 94 131 932 7 932 7 c30225_5ug3 1 95 132 942 7 942 7 c30225_5ug3 1 96 134 952 7 952 7 c30225_5ug3 1 97 136 962 7 962 7 c30225_5ug3 1 98 137 972 7 972 7 c30225_5ug3 1 99 138 982 7 982 7 c30225_5ug3 1 100 139 992 7 992 7 c30225_5ug3 1 101 140 1002 7 1002 7 c30225_5ug3 1 102 141 1012 7 1012 7 c30225_5ug3 1 103 142 1022 7 1022 7 c30225_5ug3 1 104 143 1032 7 1032 7 c30225_5ug3 1 105 144 1042 7 1042 7 c30225_5ug3 1 106 145 1052 7 1052 7 c30225_5ug3 1 107 148 1062 7 1062 7 c30225_5ug3 1 108 149 1072 7 1072 7 c30225_5ug3 1 109 152 1082 7 1082 7 c30225_5ug3 1 110 154 1092 7 1092 7 c30225_5ug3 1 111 155 1102 7 1102 7 c30225_5ug3 1 112 158 1112 7 1112 7 c30225_5ug3 1 113 159 1122 7 1122 7 c30225_5ug3 1 114 160 1132 7 1132 7 c30225_5ug3 1 115 161 1142 7 1142 7 c30225_5ug3 1 116 162 1152 7 1152 7 c30225_5ug3 1 117 163 1162 7 1162 7 c30225_5ug3 1 118 164 1172 7 1172 7 c30225_5ug3 1 119 165 1182 7 1182 7 c30225_5ug3 1 120 166 1192 7 1192 7 c30225_5ug3 1 121 167 1202 7 1202 7 c30225_5ug3 1 122 168 1212 7 1212 7 c30225_5ug3 1 123 169 1222 7 1222 7 c30225_5ug3 1 124 172 1232 7 1232 7 c30225_5ug3 1 125 174 1242 7 1242 7 c30225_5ug3 1 126 176 1252 7 1252 7 c30225_5ug3 1 127 178 1262 7 1262 7 c30225_5ug3 1 128 179 1272 7 1272 7 c30225_5ug3 1 129 180 1282 7 1282 7 c30225_5ug3 1 130 181 1292 7 1292 7 c30225_5ug3 1 131 182 1302 7 1302 7 c30225_5ug3 1 132 183 1312 7 1312 7 c30225_5ug3 1 133 184 1322 7 1322 7 c30225_5ug3 1 134 185 1332 7 1332 7 c30225_5ug3 1 135 186 1342 7 1342 7 c30225_5ug3 1 136 187 1352 7 1352 7 c30225_5ug3 1 137 188 1362 7 1362 7 c30225_5ug3 1 138 190 1372 7 1372 7 c30225_5ug3 1 139 191 1382 7 1382 7 c30225_5ug3 1 140 192 1392 7 1392 7 c30225_5ug3 1 141 193 1402 7 1402 7 c30225_5ug3 1 142 194 1412 7 1412 7 c30225_5ug3 1 143 196 1422 7 1422 7 c30225_5ug3 1 144 197 1432 7 1432 7 c30225_5ug3 1 145 198 1442 7 1442 7 c30225_5ug3 1 146 199 1452 7 1452 7 c30225_5ug3 1 147 202 1462 7 1462 7 c30225_5ug3 1 148 203 1472 7 1472 7 c30225_5ug3 1 149 204 1482 7 1482 7 c30225_5ug3 1 150 206 1492 7 1492 7 c30225_5ug3 1 151 207 1502 7 1502 7 c30225_5ug3 1 152 209 1512 7 1512 7 c30225_5ug3 1 153 211 1522 7 1522 7 c30225_5ug3 1 154 212 1532 7 1532 7 c30225_5ug3 1 155 213 1542 7 1542 7 c30225_5ug3 1 156 214 1552 7 1552 7 c30225_5ug3 1 157 215 1562 7 1562 7 c30225_5ug3 1 158 216 1572 7 1572 7 c30225_5ug3 1 159 217 1582 7 1582 7 c30225_5ug3 1 160 218 1592 7 1592 7 c30225_5ug3 1 161 219 1602 7 1602 7 c30225_5ug3 1 162 220 1612 7 1612 7 c30225_5ug3 1 163 221 1622 7 1622 7 c30225_5ug3 1 164 222 1632 7 1632 7 c30225_5ug3 1 165 223 1642 7 1642 7 c30225_5ug3 1 166 224 1652 7 1652 7 c30225_5ug3 1 167 225 1662 7 1662 7 c30225_5ug3 1 168 225 1670 5 1670 5 c30225_5ug3 1 169 227 1678 7 1678 7 c30225_5ug3 1 170 228 1688 7 1688 7 c30225_5ug3 1 171 229 1698 7 1698 7 c30225_5ug3 1 172 230 1708 7 1708 7 c30225_5ug3 1 173 231 1718 7 1718 7 c30225_5ug3 1 174 232 1728 7 1728 7 c30225_5ug3 1 175 233 1738 7 1738 7 c30225_5ug3 1 176 234 1748 7 1748 7 c30225_5ug3 1 177 236 1758 