data_c30226_5ug5 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID c30226_5ug5 _Entry.Title ; NMR SOLUTION STRUCTURE OF THE ALPHA-CONOTOXIN GID MUTANT V13Y ; _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. . . . c30226_5ug5 2 A. Leffler A. E. . . c30226_5ug5 3 A. Kuryatov A. . . . c30226_5ug5 4 H. Zebroski H. A. . . c30226_5ug5 5 S. Powell S. R. . . c30226_5ug5 6 P. Filipenko P. . . . c30226_5ug5 7 J. Gorson J. . . . c30226_5ug5 8 A. Heizmann A. . . . c30226_5ug5 9 S. Lyskov S. . . . c30226_5ug5 10 A. Nicke A. . . . c30226_5ug5 11 J. Lindstrom J. . . . c30226_5ug5 12 B. Rudy B. . . . c30226_5ug5 13 R. Bonneau R. . . . c30226_5ug5 14 M. Holford M. . . . c30226_5ug5 15 S. Poget S. F. . . c30226_5ug5 stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID NEUROTOXIN . c30226_5ug5 TOXIN . c30226_5ug5 'neuronal nicotinic acetylcholine receptors (nAChRs)' . c30226_5ug5 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 c30226_5ug5 spectral_peak_list 2 c30226_5ug5 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 34 c30226_5ug5 '1H chemical shifts' 110 c30226_5ug5 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 . c30226_5ug5 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID BMRB 30225 'NMR SOLUTION STRUCTURE OF ALPHA-CONOTOXIN GID MUTANT A10V' c30226_5ug5 PDB 5UG5 'BMRB Entry Tracking System' c30226_5ug5 stop_ save_ ############### # Citations # ############### save_citation_1 _Citation.Sf_category citations _Citation.Sf_framecode citation_1 _Citation.Entry_ID c30226_5ug5 _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 ; NMR SOLUTION STRUCTURE OF THE ALPHA-CONOTOXIN GID MUTANT V13Y ; _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. . . . c30226_5ug5 1 2 A. Leffler A. E. . . c30226_5ug5 1 3 A. Kuryatov A. . . . c30226_5ug5 1 4 H. Zebroski H. A. . . c30226_5ug5 1 5 S. Powell S. R. . . c30226_5ug5 1 6 P. Filipenko P. . . . c30226_5ug5 1 7 J. Gorson J. . . . c30226_5ug5 1 8 A. Heizmann A. . . . c30226_5ug5 1 9 S. Lyskov S. . . . c30226_5ug5 1 10 A. Nicke A. . . . c30226_5ug5 1 11 J. Lindstrom J. . . . c30226_5ug5 1 12 B. Rudy B. . . . c30226_5ug5 1 13 R. Bonneau R. . . . c30226_5ug5 1 14 M. Holford M. . . . c30226_5ug5 1 15 S. Poget S. F. . . c30226_5ug5 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID c30226_5ug5 _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 . . . . . . c30226_5ug5 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID c30226_5ug5 _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 ; IRDECCSNPACRYNNPHVC ; _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 2213.479 _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 . c30226_5ug5 1 2 2 ARG . c30226_5ug5 1 3 3 ASP . c30226_5ug5 1 4 4 GLU . c30226_5ug5 1 5 5 CYS . c30226_5ug5 1 6 6 CYS . c30226_5ug5 1 7 7 SER . c30226_5ug5 1 8 8 ASN . c30226_5ug5 1 9 9 PRO . c30226_5ug5 1 10 10 ALA . c30226_5ug5 1 11 11 CYS . c30226_5ug5 1 12 12 ARG . c30226_5ug5 1 13 13 TYR . c30226_5ug5 1 14 14 ASN . c30226_5ug5 1 15 15 ASN . c30226_5ug5 1 16 16 HYP . c30226_5ug5 1 17 17 HIS . c30226_5ug5 1 18 18 VAL . c30226_5ug5 1 19 19 CYS . c30226_5ug5 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 c30226_5ug5 1 . ARG 2 2 c30226_5ug5 1 . ASP 3 3 c30226_5ug5 1 . GLU 4 4 c30226_5ug5 1 . CYS 5 5 c30226_5ug5 1 . CYS 6 6 c30226_5ug5 1 . SER 7 7 c30226_5ug5 1 . ASN 8 8 c30226_5ug5 1 . PRO 9 9 c30226_5ug5 1 . ALA 10 10 c30226_5ug5 1 . CYS 11 11 c30226_5ug5 1 . ARG 12 12 c30226_5ug5 1 . TYR 13 13 c30226_5ug5 1 . ASN 14 14 c30226_5ug5 1 . ASN 15 15 c30226_5ug5 1 . HYP 16 16 c30226_5ug5 1 . HIS 17 17 c30226_5ug5 1 . VAL 18 18 c30226_5ug5 1 . CYS 19 19 c30226_5ug5 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 c30226_5ug5 _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 . . . . . . . . . . . . . c30226_5ug5 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 c30226_5ug5 _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' . . . . . . . . . . . . . . . . c30226_5ug5 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 c30226_5ug5 _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 c30226_5ug5 HYP C1[C@H](CN[C@@H]1C(=O)O)O SMILES_CANONICAL 'OpenEye OEToolkits' 1.5.0 c30226_5ug5 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 c30226_5ug5 HYP O=C(O)C1NCC(O)C1 SMILES ACDLabs 10.04 c30226_5ug5 HYP O[C@H]1CN[C@@H](C1)C(O)=O SMILES_CANONICAL CACTVS 3.341 c30226_5ug5 HYP O[CH]1CN[CH](C1)C(O)=O SMILES CACTVS 3.341 c30226_5ug5 HYP PMMYEEVYMWASQN-DMTCNVIQSA-N InChIKey InChI 1.03 c30226_5ug5 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 c30226_5ug5 HYP (4R)-4-hydroxy-L-proline 'SYSTEMATIC NAME' ACDLabs 10.04 c30226_5ug5 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 . c30226_5ug5 HYP CA CA CA CA . C . . S 0 . . . 1 no no . . . . -2.955 . 15.768 . 43.044 . -0.384 -0.003 -0.493 2 . c30226_5ug5 HYP C C C C . C . . N 0 . . . 1 no no . . . . -1.447 . 15.609 . 43.030 . -1.811 -0.072 -0.013 3 . c30226_5ug5 HYP O O O O . O . . N 0 . . . 1 no no . . . . -0.722 . 16.484 . 43.503 . -2.233 0.764 0.750 4 . c30226_5ug5 HYP CB CB CB CB . C . . N 0 . . . 1 no no . . . . -3.408 . 16.578 . 41.829 . 0.515 -0.924 0.359 5 . c30226_5ug5 HYP CG CG CG CG . C . . R 0 . . . 1 no no . . . . -4.437 . 17.482 . 42.330 . 1.847 -0.159 0.505 6 . c30226_5ug5 HYP CD CD CD CD . C . . N 0 . . . 1 no no . . . . -4.068 . 17.803 . 43.753 . 1.640 1.159 -0.271 7 . c30226_5ug5 HYP OD1 OD1 OD1 OD . O . . N 0 . . . 1 no no . . . . -5.693 . 16.815 . 42.294 . 2.917 -0.911 -0.071 8 . c30226_5ug5 HYP OXT OXT OXT OXT . O . . N 0 . . . 1 no yes . . . . -0.976 . 14.502 . 42.469 . -2.614 -1.063 -0.433 9 . c30226_5ug5 HYP H H H H . H . . N 0 . . . 1 no yes . . . . -3.980 . 16.047 . 44.765 . -0.107 1.981 -1.028 10 . c30226_5ug5 HYP HA HA HA HA . H . . N 0 . . . 1 no no . . . . -3.385 . 14.756 . 43.068 . -0.325 -0.278 -1.546 11 . c30226_5ug5 HYP HB2 HB2 HB2 1HB . H . . N 0 . . . 1 no no . . . . -2.567 . 17.141 . 41.398 . 0.066 -1.092 1.337 12 . c30226_5ug5 HYP HB3 HB3 HB3 2HB . H . . N 0 . . . 1 no no . . . . -3.790 . 15.930 . 41.026 . 0.678 -1.873 -0.153 13 . c30226_5ug5 HYP HG HG HG HG . H . . N 0 . . . 1 no no . . . . -4.508 . 18.399 . 41.726 . 2.052 0.048 1.555 14 . c30226_5ug5 HYP HD22 HD22 HD22 1HD . H . . N 0 . . . 0 no no . . . . -4.956 . 18.005 . 44.370 . 2.018 1.065 -1.289 15 . c30226_5ug5 HYP HD23 HD23 HD23 2HD . H . . N 0 . . . 0 no no . . . . -3.457 . 18.713 . 43.848 . 2.132 1.985 0.243 16 . c30226_5ug5 HYP HD1 HD1 HD1 HOD . H . . N 0 . . . 1 no no . . . . -5.999 . 16.666 . 43.181 . 3.780 -0.479 -0.009 17 . c30226_5ug5 HYP HXT HXT HXT HXT . H . . N 0 . . . 1 no yes . . . . -0.027 . 14.511 . 42.499 . -3.520 -1.066 -0.098 18 . c30226_5ug5 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 . c30226_5ug5 HYP 2 . SING N CD no N 2 . c30226_5ug5 HYP 3 . SING N H no N 3 . c30226_5ug5 HYP 4 . SING CA C no N 4 . c30226_5ug5 HYP 5 . SING CA CB no N 5 . c30226_5ug5 HYP 6 . SING CA HA no N 6 . c30226_5ug5 HYP 7 . DOUB C O no N 7 . c30226_5ug5 HYP 8 . SING C OXT no N 8 . c30226_5ug5 HYP 9 . SING CB CG no N 9 . c30226_5ug5 HYP 10 . SING CB HB2 no N 10 . c30226_5ug5 HYP 11 . SING CB HB3 no N 11 . c30226_5ug5 HYP 12 . SING CG CD no N 12 . c30226_5ug5 HYP 13 . SING CG OD1 no N 13 . c30226_5ug5 HYP 14 . SING CG HG no N 14 . c30226_5ug5 HYP 15 . SING CD HD22 no N 15 . c30226_5ug5 HYP 16 . SING CD HD23 no N 16 . c30226_5ug5 HYP 17 . SING OD1 HD1 no N 17 . c30226_5ug5 HYP 18 . SING OXT HXT no N 18 . c30226_5ug5 HYP stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID c30226_5ug5 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details '1.5 mM design 8, 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 'design 8' none . . 1 $entity_1 . . 1.5 . . mM 0.3 . . . c30226_5ug5 1 2 H2O 'natural abundance' . . . . . . 90 . . % . . . . c30226_5ug5 1 3 D2O 'natural abundance' . . . . . . 10 . . % . . . . c30226_5ug5 1 stop_ save_ save_sample_2 _Sample.Sf_category sample _Sample.Sf_framecode sample_2 _Sample.Entry_ID c30226_5ug5 _Sample.ID 2 _Sample.Type solution _Sample.Sub_type . _Sample.Details '1.5 mM design 8, 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 'design 8' none . . 1 $entity_1 . . 1.5 . . mM 0.3 . . . c30226_5ug5 2 2 D2O 'natural abundance' . . . . . . 100 . . % . . . . c30226_5ug5 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 c30226_5ug5 _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 c30226_5ug5 1 pH 3 . pH c30226_5ug5 1 pressure 1 . atm c30226_5ug5 1 temperature 280 . K c30226_5ug5 1 stop_ save_ save_sample_conditions_2 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_2 _Sample_condition_list.Entry_ID c30226_5ug5 _Sample_condition_list.ID 2 _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 c30226_5ug5 2 pH 3 . pH c30226_5ug5 2 pressure 1 . atm c30226_5ug5 2 temperature 280 . K c30226_5ug5 2 stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Software.Sf_category software _Software.Sf_framecode software_1 _Software.Entry_ID c30226_5ug5 _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" . . c30226_5ug5 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'structure calculation' c30226_5ug5 1 stop_ save_ save_software_2 _Software.Sf_category software _Software.Sf_framecode software_2 _Software.Entry_ID c30226_5ug5 _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' . . c30226_5ug5 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'structure calculation' c30226_5ug5 2 stop_ save_ save_software_3 _Software.Sf_category software _Software.Sf_framecode software_3 _Software.Entry_ID c30226_5ug5 _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 . . c30226_5ug5 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' c30226_5ug5 3 stop_ save_ save_software_4 _Software.Sf_category software _Software.Sf_framecode software_4 _Software.Entry_ID c30226_5ug5 _Software.ID 4 _Software.Name TALOS _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Cornilescu, Delaglio and Bax' . . c30226_5ug5 4 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'geometry optimization' c30226_5ug5 4 stop_ save_ save_software_5 _Software.Sf_category software _Software.Sf_framecode software_5 _Software.Entry_ID c30226_5ug5 _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' . . c30226_5ug5 5 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID collection c30226_5ug5 5 stop_ save_ save_software_6 _Software.Sf_category software _Software.Sf_framecode software_6 _Software.Entry_ID c30226_5ug5 _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 . . c30226_5ug5 6 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID collection c30226_5ug5 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 c30226_5ug5 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model UNITYPLUS _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_NMR_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_2 _NMR_spectrometer.Entry_ID c30226_5ug5 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 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 c30226_5ug5 _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 Varian UNITYPLUS . 600 . . . c30226_5ug5 1 2 NMR_spectrometer_2 Bruker Avance . 800 . . . c30226_5ug5 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 c30226_5ug5 _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 . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . c30226_5ug5 1 2 '2D 1H-1H NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . c30226_5ug5 1 3 '2D DQF-COSY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . c30226_5ug5 1 4 '2D 1H-1H TOCSY' no . . . . . . . . . . 2 $sample_2 isotropic . . 2 $sample_conditions_2 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . c30226_5ug5 1 5 '2D 1H-13C HSQC' no . . . . . . . . . . 2 $sample_2 isotropic . . 2 $sample_conditions_2 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . c30226_5ug5 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 c30226_5ug5 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID H 1 DSS 'methyl protons' . . . . ppm 0.000 internal direct 1.0 . . . . . c30226_5ug5 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 c30226_5ug5 _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 carbons' . . . . ppm 0.000 internal direct 0.25144953 . . . . . c30226_5ug5 2 H 1 DSS 'methyl protons' . . . . ppm 0.000 internal direct 1.0 . . . . . c30226_5ug5 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 c30226_5ug5 _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 2 _Assigned_chem_shift_list.Chem_shift_reference_label $chem_shift_reference_2 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-1H TOCSY' . . . c30226_5ug5 1 2 '2D 1H-1H NOESY' . . . c30226_5ug5 1 3 '2D DQF-COSY' . . . c30226_5ug5 1 4 '2D 1H-1H TOCSY' . . . c30226_5ug5 1 5 '2D 1H-13C HSQC' . . . c30226_5ug5 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 3.819 0.003 . 1 . 90 . A 1 ILE HA . c30226_5ug5 1 2 . 1 1 1 1 ILE HB H 1 1.922 0.003 . 1 . 91 . A 1 ILE HB . c30226_5ug5 1 3 . 1 1 1 1 ILE HG12 H 1 1.174 0.003 . 2 . 92 . A 1 ILE HG12 . c30226_5ug5 1 4 . 1 1 1 1 ILE HG13 H 1 1.444 0.007 . 2 . 93 . A 1 ILE HG13 . c30226_5ug5 1 5 . 1 1 1 1 ILE HG21 H 1 0.943 0.007 . 1 . 94 . A 1 ILE HG21 . c30226_5ug5 1 6 . 1 1 1 1 ILE HG22 H 1 0.943 0.007 . 1 . 94 . A 1 ILE HG22 . c30226_5ug5 1 7 . 1 1 1 1 ILE HG23 H 1 0.943 0.007 . 1 . 94 . A 1 ILE HG23 . c30226_5ug5 1 8 . 1 1 1 1 ILE HD11 H 1 0.877 0.002 . 1 . 95 . A 1 ILE HD11 . c30226_5ug5 1 9 . 1 1 1 1 ILE HD12 H 1 0.877 0.002 . 1 . 95 . A 1 ILE HD12 . c30226_5ug5 1 10 . 1 1 1 1 ILE HD13 H 1 0.877 0.002 . 1 . 95 . A 1 ILE HD13 . c30226_5ug5 1 11 . 1 1 1 1 ILE CA C 13 60.236 . . 1 . 115 . A 1 ILE CA . c30226_5ug5 1 12 . 1 1 1 1 ILE CB C 13 39.143 . . 1 . 132 . A 1 ILE CB . c30226_5ug5 1 13 . 1 1 1 1 ILE CG1 C 13 26.731 0.003 . 1 . 137 . A 1 ILE CG1 . c30226_5ug5 1 14 . 1 1 2 2 ARG H H 1 8.742 0.001 . 1 . 1 . A 2 ARG H . c30226_5ug5 1 15 . 1 1 2 2 ARG HA H 1 4.303 0.003 . 1 . 2 . A 2 ARG HA . c30226_5ug5 1 16 . 1 1 2 2 ARG HB2 H 1 1.747 0.007 . 2 . 34 . A 2 ARG HB2 . c30226_5ug5 1 17 . 1 1 2 2 ARG HB3 H 1 1.583 0.012 . 2 . 35 . A 2 ARG HB3 . c30226_5ug5 1 18 . 1 1 2 2 ARG HD2 H 1 3.142 0.0 . 1 . 97 . A 2 ARG HD2 . c30226_5ug5 1 19 . 1 1 2 2 ARG HE H 1 7.218 0.0 . 1 . 96 . A 2 ARG HE . c30226_5ug5 1 20 . 1 1 2 2 ARG CA C 13 56.262 . . 1 . 126 . A 2 ARG CA . c30226_5ug5 1 21 . 1 1 2 2 ARG CB C 13 27.131 0.004 . 1 . 136 . A 2 ARG CB . c30226_5ug5 1 22 . 1 1 3 3 ASP H H 1 8.712 0.002 . 1 . 3 . A 3 ASP H . c30226_5ug5 1 23 . 1 1 3 3 ASP HA H 1 4.543 0.003 . 1 . 4 . A 3 ASP HA . c30226_5ug5 1 24 . 1 1 3 3 ASP HB2 H 1 2.848 0.005 . 2 . 36 . A 3 ASP HB2 . c30226_5ug5 1 25 . 1 1 3 3 ASP HB3 H 1 2.786 0.005 . 2 . 37 . A 3 ASP HB3 . c30226_5ug5 1 26 . 1 1 3 3 ASP CA C 13 53.433 . . 1 . 124 . A 3 ASP CA . c30226_5ug5 1 27 . 1 1 3 3 ASP CB C 13 38.749 . . 1 . 145 . A 3 ASP CB . c30226_5ug5 1 28 . 1 1 4 4 GLU H H 1 8.851 0.002 . 1 . 5 . A 4 GLU H . c30226_5ug5 1 29 . 1 1 4 4 GLU HA H 1 4.180 0.004 . 1 . 6 . A 4 GLU HA . c30226_5ug5 1 30 . 1 1 4 4 GLU HB2 H 1 2.124 0.005 . 2 . 39 . A 4 GLU HB2 . c30226_5ug5 1 31 . 1 1 4 4 GLU HB3 H 1 2.006 0.005 . 2 . 40 . A 4 GLU HB3 . c30226_5ug5 1 32 . 1 1 4 4 GLU HG2 H 1 2.438 0.004 . 1 . 38 . A 4 GLU HG2 . c30226_5ug5 1 33 . 1 1 4 4 GLU CA C 13 57.466 . . 1 . 116 . A 4 GLU CA . c30226_5ug5 1 34 . 1 1 4 4 GLU CB C 13 27.792 0.003 . 1 . 140 . A 4 GLU CB . c30226_5ug5 1 35 . 1 1 4 4 GLU CG C 13 32.971 . . 1 . 130 . A 4 GLU CG . c30226_5ug5 1 36 . 1 1 5 5 CYS H H 1 8.497 0.005 . 1 . 7 . A 5 CYS H . c30226_5ug5 1 37 . 1 1 5 5 CYS HA H 1 4.435 0.003 . 1 . 8 . A 5 CYS HA . c30226_5ug5 1 38 . 1 1 5 5 CYS HB2 H 1 3.195 0.004 . 2 . 41 . A 5 CYS HB2 . c30226_5ug5 1 39 . 1 1 5 5 CYS HB3 H 1 2.769 0.008 . 2 . 42 . A 5 CYS HB3 . c30226_5ug5 1 40 . 1 1 5 5 CYS CA C 13 58.193 . . 1 . 121 . A 5 CYS CA . c30226_5ug5 1 41 . 1 1 6 6 CYS H H 1 8.135 0.001 . 1 . 9 . A 6 CYS H . c30226_5ug5 1 42 . 1 1 6 6 CYS HA H 1 4.307 0.002 . 1 . 10 . A 6 CYS HA . c30226_5ug5 1 43 . 1 1 6 6 CYS HB2 H 1 3.181 0.005 . 2 . 43 . A 6 CYS HB2 . c30226_5ug5 1 44 . 1 1 6 6 CYS HB3 H 1 2.855 0.005 . 2 . 44 . A 6 CYS HB3 . c30226_5ug5 1 45 . 1 1 6 6 CYS CA C 13 56.256 . . 1 . 128 . A 6 CYS CA . c30226_5ug5 1 46 . 1 1 7 7 SER H H 1 7.836 0.004 . 1 . 11 . A 7 SER H . c30226_5ug5 1 47 . 1 1 7 7 SER HA H 1 4.458 0.002 . 1 . 12 . A 7 SER HA . c30226_5ug5 1 48 . 1 1 7 7 SER HB2 H 1 3.964 0.002 . 2 . 45 . A 7 SER HB2 . c30226_5ug5 1 49 . 1 1 7 7 SER HB3 H 1 3.912 0.01 . 2 . 46 . A 7 SER HB3 . c30226_5ug5 1 50 . 1 1 7 7 SER CA C 13 58.710 . . 1 . 118 . A 7 SER CA . c30226_5ug5 1 51 . 1 1 7 7 SER CB C 13 63.615 0.002 . 1 . 112 . A 7 SER CB . c30226_5ug5 1 52 . 1 1 8 8 ASN H H 1 7.858 0.007 . 1 . 13 . A 8 ASN H . c30226_5ug5 1 53 . 1 1 8 8 ASN HA H 1 5.264 0.003 . 1 . 14 . A 8 ASN HA . c30226_5ug5 1 54 . 1 1 8 8 ASN HB2 H 1 3.147 0.004 . 2 . 47 . A 8 ASN HB2 . c30226_5ug5 1 55 . 1 1 8 8 ASN HB3 H 1 2.808 0.007 . 2 . 48 . A 8 ASN HB3 . c30226_5ug5 1 56 . 1 1 8 8 ASN HD21 H 1 7.869 0.003 . 1 . 104 . A 8 ASN HD21 . c30226_5ug5 1 57 . 1 1 8 8 ASN HD22 H 1 7.166 0.01 . 1 . 106 . A 8 ASN HD22 . c30226_5ug5 1 58 . 1 1 8 8 ASN CA C 13 49.909 . . 1 . 110 . A 8 ASN CA . c30226_5ug5 1 59 . 1 1 8 8 ASN CB C 13 40.726 0.013 . 1 . 131 . A 8 ASN CB . c30226_5ug5 1 60 . 1 1 9 9 PRO HA H 1 4.078 0.002 . 1 . 81 . A 9 PRO HA . c30226_5ug5 1 61 . 1 1 9 9 PRO HB2 H 1 2.362 0.002 . 2 . 85 . A 9 PRO HB2 . c30226_5ug5 1 62 . 1 1 9 9 PRO HB3 H 1 2.001 0.003 . 2 . 88 . A 9 PRO HB3 . c30226_5ug5 1 63 . 1 1 9 9 PRO HG2 H 1 2.135 0.003 . 1 . 87 . A 9 PRO HG2 . c30226_5ug5 1 64 . 1 1 9 9 PRO HD2 H 1 4.027 0.005 . 2 . 83 . A 9 PRO HD2 . c30226_5ug5 1 65 . 1 1 9 9 PRO HD3 H 1 3.904 0.006 . 2 . 84 . A 9 PRO HD3 . c30226_5ug5 1 66 . 1 1 9 9 PRO CA C 13 65.730 . . 1 . 113 . A 9 PRO CA . c30226_5ug5 1 67 . 1 1 9 9 PRO CB C 13 32.221 0.008 . 1 . 129 . A 9 PRO CB . c30226_5ug5 1 68 . 1 1 9 9 PRO CD C 13 51.085 0.003 . 1 . 141 . A 9 PRO CD . c30226_5ug5 1 69 . 1 1 10 10 ALA H H 1 7.811 0.003 . 1 . 15 . A 10 ALA H . c30226_5ug5 1 70 . 1 1 10 10 ALA HA H 1 4.196 0.002 . 1 . 16 . A 10 ALA HA . c30226_5ug5 1 71 . 1 1 10 10 ALA HB1 H 1 1.362 0.002 . 1 . 49 . A 10 ALA HB1 . c30226_5ug5 1 72 . 1 1 10 10 ALA HB2 H 1 1.362 0.002 . 1 . 49 . A 10 ALA HB2 . c30226_5ug5 1 73 . 1 1 10 10 ALA HB3 H 1 1.362 0.002 . 1 . 49 . A 10 ALA HB3 . c30226_5ug5 1 74 . 1 1 10 10 ALA CA C 13 54.332 . . 1 . 114 . A 10 ALA CA . c30226_5ug5 1 75 . 1 1 10 10 ALA CB C 13 18.213 . . 1 . 139 . A 10 ALA CB . c30226_5ug5 1 76 . 1 1 11 11 CYS H H 1 7.922 0.003 . 1 . 17 . A 11 CYS H . c30226_5ug5 1 77 . 1 1 11 11 CYS HA H 1 4.279 0.004 . 1 . 18 . A 11 CYS HA . c30226_5ug5 1 78 . 1 1 11 11 CYS HB2 H 1 3.310 0.003 . 2 . 61 . A 11 CYS HB2 . c30226_5ug5 1 79 . 1 1 11 11 CYS HB3 H 1 4.005 0.005 . 2 . 62 . A 11 CYS HB3 . c30226_5ug5 1 80 . 1 1 12 12 ARG H H 1 8.421 0.003 . 1 . 19 . A 12 ARG H . c30226_5ug5 1 81 . 1 1 12 12 ARG HA H 1 3.860 0.002 . 1 . 20 . A 12 ARG HA . c30226_5ug5 1 82 . 1 1 12 12 ARG HB2 H 1 1.868 0.011 . 2 . 50 . A 12 ARG HB2 . c30226_5ug5 1 83 . 1 1 12 12 ARG HB3 H 1 1.674 0.003 . 2 . 51 . A 12 ARG HB3 . c30226_5ug5 1 84 . 1 1 12 12 ARG HG2 H 1 1.525 0.009 . 2 . 52 . A 12 ARG HG2 . c30226_5ug5 1 85 . 1 1 12 12 ARG HG3 H 1 1.395 0.005 . 2 . 53 . A 12 ARG HG3 . c30226_5ug5 1 86 . 1 1 12 12 ARG HD2 H 1 3.146 0.002 . 2 . 56 . A 12 ARG HD2 . c30226_5ug5 1 87 . 1 1 12 12 ARG HD3 H 1 2.653 0.0 . 2 . 109 . A 12 ARG HD3 . c30226_5ug5 1 88 . 1 1 12 12 ARG HE H 1 7.249 0.005 . 1 . 54 . A 12 ARG HE . c30226_5ug5 1 89 . 1 1 12 12 ARG CB C 13 30.683 0.007 . 1 . 147 . A 12 ARG CB . c30226_5ug5 1 90 . 1 1 13 13 TYR H H 1 7.919 0.004 . 1 . 21 . A 13 TYR H . c30226_5ug5 1 91 . 1 1 13 13 TYR HA H 1 4.248 0.003 . 1 . 22 . A 13 TYR HA . c30226_5ug5 1 92 . 1 1 13 13 TYR HB2 H 1 3.043 0.001 . 2 . 64 . A 13 TYR HB2 . c30226_5ug5 1 93 . 1 1 13 13 TYR HB3 H 1 3.052 0.003 . 2 . 148 . A 13 TYR HB3 . c30226_5ug5 1 94 . 1 1 13 13 TYR HD1 H 1 7.084 0.002 . 1 . 107 . A 13 TYR HD1 . c30226_5ug5 1 95 . 1 1 13 13 TYR HD2 H 1 7.084 0.002 . 1 . 107 . A 13 TYR HD2 . c30226_5ug5 1 96 . 1 1 13 13 TYR HE1 H 1 6.774 0.001 . 1 . 108 . A 13 TYR HE1 . c30226_5ug5 1 97 . 1 1 13 13 TYR HE2 H 1 6.774 0.001 . 1 . 108 . A 13 TYR HE2 . c30226_5ug5 1 98 . 1 1 13 13 TYR CB C 13 38.153 0.001 . 1 . 135 . A 13 TYR CB . c30226_5ug5 1 99 . 1 1 14 14 ASN H H 1 7.782 0.011 . 1 . 23 . A 14 ASN H . c30226_5ug5 1 100 . 1 1 14 14 ASN HA H 1 4.540 0.001 . 1 . 24 . A 14 ASN HA . c30226_5ug5 1 101 . 1 1 14 14 ASN HB2 H 1 2.859 0.007 . 2 . 57 . A 14 ASN HB2 . c30226_5ug5 1 102 . 1 1 14 14 ASN HB3 H 1 2.713 0.005 . 2 . 58 . A 14 ASN HB3 . c30226_5ug5 1 103 . 1 1 14 14 ASN HD21 H 1 7.619 0.001 . 1 . 98 . A 14 ASN HD21 . c30226_5ug5 1 104 . 1 1 14 14 ASN HD22 H 1 6.971 0.003 . 1 . 100 . A 14 ASN HD22 . c30226_5ug5 1 105 . 1 1 14 14 ASN CA C 13 53.930 . . 1 . 125 . A 14 ASN CA . c30226_5ug5 1 106 . 1 1 14 14 ASN CB C 13 39.256 0.003 . 1 . 133 . A 14 ASN CB . c30226_5ug5 1 107 . 1 1 15 15 ASN H H 1 7.651 0.002 . 1 . 25 . A 15 ASN H . c30226_5ug5 1 108 . 1 1 15 15 ASN HA H 1 5.040 0.004 . 1 . 26 . A 15 ASN HA . c30226_5ug5 1 109 . 1 1 15 15 ASN HB2 H 1 2.858 0.0 . 2 . 59 . A 15 ASN HB2 . c30226_5ug5 1 110 . 1 1 15 15 ASN HB3 H 1 2.657 0.003 . 2 . 60 . A 15 ASN HB3 . c30226_5ug5 1 111 . 1 1 15 15 ASN HD21 H 1 7.743 0.004 . 1 . 101 . A 15 ASN HD21 . c30226_5ug5 1 112 . 1 1 15 15 ASN HD22 H 1 7.247 0.003 . 1 . 102 . A 15 ASN HD22 . c30226_5ug5 1 113 . 1 1 15 15 ASN CA C 13 51.439 . . 1 . 111 . A 15 ASN CA . c30226_5ug5 1 114 . 1 1 15 15 ASN CB C 13 40.049 . . 1 . 144 . A 15 ASN CB . c30226_5ug5 1 115 . 1 1 16 16 HYP CA C 13 62.893 . . 1 . 117 . A 16 HYP CA . c30226_5ug5 1 116 . 1 1 16 16 HYP CB C 13 39.137 0.002 . 1 . 134 . A 16 HYP CB . c30226_5ug5 1 117 . 1 1 16 16 HYP CG C 13 71.859 . . 1 . 123 . A 16 HYP CG . c30226_5ug5 1 118 . 1 1 16 16 HYP HA H 1 4.459 0.002 . 1 . 72 . A 16 HYP HA . c30226_5ug5 1 119 . 1 1 16 16 HYP HB2 H 1 2.150 0.003 . 2 . 74 . A 16 HYP HB2 . c30226_5ug5 1 120 . 1 1 16 16 HYP HB3 H 1 1.835 0.005 . 2 . 75 . A 16 HYP HB3 . c30226_5ug5 1 121 . 1 1 16 16 HYP HD1 H 1 3.477 0.005 . 1 . 78 . A 16 HYP HD1 . c30226_5ug5 1 122 . 1 1 16 16 HYP HD22 H 1 3.719 0.002 . 1 . 77 . A 16 HYP HD22 . c30226_5ug5 1 123 . 1 1 16 16 HYP HG H 1 4.278 0.009 . 1 . 76 . A 16 HYP HG . c30226_5ug5 1 124 . 1 1 17 17 HIS H H 1 8.690 0.001 . 1 . 27 . A 17 HIS H . c30226_5ug5 1 125 . 1 1 17 17 HIS HA H 1 4.632 0.002 . 1 . 28 . A 17 HIS HA . c30226_5ug5 1 126 . 1 1 17 17 HIS HB2 H 1 3.293 0.008 . 2 . 65 . A 17 HIS HB2 . c30226_5ug5 1 127 . 1 1 17 17 HIS HB3 H 1 3.222 0.004 . 2 . 66 . A 17 HIS HB3 . c30226_5ug5 1 128 . 1 1 17 17 HIS CA C 13 56.073 . . 1 . 120 . A 17 HIS CA . c30226_5ug5 1 129 . 1 1 17 17 HIS CB C 13 28.302 0.025 . 1 . 143 . A 17 HIS CB . c30226_5ug5 1 130 . 1 1 18 18 VAL H H 1 7.678 0.002 . 1 . 29 . A 18 VAL H . c30226_5ug5 1 131 . 1 1 18 18 VAL HA H 1 4.182 0.003 . 1 . 30 . A 18 VAL HA . c30226_5ug5 1 132 . 1 1 18 18 VAL HB H 1 2.136 0.004 . 1 . 67 . A 18 VAL HB . c30226_5ug5 1 133 . 1 1 18 18 VAL HG11 H 1 0.914 0.007 . 2 . 68 . A 18 VAL HG11 . c30226_5ug5 1 134 . 1 1 18 18 VAL HG12 H 1 0.914 0.007 . 2 . 68 . A 18 VAL HG12 . c30226_5ug5 1 135 . 1 1 18 18 VAL HG13 H 1 0.914 0.007 . 2 . 68 . A 18 VAL HG13 . c30226_5ug5 1 136 . 1 1 18 18 VAL HG21 H 1 0.884 0.001 . 2 . 69 . A 18 VAL HG21 . c30226_5ug5 1 137 . 1 1 18 18 VAL HG22 H 1 0.884 0.001 . 2 . 69 . A 18 VAL HG22 . c30226_5ug5 1 138 . 1 1 18 18 VAL HG23 H 1 0.884 0.001 . 2 . 69 . A 18 VAL HG23 . c30226_5ug5 1 139 . 1 1 18 18 VAL CA C 13 62.888 . . 1 . 119 . A 18 VAL CA . c30226_5ug5 1 140 . 1 1 18 18 VAL CB C 13 32.586 . . 1 . 138 . A 18 VAL CB . c30226_5ug5 1 141 . 1 1 19 19 CYS H H 1 7.938 0.002 . 1 . 31 . A 19 CYS H . c30226_5ug5 1 142 . 1 1 19 19 CYS HA H 1 4.727 0.002 . 1 . 32 . A 19 CYS HA . c30226_5ug5 1 143 . 1 1 19 19 CYS HB2 H 1 3.214 0.007 . 2 . 70 . A 19 CYS HB2 . c30226_5ug5 1 144 . 1 1 19 19 CYS HB3 H 1 2.705 0.003 . 2 . 71 . A 19 CYS HB3 . c30226_5ug5 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 c30226_5ug5 _Spectral_peak_list.ID 1 _Spectral_peak_list.Sample_ID 1 _Spectral_peak_list.Sample_label $sample_1 _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,Volume 1,5.26835,49.90868, 8AsnHa, 8AsnCa,2.17E+08 2,5.05055,51.43912, 15AsnHa, 15AsnCa,1.86E+08 3,3.90696,51.08196, 9ProHda, 9ProCd,3.32E+08 4,3.91485,63.61276, 7SerHba, 7SerCb,3.59E+08 5,3.96297,63.61696, 7SerHbb, 7SerCb,4.16E+08 6,4.07625,65.73034, 9ProHa, 9ProCa,3.00E+08 7,4.2654,71.85881, 16HypHg, 16HypCg,4.18E+08 8,4.45779,62.8932, 16HypHa, 16HypCa,3.54E+08 9,4.19817,54.33235, 10AlaHa, 10AlaCa,1.81E+08 10,4.2406,52.54934,None,None,7.97E+07 11,3.819,60.23635, 1IleHa, 1IleCa,1.58E+09 12,4.18622,57.4664, 4GluHa, 4GluCa,4.70E+08 13,4.46078,58.70984, 7SerHa, 7SerCa,3.73E+08 14,4.17996,62.8877, 18ValHa, 18ValCa,4.55E+08 15,4.63155,56.07254, 17HisHa, 17HisCa,2.15E+08 16,4.43746,58.1927, 5CysHa, 5CysCa,1.51E+08 17,4.53866,53.93042, 14AsnHa, 14AsnCa,3.10E+08 18,4.55559,53.43306, 3AspHa, 3AspCa,4.06E+08 19,4.30104,56.26153, 2ArgHa, 2ArgCa,9.51E+08 20,4.36707,56.20682,None,None,1.29E+08 21,3.81468,58.11363,None, [122],1.34E+08 22,4.03197,51.08754, 9ProHdb, 9ProCd,3.28E+08 23,4.3117,56.2558, 6CysHa, 6CysCa,5.23E+08 24,3.59319,51.52534,None,None,1.33E+08 25,3.14377,43.39284,None,None,2.02E+09 26,2.00444,32.22934, 9ProHba, 9ProCb,3.48E+08 27,2.36113,32.21329, 9ProHbb, 9ProCb,4.27E+08 28,2.44162,32.97137, 4GluHga, 4GluCg,5.67E+08 29,2.47044,32.97421,None,None,6.81E+08 30,2.14987,32.58625, 18ValHb, 18ValCb,3.69E+08 31,2.81044,40.71317, 8AsnHba, 8AsnCb,1.54E+08 32,3.15811,40.739, 8AsnHbb, 8AsnCb,1.19E+08 33,2.81869,39.0548,None,None,2.80E+08 34,2.15696,39.13493, 16HypHbb, 16HypCb,2.51E+08 35,1.92707,39.14265, 1IleHb, 1IleCb,1.12E+09 36,1.84175,39.13991, 16HypHba, 16HypCb,1.46E+08 37,2.71248,39.25305, 14AsnHba, 14AsnCb,1.89E+08 38,2.85382,39.25927, 14AsnHbb, 14AsnCb,1.79E+08 39,3.04707,38.15261, 13TyrHba, 13TyrCb,4.65E+08 40,2.66131,40.04901, 15AsnHba, 15AsnCb,5.26E+08 41,2.13988,27.46015,None,None,2.93E+08 42,1.60357,27.13546, 2ArgHba, 2ArgCb,5.80E+08 43,1.55737,27.14318,None,None,4.12E+08 44,2.00588,27.46705,None,None,2.55E+08 45,1.75161,30.78039,None,None,6.54E+08 46,1.17223,26.72811, 1IleHg1a, 1IleCg1,7.15E+08 47,1.45213,26.73426, 1IleHg1b, 1IleCg1,8.64E+08 48,2.07002,24.19136,None,None,1.24E+08 49,0.88123,26.71181,None,None,1.68E+08 50,0.89178,21.34501,None,None,2.04E+09 51,0.93159,20.77254,None,None,1.61E+09 52,1.36584,18.21348, 10AlaHb*, 10AlaCb,1.92E+09 53,2.13046,27.79462, 4GluHbb, 4GluCb,2.75E+08 54,2.01335,27.78877, 4GluHba, 4GluCb,2.22E+08 55,2.86185,38.74922, 3AspHbb, 3AspCb,1.66E+08 56,2.7652,42.02369,None,None,6.63E+07 57,1.94435,27.13361,None,None,1.12E+08 58,1.75899,27.12703, 2ArgHbb, 2ArgCb,8.63E+07 59,1.40767,27.41505,None,None,1.39E+08 60,3.32263,28.27695, 17HisHbb, 17HisCb,7.62E+07 61,3.2314,28.3275, 17HisHba, 17HisCb,6.67E+07 62,3.20171,42.02454, 5CysHbb,None,6.48E+07 63,1.87249,30.6896, 12ArgHbb, 12ArgCb,1.70E+08 64,1.67717,30.67583, 12ArgHba, 12ArgCb,8.64E+07 65,3.05711,38.15398, 13TyrHbb, 13TyrCb,4.05E+08 ; 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 . . 12.044 ppm 4.997 . . c30226_5ug5 1 2 H 1 H . . 12.000 ppm 4.994 . . c30226_5ug5 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 c30226_5ug5 _Spectral_peak_list.ID 2 _Spectral_peak_list.Sample_ID 2 _Spectral_peak_list.Sample_label $sample_2 _Spectral_peak_list.Sample_condition_list_ID 2 _Spectral_peak_list.Sample_condition_list_label $sample_conditions_2 _Spectral_peak_list.Experiment_ID 5 _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 1,8.74072,4.29991, 2ArgH, 2ArgHa,1.27E+04 2,8.71232,4.54446, 3AspH, 3AspHa,1.57E+04 3,8.71099,4.29927, 3AspH, 2ArgHa,5.27E+04 4,8.85216,4.17445, 4GluH, 4GluHa,1.21E+04 5,8.49945,4.43038, 5CysH, 5CysHa,1.31E+04 6,8.13678,4.30844, 6CysH, 6CysHa,1.30E+04 7,7.84185,4.45523, 7SerH, 7SerHa,1.66E+04 8,7.85939,4.45492, 8AsnH, 7SerHa,9207.58551 9,7.86371,5.26424, 8AsnH, 8AsnHa,1.42E+04 10,7.81296,4.19549, 10AlaH, 10AlaHa,1.85E+04 11,7.92004,4.27487, 11CysH, 11CysHa,2.90E+04 12,8.4237,3.85528, 12ArgH, 12ArgHa,1.19E+04 13,7.91846,4.24526, 13TyrH, 13TyrHa,2.38E+04 14,7.78742,4.54073, 14AsnH, 14AsnHa,1.52E+04 15,7.6516,5.03887, 15AsnH, 15AsnHa,6964.17037 16,8.69102,4.632, 17HisH, 17HisHa,1.89E+04 17,7.67794,4.17709, 18ValH, 18ValHa,7015.39598 18,7.93992,4.72484, 19CysH, 19CysHa,8576.8823 19,8.74217,1.92135, 2ArgH, 1IleHb,8637.52237 20,8.74256,1.74899, 2ArgH, 2ArgHbb,2.14E+04 21,8.73944,1.58656, 2ArgH, 2ArgHba,5887.22479 22,4.30383,1.75252, 2ArgHa, 2ArgHbb,2.28E+04 23,4.30365,1.57319, 2ArgHa, 2ArgHba,8992.94089 24,4.30544,1.52607, 6CysHa, 12ArgHgb,8634.33363 25,1.74773,1.58709, 2ArgHbb, 2ArgHba,2.53E+04 26,4.30669,8.74394, 2ArgHa, 2ArgH,3.86E+04 27,3.81978,8.74319, 1IleHa, 2ArgH,4.48E+04 28,1.74957,8.74091, 2ArgHbb, 2ArgH,1.60E+04 29,1.5844,8.74108, 2ArgHba, 2ArgH,4081.48753 30,8.71136,2.84465, 3AspH, 3AspHbb,1.67E+04 31,8.71042,2.7857, 3AspH, 3AspHba,1.71E+04 32,4.54055,2.84432, 3AspHa, 3AspHbb,3.16E+04 33,4.54204,2.78282, 3AspHa, 3AspHba,2.28E+04 34,2.85271,2.7132, 14AsnHbb, 14AsnHba,6.98E+04 35,2.85256,2.78927, 3AspHbb, 3AspHba,1.01E+05 36,4.54488,8.71173, 3AspHa, 3AspH,1.24E+04 37,2.85044,8.71219, 3AspHbb, 3AspH,1.32E+04 38,2.83912,8.70465, 3AspHbb, 3AspH,9166.30945 39,2.79157,8.71044, 3AspHba, 3AspH,1.31E+04 40,8.85266,2.43919, 4GluH, 4GluHga,1.03E+04 41,8.85174,2.11723, 4GluH, 4GluHbb,1.30E+04 42,8.8524,2.00557, 4GluH, 4GluHba,1.67E+04 43,8.49922,3.19383, 5CysH, 5CysHbb,3.27E+04 44,8.52456,2.76794, 5CysH, 5CysHba,2331.74389 45,8.4993,2.76362, 5CysH, 5CysHba,2.94E+04 46,4.18137,2.43628, 4GluHa, 4GluHga,1.04E+04 47,4.18423,2.13174, 4GluHa, 4GluHbb,3.45E+04 48,4.18244,2.0091, 4GluHa, 4GluHba,1.50E+04 49,2.45266,2.12159, 4GluHga, 4GluHbb,1.34E+04 50,2.44191,2.00374, 4GluHga, 4GluHba,1.49E+04 51,2.11698,1.99766, 4GluHbb, 4GluHba,1.23E+05 52,4.18185,8.85261, 4GluHa, 4GluH,1.42E+04 53,2.43537,8.85158, 4GluHga, 4GluH,4656.8282 54,2.12517,8.85071, 4GluHbb, 4GluH,9213.44221 55,2.01127,8.85221, 4GluHba, 4GluH,1.06E+04 56,2.4368,4.17576, 4GluHga, 4GluHa,7824.86166 57,2.13212,4.17702, 4GluHbb, 4GluHa,2.95E+04 58,2.00542,4.17638, 4GluHba, 4GluHa,1.47E+04 59,2.12271,2.43614, 4GluHbb, 4GluHga,1.87E+04 60,2.01334,2.4374, 4GluHba, 4GluHga,1.95E+04 61,2.00672,2.12905, 4GluHba, 4GluHbb,1.32E+05 62,4.43572,3.18998, 5CysHa, 5CysHbb,2.45E+04 63,4.43829,2.76774, 5CysHa, 5CysHba,1.69E+04 64,3.1952,2.77064, 5CysHbb, 5CysHba,8.39E+04 65,4.43614,8.49167, 5CysHa, 5CysH,1.68E+04 66,3.20625,8.49125, 5CysHbb, 5CysH,1.81E+04 67,2.76511,8.49329, 5CysHba, 5CysH,1.71E+04 68,3.19895,4.43054, 5CysHbb, 5CysHa,1.34E+04 69,2.77468,4.42803, 5CysHba, 5CysHa,6968.28274 70,2.76715,3.19352, 5CysHba, 5CysHbb,6.98E+04 71,8.1365,3.18638, 6CysH, 6CysHbb,2.41E+04 72,8.13608,2.85275, 6CysH, 6CysHba,2.68E+04 73,4.30719,3.17668, 6CysHa, 6CysHbb,2.47E+04 74,4.30385,2.85394, 6CysHa, 6CysHba,1.75E+04 75,3.17695,2.8512, 6CysHbb, 6CysHba,8.77E+04 76,4.30731,8.13346, 6CysHa, 6CysH,1.12E+04 77,3.19283,8.1341, 6CysHbb, 6CysH,1.38E+04 78,2.85392,8.13285, 6CysHba, 6CysH,1.66E+04 79,2.8602,4.30816, 6CysHba, 6CysHa,1.16E+04 80,3.18656,4.31067, 6CysHbb, 6CysHa,1.66E+04 81,7.84146,3.96429, 7SerH, 7SerHbb,1.61E+04 82,7.84096,3.91579, 7SerH, 7SerHba,1.18E+04 83,4.45888,3.96324, 7SerHa, 7SerHbb,3.35E+04 84,4.45958,3.91514, 7SerHa, 7SerHba,3.28E+04 85,3.96083,3.91751, 7SerHbb, 7SerHba,1.09E+05 86,4.4588,7.83425, 7SerHa, 7SerH,2.23E+04 87,3.96806,7.83392, 7SerHbb, 7SerH,1.22E+04 88,3.92125,7.83126, 7SerHba, 7SerH,1.39E+04 89,3.96692,4.46563, 7SerHbb, 7SerHa,3623.43265 90,3.92161,4.45816, 7SerHba, 7SerHa,4895.25443 91,3.91302,3.96446, 7SerHba, 7SerHbb,1.08E+05 92,7.86297,3.14852, 8AsnH, 8AsnHbb,2.37E+04 93,7.86454,2.80582, 8AsnH, 8AsnHba,2.59E+04 94,5.26975,3.14163, 8AsnHa, 8AsnHbb,8202.87812 95,5.2657,7.84978, 8AsnHa, 8AsnH,3660.586 96,3.15263,7.85438, 8AsnHbb, 8AsnH,2.09E+04 97,2.80575,7.85732, 8AsnHba, 8AsnH,2.25E+04 98,3.15085,5.25959, 8AsnHbb, 8AsnHa,1.79E+04 99,2.80528,5.26433, 8AsnHba, 8AsnHa,1.88E+04 100,3.14643,3.14317, (12Arg/8Asn)(Hdb/Hbb), (8Asn/12Arg)(Hbb/Hdb),1.26E+06 101,2.80654,3.14393, 8AsnHba, 8AsnHbb,7.88E+04 102,7.81289,1.36181, 10AlaH, 10AlaHb*,3.86E+04 103,4.19539,1.36141, 10AlaHa, 10AlaHb*,3.80E+04 104,1.3641,4.19436, 10AlaHb*, 10AlaHa,4.44E+04 105,1.36303,1.36162, 10AlaHb*, 10AlaHb*,1.10E+06 106,8.42443,1.86963, 12ArgH, 12ArgHbb,1.90E+04 107,8.42397,1.67313, 12ArgH, 12ArgHba,1.54E+04 108,8.42462,1.52188, 12ArgH, 12ArgHgb,8040.86831 109,8.42327,1.39028, 12ArgH, 12ArgHga,8168.27725 110,7.25671,3.86394, 12ArgHe, 12ArgHa,2006.55413 111,7.24827,3.14274, 12ArgHe, 12ArgHdb,2.59E+04 112,8.42274,3.14231, 12ArgH, 12ArgHdb,5247.84477 113,7.24856,1.85651, 12ArgHe, 12ArgHbb,6135.09711 114,7.24931,1.6718, 12ArgHe, 12ArgHba,4716.02921 115,7.24971,1.51982, 12ArgHe, 12ArgHgb,6192.02884 116,7.247,1.38778, 12ArgHe, 12ArgHga,6181.25423 117,3.8599,3.14404, 12ArgHa, 12ArgHdb,4707.16239 118,3.86095,1.87029, 12ArgHa, 12ArgHbb,1.85E+04 119,3.86096,1.67124, 12ArgHa, 12ArgHba,1.62E+04 120,3.86096,1.52035, 12ArgHa, 12ArgHgb,1.13E+04 121,3.85987,1.3967, 12ArgHa, 12ArgHga,9501.10469 122,3.14668,1.87185, 12ArgHdb, 12ArgHbb,1.14E+04 123,3.15,1.67374, 12ArgHdb, 12ArgHba,1.31E+04 124,3.14543,1.52964, 12ArgHdb, 12ArgHgb,2.47E+04 125,3.14489,1.39524, 12ArgHdb, 12ArgHga,1.97E+04 126,1.87153,1.67381, 12ArgHbb, 12ArgHba,4.59E+04 127,1.87385,1.52303, 12ArgHbb, 12ArgHgb,1.23E+04 128,1.8734,1.39339, 12ArgHbb, 12ArgHga,8659.87512 129,1.86141,1.38958, 12ArgHbb, 12ArgHga,8761.03223 130,1.67731,1.52379, 12ArgHba, 12ArgHgb,1.56E+04 131,1.67129,1.40006, 12ArgHba, 12ArgHga,1.28E+04 132,1.52263,1.39555, 12ArgHgb, 12ArgHga,5.11E+04 133,3.85989,8.41826, 12ArgHa, 12ArgH,1.34E+04 134,3.14728,8.41936, 12ArgHdb, 12ArgH,5328.90979 135,1.87468,8.41845, 12ArgHbb, 12ArgH,9695.54087 136,1.72732,8.41637, 2ArgHbb, 12ArgH,1132.26764 137,1.67429,8.418, 12ArgHba, 12ArgH,9382.96041 138,1.51843,8.41585, 12ArgHgb, 12ArgH,4027.99715 139,1.40357,8.41584, 12ArgHga, 12ArgH,4033.03612 140,3.14606,3.85947, 12ArgHdb, 12ArgHa,5843.02736 141,1.87537,3.85796, 12ArgHbb, 12ArgHa,1.14E+04 142,1.6799,3.8576, 12ArgHba, 12ArgHa,1.05E+04 143,1.56601,3.89219, (12Arg/2Arg)(Hgb/Hba), (9Pro/7Ser)(Hda/Hba),1262.59404 144,1.52933,3.85315, 12ArgHgb, 12ArgHa,7092.72432 145,1.39494,3.85564, 12ArgHga, 12ArgHa,6236.16372 146,1.87279,3.1431, 12ArgHbb, 12ArgHdb,1.18E+04 147,1.74883,3.14344, 2ArgHbb, 8AsnHbb,1.07E+04 148,1.67883,3.14366, 12ArgHba, 12ArgHdb,1.27E+04 149,1.52835,3.14275, 12ArgHgb, 12ArgHdb,1.90E+04 150,1.39787,3.14252, 12ArgHga, 12ArgHdb,1.74E+04 151,1.67612,1.87014, 12ArgHba, 12ArgHbb,5.01E+04 152,1.52955,1.87058, 12ArgHgb, 12ArgHbb,1.20E+04 153,1.38736,1.86879, 12ArgHga, 12ArgHbb,8044.0347 154,1.52527,1.66953, 12ArgHgb, 12ArgHba,1.45E+04 155,1.39683,1.66819, 12ArgHga, 12ArgHba,1.20E+04 156,1.39929,1.51964, 12ArgHga, 12ArgHgb,4.73E+04 157,7.78613,2.85254, 14AsnH, 14AsnHbb,9910.04761 158,7.78725,2.7112, 14AsnH, 14AsnHba,1.69E+04 159,4.54079,2.86794, 14AsnHa, 14AsnHbb,4.31E+04 160,4.53905,2.7089, 14AsnHa, 14AsnHba,1.55E+04 161,4.53982,7.7814, 14AsnHa, 14AsnH,1.81E+04 162,2.86177,7.78154, 14AsnHbb, 14AsnH,7987.77985 163,2.71088,7.78218, 14AsnHba, 14AsnH,1.12E+04 164,2.87515,4.53846, 14AsnHbb, 14AsnHa,2.28E+04 165,2.72743,4.53989, 14AsnHba, 14AsnHa,1.04E+04 166,2.72322,2.8579, 14AsnHba, 14AsnHbb,5.96E+04 167,7.65064,2.85757, 15AsnH, 15AsnHbb,4578.47156 168,7.65224,2.65287, 15AsnH, 15AsnHba,2.49E+04 169,2.658,7.652, 15AsnHba, 15AsnH,2.39E+04 170,2.68979,7.62244, 14AsnHba, 14AsnHd2b,5678.22459 171,2.65861,5.03863, 15AsnHba, 15AsnHa,2.79E+04 172,7.92174,4.00294, 11CysH, 11CysHbb,1.93E+04 173,7.92294,3.31244, 11CysH, 11CysHba,2.40E+04 174,4.27736,4.00538, 11CysHa, 11CysHbb,9859.47425 175,4.28143,3.31293, 11CysHa, 11CysHba,2.07E+04 176,4.00295,3.31167, 11CysHbb, 11CysHba,3.98E+04 177,4.27757,7.92399, 11CysHa, 11CysH,1.65E+04 178,4.00403,7.92172, 11CysHbb, 11CysH,9331.58783 179,3.305,7.92228, 11CysHba, 11CysH,1.30E+04 180,3.3047,4.27688, 11CysHba, 11CysHa,1.38E+04 181,3.30529,4.00229, 11CysHba, 11CysHbb,4.17E+04 182,7.91874,3.04311, 13TyrH, 13TyrHba,4.95E+04 183,4.28078,3.32162, 11CysHa, 11CysHba,1.97E+04 184,4.2521,3.04386, 13TyrHa, 13TyrHba,3.13E+04 185,4.2513,7.91976, 13TyrHa, 13TyrH,1.40E+04 186,3.04407,7.91988, 13TyrHba, 13TyrH,4.20E+04 187,3.04384,4.24546, 13TyrHba, 13TyrHa,3.42E+04 188,8.68922,3.29158, 17HisH, 17HisHbb,7831.70813 189,8.69055,3.21856, 17HisH, 17HisHba,1.44E+04 190,4.63187,3.28952, 17HisHa, 17HisHbb,1.00E+04 191,4.63328,3.22095, 17HisHa, 17HisHba,8281.40528 192,3.29402,3.21929, 17HisHbb, 17HisHba,9.19E+04 193,4.63423,8.69082, 17HisHa, 17HisH,1.20E+04 194,3.29511,8.69026, 17HisHbb, 17HisH,7251.44207 195,3.21812,8.68982, 17HisHba, 17HisH,9739.31151 196,3.29469,4.63132, 17HisHbb, 17HisHa,1.43E+04 197,3.2198,4.62969, 17HisHba, 17HisHa,9814.89948 198,3.22566,3.2855, 17HisHba, 17HisHbb,9.46E+04 199,7.67909,2.13605, 18ValH, 18ValHb,1.33E+04 200,7.67961,0.91552, 18ValH, 18ValHgb*,2.09E+04 201,4.18079,2.13608, 18ValHa, 18ValHb,3.45E+04 202,4.18549,0.90372, 18ValHa, 18ValHgb*,3.15E+04 203,2.13596,0.90563, 18ValHb, 18ValHgb*,4.07E+04 204,0.92286,0.91723, 18ValHgb*, 18ValHgb*,1.30E+06 205,4.18485,7.67611, 18ValHa, 18ValH,1.04E+04 206,2.14034,7.68179, 18ValHb, 18ValH,1.26E+04 207,0.92397,7.67718, 18ValHgb*, 18ValH,1.73E+04 208,0.88705,7.67178, 18ValHga*, 18ValH,6500.81314 209,7.67443,0.88342, 18ValH, 18ValHga*,1.87E+04 210,4.18511,0.88342, 18ValHa, 18ValHga*,3.15E+04 211,2.13627,0.88342, 18ValHb, 18ValHga*,4.24E+04 212,0.88339,0.88446, 18ValHga*, 18ValHga*,2.60E+06 213,2.12099,4.17504, 18ValHb, 18ValHa,2.52E+04 214,0.9232,4.17681, 18ValHgb*, 18ValHa,1.78E+04 215,0.88434,4.17701, 18ValHga*, 18ValHa,2.18E+04 216,0.9248,2.13539, 18ValHgb*, 18ValHb,3.40E+04 217,0.88648,2.13567, 18ValHga*, 18ValHb,3.36E+04 218,7.93996,3.21338, 19CysH, 19CysHbb,6164.47437 219,7.93802,2.70225, 19CysH, 19CysHba,1.23E+04 220,4.72646,3.21798, 19CysHa, 19CysHbb,2609.77105 221,4.72687,2.707, 19CysHa, 19CysHba,474.05824 222,3.20662,2.70398, 19CysHbb, 19CysHba,6.96E+04 223,4.45963,2.14698, 16HypHa, 16HypHbb,3.91E+04 224,4.45998,1.84318, 16HypHa, 16HypHba,1.72E+04 225,4.27962,3.71836, 16HypHg, 16HypHd2a,2.19E+04 226,4.27928,3.47438, 16HypHg, 16HypHd1,1.27E+04 227,4.28076,2.14998, 16HypHg, 16HypHbb,1.06E+04 228,4.27993,1.83304, 16HypHg, 16HypHba,1.98E+04 229,3.71823,3.47386, 16HypHd2a, 16HypHd1,8.75E+04 230,3.71763,2.15547, 16HypHd2a, 16HypHbb,3541.10861 231,3.72239,1.83183, 16HypHd2a, 16HypHba,5994.69643 232,3.48839,2.15114, 16HypHd1, 16HypHbb,3041.98955 233,3.47279,2.14687, 16HypHd1, 16HypHbb,3264.94629 234,3.48649,1.83055, 16HypHd1, 16HypHba,2766.45576 235,3.47282,1.8331, 16HypHd1, 12ArgHbb,3549.35923 236,2.14975,1.83304, 16HypHbb, 16HypHba,7.01E+04 237,4.07669,3.90999, 9ProHa, 9ProHda,6740.32814 238,4.07685,2.1343, 9ProHa, 9ProHga,3109.2905 239,4.07743,1.998, 9ProHa, 9ProHba,2.01E+04 240,4.0787,1.87161, 9ProHa, 12ArgHbb,4887.32504 241,4.02754,3.90443, 9ProHdb, 9ProHda,7.60E+04 242,4.02707,2.13616, 9ProHdb, 9ProHga,1.06E+04 243,4.02616,1.99998, 9ProHdb, 9ProHba,1.76E+04 244,3.9079,2.1343, 9ProHda, 9ProHga,1.44E+04 245,3.90722,1.99984, 9ProHda, 9ProHba,1.57E+04 246,2.13171,1.99785, 9ProHga, 9ProHba,1.35E+05 247,8.85246,4.54396, 4GluH, 3AspHa,4.36E+04 248,8.49906,4.17481, 5CysH, 4GluHa,1.45E+04 249,8.13615,4.43209, 6CysH, 5CysHa,4467.20145 250,7.65122,4.54143, 15AsnH, 14AsnHa,1.10E+04 251,7.67972,4.62969, 18ValH, 17HisHa,1.13E+04 252,7.91814,1.67199, 11CysH, 12ArgHba,1.18E+04 253,7.81288,1.99679, 10AlaH, 9ProHba,1.42E+04 254,3.81804,1.92112, 1IleHa, 1IleHb,1.16E+04 255,3.81538,1.17435, 1IleHa, 1IleHg1a,1934.75663 256,3.82095,1.4552, 1IleHa, 1IleHg1b,1704.51112 257,3.81934,0.9423, 1IleHa, 1IleHg2*,8052.27596 258,3.82088,0.87259, 1IleHa, 1IleHd1*,1315.20793 259,1.93115,1.4375, 1IleHb, 1IleHg1b,5172.13039 260,1.91863,1.44226, 1IleHb, 1IleHg1b,5657.35342 261,1.92412,1.17622, 1IleHb, 1IleHg1a,4074.12754 262,1.90774,1.16943, 1IleHb, 1IleHg1a,3744.58608 263,1.93435,0.9585, 1IleHb, 1IleHg2*,7029.40249 264,1.91623,0.94181, 1IleHb, 1IleHg2*,8292.15433 265,1.92449,0.87484, 1IleHb, 1IleHd1*,2851.58586 266,1.46413,1.19067, 1IleHg1b, 1IleHg1a,1.03E+04 267,1.44499,1.17359, 1IleHg1b, 1IleHg1a,2.39E+04 268,1.444,0.93588, 1IleHg1b, 1IleHg2*,3703.91336 269,1.43295,0.8784, 1IleHg1b, 1IleHd1*,1.17E+04 270,8.69189,1.83081, 17HisH, 16HypHba,4309.33802 271,8.68871,2.14725, 17HisH, 16HypHbb,4679.87691 272,8.49888,2.11928, 5CysH, 4GluHbb,6616.8869 273,8.49976,2.00153, 5CysH, 4GluHba,5217.22498 274,7.93471,2.13346, 19CysH, 18ValHb,6038.40603 275,7.81356,2.13473, 10AlaH, 9ProHga,6101.89256 276,7.91717,1.52318, (13Tyr/11Cys)H, 12ArgHgb,3676.73003 277,8.85105,2.84184, 4GluH, 3AspHbb,4785.78318 278,8.85219,2.78533, 4GluH, 3AspHba,8667.25755 279,7.81451,2.35829, 10AlaH, 9ProHbb,3444.83065 280,7.92191,1.36247, 11CysH, 10AlaHb*,1.81E+04 281,8.71311,1.74492, 3AspH, 2ArgHbb,9783.04848 282,8.13654,2.76445, 6CysH, 5CysHba,1.56E+04 283,7.74655,2.65301, 14AsnH, 15AsnHba,2.88E+04 284,7.93617,0.90914, 19CysH, 18ValHgb*,6558.98308 285,7.78775,3.04281, 14AsnH, 13TyrHba,1.40E+04 286,8.42348,3.3105, 12ArgH, 11CysHba,6254.62277 287,8.74307,3.82033, 2ArgH, 1IleHa,3.67E+04 288,8.69132,3.72226, 17HisH, 16HypHd2a,4128.80813 289,8.42371,4.00035, 12ArgH, 11CysHbb,1.02E+04 290,8.42341,4.27932, 12ArgH, 11CysHa,1.10E+04 291,8.68741,4.26675, 17HisH, 16HypHg,7377.52477 292,8.6906,4.45554, 17HisH, 16HypHa,2.25E+04 