7 1758 7 c30225_5ug3 1 178 237 1768 7 1768 7 c30225_5ug3 1 179 238 1778 7 1778 7 c30225_5ug3 1 180 239 1788 7 1788 7 c30225_5ug3 1 181 240 1798 7 1798 7 c30225_5ug3 1 182 241 1808 7 1808 7 c30225_5ug3 1 183 242 1818 7 1818 7 c30225_5ug3 1 184 245 1828 7 1828 7 c30225_5ug3 1 185 246 1838 7 1838 7 c30225_5ug3 1 186 247 1848 7 1848 7 c30225_5ug3 1 187 248 1858 7 1858 7 c30225_5ug3 1 188 250 1868 7 1868 7 c30225_5ug3 1 189 251 1878 7 1878 7 c30225_5ug3 1 190 254 1888 7 1888 7 c30225_5ug3 1 191 255 1898 7 1898 7 c30225_5ug3 1 192 256 1908 7 1908 7 c30225_5ug3 1 193 257 1918 7 1918 7 c30225_5ug3 1 194 258 1928 7 1928 7 c30225_5ug3 1 195 259 1938 7 1938 7 c30225_5ug3 1 196 260 1948 7 1948 7 c30225_5ug3 1 197 261 1958 7 1958 7 c30225_5ug3 1 198 262 1968 7 1968 7 c30225_5ug3 1 199 263 1978 7 1978 7 c30225_5ug3 1 200 264 1988 7 1988 7 c30225_5ug3 1 201 265 1998 7 1998 7 c30225_5ug3 1 202 266 2008 7 2008 7 c30225_5ug3 1 203 267 2018 7 2018 7 c30225_5ug3 1 204 268 2028 7 2028 7 c30225_5ug3 1 205 270 2038 7 2038 7 c30225_5ug3 1 206 273 2048 7 2048 7 c30225_5ug3 1 207 274 2058 7 2058 7 c30225_5ug3 1 208 275 2068 7 2068 7 c30225_5ug3 1 209 276 2078 7 2078 7 c30225_5ug3 1 210 277 2088 7 2088 7 c30225_5ug3 1 211 278 2098 7 2098 7 c30225_5ug3 1 212 279 2108 7 2108 7 c30225_5ug3 1 213 280 2118 7 2118 7 c30225_5ug3 1 214 281 2128 7 2128 7 c30225_5ug3 1 215 282 2138 7 2138 7 c30225_5ug3 1 216 283 2148 7 2148 7 c30225_5ug3 1 217 284 2158 7 2158 7 c30225_5ug3 1 218 285 2168 7 2168 7 c30225_5ug3 1 219 286 2178 7 2178 7 c30225_5ug3 1 220 287 2188 7 2188 7 c30225_5ug3 1 221 289 2198 7 2198 7 c30225_5ug3 1 222 290 2208 7 2208 7 c30225_5ug3 1 223 291 2218 7 2218 7 c30225_5ug3 1 224 292 2228 7 2228 7 c30225_5ug3 1 225 294 2238 7 2238 7 c30225_5ug3 1 226 295 2248 7 2248 7 c30225_5ug3 1 227 296 2258 7 2258 7 c30225_5ug3 1 228 298 2268 7 2268 7 c30225_5ug3 1 229 299 2278 7 2278 7 c30225_5ug3 1 230 301 2288 7 2288 7 c30225_5ug3 1 231 303 2298 7 2298 7 c30225_5ug3 1 232 304 2308 7 2308 7 c30225_5ug3 1 233 305 2318 7 2318 7 c30225_5ug3 1 234 306 2328 7 2328 7 c30225_5ug3 1 235 307 2338 7 2338 7 c30225_5ug3 1 236 308 2348 7 2348 7 c30225_5ug3 1 237 309 2358 7 2358 7 c30225_5ug3 1 238 310 2368 7 2368 7 c30225_5ug3 1 239 311 2378 7 2378 7 c30225_5ug3 1 240 315 2388 7 2388 7 c30225_5ug3 1 241 316 2398 7 2398 7 c30225_5ug3 1 242 318 2408 7 2408 7 c30225_5ug3 1 243 321 2418 7 2418 7 c30225_5ug3 1 244 322 2428 7 2428 7 c30225_5ug3 1 245 323 2438 7 2438 7 c30225_5ug3 1 246 324 2448 7 2448 7 c30225_5ug3 1 247 325 2458 7 2458 7 c30225_5ug3 1 248 326 2468 7 2468 7 c30225_5ug3 1 249 327 2478 7 2478 7 c30225_5ug3 1 250 328 2488 7 2488 7 c30225_5ug3 1 251 329 2498 7 2498 7 c30225_5ug3 1 252 332 2508 7 2508 7 c30225_5ug3 1 253 334 2518 7 2518 7 c30225_5ug3 1 254 335 2528 7 2528 7 c30225_5ug3 1 255 337 2538 7 2538 7 c30225_5ug3 1 256 338 2548 7 2548 7 c30225_5ug3 1 257 339 2558 7 2558 7 c30225_5ug3 1 258 341 2568 7 2568 7 c30225_5ug3 1 259 342 2578 7 2578 7 c30225_5ug3 1 260 343 2588 7 2588 7 c30225_5ug3 1 261 344 2598 7 2598 7 c30225_5ug3 1 262 346 2608 7 2608 7 c30225_5ug3 1 263 348 2618 7 2618 7 c30225_5ug3 1 264 349 2628 7 2628 7 c30225_5ug3 1 265 350 2638 7 2638 7 c30225_5ug3 1 266 351 2648 7 2648 7 c30225_5ug3 1 267 352 2658 7 2658 7 c30225_5ug3 1 268 353 2668 7 2668 7 c30225_5ug3 1 269 354 2678 7 2678 7 c30225_5ug3 1 270 355 2688 7 2688 7 c30225_5ug3 1 271 357 2698 7 2698 7 c30225_5ug3 1 272 358 2708 7 2708 7 c30225_5ug3 1 273 359 2718 7 2718 7 c30225_5ug3 1 274 360 2728 7 2728 7 c30225_5ug3 1 275 362 2738 7 2738 7 c30225_5ug3 1 276 364 2748 7 2748 7 c30225_5ug3 1 277 365 2758 7 2758 7 c30225_5ug3 1 278 366 2768 7 2768 7 c30225_5ug3 1 279 368 2778 7 2778 7 c30225_5ug3 1 280 370 2788 7 2788 7 c30225_5ug3 1 281 371 2798 7 2798 7 c30225_5ug3 1 282 372 2808 7 2808 7 c30225_5ug3 1 283 373 2818 7 2818 7 c30225_5ug3 1 284 374 2828 7 2828 7 c30225_5ug3 1 285 375 2838 7 2838 7 c30225_5ug3 1 286 376 2848 7 2848 7 c30225_5ug3 1 287 377 2858 7 2858 7 c30225_5ug3 1 288 378 2868 7 2868 7 c30225_5ug3 1 289 379 2878 7 2878 7 c30225_5ug3 1 290 380 2888 7 2888 7 c30225_5ug3 1 291 381 2898 7 2898 7 c30225_5ug3 1 292 382 2908 7 2908 7 c30225_5ug3 1 293 383 2918 7 2918 7 c30225_5ug3 1 294 384 2928 7 2928 7 c30225_5ug3 1 295 385 2938 7 2938 7 c30225_5ug3 1 296 386 2948 7 2948 7 c30225_5ug3 1 297 387 2958 7 2958 7 c30225_5ug3 1 298 388 2968 7 2968 7 c30225_5ug3 1 299 389 2978 7 2978 7 c30225_5ug3 1 300 391 2988 7 2988 7 c30225_5ug3 1 301 392 2998 7 2998 7 c30225_5ug3 1 302 393 3008 7 3008 7 c30225_5ug3 1 303 393 3016 5 3016 5 c30225_5ug3 1 304 394 3024 7 3024 7 c30225_5ug3 1 305 395 3034 7 3034 7 c30225_5ug3 1 306 397 3044 7 3044 7 c30225_5ug3 1 307 398 3054 7 3054 7 c30225_5ug3 1 308 399 3064 7 3064 7 c30225_5ug3 1 309 400 3074 7 3074 7 c30225_5ug3 1 310 401 3084 7 3084 7 c30225_5ug3 1 311 403 3094 7 3094 7 c30225_5ug3 1 312 404 3104 7 3104 7 c30225_5ug3 1 313 405 3114 7 3114 7 c30225_5ug3 1 314 407 3124 7 3124 7 c30225_5ug3 1 315 408 3134 7 3134 7 c30225_5ug3 1 316 410 3144 7 3144 7 c30225_5ug3 1 317 412 3154 7 3154 7 c30225_5ug3 1 318 413 3164 7 3164 7 c30225_5ug3 1 319 414 3174 7 3174 7 c30225_5ug3 1 320 415 3184 7 3184 7 c30225_5ug3 1 321 416 3194 7 3194 7 c30225_5ug3 1 322 417 3204 7 3204 7 c30225_5ug3 1 323 418 3214 7 3214 7 c30225_5ug3 1 324 419 3224 7 3224 7 c30225_5ug3 1 325 420 3234 7 3234 7 c30225_5ug3 1 326 421 3244 7 3244 7 c30225_5ug3 1 327 422 3254 7 3254 7 c30225_5ug3 1 328 423 3264 7 3264 7 c30225_5ug3 1 329 424 3274 7 3274 7 c30225_5ug3 1 330 425 3284 7 3284 7 c30225_5ug3 1 331 426 3294 7 3294 7 c30225_5ug3 1 332 427 3304 7 3304 7 c30225_5ug3 1 333 428 3314 7 3314 7 c30225_5ug3 1 334 430 3324 7 3324 7 c30225_5ug3 1 335 431 3334 7 3334 7 c30225_5ug3 1 336 432 3344 7 3344 7 c30225_5ug3 1 337 433 3354 7 3354 7 c30225_5ug3 1 338 435 3364 7 3364 7 c30225_5ug3 1 339 436 3374 7 3374 7 c30225_5ug3 1 340 437 3384 7 3384 7 c30225_5ug3 1 341 440 3394 7 3394 7 c30225_5ug3 1 342 441 3404 7 3404 7 c30225_5ug3 1 343 