293,7.9375,4.17826, 19CysH, 18ValHa,1.89E+04 294,7.84178,4.31083, 7SerH, 6CysHa,6352.02845 295,7.78661,4.24794, 14AsnH, 13TyrHa,1.15E+04 296,8.13459,4.1738, 6CysH, 4GluHa,2818.30698 297,7.65264,3.47523, 15AsnH, 16HypHd1,5777.036 298,4.07825,1.67306, 9ProHa, 12ArgHba,7572.91432 299,4.0798,1.52239, 9ProHa, 12ArgHgb,1970.20939 300,4.0769,1.40298, 9ProHa, 12ArgHga,2991.82508 301,3.8609,2.65277, 12ArgHa, 15AsnHba,5707.17543 302,3.7201,2.65341, 16HypHd2a, 15AsnHba,8370.99565 303,3.4767,2.65592, 16HypHd1, 15AsnHba,5462.37288 304,2.66152,2.13564, 15AsnHba, 18ValHb,9009.68573 305,3.47941,3.71521, 16HypHd1, 16HypHd2a,7.48E+04 306,2.1521,3.717, 16HypHbb, 16HypHd2a,4397.05544 307,1.83688,3.71728, 16HypHba, 16HypHd2a,5763.62595 308,8.85184,8.49093, 4GluH, 5CysH,1.34E+04 309,8.49936,8.85188, 5CysH, 4GluH,1.66E+04 310,8.4992,8.13445, 5CysH, 6CysH,1.49E+04 311,8.13571,8.49211, 6CysH, 5CysH,1.53E+04 312,7.67979,8.68855, 18ValH, 17HisH,1.17E+04 313,7.68073,7.93905, 18ValH, 19CysH,1.37E+04 314,7.8413,8.13429, 7SerH, 6CysH,1.53E+04 315,7.85833,8.13573, 8AsnH, 6CysH,1.17E+04 316,7.65246,7.78193, 15AsnH, 14AsnH,1.83E+04 317,7.7862,7.65117, 14AsnH, 15AsnH,2.01E+04 318,7.93973,7.67526, 19CysH, 18ValH,1.28E+04 319,8.13621,7.83258, 6CysH, 7SerH,1.67E+04 320,7.81294,8.41816, 10AlaH, 12ArgH,4478.28075 321,7.81307,7.92278, 10AlaH, 11CysH,3.04E+04 322,7.85122,8.41539, 8AsnH, 12ArgH,4208.65779 323,8.71359,8.85074, 3AspH, 4GluH,6888.62318 324,8.85833,8.71899, 4GluH, 3AspH,6240.26553 325,8.69141,7.6784, 17HisH, 18ValH,1.19E+04 326,4.00249,3.1478, 11CysHbb, 12ArgHdb,6290.27423 327,4.19656,3.04313, 10AlaHa, 13TyrHba,9828.89786 328,4.07748,3.14392, 9ProHa, 12ArgHdb,3563.55919 329,2.13441,2.65244, 18ValHb, 15AsnHba,6485.40142 330,3.71874,5.03777, 16HypHd2a, 15AsnHa,1.59E+04 331,3.4756,5.03756, 16HypHd1, 15AsnHa,1.32E+04 332,4.00451,4.26764, 11CysHbb, 11CysHa,5352.65534 333,7.21718,3.1417, 2ArgHe, 2ArgHda,9847.68019 334,7.21802,1.75269, 2ArgHe, 2ArgHbb,3663.55395 335,7.21805,1.58733, 2ArgHe, 2ArgHba,3532.27684 336,3.14451,4.07905, 12ArgHdb, 9ProHa,6125.81839 337,2.36281,4.07724, 9ProHbb, 9ProHa,2.62E+04 338,2.1387,4.07578, 9ProHga, 9ProHa,5408.38673 339,2.00346,4.07632, 9ProHba, 9ProHa,2.13E+04 340,2.36474,3.90072, 9ProHbb, 9ProHda,4095.16908 341,2.13516,3.89999, 9ProHga, 9ProHda,1.47E+04 342,2.00403,3.90306, 9ProHba, 9ProHda,1.75E+04 343,1.84155,2.14641, 16HypHba, 16HypHbb,6.59E+04 344,3.1462,7.24168, 12ArgHdb, 12ArgHe,2.66E+04 345,1.42404,7.25971, 12ArgHga, 12ArgHe,1770.41827 346,1.86403,7.24412, 12ArgHbb, 12ArgHe,3927.21484 347,1.67978,7.24355, 12ArgHba, 12ArgHe,2976.18872 348,1.52445,7.24403, 12ArgHgb, 12ArgHe,4452.17147 349,1.39555,7.24317, 12ArgHga, 12ArgHe,5414.69443 350,1.92027,8.74396, 1IleHb, 2ArgH,6148.14397 351,7.92047,8.41836, 11CysH, 12ArgH,3.90E+04 352,8.42402,7.92164, 12ArgH, 11CysH,3.49E+04 353,4.54243,8.84895, 3AspHa, 4GluH,4.93E+04 354,4.45973,8.68896, 16HypHa, 17HisH,2.94E+04 355,4.17963,8.49068, 4GluHa, 5CysH,1.32E+04 356,4.28343,8.41869, 11CysHa, 12ArgH,1.09E+04 357,4.00682,8.419, 11CysHbb, 12ArgH,6606.77584 358,4.07748,8.42107, 9ProHa, 12ArgH,3480.26042 359,2.84469,8.84853, 3AspHbb, 4GluH,4881.47998 360,2.78918,8.85012, 3AspHba, 4GluH,5877.74551 361,4.53887,7.64633, 14AsnHa, 15AsnH,1.66E+04 362,4.63343,7.67503, 17HisHa, 18ValH,1.35E+04 363,4.30769,7.83594, 6CysHa, 7SerH,8017.26255 364,4.43804,8.13496, 5CysHa, 6CysH,7986.27818 365,4.19604,7.80721, 10AlaHa, 10AlaH,1.51E+04 366,1.36281,7.80749, 10AlaHb*, 10AlaH,2.94E+04 367,4.25244,7.78449, 13TyrHa, 14AsnH,1.33E+04 368,4.2842,7.74197, 11CysHa, 15AsnHd2b,6470.34902 369,4.07856,7.80625, 9ProHa, 10AlaH,4145.16663 370,3.86071,7.92129, 12ArgHa, 11CysH,7133.33472 371,4.17692,8.13324, 4GluHa, 6CysH,3256.05193 372,3.04488,7.7837, 13TyrHba, 14AsnH,1.38E+04 373,4.25192,7.0821, 13TyrHa, 13TyrHd*,1.57E+04 374,1.87249,4.08048, 12ArgHbb, 9ProHa,5164.79735 375,1.67456,4.07668, 12ArgHba, 9ProHa,6636.02386 376,2.65961,3.71864, 15AsnHba, 16HypHd2a,8615.83551 377,2.65906,3.85388, 15AsnHba, 12ArgHa,5260.78078 378,2.65793,3.47813, 15AsnHba, 16HypHd1,6054.74916 379,7.6188,6.9643, 14AsnHd2b, 14AsnHd2a,1.35E+05 380,7.74644,7.24629, 15AsnHd2b, 15AsnHd2a,1.11E+05 381,7.86868,7.17213, 8AsnHd2b, 8AsnHd2a,1.27E+05 382,7.08463,7.08123, 13TyrHd*, 13TyrHd*,6.80E+05 383,7.08334,6.77404, 13TyrHd*, 13TyrHe*,7.51E+04 384,6.77243,6.77312, 13TyrHe*, 13TyrHe*,7.51E+05 385,7.25466,7.73969, 15AsnHd2a, 15AsnHd2b,1.06E+05 386,7.17074,7.86732, 8AsnHd2a, 8AsnHd2b,1.32E+05 387,6.97271,7.61869, 14AsnHd2a, 14AsnHd2b,1.48E+05 388,6.77519,7.08017, 13TyrHe*, 13TyrHd*,9.23E+04 389,8.49807,4.54336, 5CysH, 3AspHa,6238.44381 390,7.0851,4.24669, 13TyrHd*, 13TyrHa,2.10E+04 391,1.6801,7.9201, 12ArgHba, 11CysH,6694.8672 392,2.14971,4.45609, 16HypHbb, 16HypHa,2.56E+04 393,1.84578,4.45603, 16HypHba, 16HypHa,1.37E+04 394,2.15086,4.27213, 16HypHbb, 16HypHg,9574.5407 395,1.8379,4.27443, 16HypHba, 16HypHg,1.52E+04 396,3.71868,4.27019, 16HypHd2a, 16HypHg,1.53E+04 397,3.48065,4.26855, 16HypHd1, 16HypHg,7738.83199 398,4.07796,2.3598, 9ProHa, 9ProHbb,2.77E+04 399,1.75007,4.29765, 2ArgHbb, 2ArgHa,1.45E+04 400,1.59806,4.30485, 2ArgHba, 2ArgHa,5244.28459 401,1.54961,4.30494, 2ArgHba, 2ArgHa,6956.99616 402,1.53734,4.30676, 2ArgHba, 2ArgHa,7171.6752 403,7.08499,3.0426, 13TyrHd*, 13TyrHba,5.88E+04 404,6.77576,3.04082, 13TyrHe*, 13TyrHba,6728.90443 405,7.25415,2.65262, 12ArgHe, 12ArgHda,1.20E+04 406,7.94036,1.89171, 13TyrH, 12ArgHbb,1219.87616 407,7.9201,1.86949, 13TyrH, 12ArgHbb,9054.7448 408,2.138,7.93003, 18ValHb, 19CysH,5790.24665 409,2.00414,7.80733, 9ProHba, 10AlaH,1.07E+04 410,1.8786,7.92299, 12ArgHbb, 11CysH,4853.17529 411,2.65855,0.91539, 15AsnHba, 18ValHgb*,2.02E+04 412,1.9251,3.82076, 1IleHb, 1IleHa,1.07E+04 413,1.7473,3.8156, 2ArgHbb, 1IleHa,2290.54895 414,1.16487,3.81642, 1IleHg1a, 1IleHa,1684.86011 415,0.95279,3.82142, 1IleHg2*, 1IleHa,8458.97889 416,0.87922,3.82347, 1IleHd1*, 1IleHa,5257.62869 417,1.17915,1.4396, 1IleHg1a, 1IleHg1b,2.01E+04 418,2.13016,4.03072, 9ProHga, 9ProHdb,1.18E+04 419,2.00299,4.02948, 9ProHba, 9ProHdb,2.40E+04 420,2.13641,2.3632, 9ProHga, 9ProHbb,2.57E+04 421,2.00436,2.35814, 9ProHba, 9ProHbb,7.88E+04 422,2.36221,2.13333, 9ProHbb, 9ProHga,2.24E+04 423,2.3616,1.99791, 9ProHbb, 9ProHba,7.93E+04 424,4.03146,5.26533, 9ProHdb, 8AsnHa,5.34E+04 425,3.91046,5.26286, 9ProHda, 8AsnHa,4.99E+04 426,0.92349,2.65269, 18ValHgb*, 15AsnHba,1.59E+04 427,0.88302,2.6543, 18ValHga*, 15AsnHba,7404.36841 428,5.26761,3.90247, 8AsnHa, 7SerHba,1.66E+04 429,3.0428,7.0818, 13TyrHba, 13TyrHd*,4.14E+04 430,2.65933,7.24628, 15AsnHba, 15AsnHd2a,1.09E+04 431,1.36506,7.92099, 10AlaHb*, 11CysH,1.33E+04 432,2.35787,7.80863, 9ProHbb, 10AlaH,2902.89696 433,7.08472,7.92082, 13TyrHd*, 13TyrH,8414.61977 434,4.0166,2.80618, (11Cys/9Pro)(Hbb/Hdb), 8AsnHba,7192.80818 435,4.43681,3.31317, 5CysHa, 11CysHba,5262.08585 436,4.43016,4.00064, 5CysHa, 11CysHbb,1.05E+04 437,2.80594,4.01299, (5Cys/8Asn)Hba, 11CysHbb,7103.57632 438,7.92253,7.80487, 11CysH, 10AlaH,3.54E+04 439,7.91839,7.0813, 13TyrH, 13TyrHd*,5207.91779 440,4.0778,7.92343, 9ProHa, 11CysH,2244.57754 441,2.13535,7.81008, 9ProHga, 10AlaH,2961.85121 442,7.91702,3.85804, 13TyrH, 12ArgHa,8363.62464 443,7.91909,3.1455, 11CysH, 8AsnHbb,1.18E+04 444,7.1699,2.80595, 8AsnHd2a, 8AsnHba,6216.46021 445,7.61916,2.71171, 14AsnHd2b, 14AsnHba,9439.94249 446,7.61949,2.85887, 14AsnHd2b, 14AsnHbb,6493.77393 447,6.9728,2.70765, 14AsnHd2a, 14AsnHba,4963.68782 448,8.42401,7.80563, 12ArgH, 10AlaH,3744.85281 449,8.49699,7.8337, 5CysH, 7SerH,1846.04842 450,7.14389,7.73598, 8AsnHd2a, 15AsnHd2b,1.04E+04 451,2.76473,8.13429, 5CysHba, 6CysH,8392.84065 452,2.65819,7.73953, 15AsnHba, 15AsnHd2b,2.76E+04 453,2.71298,7.62078, 14AsnHba, 14AsnHd2b,9909.14551 454,2.86373,7.61774, 14AsnHbb, 14AsnHd2b,6124.50213 455,7.0867,4.54236, 13TyrHd*, 14AsnHa,4225.05016 456,7.74648,0.91149, 15AsnHd2b, 18ValHgb*,3092.25057 457,7.91806,3.05053, 13TyrH, 13TyrHbb,4.95E+04 458,4.28124,1.35883, 11CysHa, 10AlaHb*,5111.87686 459,3.22684,4.72453, 19CysHbb, 19CysHa,1.31E+04 460,2.71201,4.72587, 19CysHba, 19CysHa,8547.30807 461,3.15095,4.00411, 8AsnHbb, 11CysHbb,1.18E+04 462,3.0448,4.20046, 13TyrHba, 10AlaHa,1.33E+04 ; 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 . . 7.511 ppm 3.252 . . c30226_5ug5 2 2 C 13 C . . 79.896 ppm 43.034 . . c30226_5ug5 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 c30226_5ug5 _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 c30226_5ug5 _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 . . . c30226_5ug5 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 . . . . c30226_5ug5 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 5.772 0.704 -4.417 . . . 1.0 . . . . . . . . . . . . A . 1 ILE C . . . . . . . . . c30226_5ug5 1 . 1 . 2 . 1 1 1 ILE CA C 4.681 1.271 -5.315 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CA . . . . . . . . . c30226_5ug5 1 . 1 . 3 . 1 1 1 ILE CB C 3.858 0.107 -5.913 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CB . . . . . . . . . c30226_5ug5 1 . 1 . 4 . 1 1 1 ILE CD1 C 4.005 -1.956 -7.407 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CD1 . . . . . . . . . c30226_5ug5 1 . 1 . 5 . 1 1 1 ILE CG1 C 4.708 -0.722 -6.881 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CG1 . . . . . . . . . c30226_5ug5 1 . 1 . 6 . 1 1 1 ILE CG2 C 2.618 0.644 -6.612 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CG2 . . . . . . . . . c30226_5ug5 1 . 1 . 7 . 1 1 1 ILE H1 H 5.931 1.566 -6.949 . . . 1.0 . . . . . . . . . . . . A . 1 ILE H1 . . . . . . . . . c30226_5ug5 1 . 1 . 8 . 1 1 1 ILE H2 H 5.800 2.906 -5.934 . . . 1.0 . . . . . . . . . . . . A . 1 ILE H2 . . . . . . . . . c30226_5ug5 1 . 1 . 9 . 1 1 1 ILE H3 H 4.531 2.515 -6.979 . . . 1.0 . . . . . . . . . . . . A . 1 ILE H3 . . . . . . . . . c30226_5ug5 1 . 1 . 10 . 1 1 1 ILE HA H 4.022 1.882 -4.718 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HA . . . . . . . . . c30226_5ug5 1 . 1 . 11 . 1 1 1 ILE HB H 3.533 -0.526 -5.100 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HB . . . . . . . . . c30226_5ug5 1 . 1 . 12 . 1 1 1 ILE HD11 H 4.662 -2.483 -8.084 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HD11 . . . . . . . . . c30226_5ug5 1 . 1 . 13 . 1 1 1 ILE HD12 H 3.107 -1.664 -7.932 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HD12 . . . . . . . . . c30226_5ug5 1 . 1 . 14 . 1 1 1 ILE HD13 H 3.747 -2.602 -6.582 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HD13 . . . . . . . . . c30226_5ug5 1 . 1 . 15 . 1 1 1 ILE HG12 H 4.976 -0.109 -7.728 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG12 . . . . . . . . . c30226_5ug5 1 . 1 . 16 . 1 1 1 ILE HG13 H 5.607 -1.042 -6.375 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG13 . . . . . . . . . c30226_5ug5 1 . 1 . 17 . 1 1 1 ILE HG21 H 1.995 1.161 -5.897 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG21 . . . . . . . . . c30226_5ug5 1 . 1 . 18 . 1 1 1 ILE HG22 H 2.063 -0.177 -7.043 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG22 . . . . . . . . . c30226_5ug5 1 . 1 . 19 . 1 1 1 ILE HG23 H 2.913 1.327 -7.393 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG23 . . . . . . . . . c30226_5ug5 1 . 1 . 20 . 1 1 1 ILE N N 5.274 2.122 -6.368 . . . 1.0 . . . . . . . . . . . . A . 1 ILE N . . . . . . . . . c30226_5ug5 1 . 1 . 21 . 1 1 1 ILE O O 6.863 0.372 -4.880 . . . 1.0 . . . . . . . . . . . . A . 1 ILE O . . . . . . . . . c30226_5ug5 1 . 1 . 22 . 1 1 2 ARG C C 6.415 -1.440 -2.177 . . . 1.0 . . . . . . . . . . . . A . 2 ARG C . . . . . . . . . c30226_5ug5 1 . 1 . 23 . 1 1 2 ARG CA C 6.433 0.084 -2.165 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CA . . . . . . . . . c30226_5ug5 1 . 1 . 24 . 1 1 2 ARG CB C 6.107 0.593 -0.758 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CB . . . . . . . . . c30226_5ug5 1 . 1 . 25 . 1 1 2 ARG CD C 7.668 2.569 -0.836 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CD . . . . . . . . . c30226_5ug5 1 . 1 . 26 . 1 1 2 ARG CG C 6.239 2.099 -0.604 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CG . . . . . . . . . c30226_5ug5 1 . 1 . 27 . 1 1 2 ARG CZ C 9.651 2.632 0.632 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CZ . . . . . . . . . c30226_5ug5 1 . 1 . 28 . 1 1 2 ARG H H 4.604 0.919 -2.813 . . . 1.0 . . . . . . . . . . . . A . 2 ARG H . . . . . . . . . c30226_5ug5 1 . 1 . 29 . 1 1 2 ARG HA H 7.414 0.425 -2.445 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HA . . . . . . . . . c30226_5ug5 1 . 1 . 30 . 1 1 2 ARG HB2 H 5.092 0.314 -0.514 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB2 . . . . . . . . . c30226_5ug5 1 . 1 . 31 . 1 1 2 ARG HB3 H 6.777 0.120 -0.054 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB3 . . . . . . . . . c30226_5ug5 1 . 1 . 32 . 1 1 2 ARG HD2 H 7.968 2.289 -1.833 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD2 . . . . . . . . . c30226_5ug5 1 . 1 . 33 . 1 1 2 ARG HD3 H 7.698 3.644 -0.742 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD3 . . . . . . . . . c30226_5ug5 1 . 1 . 34 . 1 1 2 ARG HE H 8.446 1.052 0.397 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HE . . . . . . . . . c30226_5ug5 1 . 1 . 35 . 1 1 2 ARG HG2 H 5.594 2.581 -1.323 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG2 . . . . . . . . . c30226_5ug5 1 . 1 . 36 . 1 1 2 ARG HG3 H 5.936 2.376 0.395 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG3 . . . . . . . . . c30226_5ug5 1 . 1 . 37 . 1 1 2 ARG HH11 H 9.311 4.349 -0.391 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH11 . . . . . . . . . c30226_5ug5 1 . 1 . 38 . 1 1 2 ARG HH12 H 10.693 4.372 0.653 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH12 . . . . . . . . . c30226_5ug5 1 . 1 . 39 . 1 1 2 ARG HH21 H 10.263 1.075 1.779 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH21 . . . . . . . . . c30226_5ug5 1 . 1 . 40 . 1 1 2 ARG HH22 H 11.239 2.505 1.884 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH22 . . . . . . . . . c30226_5ug5 1 . 1 . 41 . 1 1 2 ARG N N 5.482 0.616 -3.128 . . . 1.0 . . . . . . . . . . . . A . 2 ARG N . . . . . . . . . c30226_5ug5 1 . 1 . 42 . 1 1 2 ARG NE N 8.605 1.984 0.121 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NE . . . . . . . . . c30226_5ug5 1 . 1 . 43 . 1 1 2 ARG NH1 N 9.904 3.885 0.268 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH1 . . . . . . . . . c30226_5ug5 1 . 1 . 44 . 1 1 2 ARG NH2 N 10.447 2.023 1.501 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH2 . . . . . . . . . c30226_5ug5 1 . 1 . 45 . 1 1 2 ARG O O 5.412 -2.059 -2.527 . . . 1.0 . . . . . . . . . . . . A . 2 ARG O . . . . . . . . . c30226_5ug5 1 . 1 . 46 . 1 1 3 ASP C C 7.148 -3.988 -0.387 . . . 1.0 . . . . . . . . . . . . A . 3 ASP C . . . . . . . . . c30226_5ug5 1 . 1 . 47 . 1 1 3 ASP CA C 7.643 -3.494 -1.730 . . . 1.0 . . . . . . . . . . . . A . 3 ASP CA . . . . . . . . . c30226_5ug5 1 . 1 . 48 . 1 1 3 ASP CB C 9.087 -3.928 -1.996 . . . 1.0 . . . . . . . . . . . . A . 3 ASP CB . . . . . . . . . c30226_5ug5 1 . 1 . 49 . 1 1 3 ASP CG C 9.287 -5.426 -1.911 . . . 1.0 . . . . . . . . . . . . A . 3 ASP CG . . . . . . . . . c30226_5ug5 1 . 1 . 50 . 1 1 3 ASP H H 8.305 -1.485 -1.533 . . . 1.0 . . . . . . . . . . . . A . 3 ASP H . . . . . . . . . c30226_5ug5 1 . 1 . 51 . 1 1 3 ASP HA H 7.003 -3.886 -2.480 . . . 1.0 . . . . . . . . . . . . A . 3 ASP HA . . . . . . . . . c30226_5ug5 1 . 1 . 52 . 1 1 3 ASP HB2 H 9.373 -3.607 -2.985 . . . 1.0 . . . . . . . . . . . . A . 3 ASP HB2 . . . . . . . . . c30226_5ug5 1 . 1 . 53 . 1 1 3 ASP HB3 H 9.735 -3.456 -1.272 . . . 1.0 . . . . . . . . . . . . A . 3 ASP HB3 . . . . . . . . . c30226_5ug5 1 . 1 . 54 . 1 1 3 ASP N N 7.532 -2.037 -1.789 . . . 1.0 . . . . . . . . . . . . A . 3 ASP N . . . . . . . . . c30226_5ug5 1 . 1 . 55 . 1 1 3 ASP O O 7.025 -5.183 -0.114 . . . 1.0 . . . . . . . . . . . . A . 3 ASP O . . . . . . . . . c30226_5ug5 1 . 1 . 56 . 1 1 3 ASP OD1 O 8.716 -6.160 -2.746 . . . 1.0 . . . . . . . . . . . . A . 3 ASP OD1 . . . . . . . . . c30226_5ug5 1 . 1 . 57 . 1 1 3 ASP OD2 O 10.037 -5.875 -1.019 . . . 1.0 . . . . . . . . . . . . A . 3 ASP OD2 . . . . . . . . . c30226_5ug5 1 . 1 . 58 . 1 1 4 GLU C C 4.821 -2.613 1.692 . . . 1.0 . . . . . . . . . . . . A . 4 GLU C . . . . . . . . . c30226_5ug5 1 . 1 . 59 . 1 1 4 GLU CA C 6.217 -3.203 1.713 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CA . . . . . . . . . c30226_5ug5 1 . 1 . 60 . 1 1 4 GLU CB C 7.035 -2.541 2.806 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CB . . . . . . . . . c30226_5ug5 1 . 1 . 61 . 1 1 4 GLU CD C 7.735 -4.718 3.847 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CD . . . . . . . . . c30226_5ug5 1 . 1 . 62 . 1 1 4 GLU CG C 8.196 -3.387 3.298 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CG . . . . . . . . . c30226_5ug5 1 . 1 . 63 . 1 1 4 GLU H H 7.014 -2.112 0.104 . . . 1.0 . . . . . . . . . . . . A . 4 GLU H . . . . . . . . . c30226_5ug5 1 . 1 . 64 . 1 1 4 GLU HA H 6.152 -4.263 1.905 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HA . . . . . . . . . c30226_5ug5 1 . 1 . 65 . 1 1 4 GLU HB2 H 7.429 -1.608 2.431 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HB2 . . . . . . . . . c30226_5ug5 1 . 1 . 66 . 1 1 4 GLU HB3 H 6.383 -2.338 3.631 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HB3 . . . . . . . . . c30226_5ug5 1 . 1 . 67 . 1 1 4 GLU HG2 H 8.871 -3.565 2.475 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HG2 . . . . . . . . . c30226_5ug5 1 . 1 . 68 . 1 1 4 GLU HG3 H 8.712 -2.849 4.079 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HG3 . . . . . . . . . c30226_5ug5 1 . 1 . 69 . 1 1 4 GLU N N 6.834 -3.015 0.416 . . . 1.0 . . . . . . . . . . . . A . 4 GLU N . . . . . . . . . c30226_5ug5 1 . 1 . 70 . 1 1 4 GLU O O 4.304 -2.165 2.707 . . . 1.0 . . . . . . . . . . . . A . 4 GLU O . . . . . . . . . c30226_5ug5 1 . 1 . 71 . 1 1 4 GLU OE1 O 7.940 -5.747 3.167 . . . 1.0 . . . . . . . . . . . . A . 4 GLU OE1 . . . . . . . . . c30226_5ug5 1 . 1 . 72 . 1 1 4 GLU OE2 O 7.175 -4.748 4.961 . . . 1.0 . . . . . . . . . . . . A . 4 GLU OE2 . . . . . . . . . c30226_5ug5 1 . 1 . 73 . 1 1 5 CYS C C 1.866 -2.274 1.184 . . . 1.0 . . . . . . . . . . . . A . 5 CYS C . . . . . . . . . c30226_5ug5 1 . 1 . 74 . 1 1 5 CYS CA C 3.002 -1.917 0.220 . . . 1.0 . . . . . . . . . . . . A . 5 CYS CA . . . . . . . . . c30226_5ug5 1 . 1 . 75 . 1 1 5 CYS CB C 2.598 -2.235 -1.215 . . . 1.0 . . . . . . . . . . . . A . 5 CYS CB . . . . . . . . . c30226_5ug5 1 . 1 . 76 . 1 1 5 CYS H H 4.660 -3.114 -0.206 . . . 1.0 . . . . . . . . . . . . A . 5 CYS H . . . . . . . . . c30226_5ug5 1 . 1 . 77 . 1 1 5 CYS HA H 3.193 -0.859 0.293 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HA . . . . . . . . . c30226_5ug5 1 . 1 . 78 . 1 1 5 CYS HB2 H 3.315 -2.926 -1.634 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HB2 . . . . . . . . . c30226_5ug5 1 . 1 . 79 . 1 1 5 CYS HB3 H 1.633 -2.697 -1.208 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HB3 . . . . . . . . . c30226_5ug5 1 . 1 . 80 . 1 1 5 CYS N N 4.243 -2.608 0.510 . . . 1.0 . . . . . . . . . . . . A . 5 CYS N . . . . . . . . . c30226_5ug5 1 . 1 . 81 . 1 1 5 CYS O O 1.033 -1.429 1.480 . . . 1.0 . . . . . . . . . . . . A . 5 CYS O . . . . . . . . . c30226_5ug5 1 . 1 . 82 . 1 1 5 CYS SG S 2.532 -0.782 -2.314 . . . 1.0 . . . . . . . . . . . . A . 5 CYS SG . . . . . . . . . c30226_5ug5 1 . 1 . 83 . 1 1 6 CYS C C 1.081 -3.577 4.025 . . . 1.0 . . . . . . . . . . . . A . 6 CYS C . . . . . . . . . c30226_5ug5 1 . 1 . 84 . 1 1 6 CYS CA C 0.779 -3.969 2.579 . . . 1.0 . . . . . . . . . . . . A . 6 CYS CA . . . . . . . . . c30226_5ug5 1 . 1 . 85 . 1 1 6 CYS CB C 0.629 -5.490 2.448 . . . 1.0 . . . . . . . . . . . . A . 6 CYS CB . . . . . . . . . c30226_5ug5 1 . 1 . 86 . 1 1 6 CYS H H 2.568 -4.130 1.441 . . . 1.0 . . . . . . . . . . . . A . 6 CYS H . . . . . . . . . c30226_5ug5 1 . 1 . 87 . 1 1 6 CYS HA H -0.157 -3.485 2.283 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HA . . . . . . . . . c30226_5ug5 1 . 1 . 88 . 1 1 6 CYS HB2 H 0.523 -5.742 1.405 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HB2 . . . . . . . . . c30226_5ug5 1 . 1 . 89 . 1 1 6 CYS HB3 H 1.519 -5.961 2.834 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HB3 . . . . . . . . . c30226_5ug5 1 . 1 . 90 . 1 1 6 CYS N N 1.845 -3.507 1.681 . . . 1.0 . . . . . . . . . . . . A . 6 CYS N . . . . . . . . . c30226_5ug5 1 . 1 . 91 . 1 1 6 CYS O O 0.173 -3.470 4.850 . . . 1.0 . . . . . . . . . . . . A . 6 CYS O . . . . . . . . . c30226_5ug5 1 . 1 . 92 . 1 1 6 CYS SG S -0.798 -6.206 3.328 . . . 1.0 . . . . . . . . . . . . A . 6 CYS SG . . . . . . . . . c30226_5ug5 1 . 1 . 93 . 1 1 7 SER C C 2.586 -1.312 5.585 . . . 1.0 . . . . . . . . . . . . A . 7 SER C . . . . . . . . . c30226_5ug5 1 . 