443 3414 7 3414 7 c30225_5ug3 1 344 445 3424 7 3424 7 c30225_5ug3 1 345 446 3434 7 3434 7 c30225_5ug3 1 346 448 3444 7 3444 7 c30225_5ug3 1 347 449 3454 7 3454 7 c30225_5ug3 1 348 450 3464 7 3464 7 c30225_5ug3 1 349 451 3474 7 3474 7 c30225_5ug3 1 350 452 3484 7 3484 7 c30225_5ug3 1 351 453 3494 7 3494 7 c30225_5ug3 1 352 454 3504 7 3504 7 c30225_5ug3 1 353 455 3514 7 3514 7 c30225_5ug3 1 354 456 3524 7 3524 7 c30225_5ug3 1 355 457 3534 7 3534 7 c30225_5ug3 1 356 458 3544 7 3544 7 c30225_5ug3 1 357 460 3554 7 3554 7 c30225_5ug3 1 358 462 3564 7 3564 7 c30225_5ug3 1 359 463 3574 7 3574 7 c30225_5ug3 1 360 464 3584 7 3584 7 c30225_5ug3 1 361 465 3594 7 3594 7 c30225_5ug3 1 362 466 3604 7 3604 7 c30225_5ug3 1 363 467 3614 7 3614 7 c30225_5ug3 1 364 468 3624 7 3624 7 c30225_5ug3 1 365 469 3634 7 3634 7 c30225_5ug3 1 366 470 3644 7 3644 7 c30225_5ug3 1 367 471 3654 7 3654 7 c30225_5ug3 1 368 472 3664 7 3664 7 c30225_5ug3 1 369 473 3674 7 3674 7 c30225_5ug3 1 370 474 3684 7 3684 7 c30225_5ug3 1 371 475 3694 7 3694 7 c30225_5ug3 1 372 476 3704 7 3704 7 c30225_5ug3 1 373 477 3714 7 3714 7 c30225_5ug3 1 374 478 3724 7 3724 7 c30225_5ug3 1 375 479 3734 7 3734 7 c30225_5ug3 1 376 480 3744 7 3744 7 c30225_5ug3 1 377 481 3754 7 3754 7 c30225_5ug3 1 378 482 3764 7 3764 7 c30225_5ug3 1 379 483 3774 7 3774 7 c30225_5ug3 1 380 484 3784 7 3784 7 c30225_5ug3 1 381 485 3794 7 3794 7 c30225_5ug3 1 382 486 3804 7 3804 7 c30225_5ug3 1 383 487 3814 7 3814 7 c30225_5ug3 1 384 488 3824 7 3824 7 c30225_5ug3 1 385 489 3834 7 3834 7 c30225_5ug3 1 386 490 3844 7 3844 7 c30225_5ug3 1 387 491 3854 7 3854 7 c30225_5ug3 1 388 492 3864 7 3864 7 c30225_5ug3 1 389 493 3874 7 3874 7 c30225_5ug3 1 390 494 3884 7 3884 7 c30225_5ug3 1 391 495 3894 7 3894 7 c30225_5ug3 1 392 496 3904 7 3904 7 c30225_5ug3 1 393 497 3914 7 3914 7 c30225_5ug3 1 394 498 3924 7 3924 7 c30225_5ug3 1 395 499 3934 7 3934 7 c30225_5ug3 1 396 500 3944 7 3944 7 c30225_5ug3 1 397 501 3954 7 3954 7 c30225_5ug3 1 398 503 3964 7 3964 7 c30225_5ug3 1 399 504 3974 7 3974 7 c30225_5ug3 1 400 505 3984 7 3984 7 c30225_5ug3 1 401 506 3994 7 3994 7 c30225_5ug3 1 402 507 4004 7 4004 7 c30225_5ug3 1 403 508 4014 7 4014 7 c30225_5ug3 1 404 509 4024 7 4024 7 c30225_5ug3 1 405 510 4034 7 4034 7 c30225_5ug3 1 406 511 4044 7 4044 7 c30225_5ug3 1 407 512 4054 7 4054 7 c30225_5ug3 1 408 513 4064 7 4064 7 c30225_5ug3 1 409 514 4074 7 4074 7 c30225_5ug3 1 410 515 4084 7 4084 7 c30225_5ug3 1 411 516 4094 7 4094 7 c30225_5ug3 1 412 517 4104 7 4104 7 c30225_5ug3 1 413 517 4112 5 4112 5 c30225_5ug3 1 414 518 4120 7 4120 7 c30225_5ug3 1 415 519 4130 7 4130 7 c30225_5ug3 1 416 520 4140 7 4140 7 c30225_5ug3 1 417 521 4150 7 4150 7 c30225_5ug3 1 418 522 4160 7 4160 7 c30225_5ug3 1 419 523 4170 7 4170 7 c30225_5ug3 1 420 524 4180 7 4180 7 c30225_5ug3 1 421 525 4190 7 4190 7 c30225_5ug3 1 422 526 4200 7 4200 7 c30225_5ug3 1 423 527 4210 7 4210 7 c30225_5ug3 1 424 528 4220 7 4220 7 c30225_5ug3 1 425 529 4230 7 4230 7 c30225_5ug3 