1 . 94 . 1 1 7 SER CA C 2.745 -2.820 5.611 . . . 1.0 . . . . . . . . . . . . A . 7 SER CA . . . . . . . . . c30226_5ug5 1 . 1 . 95 . 1 1 7 SER CB C 4.207 -3.125 5.875 . . . 1.0 . . . . . . . . . . . . A . 7 SER CB . . . . . . . . . c30226_5ug5 1 . 1 . 96 . 1 1 7 SER H H 3.049 -3.592 3.683 . . . 1.0 . . . . . . . . . . . . A . 7 SER H . . . . . . . . . c30226_5ug5 1 . 1 . 97 . 1 1 7 SER HA H 2.133 -3.246 6.386 . . . 1.0 . . . . . . . . . . . . A . 7 SER HA . . . . . . . . . c30226_5ug5 1 . 1 . 98 . 1 1 7 SER HB2 H 4.807 -2.357 5.404 . . . 1.0 . . . . . . . . . . . . A . 7 SER HB2 . . . . . . . . . c30226_5ug5 1 . 1 . 99 . 1 1 7 SER HB3 H 4.381 -3.113 6.934 . . . 1.0 . . . . . . . . . . . . A . 7 SER HB3 . . . . . . . . . c30226_5ug5 1 . 1 . 100 . 1 1 7 SER HG H 5.544 -4.442 5.267 . . . 1.0 . . . . . . . . . . . . A . 7 SER HG . . . . . . . . . c30226_5ug5 1 . 1 . 101 . 1 1 7 SER N N 2.351 -3.364 4.329 . . . 1.0 . . . . . . . . . . . . A . 7 SER N . . . . . . . . . c30226_5ug5 1 . 1 . 102 . 1 1 7 SER O O 2.268 -0.679 6.591 . . . 1.0 . . . . . . . . . . . . A . 7 SER O . . . . . . . . . c30226_5ug5 1 . 1 . 103 . 1 1 7 SER OG O 4.573 -4.400 5.363 . . . 1.0 . . . . . . . . . . . . A . 7 SER OG . . . . . . . . . c30226_5ug5 1 . 1 . 104 . 1 1 8 ASN C C 1.571 1.343 4.208 . . . 1.0 . . . . . . . . . . . . A . 8 ASN C . . . . . . . . . c30226_5ug5 1 . 1 . 105 . 1 1 8 ASN CA C 2.938 0.669 4.228 . . . 1.0 . . . . . . . . . . . . A . 8 ASN CA . . . . . . . . . c30226_5ug5 1 . 1 . 106 . 1 1 8 ASN CB C 3.659 0.963 2.912 . . . 1.0 . . . . . . . . . . . . A . 8 ASN CB . . . . . . . . . c30226_5ug5 1 . 1 . 107 . 1 1 8 ASN CG C 3.925 2.444 2.690 . . . 1.0 . . . . . . . . . . . . A . 8 ASN CG . . . . . . . . . c30226_5ug5 1 . 1 . 108 . 1 1 8 ASN H H 2.884 -1.338 3.616 . . . 1.0 . . . . . . . . . . . . A . 8 ASN H . . . . . . . . . c30226_5ug5 1 . 1 . 109 . 1 1 8 ASN HA H 3.527 1.042 5.050 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HA . . . . . . . . . c30226_5ug5 1 . 1 . 110 . 1 1 8 ASN HB2 H 4.608 0.445 2.907 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HB2 . . . . . . . . . c30226_5ug5 1 . 1 . 111 . 1 1 8 ASN HB3 H 3.052 0.598 2.096 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HB3 . . . . . . . . . c30226_5ug5 1 . 1 . 112 . 1 1 8 ASN HD21 H 4.414 2.691 4.604 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HD21 . . . . . . . . . c30226_5ug5 1 . 1 . 113 . 1 1 8 ASN HD22 H 4.509 4.106 3.610 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HD22 . . . . . . . . . c30226_5ug5 1 . 1 . 114 . 1 1 8 ASN N N 2.808 -0.758 4.405 . . . 1.0 . . . . . . . . . . . . A . 8 ASN N . . . . . . . . . c30226_5ug5 1 . 1 . 115 . 1 1 8 ASN ND2 N 4.315 3.152 3.741 . . . 1.0 . . . . . . . . . . . . A . 8 ASN ND2 . . . . . . . . . c30226_5ug5 1 . 1 . 116 . 1 1 8 ASN O O 0.804 1.160 3.260 . . . 1.0 . . . . . . . . . . . . A . 8 ASN O . . . . . . . . . c30226_5ug5 1 . 1 . 117 . 1 1 8 ASN OD1 O 3.810 2.941 1.572 . . . 1.0 . . . . . . . . . . . . A . 8 ASN OD1 . . . . . . . . . c30226_5ug5 1 . 1 . 118 . 1 1 9 PRO C C -0.249 3.776 4.135 . . . 1.0 . . . . . . . . . . . . A . 9 PRO C . . . . . . . . . c30226_5ug5 1 . 1 . 119 . 1 1 9 PRO CA C -0.018 2.863 5.333 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CA . . . . . . . . . c30226_5ug5 1 . 1 . 120 . 1 1 9 PRO CB C 0.163 3.692 6.603 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CB . . . . . . . . . c30226_5ug5 1 . 1 . 121 . 1 1 9 PRO CD C 2.112 2.429 6.400 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CD . . . . . . . . . c30226_5ug5 1 . 1 . 122 . 1 1 9 PRO CG C 1.138 2.943 7.403 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CG . . . . . . . . . c30226_5ug5 1 . 1 . 123 . 1 1 9 PRO HA H -0.853 2.187 5.449 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HA . . . . . . . . . c30226_5ug5 1 . 1 . 124 . 1 1 9 PRO HB2 H 0.566 4.647 6.343 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HB2 . . . . . . . . . c30226_5ug5 1 . 1 . 125 . 1 1 9 PRO HB3 H -0.779 3.804 7.117 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HB3 . . . . . . . . . c30226_5ug5 1 . 1 . 126 . 1 1 9 PRO HD2 H 2.851 3.180 6.167 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HD2 . . . . . . . . . c30226_5ug5 1 . 1 . 127 . 1 1 9 PRO HD3 H 2.572 1.544 6.761 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HD3 . . . . . . . . . c30226_5ug5 1 . 1 . 128 . 1 1 9 PRO HG2 H 1.627 3.610 8.093 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HG2 . . . . . . . . . c30226_5ug5 1 . 1 . 129 . 1 1 9 PRO HG3 H 0.657 2.128 7.923 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HG3 . . . . . . . . . c30226_5ug5 1 . 1 . 130 . 1 1 9 PRO N N 1.256 2.146 5.236 . . . 1.0 . . . . . . . . . . . . A . 9 PRO N . . . . . . . . . c30226_5ug5 1 . 1 . 131 . 1 1 9 PRO O O -1.384 4.036 3.745 . . . 1.0 . . . . . . . . . . . . A . 9 PRO O . . . . . . . . . c30226_5ug5 1 . 1 . 132 . 1 1 10 ALA C C 0.427 4.430 1.116 . . . 1.0 . . . . . . . . . . . . A . 10 ALA C . . . . . . . . . c30226_5ug5 1 . 1 . 133 . 1 1 10 ALA CA C 0.787 5.153 2.415 . . . 1.0 . . . . . . . . . . . . A . 10 ALA CA . . . . . . . . . c30226_5ug5 1 . 1 . 134 . 1 1 10 ALA CB C 2.109 5.890 2.263 . . . 1.0 . . . . . . . . . . . . A . 10 ALA CB . . . . . . . . . c30226_5ug5 1 . 1 . 135 . 1 1 10 ALA H H 1.721 3.973 3.902 . . . 1.0 . . . . . . . . . . . . A . 10 ALA H . . . . . . . . . c30226_5ug5 1 . 1 . 136 . 1 1 10 ALA HA H 0.022 5.886 2.624 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HA . . . . . . . . . c30226_5ug5 1 . 1 . 137 . 1 1 10 ALA HB1 H 2.035 6.598 1.451 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HB1 . . . . . . . . . c30226_5ug5 1 . 1 . 138 . 1 1 10 ALA HB2 H 2.895 5.180 2.053 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HB2 . . . . . . . . . c30226_5ug5 1 . 1 . 139 . 1 1 10 ALA HB3 H 2.334 6.417 3.178 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HB3 . . . . . . . . . c30226_5ug5 1 . 1 . 140 . 1 1 10 ALA N N 0.847 4.242 3.550 . . . 1.0 . . . . . . . . . . . . A . 10 ALA N . . . . . . . . . c30226_5ug5 1 . 1 . 141 . 1 1 10 ALA O O -0.063 5.052 0.172 . . . 1.0 . . . . . . . . . . . . A . 10 ALA O . . . . . . . . . c30226_5ug5 1 . 1 . 142 . 1 1 11 CYS C C -1.051 1.909 0.030 . . . 1.0 . . . . . . . . . . . . A . 11 CYS C . . . . . . . . . c30226_5ug5 1 . 1 . 143 . 1 1 11 CYS CA C 0.347 2.382 -0.150 . . . 1.0 . . . . . . . . . . . . A . 11 CYS CA . . . . . . . . . c30226_5ug5 1 . 1 . 144 . 1 1 11 CYS CB C 1.290 1.201 -0.370 . . . 1.0 . . . . . . . . . . . . A . 11 CYS CB . . . . . . . . . c30226_5ug5 1 . 1 . 145 . 1 1 11 CYS H H 0.866 2.620 1.875 . . . 1.0 . . . . . . . . . . . . A . 11 CYS H . . . . . . . . . c30226_5ug5 1 . 1 . 146 . 1 1 11 CYS HA H 0.395 3.059 -0.991 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HA . . . . . . . . . c30226_5ug5 1 . 1 . 147 . 1 1 11 CYS HB2 H 2.288 1.572 -0.555 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HB2 . . . . . . . . . c30226_5ug5 1 . 1 . 148 . 1 1 11 CYS HB3 H 1.296 0.583 0.514 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HB3 . . . . . . . . . c30226_5ug5 1 . 1 . 149 . 1 1 11 CYS N N 0.658 3.122 1.055 . . . 1.0 . . . . . . . . . . . . A . 11 CYS N . . . . . . . . . c30226_5ug5 1 . 1 . 150 . 1 1 11 CYS O O -1.917 2.050 -0.833 . . . 1.0 . . . . . . . . . . . . A . 11 CYS O . . . . . . . . . c30226_5ug5 1 . 1 . 151 . 1 1 11 CYS SG S 0.814 0.148 -1.782 . . . 1.0 . . . . . . . . . . . . A . 11 CYS SG . . . . . . . . . c30226_5ug5 1 . 1 . 152 . 1 1 12 ARG C C -3.573 2.031 1.441 . . . 1.0 . . . . . . . . . . . . A . 12 ARG C . . . . . . . . . c30226_5ug5 1 . 1 . 153 . 1 1 12 ARG CA C -2.503 1.001 1.761 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CA . . . . . . . . . c30226_5ug5 1 . 1 . 154 . 1 1 12 ARG CB C -2.351 0.890 3.266 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CB . . . . . . . . . c30226_5ug5 1 . 1 . 155 . 1 1 12 ARG CD C -1.298 -1.376 3.071 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CD . . . . . . . . . c30226_5ug5 1 . 1 . 156 . 1 1 12 ARG CG C -2.290 -0.522 3.807 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CG . . . . . . . . . c30226_5ug5 1 . 1 . 157 . 1 1 12 ARG CZ C -2.720 -3.114 2.085 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CZ . . . . . . . . . c30226_5ug5 1 . 1 . 158 . 1 1 12 ARG H H -0.435 1.200 1.786 . . . 1.0 . . . . . . . . . . . . A . 12 ARG H . . . . . . . . . c30226_5ug5 1 . 1 . 159 . 1 1 12 ARG HA H -2.760 0.057 1.359 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HA . . . . . . . . . c30226_5ug5 1 . 1 . 160 . 1 1 12 ARG HB2 H -1.441 1.394 3.554 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HB2 . . . . . . . . . c30226_5ug5 1 . 1 . 161 . 1 1 12 ARG HB3 H -3.173 1.395 3.714 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HB3 . . . . . . . . . c30226_5ug5 1 . 1 . 162 . 1 1 12 ARG HD2 H -0.492 -0.752 2.705 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HD2 . . . . . . . . . c30226_5ug5 1 . 1 . 163 . 1 1 12 ARG HD3 H -0.907 -2.124 3.744 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HD3 . . . . . . . . . c30226_5ug5 1 . 1 . 164 . 1 1 12 ARG HE H -1.849 -1.626 1.064 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HE . . . . . . . . . c30226_5ug5 1 . 1 . 165 . 1 1 12 ARG HG2 H -2.026 -0.494 4.848 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HG2 . . . . . . . . . c30226_5ug5 1 . 1 . 166 . 1 1 12 ARG HG3 H -3.252 -0.975 3.691 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HG3 . . . . . . . . . c30226_5ug5 1 . 1 . 167 . 1 1 12 ARG HH11 H -2.306 -3.378 4.054 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH11 . . . . . . . . . c30226_5ug5 1 . 1 . 168 . 1 1 12 ARG HH12 H -3.390 -4.543 3.362 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH12 . . . . . . . . . c30226_5ug5 1 . 1 . 169 . 1 1 12 ARG HH21 H -3.336 -3.131 0.158 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH21 . . . . . . . . . c30226_5ug5 1 . 1 . 170 . 1 1 12 ARG HH22 H -3.975 -4.408 1.165 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH22 . . . . . . . . . c30226_5ug5 1 . 1 . 171 . 1 1 12 ARG N N -1.230 1.371 1.226 . . . 1.0 . . . . . . . . . . . . A . 12 ARG N . . . . . . . . . c30226_5ug5 1 . 1 . 172 . 1 1 12 ARG NE N -1.950 -2.037 1.948 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NE . . . . . . . . . c30226_5ug5 1 . 1 . 173 . 1 1 12 ARG NH1 N -2.813 -3.725 3.260 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NH1 . . . . . . . . . c30226_5ug5 1 . 1 . 174 . 1 1 12 ARG NH2 N -3.394 -3.586 1.050 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NH2 . . . . . . . . . c30226_5ug5 1 . 1 . 175 . 1 1 12 ARG O O -4.688 1.688 1.060 . . . 1.0 . . . . . . . . . . . . A . 12 ARG O . . . . . . . . . c30226_5ug5 1 . 1 . 176 . 1 1 13 TYR C C -4.982 4.334 0.230 . . . 1.0 . . . . . . . . . . . . A . 13 TYR C . . . . . . . . . c30226_5ug5 1 . 1 . 177 . 1 1 13 TYR CA C -4.052 4.443 1.432 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CA . . . . . . . . . c30226_5ug5 1 . 1 . 178 . 1 1 13 TYR CB C -3.169 5.673 1.291 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CB . . . . . . . . . c30226_5ug5 1 . 1 . 179 . 1 1 13 TYR CD1 C -3.984 7.380 2.948 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CD1 . . . . . . . . . c30226_5ug5 1 . 1 . 180 . 1 1 13 TYR CD2 C -4.321 7.776 0.638 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CD2 . . . . . . . . . c30226_5ug5 1 . 1 . 181 . 1 1 13 TYR CE1 C -4.626 8.563 3.248 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CE1 . . . . . . . . . c30226_5ug5 1 . 1 . 182 . 1 1 13 TYR CE2 C -4.953 8.956 0.922 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CE2 . . . . . . . . . c30226_5ug5 1 . 1 . 183 . 1 1 13 TYR CG C -3.826 6.972 1.639 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CG . . . . . . . . . c30226_5ug5 1 . 1 . 184 . 1 1 13 TYR CZ C -4.974 9.390 2.332 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CZ . . . . . . . . . c30226_5ug5 1 . 1 . 185 . 1 1 13 TYR H H -2.239 3.455 1.784 . . . 1.0 . . . . . . . . . . . . A . 13 TYR H . . . . . . . . . c30226_5ug5 1 . 1 . 186 . 1 1 13 TYR HA H -4.639 4.534 2.328 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HA . . . . . . . . . c30226_5ug5 1 . 1 . 187 . 1 1 13 TYR HB2 H -2.327 5.568 1.947 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HB2 . . . . . . . . . c30226_5ug5 1 . 1 . 188 . 1 1 13 TYR HB3 H -2.816 5.734 0.275 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HB3 . . . . . . . . . c30226_5ug5 1 . 1 . 189 . 1 1 13 TYR HD1 H -3.602 6.758 3.740 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HD1 . . . . . . . . . c30226_5ug5 1 . 1 . 190 . 1 1 13 TYR HD2 H -4.199 7.466 -0.385 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HD2 . . . . . . . . . c30226_5ug5 1 . 1 . 191 . 1 1 13 TYR HE1 H -4.742 8.868 4.271 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HE1 . . . . . . . . . c30226_5ug5 1 . 1 . 192 . 1 1 13 TYR HE2 H -5.326 9.562 0.123 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HE2 . . . . . . . . . c30226_5ug5 1 . 1 . 193 . 1 1 13 TYR HH H -6.558 10.588 1.962 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HH . . . . . . . . . c30226_5ug5 1 . 1 . 194 . 1 1 13 TYR N N -3.180 3.289 1.574 . . . 1.0 . . . . . . . . . . . . A . 13 TYR N . . . . . . . . . c30226_5ug5 1 . 1 . 195 . 1 1 13 TYR O O -6.194 4.508 0.358 . . . 1.0 . . . . . . . . . . . . A . 13 TYR O . . . . . . . . . c30226_5ug5 1 . 1 . 196 . 1 1 13 TYR OH O -5.762 10.530 2.514 . . . 1.0 . . . . . . . . . . . . A . 13 TYR OH . . . . . . . . . c30226_5ug5 1 . 1 . 197 . 1 1 14 ASN C C -5.289 2.612 -2.685 . . . 1.0 . . . . . . . . . . . . A . 14 ASN C . . . . . . . . . c30226_5ug5 1 . 1 . 198 . 1 1 14 ASN CA C -5.209 4.031 -2.156 . . . 1.0 . . . . . . . . . . . . A . 14 ASN CA . . . . . . . . . c30226_5ug5 1 . 1 . 199 . 1 1 14 ASN CB C -4.580 4.962 -3.203 . . . 1.0 . . . . . . . . . . . . A . 14 ASN CB . . . . . . . . . c30226_5ug5 1 . 1 . 200 . 1 1 14 ASN CG C -5.576 5.443 -4.249 . . . 1.0 . . . . . . . . . . . . A . 14 ASN CG . . . . . . . . . c30226_5ug5 1 . 1 . 201 . 1 1 14 ASN H H -3.471 3.752 -0.953 . . . 1.0 . . . . . . . . . . . . A . 14 ASN H . . . . . . . . . c30226_5ug5 1 . 1 . 202 . 1 1 14 ASN HA H -6.205 4.377 -1.920 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HA . . . . . . . . . c30226_5ug5 1 . 1 . 203 . 1 1 14 ASN HB2 H -4.170 5.827 -2.704 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HB2 . . . . . . . . . c30226_5ug5 1 . 1 . 204 . 1 1 14 ASN HB3 H -3.783 4.435 -3.708 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HB3 . . . . . . . . . c30226_5ug5 1 . 1 . 205 . 1 1 14 ASN HD21 H -4.510 7.093 -4.540 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HD21 . . . . . . . . . c30226_5ug5 1 . 1 . 206 . 1 1 14 ASN HD22 H -5.943 6.944 -5.494 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HD22 . . . . . . . . . c30226_5ug5 1 . 1 . 207 . 1 1 14 ASN N N -4.420 4.038 -0.928 . . . 1.0 . . . . . . . . . . . . A . 14 ASN N . . . . . . . . . c30226_5ug5 1 . 1 . 208 . 1 1 14 ASN ND2 N -5.316 6.610 -4.818 . . . 1.0 . . . . . . . . . . . . A . 14 ASN ND2 . . . . . . . . . c30226_5ug5 1 . 1 . 209 . 1 1 14 ASN O O -5.789 2.351 -3.779 . . . 1.0 . . . . . . . . . . . . A . 14 ASN O . . . . . . . . . c30226_5ug5 1 . 1 . 210 . 1 1 14 ASN OD1 O -6.564 4.777 -4.551 . . . 1.0 . . . . . . . . . . . . A . 14 ASN OD1 . . . . . . . . . c30226_5ug5 1 . 1 . 211 . 1 1 15 ASN C C -4.891 -0.706 -1.278 . . . 1.0 . . . . . . . . . . . . A . 15 ASN C . . . . . . . . . c30226_5ug5 1 . 1 . 212 . 1 1 15 ASN CA C -4.577 0.330 -2.352 . . . 1.0 . . . . . . . . . . . . A . 15 ASN CA . . . . . . . . . c30226_5ug5 1 . 1 . 213 . 1 1 15 ASN CB C -3.130 0.208 -2.775 . . . 1.0 . . . . . . . . . . . . A . 15 ASN CB . . . . . . . . . c30226_5ug5 1 . 1 . 214 . 1 1 15 ASN CG C -2.824 0.906 -4.090 . . . 1.0 . . . . . . . . . . . . A . 15 ASN CG . . . . . . . . . c30226_5ug5 1 . 1 . 215 . 1 1 15 ASN H H -4.573 1.919 -0.958 . . . 1.0 . . . . . . . . . . . . A . 15 ASN H . . . . . . . . . c30226_5ug5 1 . 1 . 216 . 1 1 15 ASN HA H -5.214 0.167 -3.197 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HA . . . . . . . . . c30226_5ug5 1 . 1 . 217 . 1 1 15 ASN HB2 H -2.542 0.683 -2.003 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HB2 . . . . . . . . . c30226_5ug5 1 . 1 . 218 . 1 1 15 ASN HB3 H -2.858 -0.833 -2.854 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HB3 . . . . . . . . . c30226_5ug5 1 . 1 . 219 . 1 1 15 ASN HD21 H -2.138 2.491 -3.112 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HD21 . . . . . . . . . c30226_5ug5 1 . 1 . 220 . 1 1 15 ASN HD22 H -2.103 2.598 -4.838 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HD22 . . . . . . . . . c30226_5ug5 1 . 1 . 221 . 1 1 15 ASN N N -4.796 1.685 -1.885 . . . 1.0 . . . . . . . . . . . . A . 15 ASN N . . . . . . . . . c30226_5ug5 1 . 1 . 222 . 1 1 15 ASN ND2 N -2.300 2.119 -4.005 . . . 1.0 . . . . . . . . . . . . A . 15 ASN ND2 . . . . . . . . . c30226_5ug5 1 . 1 . 223 . 1 1 15 ASN O O -4.015 -1.450 -0.828 . . . 1.0 . . . . . . . . . . . . A . 15 ASN O . . . . . . . . . c30226_5ug5 1 . 1 . 224 . 1 1 15 ASN OD1 O -3.034 0.353 -5.169 . . . 1.0 . . . . . . . . . . . . A . 15 ASN OD1 . . . . . . . . . c30226_5ug5 1 . 1 . 225 . 1 1 16 HYP C C -7.051 -3.023 -0.297 . . . 1.0 . . . . . . . . . . . . A . 16 HYP C . . . . . . . . . c30226_5ug5 1 . 1 . 226 . 1 1 16 HYP CA C -6.610 -1.663 0.213 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CA . . . . . . . . . c30226_5ug5 1 . 1 . 227 . 1 1 16 HYP CB C -7.774 -0.840 0.738 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CB . . . . . . . . . c30226_5ug5 1 . 1 . 228 . 1 1 16 HYP CD C -7.270 0.042 -1.385 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CD . . . . . . . . . c30226_5ug5 1 . 1 . 229 . 1 1 16 HYP CG C -7.951 0.402 -0.115 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CG . . . . . . . . . c30226_5ug5 1 . 1 . 230 . 1 1 16 HYP HA H -5.865 -1.784 0.965 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HA . . . . . . . . . c30226_5ug5 1 . 1 . 231 . 1 1 16 HYP HB2 H -7.576 -0.541 1.753 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HB2 . . . . . . . . . c30226_5ug5 1 . 1 . 232 . 1 1 16 HYP HB3 H -8.676 -1.436 0.704 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HB3 . . . . . . . . . c30226_5ug5 1 . 1 . 233 . 1 1 16 HYP HD1 H -6.303 1.437 0.120 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HD1 . . . . . . . . . c30226_5ug5 1 . 1 . 234 . 1 1 16 HYP HD22 H -7.915 -0.528 -2.018 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HD22 . . . . . . . . . c30226_5ug5 1 . 1 . 235 . 1 1 16 HYP HD23 H -6.904 0.920 -1.891 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HD23 . . . . . . . . . c30226_5ug5 1 . 1 . 236 . 1 1 16 HYP HG H -8.993 0.641 -0.254 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HG . . . . . . . . . c30226_5ug5 1 . 1 . 237 . 1 1 16 HYP N N -6.154 -0.776 -0.868 . . . 1.0 . . . . . . . . . . . . A . 16 HYP N . . . . . . . . . c30226_5ug5 1 . 1 . 238 . 1 1 16 HYP O O -7.322 -3.942 0.468 . . . 1.0 . . . . . . . . . . . . A . 16 HYP O . . . . . . . . . c30226_5ug5 1 . 1 . 239 . 1 1 16 HYP OD1 O -7.229 1.496 0.436 . . . 1.0 . . . . . . . . . . . . A . 16 HYP OD1 . . . . . . . . . c30226_5ug5 1 . 1 . 240 . 1 1 17 HIS C C -6.174 -4.949 -2.945 . . . 1.0 . . . . . . . . . . . . A . 17 HIS C . . . . . . . . . c30226_5ug5 1 . 1 . 241 . 1 1 17 HIS CA C -7.417 -4.389 -2.268 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CA . . . . . . . . . c30226_5ug5 1 . 1 . 242 . 1 1 17 HIS CB C -8.547 -4.207 -3.288 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CB . . . . . . . . . c30226_5ug5 1 . 1 . 243 . 1 1 17 HIS CD2 C -10.593 -4.557 -1.737 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CD2 . . . . . . . . . c30226_5ug5 1 . 1 . 244 . 1 1 17 HIS CE1 C -11.733 -2.776 -2.303 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CE1 . . . . . . . . . c30226_5ug5 1 . 1 . 245 . 1 1 17 HIS CG C -9.872 -3.891 -2.668 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CG . . . . . . . . . c30226_5ug5 1 . 1 . 246 . 1 1 17 HIS H H -6.901 -2.331 -2.132 . . . 1.0 . . . . . . . . . . . . A . 17 HIS H . . . . . . . . . c30226_5ug5 1 . 1 . 247 . 1 1 17 HIS HA H -7.739 -5.087 -1.509 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HA . . . . . . . . . c30226_5ug5 1 . 1 . 248 . 1 1 17 HIS HB2 H -8.294 -3.400 -3.956 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HB2 . . . . . . . . . c30226_5ug5 1 . 1 . 249 . 1 1 17 HIS HB3 H -8.655 -5.119 -3.858 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HB3 . . . . . . . . . c30226_5ug5 1 . 1 . 250 . 1 1 17 HIS HD1 H -10.362 -2.096 -3.660 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HD1 . . . . . . . . . c30226_5ug5 1 . 1 . 251 . 1 1 17 HIS HD2 H -10.312 -5.477 -1.247 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HD2 . . . . . . . . . c30226_5ug5 1 . 1 . 252 . 1 1 17 HIS HE1 H -12.507 -2.025 -2.355 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HE1 . . . . . . . . . c30226_5ug5 1 . 1 . 253 . 1 1 17 HIS HE2 H -12.380 -3.999 -0.793 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HE2 . . . . . . . . . c30226_5ug5 1 . 1 . 254 . 1 1 17 HIS N N -7.096 -3.130 -1.600 . . . 1.0 . . . . . . . . . . . . A . 17 HIS N . . . . . . . . . c30226_5ug5 1 . 1 . 255 . 1 1 17 HIS ND1 N -10.615 -2.781 -3.002 . . . 1.0 . . . . . . . . . . . . A . 17 HIS ND1 . . . . . . . . . c30226_5ug5 1 . 1 . 256 . 1 1 17 HIS NE2 N -11.746 -3.842 -1.527 . . . 1.0 . . . . . . . . . . . . A . 17 HIS NE2 . . . . . . . . . c30226_5ug5 1 . 1 . 257 . 1 1 17 HIS O O -6.236 -5.923 -3.695 . . . 1.0 . . . . . . . . . . . . A . 17 HIS O . . . . . . . . . c30226_5ug5 1 . 1 . 258 . 1 1 18 VAL C C -3.232 -5.874 -2.240 . . . 1.0 . . . . . . . . . . . . A . 18 VAL C . . . . . . . . . c30226_5ug5 1 . 1 . 259 . 1 1 18 VAL CA C -3.753 -4.763 -3.145 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CA . . . . . . . . . c30226_5ug5 1 . 1 . 260 . 1 1 18 VAL CB C -2.789 -3.560 -3.171 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CB . . . . . . . . . c30226_5ug5 1 . 1 . 261 . 1 1 18 VAL CG1 C -1.342 -3.975 -3.032 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CG1 . . . . . . . . . c30226_5ug5 1 . 1 . 262 . 1 1 18 VAL CG2 C -2.989 -2.765 -4.445 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CG2 . . . . . . . . . c30226_5ug5 1 . 1 . 263 . 1 1 18 VAL H H -5.075 -3.501 -2.131 . . . 1.0 . . . . . . . . . . . . A . 18 VAL H . . . . . . . . . c30226_5ug5 1 . 1 . 264 . 1 1 18 VAL HA H -3.869 -5.138 -4.142 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HA . . . . . . . . . c30226_5ug5 1 . 1 . 265 . 1 1 18 VAL HB H -3.035 -2.922 -2.341 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HB . . . . . . . . . c30226_5ug5 1 . 1 . 266 . 1 1 18 VAL HG11 H -1.060 -4.589 -3.870 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG11 . . . . . . . . . c30226_5ug5 1 . 1 . 267 . 1 1 18 VAL HG12 H -1.225 -4.533 -2.118 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG12 . . . . . . . . . c30226_5ug5 1 . 1 . 268 . 1 1 18 VAL HG13 H -0.722 -3.094 -3.001 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG13 . . . . . . . . . c30226_5ug5 1 . 1 . 269 . 1 1 18 VAL HG21 H -2.359 -1.886 -4.422 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG21 . . . . . . . . . c30226_5ug5 1 . 1 . 270 . 1 1 18 VAL HG22 H -4.024 -2.463 -4.518 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG22 . . . . . . . . . c30226_5ug5 1 . 1 . 271 . 1 1 18 VAL HG23 H -2.729 -3.374 -5.296 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG23 . . . . . . . . . c30226_5ug5 1 . 1 . 272 . 1 1 18 VAL N N -5.043 -4.313 -2.670 . . . 1.0 . . . . . . . . . . . . A . 18 VAL N . . . . . . . . . c30226_5ug5 1 . 1 . 273 . 1 1 18 VAL O O -2.412 -6.704 -2.632 . . . 1.0 . . . . . . . . . . . . A . 18 VAL O . . . . . . . . . c30226_5ug5 1 . 1 . 274 . 1 1 19 CYS C C -4.468 -6.850 1.069 . . . 1.0 . . . . . . . . . . . . A . 19 CYS C . . . . . . . . . c30226_5ug5 1 . 1 . 275 . 1 1 19 CYS CA C -3.404 -6.854 -0.017 . . . 1.0 . . . . . . . . . . . . A . 19 CYS CA . . . . . . . . . c30226_5ug5 1 . 1 . 276 . 1 1 19 CYS CB C -2.028 -6.523 0.574 . . . 1.0 . . . . . . . . . . . . A . 19 CYS CB . . . . . . . . . c30226_5ug5 1 . 1 . 277 . 1 1 19 CYS H H -4.459 -5.229 -0.832 . . . 1.0 . . . . . . . . . . . . A . 19 CYS H . . . . . . . . . c30226_5ug5 1 . 1 . 278 . 1 1 19 CYS HA H -3.372 -7.831 -0.475 . . . 1.0 . . . . . . . . . . . . A . 19 CYS HA . . . . . . . . . c30226_5ug5 1 . 1 . 279 . 1 1 19 CYS HB2 H -1.276 -6.658 -0.189 . . . 1.0 . . . . . . . . . . . . A . 19 CYS HB2 . . . . . . . . . c30226_5ug5 1 . 1 . 280 . 1 1 19 CYS HB3 H -2.024 -5.491 0.895 . . . 1.0 . . . . . . . . . . . . A . 19 CYS HB3 . . . . . . . . . c30226_5ug5 1 . 1 . 281 . 1 1 19 CYS N N -3.769 -5.888 -1.037 . . . 1.0 . . . . . . . . . . . . A . 19 CYS N . . . . . . . . . c30226_5ug5 1 . 1 . 282 . 1 1 19 CYS O O -5.229 -7.829 1.166 . . . 1.0 . . . . . . . . . . . . A . 19 CYS O . . . . . . . . . c30226_5ug5 1 . 1 . 283 . 1 1 19 CYS OXT O -4.578 -5.833 1.781 . . . 1.0 . . . . . . . . . . . . A . 19 CYS OXT . . . . . . . . . c30226_5ug5 1 . 1 . 284 . 1 1 19 CYS SG S -1.549 -7.549 2.003 . . . 1.0 . . . . . . . . . . . . A . 19 CYS SG . . . . . . . . . c30226_5ug5 1 . 2 . 285 . 1 1 1 ILE C C 5.337 1.059 -5.344 . . . 1.0 . . . . . . . . . . . . A . 1 ILE C . . . . . . . . . c30226_5ug5 1 . 2 . 286 . 1 1 1 ILE CA C 4.376 1.757 -6.298 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CA . . . . . . . . . c30226_5ug5 1 . 2 . 287 . 1 1 1 ILE CB C 3.394 0.699 -6.865 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CB . . . . . . . . . c30226_5ug5 1 . 2 . 288 . 1 1 1 ILE CD1 C 3.159 1.166 -9.359 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CD1 . . . . . . . . . c30226_5ug5 1 . 2 . 289 . 1 1 1 ILE CG1 C 2.530 1.276 -7.989 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CG1 . . . . . . . . . c30226_5ug5 1 . 2 . 290 . 1 1 1 ILE CG2 C 2.501 0.151 -5.759 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CG2 . . . . . . . . . c30226_5ug5 1 . 2 . 291 . 1 1 1 ILE H1 H 5.716 1.767 -7.889 . . . 1.0 . . . . . . . . . . . . A . 1 ILE H1 . . . . . . . . . c30226_5ug5 1 . 2 . 292 . 1 1 1 ILE H2 H 5.772 3.161 -6.937 . . . 1.0 . . . . . . . . . . . . A . 1 ILE H2 . . . . . . . . . c30226_5ug5 1 . 2 . 293 . 1 1 1 ILE H3 H 4.495 2.927 -8.017 . . . 1.0 . . . . . . . . . . . . A . 1 ILE H3 . . . . . . . . . c30226_5ug5 1 . 2 . 294 . 1 1 1 ILE HA H 3.809 2.495 -5.749 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HA . . . . . . . . . c30226_5ug5 1 . 2 . 295 . 1 1 1 ILE HB H 3.977 -0.120 -7.255 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HB . . . . . . . . . c30226_5ug5 1 . 2 . 296 . 1 1 1 ILE HD11 H 3.295 0.125 -9.610 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HD11 . . . . . . . . . c30226_5ug5 1 . 2 . 297 . 1 1 1 ILE HD12 H 4.117 1.664 -9.356 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HD12 . . . . . . . . . c30226_5ug5 1 . 2 . 298 . 1 1 1 ILE HD13 H 2.514 1.630 -10.089 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HD13 . . . . . . . . . c30226_5ug5 1 . 2 . 299 . 1 1 1 ILE HG12 H 1.588 0.749 -8.015 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG12 . . . . . . . . . c30226_5ug5 1 . 2 . 300 . 1 1 1 ILE HG13 H 2.345 2.323 -7.790 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG13 . . . . . . . . . c30226_5ug5 1 . 2 . 301 . 1 1 1 ILE HG21 H 3.115 -0.284 -4.984 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG21 . . . . . . . . . c30226_5ug5 1 . 2 . 302 . 1 1 1 ILE HG22 H 1.847 -0.604 -6.167 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG22 . . . . . . . . . c30226_5ug5 1 . 2 . 303 . 1 1 1 ILE HG23 H 1.911 0.953 -5.343 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG23 . . . . . . . . . c30226_5ug5 1 . 2 . 304 . 1 1 1 ILE N N 5.141 2.449 -7.360 . . . 1.0 . . . . . . . . . . . . A . 1 ILE N . . . . . . . . . c30226_5ug5 1 . 2 . 305 . 1 1 1 ILE O O 6.342 0.488 -5.771 . . . 1.0 . . . . . . . . . . . . A . 1 ILE O . . . . . . . . . c30226_5ug5 1 . 2 . 306 . 1 1 2 ARG C C 5.607 -1.049 -3.102 . . . 1.0 . . . . . . . . . . . . A . 2 ARG C . . . . . . . . . c30226_5ug5 1 . 2 . 307 . 1 1 2 ARG CA C 5.846 0.453 -3.047 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CA . . . . . . . . . c30226_5ug5 1 . 2 . 308 . 1 1 2 ARG CB C 5.520 0.952 -1.632 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CB . . . . . . . . . c30226_5ug5 1 . 2 . 309 . 1 1 2 ARG CD C 4.506 3.257 -1.973 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CD . . . . . . . . . c30226_5ug5 1 . 2 . 310 . 1 1 2 ARG CG C 5.678 2.458 -1.412 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CG . . . . . . . . . c30226_5ug5 1 . 2 . 311 . 1 1 2 ARG CZ C 3.494 5.469 -1.497 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CZ . . . . . . . . . c30226_5ug5 1 . 2 . 312 . 1 1 2 ARG H H 4.219 1.588 -3.778 . . . 1.0 . . . . . . . . . . . . A . 2 ARG H . . . . . . . . . c30226_5ug5 1 . 2 . 313 . 1 1 2 ARG HA H 6.881 0.657 -3.271 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HA . . . . . . . . . c30226_5ug5 1 . 2 . 314 . 1 1 2 ARG HB2 H 4.505 0.683 -1.405 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB2 . . . . . . . . . c30226_5ug5 1 . 2 . 315 . 1 1 2 ARG HB3 H 6.172 0.445 -0.936 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB3 . . . . . . . . . c30226_5ug5 1 . 2 . 316 . 1 1 2 ARG HD2 H 4.539 3.211 -3.050 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD2 . . . . . . . . . c30226_5ug5 1 . 2 . 317 . 1 1 2 ARG HD3 H 3.585 2.820 -1.620 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD3 . . . . . . . . . c30226_5ug5 1 . 2 . 318 . 1 1 2 ARG HE H 5.434 5.016 -1.288 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HE . . . . . . . . . c30226_5ug5 1 . 2 . 319 . 1 1 2 ARG HG2 H 5.748 2.648 -0.353 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG2 . . . . . . . . . c30226_5ug5 1 . 2 . 320 . 1 1 2 ARG HG3 H 6.586 2.784 -1.896 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG3 . . . . . . . . . c30226_5ug5 1 . 2 . 321 . 1 1 2 ARG HH11 H 2.195 4.124 -2.278 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH11 . . . . . . . . . c30226_5ug5 1 . 2 . 322 . 1 1 2 ARG HH12 H 1.511 5.663 -1.862 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH12 . . . . . . . . . c30226_5ug5 1 . 2 . 323 . 1 1 2 ARG HH21 H 4.533 7.041 -0.749 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH21 . . . . . . . . . c30226_5ug5 1 . 2 . 324 . 1 1 2 ARG HH22 H 2.835 7.320 -0.993 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH22 . . . . . . . . . c30226_5ug5 1 . 2 . 325 . 1 1 2 ARG N N 5.027 1.110 -4.054 . . . 1.0 . . . . . . . . . . . . A . 2 ARG N . . . . . . . . . c30226_5ug5 1 . 2 . 326 . 1 1 2 ARG NE N 4.556 4.660 -1.556 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NE . . . . . . . . . c30226_5ug5 1 . 2 . 327 . 1 1 2 ARG NH1 N 2.303 5.050 -1.909 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH1 . . . . . . . . . c30226_5ug5 1 . 2 . 328 . 1 1 2 ARG NH2 N 3.632 6.708 -1.043 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH2 . . . . . . . . . c30226_5ug5 1 . 2 . 329 . 1 1 2 ARG O O 4.480 -1.495 -3.318 . . . 1.0 . . . . . . . . . . . . A . 2 ARG O . . . . . . . . . c30226_5ug5 1 . 2 . 330 . 1 1 3 ASP C C 6.229 -3.819 -1.563 . . . 1.0 . . . . . . . . . . . . A . 3 ASP C . . . . . . . . . c30226_5ug5 1 . 2 . 331 . 1 1 3 ASP CA C 6.552 -3.280 -2.940 . . . 1.0 . . . . . . . . . . . . A . 3 ASP CA . . . . . . . . . c30226_5ug5 1 . 2 . 332 . 1 1 3 ASP CB C 7.835 -3.913 -3.492 . . . 1.0 . . . . . . . . . . . . A . 3 ASP CB . . . . . . . . . c30226_5ug5 1 . 2 . 333 . 1 1 3 ASP CG C 7.718 -5.415 -3.681 . . . 1.0 . . . . . . . . . . . . A . 3 ASP CG . . . . . . . . . c30226_5ug5 1 . 2 . 334 . 1 1 3 ASP H H 7.526 -1.407 -2.694 . . . 1.0 . . . . . . . . . . . . A . 3 ASP H . . . . . . . . . c30226_5ug5 1 . 2 . 335 . 1 1 3 ASP HA H 5.735 -3.509 -3.578 . . . 1.0 . . . . . . . . . . . . A . 3 ASP HA . . . . . . . . . c30226_5ug5 1 . 2 . 336 . 1 1 3 ASP HB2 H 8.065 -3.466 -4.448 . . . 1.0 . . . . . . . . . . . . A . 3 ASP HB2 . . . . . . . . . c30226_5ug5 1 . 2 . 337 . 1 1 3 ASP HB3 H 8.646 -3.718 -2.806 . . . 1.0 . . . . . . . . . . . . A . 3 ASP HB3 . . . . . . . . . c30226_5ug5 1 . 2 . 338 . 1 1 3 ASP N N 6.659 -1.823 -2.894 . . . 1.0 . . . . . . . . . . . . A . 3 ASP N . . . . . . . . . c30226_5ug5 1 . 2 . 339 . 1 1 3 ASP O O 5.947 -4.995 -1.363 . . . 1.0 . . . . . . . . . . . . A . 3 ASP O . . . . . . . . . c30226_5ug5 1 . 2 . 340 . 1 1 3 ASP OD1 O 7.223 -5.851 -4.741 . . . 1.0 . . . . . . . . . . . . A . 3 ASP OD1 . . . . . . . . . c30226_5ug5 1 . 2 . 341 . 1 1 3 ASP OD2 O 8.133 -6.169 -2.779 . . . 1.0 . . . . . . . . . . . . A . 3 ASP OD2 . . . . . . . . . c30226_5ug5 1 . 2 . 342 . 1 1 4 GLU C C 4.477 -2.620 1.015 . . . 1.0 . . . . . . . . . . . . A . 4 GLU C . . . . . . . . . c30226_5ug5 1 . 2 . 343 . 1 1 4 GLU CA C 5.864 -3.171 0.742 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CA . . . . . . . . . c30226_5ug5 1 . 2 . 344 . 1 1 4 GLU CB C 6.865 -2.525 1.684 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CB . . . . . . . . . c30226_5ug5 1 . 2 . 345 . 1 1 4 GLU CD C 8.086 -4.652 2.277 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CD . . . . . . . . . c30226_5ug5 1 . 2 . 346 . 1 1 4 GLU CG C 8.203 -3.240 1.747 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CG . . . . . . . . . c30226_5ug5 1 . 2 . 347 . 1 1 4 GLU H H 6.467 -2.001 -0.903 . . . 1.0 . . . . . . . . . . . . A . 4 GLU H . . . . . . . . . c30226_5ug5 1 . 2 . 348 . 1 1 4 GLU HA H 5.863 -4.240 0.896 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HA . . . . . . . . . c30226_5ug5 1 . 2 . 349 . 1 1 4 GLU HB2 H 7.038 -1.507 1.363 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HB2 . . . . . . . . . c30226_5ug5 1 . 2 . 350 . 1 1 4 GLU HB3 H 6.435 -2.510 2.664 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HB3 . . . . . . . . . c30226_5ug5 1 . 2 . 351 . 1 1 4 GLU HG2 H 8.622 -3.279 0.752 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HG2 . . . . . . . . . c30226_5ug5 1 . 2 . 352 . 1 1 4 GLU HG3 H 8.866 -2.682 2.392 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HG3 . . . . . . . . . c30226_5ug5 1 . 2 . 353 . 1 1 4 GLU N N 6.227 -2.905 -0.638 . . . 1.0 . . . . . . . . . . . . A . 4 GLU N . . . . . . . . . c30226_5ug5 1 . 2 . 354 . 1 1 4 GLU O O 4.127 -2.281 2.142 . . . 1.0 . . . . . . . . . . . . A . 4 GLU O . . . . . . . . . c30226_5ug5 1 . 2 . 355 . 1 1 4 GLU OE1 O 8.170 -4.838 3.509 . . . 1.0 . . . . . . . . . . . . A . 4 GLU OE1 . . . . . . . . . c30226_5ug5 1 . 2 . 356 . 1 1 4 GLU OE2 O 7.914 -5.585 1.467 . . . 1.0 . . . . . . . . . . . . A . 4 GLU OE2 . . . . . . . . . c30226_5ug5 1 . 2 . 357 . 1 1 5 CYS C C 1.452 -2.495 0.992 . . . 1.0 . . . . . . . . . . . . A . 5 CYS C . . . . . . . . . c30226_5ug5 1 . 2 . 358 . 1 1 5 CYS CA C 2.401 -1.881 -0.039 . . . 1.0 . . . . . . . . . . . . A . 5 CYS CA . . . . . . . . . c30226_5ug5 1 . 2 . 359 . 1 1 5 CYS CB C 1.778 -1.952 -1.432 . . . 1.0 . . . . . . . . . . . . A . 5 CYS CB . . . . . . . . . c30226_5ug5 1 . 2 . 360 . 1 1 5 CYS H H 4.025 -2.936 -0.879 . . . 1.0 . . . . . . . . . . . . A . 5 CYS H . . . . . . . . . c30226_5ug5 1 . 2 . 361 . 1 1 5 CYS HA H 2.559 -0.845 0.215 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HA . . . . . . . . . c30226_5ug5 1 . 2 . 362 . 1 1 5 CYS HB2 H 2.550 -1.797 -2.171 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HB2 . . . . . . . . . c30226_5ug5 1 . 2 . 363 . 1 1 5 CYS HB3 H 1.340 -2.929 -1.575 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HB3 . . . . . . . . . c30226_5ug5 1 . 2 . 364 . 1 1 5 CYS N N 3.703 -2.536 -0.048 . . . 1.0 . . . . . . . . . . . . A . 5 CYS N . . . . . . . . . c30226_5ug5 1 . 2 . 365 . 1 1 5 CYS O O 0.588 -1.808 1.530 . . . 1.0 . . . . . . . . . . . . A . 5 CYS O . . . . . . . . . c30226_5ug5 1 . 2 . 366 . 1 1 5 CYS SG S 0.477 -0.715 -1.724 . . . 1.0 . . . . . . . . . . . . A . 5 CYS SG . . . . . . . . . c30226_5ug5 1 . 2 . 367 . 1 1 6 CYS C C 1.032 -3.958 3.655 . . . 1.0 . . . . . . . . . . . . A . 6 CYS C . . . . . . . . . c30226_5ug5 1 . 2 . 368 . 1 1 6 CYS CA C 0.773 -4.469 2.242 . . . 1.0 . . . . . . . . . . . . A . 6 CYS CA . . . . . . . . . c30226_5ug5 1 . 2 . 369 . 1 1 6 CYS CB C 1.001 -5.984 2.176 . . . 1.0 . . . . . . . . . . . . A . 6 CYS CB . . . . . . . . . c30226_5ug5 1 . 2 . 370 . 1 1 6 CYS H H 2.370 -4.265 0.863 . . . 1.0 . . . . . . . . . . . . A . 6 CYS H . . . . . . . . . c30226_5ug5 1 . 2 . 371 . 1 1 6 CYS HA H -0.254 -4.256 1.978 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HA . . . . . . . . . c30226_5ug5 1 . 2 . 372 . 1 1 6 CYS HB2 H 0.798 -6.327 1.172 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HB2 . . . . . . . . . c30226_5ug5 1 . 2 . 373 . 1 1 6 CYS HB3 H 2.031 -6.193 2.420 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HB3 . . . . . . . . . c30226_5ug5 1 . 2 . 374 . 1 1 6 CYS N N 1.632 -3.777 1.286 . . . 1.0 . . . . . . . . . . . . A . 6 CYS N . . . . . . . . . c30226_5ug5 1 . 2 . 375 . 1 1 6 CYS O O 0.119 -3.872 4.479 . . . 1.0 . . . . . . . . . . . . A . 6 CYS O . . . . . . . . . c30226_5ug5 1 . 2 . 376 . 1 1 6 CYS SG S -0.046 -6.954 3.315 . . . 1.0 . . . . . . . . . . . . A . 6 CYS SG . . . . . . . . . c30226_5ug5 1 . 2 . 377 . 1 1 7 SER C C 2.457 -1.567 5.236 . . . 1.0 . . . . . . . . . . . . A . 7 SER C . . . . . . . . . c30226_5ug5 1 . 2 . 378 . 1 1 7 SER CA C 2.661 -3.067 5.209 . . . 1.0 . . . . . . . . . . . . A . 7 SER CA . . . . . . . . . c30226_5ug5 1 . 2 . 379 . 1 1 7 SER CB C 4.131 -3.344 5.444 . . . 1.0 . . . . . . . . . . . . A . 7 SER CB . . . . . . . . . c30226_5ug5 1 . 2 . 380 . 1 1 7 SER H H 2.971 -3.723 3.244 . . . 1.0 . . . . . . . . . . . . A . 7 SER H . . . . . . . . . c30226_5ug5 1 . 2 . 381 . 1 1 7 SER HA H 2.074 -3.535 5.979 . . . 1.0 . . . . . . . . . . . . A . 7 SER HA . . . . . . . . . c30226_5ug5 1 . 2 . 382 . 1 1 7 SER HB2 H 4.708 -2.549 4.991 . . . 1.0 . . . . . . . . . . . . A . 7 SER HB2 . . . . . . . . . c30226_5ug5 1 . 2 . 383 . 1 1 7 SER HB3 H 4.320 -3.370 6.500 . . . 1.0 . . . . . . . . . . . . A . 7 SER HB3 . . . . . . . . . c30226_5ug5 1 . 2 . 384 . 1 1 7 SER HG H 3.864 -5.266 5.147 . . . 1.0 . . . . . . . . . . . . A . 7 SER HG . . . . . . . . . c30226_5ug5 1 . 2 . 385 . 1 1 7 SER N N 2.278 -3.607 3.925 . . . 1.0 . . . . . . . . . . . . A . 7 SER N . . . . . . . . . c30226_5ug5 1 . 2 . 386 . 1 1 7 SER O O 2.128 -0.990 6.271 . . . 1.0 . . . . . . . . . . . . A . 7 SER O . . . . . . . . . c30226_5ug5 1 . 2 . 387 . 1 1 7 SER OG O 4.505 -4.592 4.880 . . . 1.0 . . . . . . . . . . . . A . 7 SER OG . . . . . . . . . c30226_5ug5 1 . 2 . 388 . 1 1 8 ASN C C 1.394 1.156 4.019 . . . 1.0 . . . . . . . . . . . . A . 8 ASN C . . . . . . . . . c30226_5ug5 1 . 2 . 389 . 1 1 8 ASN CA C 2.767 0.494 4.014 . . . 1.0 . . . . . . . . . . . . A . 8 ASN CA . . . . . . . . . c30226_5ug5 1 . 2 . 390 . 1 1 8 ASN CB C 3.519 0.900 2.746 . . . 1.0 . . . . . . . . . . . . A . 8 ASN CB . . . . . . . . . c30226_5ug5 1 . 2 . 391 . 1 1 8 ASN CG C 3.824 2.388 2.692 . . . 1.0 . . . . . . . . . . . . A . 8 ASN CG . . . . . . . . . c30226_5ug5 1 . 2 . 392 . 1 1 8 ASN H H 2.675 -1.469 3.250 . . . 1.0 . . . . . . . . . . . . A . 8 ASN H . . . . . . . . . c30226_5ug5 1 . 2 . 393 . 1 1 8 ASN HA H 3.332 0.803 4.876 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HA . . . . . . . . . c30226_5ug5 1 . 2 . 394 . 1 1 8 ASN HB2 H 4.452 0.358 2.700 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HB2 . . . . . . . . . c30226_5ug5 1 . 2 . 395 . 1 1 8 ASN HB3 H 2.915 0.641 1.887 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HB3 . . . . . . . . . c30226_5ug5 1 . 2 . 396 . 1 1 8 ASN HD21 H 4.344 2.390 4.610 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HD21 . . . . . . . . . c30226_5ug5 1 . 2 . 397 . 1 1 8 ASN HD22 H 4.455 3.914 3.800 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HD22 . . . . . . . . . c30226_5ug5 1 . 2 . 398 . 1 1 8 ASN N N 2.642 -0.945 4.083 . . . 1.0 . . . . . . . . . . . . A . 8 ASN N . . . . . . . . . c30226_5ug5 1 . 2 . 399 . 1 1 8 ASN ND2 N 4.246 2.954 3.813 . . . 1.0 . . . . . . . . . . . . A . 8 ASN ND2 . . . . . . . . . c30226_5ug5 1 . 2 . 400 . 1 1 8 ASN O O 0.655 1.069 3.038 . . . 1.0 . . . . . . . . . . . . A . 8 ASN O . . . . . . . . . c30226_5ug5 1 . 2 . 401 . 1 1 8 ASN OD1 O 3.717 3.018 1.640 . . . 1.0 . . . . . . . . . . . . A . 8 ASN OD1 . . . . . . . . . c30226_5ug5 1 . 2 . 402 . 1 1 9 PRO C C -0.518 3.527 4.191 . . . 1.0 . . . . . . . . . . . . A . 9 PRO C . . . . . . . . . c30226_5ug5 1 . 2 . 403 . 1 1 9 PRO CA C -0.254 2.504 5.277 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CA . . . . . . . . . c30226_5ug5 1 . 2 . 404 . 1 1 9 PRO CB C -0.117 3.199 6.632 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CB . . . . . . . . . c30226_5ug5 1 . 2 . 405 . 1 1 9 PRO CD C 1.904 2.097 6.286 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CD . . . . . . . . . c30226_5ug5 1 . 2 . 406 . 1 1 9 PRO CG C 1.331 3.355 6.834 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CG . . . . . . . . . c30226_5ug5 1 . 2 . 407 . 1 1 9 PRO HA H -1.061 1.789 5.311 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HA . . . . . . . . . c30226_5ug5 1 . 