1 426 530 4240 7 4240 7 c30225_5ug3 1 427 531 4250 7 4250 7 c30225_5ug3 1 428 532 4260 7 4260 7 c30225_5ug3 1 429 533 4270 7 4270 7 c30225_5ug3 1 430 534 4280 7 4280 7 c30225_5ug3 1 431 535 4290 7 4290 7 c30225_5ug3 1 432 536 4300 7 4300 7 c30225_5ug3 1 433 537 4310 7 4310 7 c30225_5ug3 1 434 538 4320 7 4320 7 c30225_5ug3 1 435 538 4328 5 4328 5 c30225_5ug3 1 436 539 4336 7 4336 7 c30225_5ug3 1 437 540 4346 7 4346 7 c30225_5ug3 1 438 542 4356 7 4356 7 c30225_5ug3 1 439 544 4366 7 4366 7 c30225_5ug3 1 440 545 4376 7 4376 7 c30225_5ug3 1 441 546 4386 7 4386 7 c30225_5ug3 1 442 546 4394 5 4394 5 c30225_5ug3 1 443 547 4402 7 4402 7 c30225_5ug3 1 444 549 4412 7 4412 7 c30225_5ug3 1 445 550 4422 7 4422 7 c30225_5ug3 1 446 551 4432 7 4432 7 c30225_5ug3 1 447 552 4442 7 4442 7 c30225_5ug3 1 448 554 4452 7 4452 7 c30225_5ug3 1 449 555 4462 7 4462 7 c30225_5ug3 1 450 557 4472 7 4472 7 c30225_5ug3 1 451 558 4482 7 4482 7 c30225_5ug3 1 452 559 4492 7 4492 7 c30225_5ug3 1 453 560 4502 7 4502 7 c30225_5ug3 1 454 560 4510 5 4510 5 c30225_5ug3 1 455 561 4518 7 4518 7 c30225_5ug3 1 456 562 4528 7 4528 7 c30225_5ug3 1 457 563 4538 7 4538 7 c30225_5ug3 1 458 564 4548 7 4548 7 c30225_5ug3 1 459 565 4558 7 4558 7 c30225_5ug3 1 460 566 4568 7 4568 7 c30225_5ug3 1 461 567 4578 7 4578 7 c30225_5ug3 1 462 568 4588 7 4588 7 c30225_5ug3 1 463 568 4596 5 4596 5 c30225_5ug3 1 464 568 4602 5 4602 5 c30225_5ug3 1 465 569 4610 7 4610 7 c30225_5ug3 1 466 570 4620 7 4620 7 c30225_5ug3 1 467 571 4630 7 4630 7 c30225_5ug3 1 468 571 4638 5 4638 5 c30225_5ug3 1 469 571 4644 5 4644 5 c30225_5ug3 1 470 571 4650 5 4650 5 c30225_5ug3 1 471 572 4658 7 4658 7 c30225_5ug3 1 472 573 4668 7 4668 7 c30225_5ug3 1 473 573 4676 5 4676 5 c30225_5ug3 1 474 573 4682 5 4682 5 c30225_5ug3 1 475 573 4688 5 4688 5 c30225_5ug3 1 476 574 4696 7 4696 7 c30225_5ug3 1 477 575 4706 7 4706 7 c30225_5ug3 1 478 576 4716 7 4716 7 c30225_5ug3 1 479 577 4726 7 4726 7 c30225_5ug3 1 480 578 4736 7 4736 7 c30225_5ug3 1 481 579 4746 7 4746 7 c30225_5ug3 1 482 580 4756 7 4756 7 c30225_5ug3 1 483 581 4766 7 4766 7 c30225_5ug3 1 484 582 4776 7 4776 7 c30225_5ug3 1 485 583 4786 7 4786 7 c30225_5ug3 1 486 583 4794 5 4794 5 c30225_5ug3 1 487 583 4800 5 4800 5 c30225_5ug3 1 488 584 4808 7 4808 7 c30225_5ug3 1 489 584 4816 5 4816 5 c30225_5ug3 1 490 584 4822 5 4822 5 c30225_5ug3 1 491 585 4830 7 4830 7 c30225_5ug3 1 492 586 4840 7 4840 7 c30225_5ug3 1 493 587 4850 7 4850 7 c30225_5ug3 1 494 588 4860 7 4860 7 c30225_5ug3 1 495 589 4870 7 4870 7 c30225_5ug3 1 496 590 4880 7 4880 7 c30225_5ug3 1 497 591 4890 7 4890 7 c30225_5ug3 1 498 593 4900 7 4900 7 c30225_5ug3 1 499 594 4910 7 4910 7 c30225_5ug3 1 500 595 4920 7 4920 7 c30225_5ug3 1 501 596 4930 7 4930 7 c30225_5ug3 1 502 597 4940 7 4940 7 c30225_5ug3 1 503 598 4950 7 4950 7 c30225_5ug3 1 504 599 4960 7 4960 7 c30225_5ug3 1 505 600 4970 7 4970 7 c30225_5ug3 1 506 601 4980 7 4980 7 c30225_5ug3 1 507 602 4990 7 4990 7 c30225_5ug3 1 508 603 5000 7 5000 7 c30225_5ug3 