2 . 408 . 1 1 9 PRO HB2 H -0.627 4.147 6.624 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HB2 . . . . . . . . . c30226_5ug5 1 . 2 . 409 . 1 1 9 PRO HB3 H -0.516 2.573 7.377 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HB3 . . . . . . . . . c30226_5ug5 1 . 2 . 410 . 1 1 9 PRO HD2 H 2.916 2.253 6.006 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HD2 . . . . . . . . . c30226_5ug5 1 . 2 . 411 . 1 1 9 PRO HD3 H 1.821 1.293 7.001 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HD3 . . . . . . . . . c30226_5ug5 1 . 2 . 412 . 1 1 9 PRO HG2 H 1.694 4.213 6.290 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HG2 . . . . . . . . . c30226_5ug5 1 . 2 . 413 . 1 1 9 PRO HG3 H 1.548 3.443 7.886 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HG3 . . . . . . . . . c30226_5ug5 1 . 2 . 414 . 1 1 9 PRO N N 1.050 1.855 5.114 . . . 1.0 . . . . . . . . . . . . A . 9 PRO N . . . . . . . . . c30226_5ug5 1 . 2 . 415 . 1 1 9 PRO O O -1.606 3.603 3.629 . . . 1.0 . . . . . . . . . . . . A . 9 PRO O . . . . . . . . . c30226_5ug5 1 . 2 . 416 . 1 1 10 ALA C C 0.246 4.728 1.480 . . . 1.0 . . . . . . . . . . . . A . 10 ALA C . . . . . . . . . c30226_5ug5 1 . 2 . 417 . 1 1 10 ALA CA C 0.440 5.328 2.876 . . . 1.0 . . . . . . . . . . . . A . 10 ALA CA . . . . . . . . . c30226_5ug5 1 . 2 . 418 . 1 1 10 ALA CB C 1.697 6.183 2.907 . . . 1.0 . . . . . . . . . . . . A . 10 ALA CB . . . . . . . . . c30226_5ug5 1 . 2 . 419 . 1 1 10 ALA H H 1.311 4.214 4.457 . . . 1.0 . . . . . . . . . . . . A . 10 ALA H . . . . . . . . . c30226_5ug5 1 . 2 . 420 . 1 1 10 ALA HA H -0.401 5.968 3.096 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HA . . . . . . . . . c30226_5ug5 1 . 2 . 421 . 1 1 10 ALA HB1 H 1.604 6.987 2.191 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HB1 . . . . . . . . . c30226_5ug5 1 . 2 . 422 . 1 1 10 ALA HB2 H 2.553 5.575 2.653 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HB2 . . . . . . . . . c30226_5ug5 1 . 2 . 423 . 1 1 10 ALA HB3 H 1.829 6.595 3.896 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HB3 . . . . . . . . . c30226_5ug5 1 . 2 . 424 . 1 1 10 ALA N N 0.499 4.307 3.914 . . . 1.0 . . . . . . . . . . . . A . 10 ALA N . . . . . . . . . c30226_5ug5 1 . 2 . 425 . 1 1 10 ALA O O -0.178 5.423 0.559 . . . 1.0 . . . . . . . . . . . . A . 10 ALA O . . . . . . . . . c30226_5ug5 1 . 2 . 426 . 1 1 11 CYS C C -0.954 2.295 -0.062 . . . 1.0 . . . . . . . . . . . . A . 11 CYS C . . . . . . . . . c30226_5ug5 1 . 2 . 427 . 1 1 11 CYS CA C 0.434 2.829 0.005 . . . 1.0 . . . . . . . . . . . . A . 11 CYS CA . . . . . . . . . c30226_5ug5 1 . 2 . 428 . 1 1 11 CYS CB C 1.456 1.708 -0.178 . . . 1.0 . . . . . . . . . . . . A . 11 CYS CB . . . . . . . . . c30226_5ug5 1 . 2 . 429 . 1 1 11 CYS H H 0.641 2.852 2.096 . . . 1.0 . . . . . . . . . . . . A . 11 CYS H . . . . . . . . . c30226_5ug5 1 . 2 . 430 . 1 1 11 CYS HA H 0.571 3.591 -0.750 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HA . . . . . . . . . c30226_5ug5 1 . 2 . 431 . 1 1 11 CYS HB2 H 2.440 2.084 0.057 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HB2 . . . . . . . . . c30226_5ug5 1 . 2 . 432 . 1 1 11 CYS HB3 H 1.213 0.897 0.500 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HB3 . . . . . . . . . c30226_5ug5 1 . 2 . 433 . 1 1 11 CYS N N 0.537 3.440 1.313 . . . 1.0 . . . . . . . . . . . . A . 11 CYS N . . . . . . . . . c30226_5ug5 1 . 2 . 434 . 1 1 11 CYS O O -1.711 2.501 -1.012 . . . 1.0 . . . . . . . . . . . . A . 11 CYS O . . . . . . . . . c30226_5ug5 1 . 2 . 435 . 1 1 11 CYS SG S 1.509 1.027 -1.867 . . . 1.0 . . . . . . . . . . . . A . 11 CYS SG . . . . . . . . . c30226_5ug5 1 . 2 . 436 . 1 1 12 ARG C C -3.652 2.165 1.186 . . . 1.0 . . . . . . . . . . . . A . 12 ARG C . . . . . . . . . c30226_5ug5 1 . 2 . 437 . 1 1 12 ARG CA C -2.551 1.120 1.334 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CA . . . . . . . . . c30226_5ug5 1 . 2 . 438 . 1 1 12 ARG CB C -2.496 0.593 2.748 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CB . . . . . . . . . c30226_5ug5 1 . 2 . 439 . 1 1 12 ARG CD C -1.391 -1.230 4.058 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CD . . . . . . . . . c30226_5ug5 1 . 2 . 440 . 1 1 12 ARG CG C -2.187 -0.886 2.815 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CG . . . . . . . . . c30226_5ug5 1 . 2 . 441 . 1 1 12 ARG CZ C -1.886 -1.385 6.471 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CZ . . . . . . . . . c30226_5ug5 1 . 2 . 442 . 1 1 12 ARG H H -0.544 1.455 1.691 . . . 1.0 . . . . . . . . . . . . A . 12 ARG H . . . . . . . . . c30226_5ug5 1 . 2 . 443 . 1 1 12 ARG HA H -2.726 0.313 0.669 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HA . . . . . . . . . c30226_5ug5 1 . 2 . 444 . 1 1 12 ARG HB2 H -1.719 1.124 3.280 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HB2 . . . . . . . . . c30226_5ug5 1 . 2 . 445 . 1 1 12 ARG HB3 H -3.427 0.781 3.222 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HB3 . . . . . . . . . c30226_5ug5 1 . 2 . 446 . 1 1 12 ARG HD2 H -1.248 -2.300 4.092 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HD2 . . . . . . . . . c30226_5ug5 1 . 2 . 447 . 1 1 12 ARG HD3 H -0.425 -0.739 3.993 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HD3 . . . . . . . . . c30226_5ug5 1 . 2 . 448 . 1 1 12 ARG HE H -2.674 -0.035 5.220 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HE . . . . . . . . . c30226_5ug5 1 . 2 . 449 . 1 1 12 ARG HG2 H -3.110 -1.433 2.827 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HG2 . . . . . . . . . c30226_5ug5 1 . 2 . 450 . 1 1 12 ARG HG3 H -1.612 -1.164 1.943 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HG3 . . . . . . . . . c30226_5ug5 1 . 2 . 451 . 1 1 12 ARG HH11 H -0.632 -2.829 5.784 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH11 . . . . . . . . . c30226_5ug5 1 . 2 . 452 . 1 1 12 ARG HH12 H -0.974 -2.885 7.486 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH12 . . . . . . . . . c30226_5ug5 1 . 2 . 453 . 1 1 12 ARG HH21 H -3.115 -0.106 7.446 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH21 . . . . . . . . . c30226_5ug5 1 . 2 . 454 . 1 1 12 ARG HH22 H -2.395 -1.343 8.431 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH22 . . . . . . . . . c30226_5ug5 1 . 2 . 455 . 1 1 12 ARG N N -1.260 1.635 1.036 . . . 1.0 . . . . . . . . . . . . A . 12 ARG N . . . . . . . . . c30226_5ug5 1 . 2 . 456 . 1 1 12 ARG NE N -2.063 -0.805 5.284 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NE . . . . . . . . . c30226_5ug5 1 . 2 . 457 . 1 1 12 ARG NH1 N -1.100 -2.452 6.591 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NH1 . . . . . . . . . c30226_5ug5 1 . 2 . 458 . 1 1 12 ARG NH2 N -2.514 -0.906 7.535 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NH2 . . . . . . . . . c30226_5ug5 1 . 2 . 459 . 1 1 12 ARG O O -4.798 1.830 0.893 . . . 1.0 . . . . . . . . . . . . A . 12 ARG O . . . . . . . . . c30226_5ug5 1 . 2 . 460 . 1 1 13 TYR C C -4.911 4.517 -0.128 . . . 1.0 . . . . . . . . . . . . A . 13 TYR C . . . . . . . . . c30226_5ug5 1 . 2 . 461 . 1 1 13 TYR CA C -4.228 4.530 1.243 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CA . . . . . . . . . c30226_5ug5 1 . 2 . 462 . 1 1 13 TYR CB C -3.492 5.845 1.454 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CB . . . . . . . . . c30226_5ug5 1 . 2 . 463 . 1 1 13 TYR CD1 C -5.166 7.158 2.739 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CD1 . . . . . . . . . c30226_5ug5 1 . 2 . 464 . 1 1 13 TYR CD2 C -4.485 7.988 0.628 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CD2 . . . . . . . . . c30226_5ug5 1 . 2 . 465 . 1 1 13 TYR CE1 C -6.001 8.230 2.903 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CE1 . . . . . . . . . c30226_5ug5 1 . 2 . 466 . 1 1 13 TYR CE2 C -5.323 9.073 0.779 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CE2 . . . . . . . . . c30226_5ug5 1 . 2 . 467 . 1 1 13 TYR CG C -4.401 7.019 1.607 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CG . . . . . . . . . c30226_5ug5 1 . 2 . 468 . 1 1 13 TYR CZ C -6.087 9.194 1.860 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CZ . . . . . . . . . c30226_5ug5 1 . 2 . 469 . 1 1 13 TYR H H -2.379 3.626 1.660 . . . 1.0 . . . . . . . . . . . . A . 13 TYR H . . . . . . . . . c30226_5ug5 1 . 2 . 470 . 1 1 13 TYR HA H -4.977 4.427 2.007 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HA . . . . . . . . . c30226_5ug5 1 . 2 . 471 . 1 1 13 TYR HB2 H -2.879 5.779 2.339 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HB2 . . . . . . . . . c30226_5ug5 1 . 2 . 472 . 1 1 13 TYR HB3 H -2.868 6.036 0.601 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HB3 . . . . . . . . . c30226_5ug5 1 . 2 . 473 . 1 1 13 TYR HD1 H -5.099 6.404 3.505 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HD1 . . . . . . . . . c30226_5ug5 1 . 2 . 474 . 1 1 13 TYR HD2 H -3.884 7.881 -0.261 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HD2 . . . . . . . . . c30226_5ug5 1 . 2 . 475 . 1 1 13 TYR HE1 H -6.586 8.313 3.795 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HE1 . . . . . . . . . c30226_5ug5 1 . 2 . 476 . 1 1 13 TYR HE2 H -5.381 9.821 0.011 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HE2 . . . . . . . . . c30226_5ug5 1 . 2 . 477 . 1 1 13 TYR HH H -7.415 10.419 1.275 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HH . . . . . . . . . c30226_5ug5 1 . 2 . 478 . 1 1 13 TYR N N -3.295 3.427 1.384 . . . 1.0 . . . . . . . . . . . . A . 13 TYR N . . . . . . . . . c30226_5ug5 1 . 2 . 479 . 1 1 13 TYR O O -6.059 4.939 -0.257 . . . 1.0 . . . . . . . . . . . . A . 13 TYR O . . . . . . . . . c30226_5ug5 1 . 2 . 480 . 1 1 13 TYR OH O -6.914 10.273 2.089 . . . 1.0 . . . . . . . . . . . . A . 13 TYR OH . . . . . . . . . c30226_5ug5 1 . 2 . 481 . 1 1 14 ASN C C -4.941 2.487 -2.866 . . . 1.0 . . . . . . . . . . . . A . 14 ASN C . . . . . . . . . c30226_5ug5 1 . 2 . 482 . 1 1 14 ASN CA C -4.771 3.949 -2.488 . . . 1.0 . . . . . . . . . . . . A . 14 ASN CA . . . . . . . . . c30226_5ug5 1 . 2 . 483 . 1 1 14 ASN CB C -3.854 4.673 -3.485 . . . 1.0 . . . . . . . . . . . . A . 14 ASN CB . . . . . . . . . c30226_5ug5 1 . 2 . 484 . 1 1 14 ASN CG C -4.347 4.607 -4.921 . . . 1.0 . . . . . . . . . . . . A . 14 ASN CG . . . . . . . . . c30226_5ug5 1 . 2 . 485 . 1 1 14 ASN H H -3.301 3.663 -0.985 . . . 1.0 . . . . . . . . . . . . A . 14 ASN H . . . . . . . . . c30226_5ug5 1 . 2 . 486 . 1 1 14 ASN HA H -5.740 4.428 -2.476 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HA . . . . . . . . . c30226_5ug5 1 . 2 . 487 . 1 1 14 ASN HB2 H -3.778 5.710 -3.202 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HB2 . . . . . . . . . c30226_5ug5 1 . 2 . 488 . 1 1 14 ASN HB3 H -2.871 4.224 -3.443 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HB3 . . . . . . . . . c30226_5ug5 1 . 2 . 489 . 1 1 14 ASN HD21 H -5.538 6.165 -4.614 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HD21 . . . . . . . . . c30226_5ug5 1 . 2 . 490 . 1 1 14 ASN HD22 H -5.577 5.489 -6.205 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HD22 . . . . . . . . . c30226_5ug5 1 . 2 . 491 . 1 1 14 ASN N N -4.209 4.027 -1.145 . . . 1.0 . . . . . . . . . . . . A . 14 ASN N . . . . . . . . . c30226_5ug5 1 . 2 . 492 . 1 1 14 ASN ND2 N -5.244 5.511 -5.282 . . . 1.0 . . . . . . . . . . . . A . 14 ASN ND2 . . . . . . . . . c30226_5ug5 1 . 2 . 493 . 1 1 14 ASN O O -5.483 2.140 -3.912 . . . 1.0 . . . . . . . . . . . . A . 14 ASN O . . . . . . . . . c30226_5ug5 1 . 2 . 494 . 1 1 14 ASN OD1 O -3.931 3.746 -5.699 . . . 1.0 . . . . . . . . . . . . A . 14 ASN OD1 . . . . . . . . . c30226_5ug5 1 . 2 . 495 . 1 1 15 ASN C C -4.761 -0.639 -1.076 . . . 1.0 . . . . . . . . . . . . A . 15 ASN C . . . . . . . . . c30226_5ug5 1 . 2 . 496 . 1 1 15 ASN CA C -4.316 0.225 -2.245 . . . 1.0 . . . . . . . . . . . . A . 15 ASN CA . . . . . . . . . c30226_5ug5 1 . 2 . 497 . 1 1 15 ASN CB C -2.845 0.011 -2.497 . . . 1.0 . . . . . . . . . . . . A . 15 ASN CB . . . . . . . . . c30226_5ug5 1 . 2 . 498 . 1 1 15 ASN CG C -2.412 0.418 -3.891 . . . 1.0 . . . . . . . . . . . . A . 15 ASN CG . . . . . . . . . c30226_5ug5 1 . 2 . 499 . 1 1 15 ASN H H -4.306 1.964 -1.058 . . . 1.0 . . . . . . . . . . . . A . 15 ASN H . . . . . . . . . c30226_5ug5 1 . 2 . 500 . 1 1 15 ASN HA H -4.879 -0.029 -3.125 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HA . . . . . . . . . c30226_5ug5 1 . 2 . 501 . 1 1 15 ASN HB2 H -2.322 0.637 -1.787 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HB2 . . . . . . . . . c30226_5ug5 1 . 2 . 502 . 1 1 15 ASN HB3 H -2.588 -1.022 -2.330 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HB3 . . . . . . . . . c30226_5ug5 1 . 2 . 503 . 1 1 15 ASN HD21 H -1.774 2.167 -3.205 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HD21 . . . . . . . . . c30226_5ug5 1 . 2 . 504 . 1 1 15 ASN HD22 H -1.584 1.911 -4.904 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HD22 . . . . . . . . . c30226_5ug5 1 . 2 . 505 . 1 1 15 ASN N N -4.506 1.635 -1.959 . . . 1.0 . . . . . . . . . . . . A . 15 ASN N . . . . . . . . . c30226_5ug5 1 . 2 . 506 . 1 1 15 ASN ND2 N -1.869 1.618 -4.013 . . . 1.0 . . . . . . . . . . . . A . 15 ASN ND2 . . . . . . . . . c30226_5ug5 1 . 2 . 507 . 1 1 15 ASN O O -3.947 -1.271 -0.409 . . . 1.0 . . . . . . . . . . . . A . 15 ASN O . . . . . . . . . c30226_5ug5 1 . 2 . 508 . 1 1 15 ASN OD1 O -2.542 -0.351 -4.843 . . . 1.0 . . . . . . . . . . . . A . 15 ASN OD1 . . . . . . . . . c30226_5ug5 1 . 2 . 509 . 1 1 16 HYP C C -6.980 -2.790 0.104 . . . 1.0 . . . . . . . . . . . . A . 16 HYP C . . . . . . . . . c30226_5ug5 1 . 2 . 510 . 1 1 16 HYP CA C -6.624 -1.342 0.366 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CA . . . . . . . . . c30226_5ug5 1 . 2 . 511 . 1 1 16 HYP CB C -7.854 -0.482 0.576 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CB . . . . . . . . . c30226_5ug5 1 . 2 . 512 . 1 1 16 HYP CD C -7.108 -0.010 -1.607 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CD . . . . . . . . . c30226_5ug5 1 . 2 . 513 . 1 1 16 HYP CG C -7.947 0.563 -0.523 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CG . . . . . . . . . c30226_5ug5 1 . 2 . 514 . 1 1 16 HYP HA H -5.974 -1.279 1.208 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HA . . . . . . . . . c30226_5ug5 1 . 2 . 515 . 1 1 16 HYP HB2 H -7.786 0.017 1.528 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HB2 . . . . . . . . . c30226_5ug5 1 . 2 . 516 . 1 1 16 HYP HB3 H -8.734 -1.110 0.555 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HB3 . . . . . . . . . c30226_5ug5 1 . 2 . 517 . 1 1 16 HYP HD1 H -6.362 1.694 -0.335 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HD1 . . . . . . . . . c30226_5ug5 1 . 2 . 518 . 1 1 16 HYP HD22 H -7.662 -0.714 -2.188 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HD22 . . . . . . . . . c30226_5ug5 1 . 2 . 519 . 1 1 16 HYP HD23 H -6.694 0.769 -2.227 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HD23 . . . . . . . . . c30226_5ug5 1 . 2 . 520 . 1 1 16 HYP HG H -8.969 0.726 -0.830 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HG . . . . . . . . . c30226_5ug5 1 . 2 . 521 . 1 1 16 HYP N N -6.057 -0.670 -0.812 . . . 1.0 . . . . . . . . . . . . A . 16 HYP N . . . . . . . . . c30226_5ug5 1 . 2 . 522 . 1 1 16 HYP O O -7.308 -3.550 1.014 . . . 1.0 . . . . . . . . . . . . A . 16 HYP O . . . . . . . . . c30226_5ug5 1 . 2 . 523 . 1 1 16 HYP OD1 O -7.315 1.774 -0.123 . . . 1.0 . . . . . . . . . . . . A . 16 HYP OD1 . . . . . . . . . c30226_5ug5 1 . 2 . 524 . 1 1 17 HIS C C -5.930 -5.112 -2.253 . . . 1.0 . . . . . . . . . . . . A . 17 HIS C . . . . . . . . . c30226_5ug5 1 . 2 . 525 . 1 1 17 HIS CA C -7.171 -4.520 -1.584 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CA . . . . . . . . . c30226_5ug5 1 . 2 . 526 . 1 1 17 HIS CB C -8.370 -4.534 -2.544 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CB . . . . . . . . . c30226_5ug5 1 . 2 . 527 . 1 1 17 HIS CD2 C -9.637 -6.751 -2.060 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CD2 . . . . . . . . . c30226_5ug5 1 . 2 . 528 . 1 1 17 HIS CE1 C -9.330 -7.727 -3.997 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CE1 . . . . . . . . . c30226_5ug5 1 . 2 . 529 . 1 1 17 HIS CG C -8.913 -5.905 -2.831 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CG . . . . . . . . . c30226_5ug5 1 . 2 . 530 . 1 1 17 HIS H H -6.628 -2.480 -1.807 . . . 1.0 . . . . . . . . . . . . A . 17 HIS H . . . . . . . . . c30226_5ug5 1 . 2 . 531 . 1 1 17 HIS HA H -7.410 -5.105 -0.708 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HA . . . . . . . . . c30226_5ug5 1 . 2 . 532 . 1 1 17 HIS HB2 H -9.168 -3.947 -2.118 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HB2 . . . . . . . . . c30226_5ug5 1 . 2 . 533 . 1 1 17 HIS HB3 H -8.070 -4.094 -3.484 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HB3 . . . . . . . . . c30226_5ug5 1 . 2 . 534 . 1 1 17 HIS HD1 H -8.254 -6.192 -4.815 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HD1 . . . . . . . . . c30226_5ug5 1 . 2 . 535 . 1 1 17 HIS HD2 H -9.966 -6.573 -1.046 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HD2 . . . . . . . . . c30226_5ug5 1 . 2 . 536 . 1 1 17 HIS HE1 H -9.357 -8.449 -4.799 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HE1 . . . . . . . . . c30226_5ug5 1 . 2 . 537 . 1 1 17 HIS HE2 H -10.334 -8.686 -2.491 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HE2 . . . . . . . . . c30226_5ug5 1 . 2 . 538 . 1 1 17 HIS N N -6.892 -3.156 -1.149 . . . 1.0 . . . . . . . . . . . . A . 17 HIS N . . . . . . . . . c30226_5ug5 1 . 2 . 539 . 1 1 17 HIS ND1 N -8.738 -6.549 -4.038 . . . 1.0 . . . . . . . . . . . . A . 17 HIS ND1 . . . . . . . . . c30226_5ug5 1 . 2 . 540 . 1 1 17 HIS NE2 N -9.882 -7.875 -2.809 . . . 1.0 . . . . . . . . . . . . A . 17 HIS NE2 . . . . . . . . . c30226_5ug5 1 . 2 . 541 . 1 1 17 HIS O O -5.973 -6.191 -2.842 . . . 1.0 . . . . . . . . . . . . A . 17 HIS O . . . . . . . . . c30226_5ug5 1 . 2 . 542 . 1 1 18 VAL C C -2.944 -5.975 -2.014 . . . 1.0 . . . . . . . . . . . . A . 18 VAL C . . . . . . . . . c30226_5ug5 1 . 2 . 543 . 1 1 18 VAL CA C -3.566 -4.788 -2.747 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CA . . . . . . . . . c30226_5ug5 1 . 2 . 544 . 1 1 18 VAL CB C -2.597 -3.596 -2.740 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CB . . . . . . . . . c30226_5ug5 1 . 2 . 545 . 1 1 18 VAL CG1 C -1.906 -3.459 -1.398 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CG1 . . . . . . . . . c30226_5ug5 1 . 2 . 546 . 1 1 18 VAL CG2 C -1.599 -3.710 -3.862 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CG2 . . . . . . . . . c30226_5ug5 1 . 2 . 547 . 1 1 18 VAL H H -4.848 -3.541 -1.666 . . . 1.0 . . . . . . . . . . . . A . 18 VAL H . . . . . . . . . c30226_5ug5 1 . 2 . 548 . 1 1 18 VAL HA H -3.753 -5.064 -3.763 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HA . . . . . . . . . c30226_5ug5 1 . 2 . 549 . 1 1 18 VAL HB H -3.178 -2.702 -2.905 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HB . . . . . . . . . c30226_5ug5 1 . 2 . 550 . 1 1 18 VAL HG11 H -1.224 -2.623 -1.426 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG11 . . . . . . . . . c30226_5ug5 1 . 2 . 551 . 1 1 18 VAL HG12 H -1.361 -4.365 -1.186 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG12 . . . . . . . . . c30226_5ug5 1 . 2 . 552 . 1 1 18 VAL HG13 H -2.648 -3.298 -0.632 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG13 . . . . . . . . . c30226_5ug5 1 . 2 . 553 . 1 1 18 VAL HG21 H -0.924 -2.871 -3.825 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG21 . . . . . . . . . c30226_5ug5 1 . 2 . 554 . 1 1 18 VAL HG22 H -2.128 -3.707 -4.800 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG22 . . . . . . . . . c30226_5ug5 1 . 2 . 555 . 1 1 18 VAL HG23 H -1.046 -4.628 -3.760 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG23 . . . . . . . . . c30226_5ug5 1 . 2 . 556 . 1 1 18 VAL N N -4.821 -4.389 -2.146 . . . 1.0 . . . . . . . . . . . . A . 18 VAL N . . . . . . . . . c30226_5ug5 1 . 2 . 557 . 1 1 18 VAL O O -2.007 -6.609 -2.505 . . . 1.0 . . . . . . . . . . . . A . 18 VAL O . . . . . . . . . c30226_5ug5 1 . 2 . 558 . 1 1 19 CYS C C -4.127 -8.209 0.463 . . . 1.0 . . . . . . . . . . . . A . 19 CYS C . . . . . . . . . c30226_5ug5 1 . 2 . 559 . 1 1 19 CYS CA C -2.969 -7.357 -0.028 . . . 1.0 . . . . . . . . . . . . A . 19 CYS CA . . . . . . . . . c30226_5ug5 1 . 2 . 560 . 1 1 19 CYS CB C -2.169 -6.798 1.150 . . . 1.0 . . . . . . . . . . . . A . 19 CYS CB . . . . . . . . . c30226_5ug5 1 . 2 . 561 . 1 1 19 CYS H H -4.242 -5.757 -0.530 . . . 1.0 . . . . . . . . . . . . A . 19 CYS H . . . . . . . . . c30226_5ug5 1 . 2 . 562 . 1 1 19 CYS HA H -2.319 -7.964 -0.642 . . . 1.0 . . . . . . . . . . . . A . 19 CYS HA . . . . . . . . . c30226_5ug5 1 . 2 . 563 . 1 1 19 CYS HB2 H -1.460 -6.073 0.781 . . . 1.0 . . . . . . . . . . . . A . 19 CYS HB2 . . . . . . . . . c30226_5ug5 1 . 2 . 564 . 1 1 19 CYS HB3 H -2.848 -6.315 1.837 . . . 1.0 . . . . . . . . . . . . A . 19 CYS HB3 . . . . . . . . . c30226_5ug5 1 . 2 . 565 . 1 1 19 CYS N N -3.476 -6.273 -0.845 . . . 1.0 . . . . . . . . . . . . A . 19 CYS N . . . . . . . . . c30226_5ug5 1 . 2 . 566 . 1 1 19 CYS O O -4.297 -9.332 -0.050 . . . 1.0 . . . . . . . . . . . . A . 19 CYS O . . . . . . . . . c30226_5ug5 1 . 2 . 567 . 1 1 19 CYS OXT O -4.899 -7.728 1.322 . . . 1.0 . . . . . . . . . . . . A . 19 CYS OXT . . . . . . . . . c30226_5ug5 1 . 2 . 568 . 1 1 19 CYS SG S -1.235 -8.052 2.088 . . . 1.0 . . . . . . . . . . . . A . 19 CYS SG . . . . . . . . . c30226_5ug5 1 . 3 . 569 . 1 1 1 ILE C C 4.779 0.679 -4.825 . . . 1.0 . . . . . . . . . . . . A . 1 ILE C . . . . . . . . . c30226_5ug5 1 . 3 . 570 . 1 1 1 ILE CA C 3.740 1.569 -5.486 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CA . . . . . . . . . c30226_5ug5 1 . 3 . 571 . 1 1 1 ILE CB C 2.544 0.692 -5.945 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CB . . . . . . . . . c30226_5ug5 1 . 3 . 572 . 1 1 1 ILE CD1 C 3.185 0.084 -8.368 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CD1 . . . . . . . . . c30226_5ug5 1 . 3 . 573 . 1 1 1 ILE CG1 C 2.978 -0.400 -6.945 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CG1 . . . . . . . . . c30226_5ug5 1 . 3 . 574 . 1 1 1 ILE CG2 C 1.445 1.562 -6.540 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CG2 . . . . . . . . . c30226_5ug5 1 . 3 . 575 . 1 1 1 ILE H1 H 3.620 2.892 -7.090 . . . 1.0 . . . . . . . . . . . . A . 1 ILE H1 . . . . . . . . . c30226_5ug5 1 . 3 . 576 . 1 1 1 ILE H2 H 4.802 1.694 -7.270 . . . 1.0 . . . . . . . . . . . . A . 1 ILE H2 . . . . . . . . . c30226_5ug5 1 . 3 . 577 . 1 1 1 ILE H3 H 5.064 2.988 -6.223 . . . 1.0 . . . . . . . . . . . . A . 1 ILE H3 . . . . . . . . . c30226_5ug5 1 . 3 . 578 . 1 1 1 ILE HA H 3.377 2.274 -4.750 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HA . . . . . . . . . c30226_5ug5 1 . 3 . 579 . 1 1 1 ILE HB H 2.136 0.213 -5.067 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HB . . . . . . . . . c30226_5ug5 1 . 3 . 580 . 1 1 1 ILE HD11 H 3.945 0.847 -8.385 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HD11 . . . . . . . . . c30226_5ug5 1 . 3 . 581 . 1 1 1 ILE HD12 H 2.259 0.490 -8.748 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HD12 . . . . . . . . . c30226_5ug5 1 . 3 . 582 . 1 1 1 ILE HD13 H 3.495 -0.745 -8.987 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HD13 . . . . . . . . . c30226_5ug5 1 . 3 . 583 . 1 1 1 ILE HG12 H 3.910 -0.830 -6.610 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG12 . . . . . . . . . c30226_5ug5 1 . 3 . 584 . 1 1 1 ILE HG13 H 2.223 -1.173 -6.967 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG13 . . . . . . . . . c30226_5ug5 1 . 3 . 585 . 1 1 1 ILE HG21 H 1.091 2.258 -5.793 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG21 . . . . . . . . . c30226_5ug5 1 . 3 . 586 . 1 1 1 ILE HG22 H 0.627 0.939 -6.866 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG22 . . . . . . . . . c30226_5ug5 1 . 3 . 587 . 1 1 1 ILE HG23 H 1.836 2.110 -7.384 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG23 . . . . . . . . . c30226_5ug5 1 . 3 . 588 . 1 1 1 ILE N N 4.346 2.337 -6.595 . . . 1.0 . . . . . . . . . . . . A . 1 ILE N . . . . . . . . . c30226_5ug5 1 . 3 . 589 . 1 1 1 ILE O O 5.773 0.300 -5.445 . . . 1.0 . . . . . . . . . . . . A . 1 ILE O . . . . . . . . . c30226_5ug5 1 . 3 . 590 . 1 1 2 ARG C C 5.020 -1.964 -3.067 . . . 1.0 . . . . . . . . . . . . A . 2 ARG C . . . . . . . . . c30226_5ug5 1 . 3 . 591 . 1 1 2 ARG CA C 5.431 -0.519 -2.813 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CA . . . . . . . . . c30226_5ug5 1 . 3 . 592 . 1 1 2 ARG CB C 5.320 -0.228 -1.310 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CB . . . . . . . . . c30226_5ug5 1 . 3 . 593 . 1 1 2 ARG CD C 6.538 1.978 -1.214 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CD . . . . . . . . . c30226_5ug5 1 . 3 . 594 . 1 1 2 ARG CG C 5.238 1.244 -0.957 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CG . . . . . . . . . c30226_5ug5 1 . 3 . 595 . 1 1 2 ARG CZ C 7.189 4.150 -0.234 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CZ . . . . . . . . . c30226_5ug5 1 . 3 . 596 . 1 1 2 ARG H H 3.755 0.722 -3.117 . . . 1.0 . . . . . . . . . . . . A . 2 ARG H . . . . . . . . . c30226_5ug5 1 . 3 . 597 . 1 1 2 ARG HA H 6.442 -0.360 -3.145 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HA . . . . . . . . . c30226_5ug5 1 . 3 . 598 . 1 1 2 ARG HB2 H 4.430 -0.702 -0.933 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB2 . . . . . . . . . c30226_5ug5 1 . 3 . 599 . 1 1 2 ARG HB3 H 6.180 -0.649 -0.811 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB3 . . . . . . . . . c30226_5ug5 1 . 3 . 600 . 1 1 2 ARG HD2 H 7.294 1.594 -0.547 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD2 . . . . . . . . . c30226_5ug5 1 . 3 . 601 . 1 1 2 ARG HD3 H 6.839 1.810 -2.238 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD3 . . . . . . . . . c30226_5ug5 1 . 3 . 602 . 1 1 2 ARG HE H 5.617 3.844 -1.444 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HE . . . . . . . . . c30226_5ug5 1 . 3 . 603 . 1 1 2 ARG HG2 H 4.463 1.700 -1.550 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG2 . . . . . . . . . c30226_5ug5 1 . 3 . 604 . 1 1 2 ARG HG3 H 4.988 1.335 0.091 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG3 . . . . . . . . . c30226_5ug5 1 . 3 . 605 . 1 1 2 ARG HH11 H 8.355 2.598 0.344 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH11 . . . . . . . . . c30226_5ug5 1 . 3 . 606 . 1 1 2 ARG HH12 H 8.805 4.141 0.990 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH12 . . . . . . . . . c30226_5ug5 1 . 3 . 607 . 1 1 2 ARG HH21 H 6.214 5.893 -0.589 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH21 . . . . . . . . . c30226_5ug5 1 . 3 . 608 . 1 1 2 ARG HH22 H 7.591 6.014 0.461 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH22 . . . . . . . . . c30226_5ug5 1 . 3 . 609 . 1 1 2 ARG N N 4.548 0.360 -3.560 . . . 1.0 . . . . . . . . . . . . A . 2 ARG N . . . . . . . . . c30226_5ug5 1 . 3 . 610 . 1 1 2 ARG NE N 6.378 3.411 -0.993 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NE . . . . . . . . . c30226_5ug5 1 . 3 . 611 . 1 1 2 ARG NH1 N 8.198 3.585 0.416 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH1 . . . . . . . . . c30226_5ug5 1 . 3 . 612 . 1 1 2 ARG NH2 N 6.982 5.457 -0.112 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH2 . . . . . . . . . c30226_5ug5 1 . 3 . 613 . 1 1 2 ARG O O 3.838 -2.243 -3.240 . . . 1.0 . . . . . . . . . . . . A . 2 ARG O . . . . . . . . . c30226_5ug5 1 . 3 . 614 . 1 1 3 ASP C C 5.431 -4.879 -1.815 . . . 1.0 . . . . . . . . . . . . A . 3 ASP C . . . . . . . . . c30226_5ug5 1 . 3 . 615 . 1 1 3 ASP CA C 5.630 -4.302 -3.202 . . . 1.0 . . . . . . . . . . . . A . 3 ASP CA . . . . . . . . . c30226_5ug5 1 . 3 . 616 . 1 1 3 ASP CB C 6.685 -5.082 -3.990 . . . 1.0 . . . . . . . . . . . . A . 3 ASP CB . . . . . . . . . c30226_5ug5 1 . 3 . 617 . 1 1 3 ASP CG C 6.216 -6.480 -4.347 . . . 1.0 . . . . . . . . . . . . A . 3 ASP CG . . . . . . . . . c30226_5ug5 1 . 3 . 618 . 1 1 3 ASP H H 6.915 -2.611 -3.038 . . . 1.0 . . . . . . . . . . . . A . 3 ASP H . . . . . . . . . c30226_5ug5 1 . 3 . 619 . 1 1 3 ASP HA H 4.695 -4.350 -3.710 . . . 1.0 . . . . . . . . . . . . A . 3 ASP HA . . . . . . . . . c30226_5ug5 1 . 3 . 620 . 1 1 3 ASP HB2 H 6.907 -4.552 -4.903 . . . 1.0 . . . . . . . . . . . . A . 3 ASP HB2 . . . . . . . . . c30226_5ug5 1 . 3 . 621 . 1 1 3 ASP HB3 H 7.583 -5.162 -3.396 . . . 1.0 . . . . . . . . . . . . A . 3 ASP HB3 . . . . . . . . . c30226_5ug5 1 . 3 . 622 . 1 1 3 ASP N N 5.975 -2.884 -3.088 . . . 1.0 . . . . . . . . . . . . A . 3 ASP N . . . . . . . . . c30226_5ug5 1 . 3 . 623 . 1 1 3 ASP O O 5.188 -6.069 -1.609 . . . 1.0 . . . . . . . . . . . . A . 3 ASP O . . . . . . . . . c30226_5ug5 1 . 3 . 624 . 1 1 3 ASP OD1 O 5.102 -6.619 -4.896 . . . 1.0 . . . . . . . . . . . . A . 3 ASP OD1 . . . . . . . . . c30226_5ug5 1 . 3 . 625 . 1 1 3 ASP OD2 O 6.965 -7.447 -4.100 . . . 1.0 . . . . . . . . . . . . A . 3 ASP OD2 . . . . . . . . . c30226_5ug5 1 . 3 . 626 . 1 1 4 GLU C C 4.067 -3.310 0.891 . . . 1.0 . . . . . . . . . . . . A . 4 GLU C . . . . . . . . . c30226_5ug5 1 . 3 . 627 . 1 1 4 GLU CA C 5.236 -4.199 0.517 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CA . . . . . . . . . c30226_5ug5 1 . 3 . 628 . 1 1 4 GLU CB C 6.435 -3.883 1.375 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CB . . . . . . . . . c30226_5ug5 1 . 3 . 629 . 1 1 4 GLU CD C 8.288 -2.274 1.923 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CD . . . . . . . . . c30226_5ug5 1 . 3 . 630 . 1 1 4 GLU CG C 7.057 -2.529 1.089 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CG . . . . . . . . . c30226_5ug5 1 . 3 . 631 . 1 1 4 GLU H H 5.845 -3.094 -1.152 . . . 1.0 . . . . . . . . . . . . A . 4 GLU H . . . . . . . . . c30226_5ug5 1 . 3 . 632 . 1 1 4 GLU HA H 4.957 -5.235 0.644 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HA . . . . . . . . . c30226_5ug5 1 . 3 . 633 . 1 1 4 GLU HB2 H 6.118 -3.897 2.395 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HB2 . . . . . . . . . c30226_5ug5 1 . 3 . 634 . 1 1 4 GLU HB3 H 7.179 -4.641 1.217 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HB3 . . . . . . . . . c30226_5ug5 1 . 3 . 635 . 1 1 4 GLU HG2 H 7.331 -2.485 0.045 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HG2 . . . . . . . . . c30226_5ug5 1 . 3 . 636 . 1 1 4 GLU HG3 H 6.328 -1.760 1.302 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HG3 . . . . . . . . . c30226_5ug5 1 . 3 . 637 . 1 1 4 GLU N N 5.549 -3.976 -0.879 . . . 1.0 . . . . . . . . . . . . A . 4 GLU N . . . . . . . . . c30226_5ug5 1 . 3 . 638 . 1 1 4 GLU O O 3.895 -2.889 2.035 . . . 1.0 . . . . . . . . . . . . A . 4 GLU O . . . . . . . . . c30226_5ug5 1 . 3 . 639 . 1 1 4 GLU OE1 O 9.380 -2.751 1.543 . . . 1.0 . . . . . . . . . . . . A . 4 GLU OE1 . . . . . . . . . c30226_5ug5 1 . 3 . 640 . 1 1 4 GLU OE2 O 8.173 -1.594 2.962 . . . 1.0 . . . . . . . . . . . . A . 4 GLU OE2 . . . . . . . . . c30226_5ug5 1 . 3 . 641 . 1 1 5 CYS C C 1.177 -2.454 1.018 . . . 1.0 . . . . . . . . . . . . A . 5 CYS C . . . . . . . . . c30226_5ug5 1 . 3 . 642 . 1 1 5 CYS CA C 2.187 -2.075 -0.063 . . . 1.0 . . . . . . . . . . . . A . 5 CYS CA . . . . . . . . . c30226_5ug5 1 . 3 . 643 . 1 1 5 CYS CB C 1.491 -2.017 -1.425 . . . 1.0 . . . . . . . . . . . . A . 5 CYS CB . . . . . . . . . c30226_5ug5 1 . 3 . 644 . 1 1 5 CYS H H 3.495 -3.458 -0.971 . . . 1.0 . . . . . . . . . . . . A . 5 CYS H . . . . . . . . . c30226_5ug5 1 . 3 . 645 . 1 1 5 CYS HA H 2.589 -1.100 0.164 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HA . . . . . . . . . c30226_5ug5 1 . 3 . 646 . 1 1 5 CYS HB2 H 2.241 -1.950 -2.199 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HB2 . . . . . . . . . c30226_5ug5 1 . 3 . 647 . 1 1 5 CYS HB3 H 0.919 -2.922 -1.564 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HB3 . . . . . . . . . c30226_5ug5 1 . 3 . 648 . 1 1 5 CYS N N 3.300 -3.014 -0.127 . . . 1.0 . . . . . . . . . . . . A . 5 CYS N . . . . . . . . . c30226_5ug5 1 . 3 . 649 . 1 1 5 CYS O O 0.524 -1.584 1.590 . . . 1.0 . . . . . . . . . . . . A . 5 CYS O . . . . . . . . . c30226_5ug5 1 . 3 . 650 . 1 1 5 CYS SG S 0.358 -0.609 -1.634 . . . 1.0 . . . . . . . . . . . . A . 5 CYS SG . . . . . . . . . c30226_5ug5 1 . 3 . 651 . 1 1 6 CYS C C 0.556 -3.884 3.703 . . . 1.0 . . . . . . . . . . . . A . 6 CYS C . . . . . . . . . c30226_5ug5 1 . 3 . 652 . 1 1 6 CYS CA C 0.100 -4.221 2.287 . . . 1.0 . . . . . . . . . . . . A . 6 CYS CA . . . . . . . . . c30226_5ug5 1 . 3 . 653 . 1 1 6 CYS CB C -0.124 -5.728 2.142 . . . 1.0 . . . . . . . . . . . . A . 6 CYS CB . . . . . . . . . c30226_5ug5 1 . 3 . 654 . 1 1 6 CYS H H 1.676 -4.384 0.882 . . . 1.0 . . . . . . . . . . . . A . 6 CYS H . . . . . . . . . c30226_5ug5 1 . 3 . 655 . 1 1 6 CYS HA H -0.832 -3.709 2.097 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HA . . . . . . . . . c30226_5ug5 1 . 3 . 656 . 1 1 6 CYS HB2 H -0.353 -5.952 1.111 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HB2 . . . . . . . . . c30226_5ug5 1 . 3 . 657 . 1 1 6 CYS HB3 H 0.778 -6.248 2.425 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HB3 . . . . . . . . . c30226_5ug5 1 . 3 . 658 . 1 1 6 CYS N N 1.072 -3.743 1.314 . . . 1.0 . . . . . . . . . . . . A . 6 CYS N . . . . . . . . . c30226_5ug5 1 . 3 . 659 . 1 1 6 CYS O O -0.251 -3.808 4.630 . . . 1.0 . . . . . . . . . . . . A . 6 CYS O . . . . . . . . . c30226_5ug5 1 . 3 . 660 . 1 1 6 CYS SG S -1.484 -6.382 3.166 . . . 1.0 . . . . . . . . . . . . A . 6 CYS SG . . . . . . . . . c30226_5ug5 1 . 3 . 661 . 1 1 7 SER C C 2.334 -1.703 5.177 . . . 1.0 . . . . . . . . . . . . A . 7 SER C . . . . . . . . . c30226_5ug5 1 . 3 . 662 . 1 1 7 SER CA C 2.390 -3.216 5.126 . . . 1.0 . . . . . . . . . . . . A . 7 SER CA . . . . . . . . . c30226_5ug5 1 . 3 . 663 . 1 1 7 SER CB C 3.844 -3.630 5.250 . . . 1.0 . . . . . . . . . . . . A . 7 SER CB . . . . . . . . . c30226_5ug5 1 . 3 . 664 . 1 1 7 SER H H 2.472 -3.861 3.134 . . . 1.0 . . . . . . . . . . . . A . 7 SER H . . . . . . . . . c30226_5ug5 1 . 3 . 665 . 1 1 7 SER HA H 1.818 -3.636 5.935 . . . 1.0 . . . . . . . . . . . . A . 7 SER HA . . . . . . . . . c30226_5ug5 1 . 3 . 666 . 1 1 7 SER HB2 H 4.456 -2.883 4.764 . . . 1.0 . . . . . . . . . . . . A . 7 SER HB2 . . . . . . . . . c30226_5ug5 1 . 3 . 667 . 1 1 7 SER HB3 H 4.104 -3.683 6.289 . . . 1.0 . . . . . . . . . . . . A . 7 SER HB3 . . . . . . . . . c30226_5ug5 1 . 3 . 668 . 1 1 7 SER HG H 4.938 -5.232 4.943 . . . 1.0 . . . . . . . . . . . . A . 7 SER HG . . . . . . . . . c30226_5ug5 1 . 3 . 669 . 1 1 7 SER N N 1.853 -3.679 3.870 . . . 1.0 . . . . . . . . . . . . A . 7 SER N . . . . . . . . . c30226_5ug5 1 . 3 . 670 . 1 1 7 SER O O 2.075 -1.110 6.222 . . . 1.0 . . . . . . . . . . . . A . 7 SER O . . . . . . . . . c30226_5ug5 1 . 3 . 671 . 1 1 7 SER OG O 4.079 -4.900 4.656 . . . 1.0 . . . . . . . . . . . . A . 7 SER OG . . . . . . . . . c30226_5ug5 1 . 3 . 672 . 1 1 8 ASN C C 1.486 1.115 3.990 . . . 1.0 . . . . . . . . . . . . A . 8 ASN C . . . . . . . . . c30226_5ug5 1 . 3 . 673 . 1 1 8 ASN CA C 2.803 0.342 3.983 . . . 1.0 . . . . . . . . . . . . A . 8 ASN CA . . . . . . . . . c30226_5ug5 1 . 3 . 674 . 1 1 8 ASN CB C 3.613 0.706 2.737 . . . 1.0 . . . . . . . . . . . . A . 8 ASN CB . . . . . . . . . c30226_5ug5 1 . 3 . 675 . 1 1 8 ASN CG C 4.223 2.097 2.827 . . . 1.0 . . . . . . . . . . . . A . 8 ASN CG . . . . . . . . . c30226_5ug5 1 . 3 . 676 . 1 1 8 ASN H H 2.529 -1.599 3.187 . . . 1.0 . . . . . . . . . . . . A . 8 ASN H . . . . . . . . . c30226_5ug5 1 . 3 . 677 . 1 1 8 ASN HA H 3.377 0.584 4.860 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HA . . . . . . . . . c30226_5ug5 1 . 3 . 678 . 1 1 8 ASN HB2 H 4.410 -0.010 2.610 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HB2 . . . . . . . . . c30226_5ug5 1 . 3 . 679 . 1 1 8 ASN HB3 H 2.962 0.674 1.877 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HB3 . . . . . . . . . c30226_5ug5 1 . 3 . 680 . 1 1 8 ASN HD21 H 2.654 2.906 1.921 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HD21 . . . . . . . . . c30226_5ug5 1 . 3 . 681 . 1 1 8 ASN HD22 H 3.906 4.006 2.378 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HD22 . . . . . . . . . c30226_5ug5 1 . 3 . 682 . 1 1 8 ASN N N 2.555 -1.085 4.027 . . . 1.0 . . . . . . . . . . . . A . 8 ASN N . . . . . . . . . c30226_5ug5 1 . 3 . 683 . 1 1 8 ASN ND2 N 3.520 3.101 2.323 . . . 1.0 . . . . . . . . . . . . A . 8 ASN ND2 . . . . . . . . . c30226_5ug5 1 . 3 . 684 . 1 1 8 ASN O O 0.725 1.079 3.022 . . . 1.0 . . . . . . . . . . . . A . 8 ASN O . . . . . . . . . c30226_5ug5 1 . 3 . 685 . 1 1 8 ASN OD1 O 5.328 2.267 3.339 . . . 1.0 . . . . . . . . . . . . A . 8 ASN OD1 . . . . . . . . . c30226_5ug5 1 . 3 . 686 . 1 1 9 PRO C C -0.410 3.531 4.214 . . . 1.0 . . . . . . . . . . . . A . 9 PRO C . . . . . . . . . c30226_5ug5 1 . 3 . 687 . 1 1 9 PRO CA C -0.037 2.567 5.325 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CA . . . . . . . . . c30226_5ug5 1 . 3 . 688 . 1 1 9 PRO CB C 0.250 3.345 6.614 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CB . . . . . . . . . c30226_5ug5 1 . 3 . 689 . 1 1 9 PRO CD C 2.176 2.107 6.185 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CD . . . . . . . . . c30226_5ug5 1 . 3 . 690 . 1 1 9 PRO CG C 1.718 3.425 6.698 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CG . . . . . . . . . c30226_5ug5 1 . 3 . 691 . 1 1 9 PRO HA H -0.851 1.876 5.493 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HA . . . . . . . . . c30226_5ug5 1 . 3 . 692 . 1 1 9 PRO HB2 H -0.204 4.321 6.572 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HB2 . . . . . . . . . c30226_5ug5 1 . 3 . 693 . 1 1 9 PRO HB3 H -0.128 2.801 7.434 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HB3 . . . . . . . . . c30226_5ug5 1 . 3 . 694 . 1 1 9 PRO HD2 H 3.175 2.183 5.834 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HD2 . . . . . . . . . c30226_5ug5 1 . 3 . 695 . 1 1 9 PRO HD3 H 2.091 1.346 6.947 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HD3 . . . . . . . . . c30226_5ug5 1 . 3 . 696 . 1 1 9 PRO HG2 H 2.088 4.230 6.078 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HG2 . . . . . . . . . c30226_5ug5 1 . 3 . 697 . 1 1 9 PRO HG3 H 2.019 3.557 7.724 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HG3 . . . . . . . . . c30226_5ug5 1 . 3 . 698 . 1 1 9 PRO N N 1.231 1.862 5.084 . . . 1.0 . . . . . . . . . . . . A . 9 PRO N . . . . . . . . . c30226_5ug5 1 . 3 . 699 . 1 1 9 PRO O O -1.513 3.498 3.685 . . . 1.0 . . . . . . . . . . . . A . 9 PRO O . . . . . . . . . c30226_5ug5 1 . 3 . 700 . 1 1 10 ALA C C 0.238 4.776 1.441 . . . 1.0 . . . . . . . . . . . . A . 10 ALA C . . . . . . . . . c30226_5ug5 1 . 3 . 701 . 1 1 10 ALA CA C 0.316 5.393 2.837 . . . 1.0 . . . . . . . . . . . . A . 10 ALA CA . . . . . . . . . c30226_5ug5 1 . 3 . 702 . 1 1 10 ALA CB C 1.416 6.439 2.886 . . . 1.0 . . . . . . . . . . . . A . 10 ALA CB . . . . . . . . . c30226_5ug5 1 . 3 . 703 . 1 1 10 ALA H H 1.371 4.374 4.375 . . . 1.0 . . . . . . . . . . . . A . 10 ALA H . . . . . . . . . c30226_5ug5 1 . 3 . 704 . 1 1 10 ALA HA H -0.621 5.889 3.042 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HA . . . . . . . . . c30226_5ug5 1 . 3 . 705 . 1 1 10 ALA HB1 H 1.177 7.244 2.206 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HB1 . . . . . . . . . c30226_5ug5 1 . 3 . 706 . 1 1 10 ALA HB2 H 2.352 5.989 2.592 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HB2 . . . . . . . . . c30226_5ug5 1 . 3 . 707 . 1 1 10 ALA HB3 H 1.501 6.828 3.890 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HB3 . . . . . . . . . c30226_5ug5 1 . 3 . 708 . 1 1 10 ALA N N 0.524 4.391 3.879 . . . 1.0 . . . . . . . . . . . . A . 10 ALA N . . . . . . . . . c30226_5ug5 1 . 3 . 709 . 1 1 10 ALA O O -0.089 5.464 0.477 . . . 1.0 . . . . . . . . . . . . A . 10 ALA O . . . . . . . . . c30226_5ug5 1 . 3 . 710 . 1 1 11 CYS C C -0.921 2.305 -0.062 . . . 1.0 . . . . . . . . . . . . A . 11 CYS C . . . . . . . . . c30226_5ug5 1 . 3 . 711 . 1 1 11 CYS CA C 0.467 2.847 0.024 . . . 1.0 . . . . . . . . . . . . A . 11 CYS CA . . . . . . . . . c30226_5ug5 1 . 3 . 712 . 1 1 11 CYS CB C 1.503 1.729 -0.103 . . . 1.0 . . . . . . . . . . . . A . 11 CYS CB . . . . . . . . . c30226_5ug5 1 . 3 . 713 . 1 1 11 CYS H H 0.598 2.920 2.119 . . . 1.0 . . . . . . . . . . . . A . 11 CYS H . . . . . . . . . c30226_5ug5 1 . 3 . 714 . 1 1 11 CYS HA H 0.619 3.593 -0.745 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HA . . . . . . . . . c30226_5ug5 1 . 3 . 715 . 1 1 11 CYS HB2 H 2.481 2.124 0.135 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HB2 . . . . . . . . . c30226_5ug5 1 . 3 . 716 . 1 1 11 CYS HB3 H 1.258 0.941 0.597 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HB3 . . . . . . . . . c30226_5ug5 1 . 3 . 717 . 1 1 11 CYS N N 0.530 3.487 1.319 . . . 1.0 . . . . . . . . . . . . A . 11 CYS N . . . . . . . . . c30226_5ug5 1 . 3 . 718 . 1 1 11 CYS O O -1.668 2.505 -1.021 . . . 1.0 . . . . . . . . . . . . A . 11 CYS O . . . . . . . . . c30226_5ug5 1 . 3 . 719 . 1 1 11 CYS SG S 1.596 0.988 -1.764 . . . 1.0 . . . . . . . . . . . . A . 11 CYS SG . . . . . . . . . c30226_5ug5 1 . 3 . 720 . 1 1 12 ARG C C -3.627 2.248 1.188 . . . 1.0 . . . . . . . . . . . . A . 12 ARG C . . . . . . . . . c30226_5ug5 1 . 3 . 721 . 