1 509 605 5010 7 5010 7 c30225_5ug3 1 510 606 5020 7 5020 7 c30225_5ug3 1 511 607 5030 7 5030 7 c30225_5ug3 1 512 608 5040 7 5040 7 c30225_5ug3 1 513 609 5050 7 5050 7 c30225_5ug3 1 514 610 5060 7 5060 7 c30225_5ug3 1 515 611 5070 7 5070 7 c30225_5ug3 1 516 612 5080 7 5080 7 c30225_5ug3 1 517 613 5090 7 5090 7 c30225_5ug3 1 518 614 5100 7 5100 7 c30225_5ug3 1 519 615 5110 7 5110 7 c30225_5ug3 1 520 615 5118 5 5118 5 c30225_5ug3 1 521 616 5126 7 5126 7 c30225_5ug3 1 522 617 5136 7 5136 7 c30225_5ug3 1 523 617 5144 5 5144 5 c30225_5ug3 1 524 618 5152 7 5152 7 c30225_5ug3 1 525 619 5162 7 5162 7 c30225_5ug3 1 526 620 5172 7 5172 7 c30225_5ug3 1 527 621 5182 7 5182 7 c30225_5ug3 1 528 622 5192 7 5192 7 c30225_5ug3 1 529 623 5202 7 5202 7 c30225_5ug3 1 530 623 5210 5 5210 5 c30225_5ug3 1 531 624 5218 7 5218 7 c30225_5ug3 1 532 625 5228 7 5228 7 c30225_5ug3 1 533 626 5238 7 5238 7 c30225_5ug3 1 534 627 5248 7 5248 7 c30225_5ug3 1 535 628 5258 7 5258 7 c30225_5ug3 1 536 629 5268 7 5268 7 c30225_5ug3 1 537 630 5278 7 5278 7 c30225_5ug3 1 538 631 5288 7 5288 7 c30225_5ug3 1 539 632 5298 7 5298 7 c30225_5ug3 1 540 633 5308 7 5308 7 c30225_5ug3 1 541 634 5318 7 5318 7 c30225_5ug3 1 542 635 5328 7 5328 7 c30225_5ug3 1 543 636 5338 7 5338 7 c30225_5ug3 1 544 638 5348 7 5348 7 c30225_5ug3 1 545 639 5358 7 5358 7 c30225_5ug3 1 546 640 5368 7 5368 7 c30225_5ug3 1 547 641 5378 7 5378 7 c30225_5ug3 1 548 642 5388 7 5388 7 c30225_5ug3 1 549 643 5398 7 5398 7 c30225_5ug3 1 550 644 5408 7 5408 7 c30225_5ug3 1 551 646 5418 7 5418 7 c30225_5ug3 1 552 646 5426 5 5426 5 c30225_5ug3 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: design5_restraints' 1 1 1 39 c30225_5ug3 1 2 '# Restraints file 2: H-bonds_restrains_design5' 5434 1 5434 46 c30225_5ug3 1 stop_ save_ save_CNS/XPLOR_dihedral_3 _Torsion_angle_constraint_list.Sf_category torsion_angle_constraints _Torsion_angle_constraint_list.Sf_framecode CNS/XPLOR_dihedral_3 _Torsion_angle_constraint_list.Entry_ID c30225_5ug3 _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 3 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 . . . . c30225_5ug3 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 3 3 ASP C C . . 1 1 4 4 GLU N N . . 1 1 4 4 GLU CA C . . 1 1 4 4 GLU C C . -113.3 -27.9 . . . A . 3 ASP C . . A . 4 GLU N . . A . 4 GLU CA . . A . 4 GLU C . . . 3 . C . . . . . 4 . N . . . . . 4 . CA . . . . . 4 . C . . c30225_5ug3 1 2 . . 1 1 4 4 GLU N N . . 1 1 4 4 GLU CA C . . 1 1 4 4 GLU C C . . 1 1 5 5 CYS N N . -60.9 24.7 . . . A . 4 GLU N . . A . 4 GLU CA . . A . 4 GLU C . . A . 5 CYS N . . . 4 . N . . . . . 4 . CA . . . . . 4 . C . . . . . 5 . N . . c30225_5ug3 1 3 . . 1 1 4 4 GLU C C . . 1 1 5 5 CYS N N . . 1 1 5 5 CYS CA C . . 1 1 5 5 CYS C C . -91.2 -50.2 . . . A . 4 GLU C . . A . 5 CYS N . . A . 5 CYS CA . . A . 5 CYS C . . . 4 . C . . . . . 5 . N . . . . . 5 . CA . . . . . 5 . C . . c30225_5ug3 1 4 . . 1 1 5 5 CYS N N . . 1 1 5 5 CYS CA C . . 1 1 5 5 CYS C C . . 1 1 6 6 CYS N N . -54.0 -8.4 . . . A . 5 CYS N . . A . 5 CYS CA . . A . 5 CYS C . . A . 6 CYS N . . . 5 . N . . . . . 5 . CA . . . . . 5 . C . . . . . 6 . N . . c30225_5ug3 1 5 . . 1 1 5 5 CYS C C . . 1 1 6 6 CYS N N . . 1 1 6 6 CYS CA C . . 1 1 6 6 CYS C C . -122.3 -44.9 . . . A . 5 CYS C . . A . 6 CYS N . . A . 6 CYS CA . . A . 6 CYS C . . . 5 . C . . . . . 6 . N . . . . . 6 . CA . . . . . 6 . C . . c30225_5ug3 1 6 . . 1 1 6 6 CYS N N . . 1 1 6 6 CYS CA C . . 1 1 6 6 CYS C C . . 1 1 7 7 SER N N . -63.1 9.1 . . . A . 6 CYS N . . A . 6 CYS CA . . A . 6 CYS C . . A . 7 SER N . . . 6 . N . . . . . 6 . CA . . . . . 6 . C . . . . . 7 . N . . c30225_5ug3 1 7 . . 1 1 6 6 CYS C C . . 1 1 7 7 SER N N . . 1 1 7 7 SER CA C . . 1 1 7 7 SER C C . -104.7 -64.7 . . . A . 6 CYS C . . A . 7 SER N . . A . 7 SER CA . . A . 7 SER C . . . 6 . C . . . . . 7 . N . . . . . 7 . CA . . . . . 7 . C . . c30225_5ug3 1 8 . . 1 1 7 7 SER N N . . 1 1 7 7 SER CA C . . 1 1 7 7 SER C C . . 1 1 8 8 ASN N N . -57.1 33.9 . . . A . 7 SER N . . A . 7 SER CA . . A . 7 SER C . . A . 8 ASN N . . . 7 . N . . . . . 7 . CA . . . . . 7 . C . . . . . 8 . N . . c30225_5ug3 1 9 . . 1 1 7 7 SER C C . . 1 1 8 8 ASN N N . . 1 1 8 8 ASN CA C . . 1 1 8 8 ASN C C . -135.8 -45.0 . . . A . 7 SER C . . A . 8 ASN N . . A . 8 ASN CA . . A . 8 ASN C . . . 7 . C . . . . . 8 . N . . . . . 8 . CA . . . . . 8 . C . . c30225_5ug3 1 10 . . 1 1 8 8 ASN N N . . 1 1 8 8 ASN CA C . . 1 1 8 8 ASN C C . . 1 1 9 9 PRO N N . 66.3 158.7 . . . A . 8 ASN N . . A . 8 ASN CA . . A . 8 ASN C . . A . 9 PRO N . . . 8 . N . . . . . 8 . CA . . . . . 8 . C . . . . . 9 . N . . c30225_5ug3 1 11 . . 1 1 8 8 ASN C C . . 1 1 9 9 PRO N N . . 1 1 9 9 PRO CA C . . 1 1 9 9 PRO C C . -74.0 -34.0 . . . A . 8 ASN C . . A . 9 PRO N . . A . 9 PRO CA . . A . 9 PRO C . . . 8 . C . . . . . 9 . N . . . . . 9 . CA . . . . . 9 . C . . c30225_5ug3 1 12 . . 1 1 9 9 PRO N N . . 1 1 9 9 PRO CA C . . 1 1 9 9 PRO C C . . 1 1 10 10 VAL N N . -53.8 -13.8 . . . A . 9 PRO N . . A . 9 PRO CA . . A . 9 PRO C . . A . 10 VAL N . . . 9 . N . . . . . 9 . CA . . . . . 9 . C . . . . . 10 . N . . c30225_5ug3 1 13 . . 1 1 9 9 PRO C C . . 1 1 10 10 VAL N N . . 1 1 10 10 VAL CA C . . 1 1 10 10 VAL C C . -83.4 -43.4 . . . A . 9 PRO C . . A . 10 VAL N . . A . 10 VAL CA . . A . 10 VAL C . . . 9 . C . . . . . 10 . N . . . . . 10 . CA . . . . . 10 . C . . c30225_5ug3 1 14 . . 1 1 10 10 VAL N N . . 1 1 10 10 VAL CA C . . 1 1 10 10 VAL C C . . 1 1 11 11 CYS N N . -61.9 -21.9 . . . A . 10 VAL N . . A . 10 VAL CA . . A . 10 VAL C . . A . 11 CYS N . . . 10 . N . . . . . 10 . CA . . . . . 10 . C . . . . . 11 . N . . c30225_5ug3 1 15 . . 1 1 10 10 VAL C C . . 1 1 11 11 CYS N N . . 1 1 11 11 CYS CA C . . 1 1 11 11 CYS C C . -86.6 -46.6 . . . A . 10 VAL C . . A . 11 CYS N . . A . 11 CYS CA . . A . 11 CYS C . . . 10 . C . . . . . 11 . N . . . . . 11 . CA . . . . . 11 . C . . c30225_5ug3 1 16 . . 1 1 11 11 CYS N N . . 1 1 11 11 CYS CA C . . 1 1 11 11 CYS C C . . 1 1 12 12 ARG N N . -60.2 -20.2 . . . A . 11 CYS N . . A . 11 CYS CA . . A . 11 CYS C . . A . 12 ARG N . . . 11 . N . . . . . 11 . CA . . . . . 11 . C . . . . . 12 . N . . c30225_5ug3 1 17 . . 1 1 11 11 CYS C C . . 1 1 12 12 ARG N N . . 1 1 12 12 ARG CA C . . 1 1 12 12 ARG C C . -81.9 -41.9 . . . A . 11 CYS C . . A . 12 ARG N . . A . 12 ARG CA . . A . 12 ARG C . . . 11 . C . . . . . 12 . N . . . . . 12 . CA . . . . . 12 . C . . c30225_5ug3 1 18 . . 1 1 12 12 ARG N N . . 1 1 12 12 ARG CA C . . 1 1 12 12 ARG C C . . 1 1 13 13 VAL N N . -58.9 -18.9 . . . A . 12 ARG N . . A . 12 ARG CA . . A . 12 ARG C . . A . 13 VAL N . . . 12 . N . . . . . 12 . CA . . . . . 12 . C . . . . . 13 . N . . c30225_5ug3 1 19 . . 1 1 12 12 ARG C C . . 1 1 13 13 VAL N N . . 1 1 13 13 VAL CA C . . 1 1 13 13 VAL C C . -86.9 -46.9 . . . A . 12 ARG C . . A . 13 VAL N . . A . 13 VAL CA . . A . 13 VAL C . . . 12 . C . . . . . 13 . N . . . . . 13 . CA . . . . . 13 . C . . c30225_5ug3 1 20 . . 1 1 13 13 VAL N N . . 1 1 13 13 VAL CA C . . 1 1 13 13 VAL C C . . 1 1 14 14 ASN N N . -60.7 -6.7 . . . A . 13 VAL N . . A . 13 VAL CA . . A . 13 VAL C . . A . 14 ASN N . . . 13 . N . . . . . 13 . CA . . . . . 13 . C . . . . . 14 . N . . c30225_5ug3 1 21 . . 1 1 13 13 VAL C C . . 1 1 14 14 ASN N N . . 1 1 14 14 ASN CA C . . 1 1 14 14 ASN C C . -115.1 -63.9 . . . A . 13 VAL C . . A . 14 ASN N . . A . 14 ASN CA . . A . 14 ASN C . . . 13 . C . . . . . 14 . N . . . . . 14 . CA . . . . . 14 . C . . c30225_5ug3 1 22 . . 1 1 14 14 ASN N N . . 1 1 14 14 ASN CA C . . 1 1 14 14 ASN C C . . 1 1 15 15 ASN N N . -57.7 31.7 . . . A . 14 ASN N . . A . 14 ASN CA . . A . 14 ASN C . . A . 15 ASN N . . . 14 . N . . . . . 14 . CA . . . . . 14 . C . . . . . 15 . N . . c30225_5ug3 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 'error margins are set to conservative default values of double the standard deviation observed in TALOS+, capped at a minimum of +/-20 degree.' 2 3 2 153 c30225_5ug3 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 3: d5talos.tbl # REMARK error margins are set to conservative default values of double the standard deviation observed in TALOS+, capped at a minimum of +/-20 degree. ; 1 1 2 1 c30225_5ug3 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 c30225_5ug3 _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 TOXIN 06-JAN-17 5UG3 *TITLE NMR SOLUTION STRUCTURE OF ALPHA-CONOTOXIN GID MUTANT A10V *COMPND MOL_ID: 1; *COMPND 2 MOLECULE: ALPHA-CONOTOXIN GID; *COMPND 3 CHAIN: A; *COMPND 4 ENGINEERED: YES *SOURCE MOL_ID: 1; *SOURCE 2 SYNTHETIC: YES; *SOURCE 3 ORGANISM_SCIENTIFIC: CONUS GEOGRAPHUS; *SOURCE 4 ORGANISM_COMMON: GEOGRAPHY CONE; *SOURCE 5 ORGANISM_TAXID: 6491 *KEYWDS NEUROTOXIN, NEURONAL NICOTINIC ACETYLCHOLINE RECEPTORS, TOXIN *EXPDTA SOLUTION NMR *NUMMDL 20 *AUTHOR A.K.HUSSEIN,A.E.LEFFLER,H.A.ZEBROSKI,S.R.POWELL,A.KURYATOV, *AUTHOR 2 P.FILIPENKO,J.GORSON,A.HEIZMANN,S.LYSKOV,A.NICKE,J.LINDSTROM,B.RUDY, *AUTHOR 3 R.BONNEAU,M.HOLFORD,S.F.POGET *REVDAT 1 06-SEP-17 5UG3 0' save_