1 1 12 ARG CA C -2.551 1.177 1.348 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CA . . . . . . . . . c30226_5ug5 1 . 3 . 722 . 1 1 12 ARG CB C -2.514 0.680 2.771 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CB . . . . . . . . . c30226_5ug5 1 . 3 . 723 . 1 1 12 ARG CD C -1.446 -1.108 4.145 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CD . . . . . . . . . c30226_5ug5 1 . 3 . 724 . 1 1 12 ARG CG C -2.234 -0.799 2.889 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CG . . . . . . . . . c30226_5ug5 1 . 3 . 725 . 1 1 12 ARG CZ C -1.818 -1.031 6.583 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CZ . . . . . . . . . c30226_5ug5 1 . 3 . 726 . 1 1 12 ARG H H -0.530 1.445 1.686 . . . 1.0 . . . . . . . . . . . . A . 12 ARG H . . . . . . . . . c30226_5ug5 1 . 3 . 727 . 1 1 12 ARG HA H -2.751 0.363 0.700 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HA . . . . . . . . . c30226_5ug5 1 . 3 . 728 . 1 1 12 ARG HB2 H -1.733 1.210 3.298 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HB2 . . . . . . . . . c30226_5ug5 1 . 3 . 729 . 1 1 12 ARG HB3 H -3.445 0.899 3.236 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HB3 . . . . . . . . . c30226_5ug5 1 . 3 . 730 . 1 1 12 ARG HD2 H -1.340 -2.179 4.230 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HD2 . . . . . . . . . c30226_5ug5 1 . 3 . 731 . 1 1 12 ARG HD3 H -0.466 -0.656 4.052 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HD3 . . . . . . . . . c30226_5ug5 1 . 3 . 732 . 1 1 12 ARG HE H -2.761 0.118 5.240 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HE . . . . . . . . . c30226_5ug5 1 . 3 . 733 . 1 1 12 ARG HG2 H -3.169 -1.328 2.916 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HG2 . . . . . . . . . c30226_5ug5 1 . 3 . 734 . 1 1 12 ARG HG3 H -1.663 -1.117 2.029 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HG3 . . . . . . . . . c30226_5ug5 1 . 3 . 735 . 1 1 12 ARG HH11 H -0.531 -2.474 5.971 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH11 . . . . . . . . . c30226_5ug5 1 . 3 . 736 . 1 1 12 ARG HH12 H -0.754 -2.360 7.689 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH12 . . . . . . . . . c30226_5ug5 1 . 3 . 737 . 1 1 12 ARG HH21 H -3.071 0.272 7.499 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH21 . . . . . . . . . c30226_5ug5 1 . 3 . 738 . 1 1 12 ARG HH22 H -2.199 -0.789 8.559 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH22 . . . . . . . . . c30226_5ug5 1 . 3 . 739 . 1 1 12 ARG N N -1.243 1.651 1.039 . . . 1.0 . . . . . . . . . . . . A . 12 ARG N . . . . . . . . . c30226_5ug5 1 . 3 . 740 . 1 1 12 ARG NE N -2.094 -0.598 5.353 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NE . . . . . . . . . c30226_5ug5 1 . 3 . 741 . 1 1 12 ARG NH1 N -0.966 -2.035 6.762 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NH1 . . . . . . . . . c30226_5ug5 1 . 3 . 742 . 1 1 12 ARG NH2 N -2.410 -0.473 7.629 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NH2 . . . . . . . . . c30226_5ug5 1 . 3 . 743 . 1 1 12 ARG O O -4.794 1.926 0.966 . . . 1.0 . . . . . . . . . . . . A . 12 ARG O . . . . . . . . . c30226_5ug5 1 . 3 . 744 . 1 1 13 TYR C C -4.985 4.503 -0.089 . . . 1.0 . . . . . . . . . . . . A . 13 TYR C . . . . . . . . . c30226_5ug5 1 . 3 . 745 . 1 1 13 TYR CA C -4.109 4.647 1.156 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CA . . . . . . . . . c30226_5ug5 1 . 3 . 746 . 1 1 13 TYR CB C -3.261 5.911 1.072 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CB . . . . . . . . . c30226_5ug5 1 . 3 . 747 . 1 1 13 TYR CD1 C -4.523 7.695 2.284 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CD1 . . . . . . . . . c30226_5ug5 1 . 3 . 748 . 1 1 13 TYR CD2 C -4.268 7.883 -0.063 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CD2 . . . . . . . . . c30226_5ug5 1 . 3 . 749 . 1 1 13 TYR CE1 C -5.225 8.882 2.309 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CE1 . . . . . . . . . c30226_5ug5 1 . 3 . 750 . 1 1 13 TYR CE2 C -4.965 9.064 -0.055 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CE2 . . . . . . . . . c30226_5ug5 1 . 3 . 751 . 1 1 13 TYR CG C -4.041 7.186 1.100 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CG . . . . . . . . . c30226_5ug5 1 . 3 . 752 . 1 1 13 TYR CZ C -5.444 9.565 1.134 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CZ . . . . . . . . . c30226_5ug5 1 . 3 . 753 . 1 1 13 TYR H H -2.293 3.680 1.570 . . . 1.0 . . . . . . . . . . . . A . 13 TYR H . . . . . . . . . c30226_5ug5 1 . 3 . 754 . 1 1 13 TYR HA H -4.738 4.710 2.022 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HA . . . . . . . . . c30226_5ug5 1 . 3 . 755 . 1 1 13 TYR HB2 H -2.569 5.931 1.898 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HB2 . . . . . . . . . c30226_5ug5 1 . 3 . 756 . 1 1 13 TYR HB3 H -2.707 5.898 0.152 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HB3 . . . . . . . . . c30226_5ug5 1 . 3 . 757 . 1 1 13 TYR HD1 H -4.345 7.148 3.195 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HD1 . . . . . . . . . c30226_5ug5 1 . 3 . 758 . 1 1 13 TYR HD2 H -3.892 7.484 -0.990 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HD2 . . . . . . . . . c30226_5ug5 1 . 3 . 759 . 1 1 13 TYR HE1 H -5.596 9.268 3.240 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HE1 . . . . . . . . . c30226_5ug5 1 . 3 . 760 . 1 1 13 TYR HE2 H -5.129 9.587 -0.974 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HE2 . . . . . . . . . c30226_5ug5 1 . 3 . 761 . 1 1 13 TYR HH H -6.797 10.747 0.443 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HH . . . . . . . . . c30226_5ug5 1 . 3 . 762 . 1 1 13 TYR N N -3.225 3.507 1.323 . . . 1.0 . . . . . . . . . . . . A . 13 TYR N . . . . . . . . . c30226_5ug5 1 . 3 . 763 . 1 1 13 TYR O O -6.195 4.717 -0.036 . . . 1.0 . . . . . . . . . . . . A . 13 TYR O . . . . . . . . . c30226_5ug5 1 . 3 . 764 . 1 1 13 TYR OH O -6.140 10.753 1.150 . . . 1.0 . . . . . . . . . . . . A . 13 TYR OH . . . . . . . . . c30226_5ug5 1 . 3 . 765 . 1 1 14 ASN C C -5.103 2.492 -2.852 . . . 1.0 . . . . . . . . . . . . A . 14 ASN C . . . . . . . . . c30226_5ug5 1 . 3 . 766 . 1 1 14 ASN CA C -5.110 3.956 -2.451 . . . 1.0 . . . . . . . . . . . . A . 14 ASN CA . . . . . . . . . c30226_5ug5 1 . 3 . 767 . 1 1 14 ASN CB C -4.496 4.824 -3.554 . . . 1.0 . . . . . . . . . . . . A . 14 ASN CB . . . . . . . . . c30226_5ug5 1 . 3 . 768 . 1 1 14 ASN CG C -3.030 4.521 -3.792 . . . 1.0 . . . . . . . . . . . . A . 14 ASN CG . . . . . . . . . c30226_5ug5 1 . 3 . 769 . 1 1 14 ASN H H -3.414 3.896 -1.177 . . . 1.0 . . . . . . . . . . . . A . 14 ASN H . . . . . . . . . c30226_5ug5 1 . 3 . 770 . 1 1 14 ASN HA H -6.132 4.267 -2.281 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HA . . . . . . . . . c30226_5ug5 1 . 3 . 771 . 1 1 14 ASN HB2 H -5.031 4.652 -4.475 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HB2 . . . . . . . . . c30226_5ug5 1 . 3 . 772 . 1 1 14 ASN HB3 H -4.589 5.864 -3.278 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HB3 . . . . . . . . . c30226_5ug5 1 . 3 . 773 . 1 1 14 ASN HD21 H -3.494 3.273 -5.262 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HD21 . . . . . . . . . c30226_5ug5 1 . 3 . 774 . 1 1 14 ASN HD22 H -1.807 3.460 -4.937 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HD22 . . . . . . . . . c30226_5ug5 1 . 3 . 775 . 1 1 14 ASN N N -4.376 4.121 -1.202 . . . 1.0 . . . . . . . . . . . . A . 14 ASN N . . . . . . . . . c30226_5ug5 1 . 3 . 776 . 1 1 14 ASN ND2 N -2.749 3.665 -4.757 . . . 1.0 . . . . . . . . . . . . A . 14 ASN ND2 . . . . . . . . . c30226_5ug5 1 . 3 . 777 . 1 1 14 ASN O O -5.559 2.115 -3.931 . . . 1.0 . . . . . . . . . . . . A . 14 ASN O . . . . . . . . . c30226_5ug5 1 . 3 . 778 . 1 1 14 ASN OD1 O -2.155 5.067 -3.120 . . . 1.0 . . . . . . . . . . . . A . 14 ASN OD1 . . . . . . . . . c30226_5ug5 1 . 3 . 779 . 1 1 15 ASN C C -4.705 -0.611 -1.057 . . . 1.0 . . . . . . . . . . . . A . 15 ASN C . . . . . . . . . c30226_5ug5 1 . 3 . 780 . 1 1 15 ASN CA C -4.318 0.274 -2.231 . . . 1.0 . . . . . . . . . . . . A . 15 ASN CA . . . . . . . . . c30226_5ug5 1 . 3 . 781 . 1 1 15 ASN CB C -2.842 0.135 -2.497 . . . 1.0 . . . . . . . . . . . . A . 15 ASN CB . . . . . . . . . c30226_5ug5 1 . 3 . 782 . 1 1 15 ASN CG C -2.479 0.273 -3.962 . . . 1.0 . . . . . . . . . . . . A . 15 ASN CG . . . . . . . . . c30226_5ug5 1 . 3 . 783 . 1 1 15 ASN H H -4.368 2.028 -1.062 . . . 1.0 . . . . . . . . . . . . A . 15 ASN H . . . . . . . . . c30226_5ug5 1 . 3 . 784 . 1 1 15 ASN HA H -4.874 -0.014 -3.104 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HA . . . . . . . . . c30226_5ug5 1 . 3 . 785 . 1 1 15 ASN HB2 H -2.351 0.923 -1.946 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HB2 . . . . . . . . . c30226_5ug5 1 . 3 . 786 . 1 1 15 ASN HB3 H -2.500 -0.824 -2.139 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HB3 . . . . . . . . . c30226_5ug5 1 . 3 . 787 . 1 1 15 ASN HD21 H -0.719 1.055 -3.479 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HD21 . . . . . . . . . c30226_5ug5 1 . 3 . 788 . 1 1 15 ASN HD22 H -1.030 0.885 -5.174 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HD22 . . . . . . . . . c30226_5ug5 1 . 3 . 789 . 1 1 15 ASN N N -4.588 1.674 -1.951 . . . 1.0 . . . . . . . . . . . . A . 15 ASN N . . . . . . . . . c30226_5ug5 1 . 3 . 790 . 1 1 15 ASN ND2 N -1.292 0.791 -4.233 . . . 1.0 . . . . . . . . . . . . A . 15 ASN ND2 . . . . . . . . . c30226_5ug5 1 . 3 . 791 . 1 1 15 ASN O O -3.856 -1.213 -0.407 . . . 1.0 . . . . . . . . . . . . A . 15 ASN O . . . . . . . . . c30226_5ug5 1 . 3 . 792 . 1 1 15 ASN OD1 O -3.257 -0.091 -4.843 . . . 1.0 . . . . . . . . . . . . A . 15 ASN OD1 . . . . . . . . . c30226_5ug5 1 . 3 . 793 . 1 1 16 HYP C C -6.826 -2.844 0.173 . . . 1.0 . . . . . . . . . . . . A . 16 HYP C . . . . . . . . . c30226_5ug5 1 . 3 . 794 . 1 1 16 HYP CA C -6.509 -1.384 0.423 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CA . . . . . . . . . c30226_5ug5 1 . 3 . 795 . 1 1 16 HYP CB C -7.757 -0.560 0.668 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CB . . . . . . . . . c30226_5ug5 1 . 3 . 796 . 1 1 16 HYP CD C -7.086 -0.075 -1.540 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CD . . . . . . . . . c30226_5ug5 1 . 3 . 797 . 1 1 16 HYP CG C -7.921 0.467 -0.436 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CG . . . . . . . . . c30226_5ug5 1 . 3 . 798 . 1 1 16 HYP HA H -5.838 -1.300 1.244 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HA . . . . . . . . . c30226_5ug5 1 . 3 . 799 . 1 1 16 HYP HB2 H -7.670 -0.047 1.612 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HB2 . . . . . . . . . c30226_5ug5 1 . 3 . 800 . 1 1 16 HYP HB3 H -8.618 -1.215 0.688 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HB3 . . . . . . . . . c30226_5ug5 1 . 3 . 801 . 1 1 16 HYP HD1 H -6.398 1.694 -0.324 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HD1 . . . . . . . . . c30226_5ug5 1 . 3 . 802 . 1 1 16 HYP HD22 H -7.626 -0.799 -2.113 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HD22 . . . . . . . . . c30226_5ug5 1 . 3 . 803 . 1 1 16 HYP HD23 H -6.714 0.719 -2.169 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HD23 . . . . . . . . . c30226_5ug5 1 . 3 . 804 . 1 1 16 HYP HG H -8.955 0.579 -0.718 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HG . . . . . . . . . c30226_5ug5 1 . 3 . 805 . 1 1 16 HYP N N -5.994 -0.694 -0.769 . . . 1.0 . . . . . . . . . . . . A . 16 HYP N . . . . . . . . . c30226_5ug5 1 . 3 . 806 . 1 1 16 HYP O O -7.164 -3.595 1.087 . . . 1.0 . . . . . . . . . . . . A . 16 HYP O . . . . . . . . . c30226_5ug5 1 . 3 . 807 . 1 1 16 HYP OD1 O -7.340 1.711 -0.058 . . . 1.0 . . . . . . . . . . . . A . 16 HYP OD1 . . . . . . . . . c30226_5ug5 1 . 3 . 808 . 1 1 17 HIS C C -5.669 -5.103 -2.269 . . . 1.0 . . . . . . . . . . . . A . 17 HIS C . . . . . . . . . c30226_5ug5 1 . 3 . 809 . 1 1 17 HIS CA C -6.874 -4.628 -1.463 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CA . . . . . . . . . c30226_5ug5 1 . 3 . 810 . 1 1 17 HIS CB C -8.182 -4.841 -2.253 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CB . . . . . . . . . c30226_5ug5 1 . 3 . 811 . 1 1 17 HIS CD2 C -7.720 -4.545 -4.798 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CD2 . . . . . . . . . c30226_5ug5 1 . 3 . 812 . 1 1 17 HIS CE1 C -8.816 -2.679 -5.107 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CE1 . . . . . . . . . c30226_5ug5 1 . 3 . 813 . 1 1 17 HIS CG C -8.238 -4.176 -3.601 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CG . . . . . . . . . c30226_5ug5 1 . 3 . 814 . 1 1 17 HIS H H -6.487 -2.554 -1.744 . . . 1.0 . . . . . . . . . . . . A . 17 HIS H . . . . . . . . . c30226_5ug5 1 . 3 . 815 . 1 1 17 HIS HA H -6.922 -5.211 -0.554 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HA . . . . . . . . . c30226_5ug5 1 . 3 . 816 . 1 1 17 HIS HB2 H -8.322 -5.899 -2.410 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HB2 . . . . . . . . . c30226_5ug5 1 . 3 . 817 . 1 1 17 HIS HB3 H -9.007 -4.465 -1.665 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HB3 . . . . . . . . . c30226_5ug5 1 . 3 . 818 . 1 1 17 HIS HD1 H -9.425 -2.489 -3.163 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HD1 . . . . . . . . . c30226_5ug5 1 . 3 . 819 . 1 1 17 HIS HD2 H -7.123 -5.424 -4.993 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HD2 . . . . . . . . . c30226_5ug5 1 . 3 . 820 . 1 1 17 HIS HE1 H -9.250 -1.806 -5.574 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HE1 . . . . . . . . . c30226_5ug5 1 . 3 . 821 . 1 1 17 HIS HE2 H -8.028 -3.701 -6.693 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HE2 . . . . . . . . . c30226_5ug5 1 . 3 . 822 . 1 1 17 HIS N N -6.702 -3.232 -1.072 . . . 1.0 . . . . . . . . . . . . A . 17 HIS N . . . . . . . . . c30226_5ug5 1 . 3 . 823 . 1 1 17 HIS ND1 N -8.919 -3.002 -3.832 . . . 1.0 . . . . . . . . . . . . A . 17 HIS ND1 . . . . . . . . . c30226_5ug5 1 . 3 . 824 . 1 1 17 HIS NE2 N -8.095 -3.597 -5.716 . . . 1.0 . . . . . . . . . . . . A . 17 HIS NE2 . . . . . . . . . c30226_5ug5 1 . 3 . 825 . 1 1 17 HIS O O -5.739 -6.095 -2.987 . . . 1.0 . . . . . . . . . . . . A . 17 HIS O . . . . . . . . . c30226_5ug5 1 . 3 . 826 . 1 1 18 VAL C C -2.574 -5.846 -2.271 . . . 1.0 . . . . . . . . . . . . A . 18 VAL C . . . . . . . . . c30226_5ug5 1 . 3 . 827 . 1 1 18 VAL CA C -3.350 -4.667 -2.870 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CA . . . . . . . . . c30226_5ug5 1 . 3 . 828 . 1 1 18 VAL CB C -2.473 -3.411 -2.870 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CB . . . . . . . . . c30226_5ug5 1 . 3 . 829 . 1 1 18 VAL CG1 C -1.788 -3.242 -1.533 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CG1 . . . . . . . . . c30226_5ug5 1 . 3 . 830 . 1 1 18 VAL CG2 C -1.479 -3.443 -4.000 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CG2 . . . . . . . . . c30226_5ug5 1 . 3 . 831 . 1 1 18 VAL H H -4.555 -3.628 -1.519 . . . 1.0 . . . . . . . . . . . . A . 18 VAL H . . . . . . . . . c30226_5ug5 1 . 3 . 832 . 1 1 18 VAL HA H -3.614 -4.894 -3.882 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HA . . . . . . . . . c30226_5ug5 1 . 3 . 833 . 1 1 18 VAL HB H -3.119 -2.558 -3.018 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HB . . . . . . . . . c30226_5ug5 1 . 3 . 834 . 1 1 18 VAL HG11 H -1.136 -4.081 -1.362 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG11 . . . . . . . . . c30226_5ug5 1 . 3 . 835 . 1 1 18 VAL HG12 H -2.535 -3.200 -0.756 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG12 . . . . . . . . . c30226_5ug5 1 . 3 . 836 . 1 1 18 VAL HG13 H -1.215 -2.327 -1.535 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG13 . . . . . . . . . c30226_5ug5 1 . 3 . 837 . 1 1 18 VAL HG21 H -0.822 -4.286 -3.873 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG21 . . . . . . . . . c30226_5ug5 1 . 3 . 838 . 1 1 18 VAL HG22 H -0.908 -2.529 -3.998 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG22 . . . . . . . . . c30226_5ug5 1 . 3 . 839 . 1 1 18 VAL HG23 H -2.011 -3.535 -4.931 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG23 . . . . . . . . . c30226_5ug5 1 . 3 . 840 . 1 1 18 VAL N N -4.561 -4.386 -2.129 . . . 1.0 . . . . . . . . . . . . A . 18 VAL N . . . . . . . . . c30226_5ug5 1 . 3 . 841 . 1 1 18 VAL O O -1.578 -6.304 -2.830 . . . 1.0 . . . . . . . . . . . . A . 18 VAL O . . . . . . . . . c30226_5ug5 1 . 3 . 842 . 1 1 19 CYS C C -2.381 -8.699 -1.245 . . . 1.0 . . . . . . . . . . . . A . 19 CYS C . . . . . . . . . c30226_5ug5 1 . 3 . 843 . 1 1 19 CYS CA C -2.388 -7.415 -0.423 . . . 1.0 . . . . . . . . . . . . A . 19 CYS CA . . . . . . . . . c30226_5ug5 1 . 3 . 844 . 1 1 19 CYS CB C -3.077 -7.651 0.917 . . . 1.0 . . . . . . . . . . . . A . 19 CYS CB . . . . . . . . . c30226_5ug5 1 . 3 . 845 . 1 1 19 CYS H H -3.876 -5.963 -0.772 . . . 1.0 . . . . . . . . . . . . A . 19 CYS H . . . . . . . . . c30226_5ug5 1 . 3 . 846 . 1 1 19 CYS HA H -1.369 -7.113 -0.245 . . . 1.0 . . . . . . . . . . . . A . 19 CYS HA . . . . . . . . . c30226_5ug5 1 . 3 . 847 . 1 1 19 CYS HB2 H -4.096 -7.961 0.739 . . . 1.0 . . . . . . . . . . . . A . 19 CYS HB2 . . . . . . . . . c30226_5ug5 1 . 3 . 848 . 1 1 19 CYS HB3 H -2.555 -8.432 1.449 . . . 1.0 . . . . . . . . . . . . A . 19 CYS HB3 . . . . . . . . . c30226_5ug5 1 . 3 . 849 . 1 1 19 CYS N N -3.050 -6.334 -1.138 . . . 1.0 . . . . . . . . . . . . A . 19 CYS N . . . . . . . . . c30226_5ug5 1 . 3 . 850 . 1 1 19 CYS O O -3.475 -9.228 -1.539 . . . 1.0 . . . . . . . . . . . . A . 19 CYS O . . . . . . . . . c30226_5ug5 1 . 3 . 851 . 1 1 19 CYS OXT O -1.279 -9.177 -1.586 . . . 1.0 . . . . . . . . . . . . A . 19 CYS OXT . . . . . . . . . c30226_5ug5 1 . 3 . 852 . 1 1 19 CYS SG S -3.127 -6.178 1.991 . . . 1.0 . . . . . . . . . . . . A . 19 CYS SG . . . . . . . . . c30226_5ug5 1 . 4 . 853 . 1 1 1 ILE C C 4.666 1.947 -4.668 . . . 1.0 . . . . . . . . . . . . A . 1 ILE C . . . . . . . . . c30226_5ug5 1 . 4 . 854 . 1 1 1 ILE CA C 3.371 2.502 -5.247 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CA . . . . . . . . . c30226_5ug5 1 . 4 . 855 . 1 1 1 ILE CB C 2.902 1.628 -6.438 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CB . . . . . . . . . c30226_5ug5 1 . 4 . 856 . 1 1 1 ILE CD1 C 2.287 -0.753 -7.128 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CD1 . . . . . . . . . c30226_5ug5 1 . 4 . 857 . 1 1 1 ILE CG1 C 2.751 0.161 -6.016 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CG1 . . . . . . . . . c30226_5ug5 1 . 4 . 858 . 1 1 1 ILE CG2 C 3.861 1.754 -7.613 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CG2 . . . . . . . . . c30226_5ug5 1 . 4 . 859 . 1 1 1 ILE H1 H 4.308 3.989 -6.356 . . . 1.0 . . . . . . . . . . . . A . 1 ILE H1 . . . . . . . . . c30226_5ug5 1 . 4 . 860 . 1 1 1 ILE H2 H 3.804 4.489 -4.823 . . . 1.0 . . . . . . . . . . . . A . 1 ILE H2 . . . . . . . . . c30226_5ug5 1 . 4 . 861 . 1 1 1 ILE H3 H 2.668 4.285 -6.058 . . . 1.0 . . . . . . . . . . . . A . 1 ILE H3 . . . . . . . . . c30226_5ug5 1 . 4 . 862 . 1 1 1 ILE HA H 2.609 2.466 -4.480 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HA . . . . . . . . . c30226_5ug5 1 . 4 . 863 . 1 1 1 ILE HB H 1.940 1.996 -6.756 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HB . . . . . . . . . c30226_5ug5 1 . 4 . 864 . 1 1 1 ILE HD11 H 1.320 -0.428 -7.482 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HD11 . . . . . . . . . c30226_5ug5 1 . 4 . 865 . 1 1 1 ILE HD12 H 2.214 -1.765 -6.756 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HD12 . . . . . . . . . c30226_5ug5 1 . 4 . 866 . 1 1 1 ILE HD13 H 2.997 -0.720 -7.940 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HD13 . . . . . . . . . c30226_5ug5 1 . 4 . 867 . 1 1 1 ILE HG12 H 3.703 -0.205 -5.665 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG12 . . . . . . . . . c30226_5ug5 1 . 4 . 868 . 1 1 1 ILE HG13 H 2.030 0.098 -5.212 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG13 . . . . . . . . . c30226_5ug5 1 . 4 . 869 . 1 1 1 ILE HG21 H 3.880 2.780 -7.953 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG21 . . . . . . . . . c30226_5ug5 1 . 4 . 870 . 1 1 1 ILE HG22 H 3.532 1.114 -8.418 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG22 . . . . . . . . . c30226_5ug5 1 . 4 . 871 . 1 1 1 ILE HG23 H 4.852 1.461 -7.301 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG23 . . . . . . . . . c30226_5ug5 1 . 4 . 872 . 1 1 1 ILE N N 3.551 3.913 -5.651 . . . 1.0 . . . . . . . . . . . . A . 1 ILE N . . . . . . . . . c30226_5ug5 1 . 4 . 873 . 1 1 1 ILE O O 5.759 2.347 -5.064 . . . 1.0 . . . . . . . . . . . . A . 1 ILE O . . . . . . . . . c30226_5ug5 1 . 4 . 874 . 1 1 2 ARG C C 5.603 -1.078 -3.182 . . . 1.0 . . . . . . . . . . . . A . 2 ARG C . . . . . . . . . c30226_5ug5 1 . 4 . 875 . 1 1 2 ARG CA C 5.674 0.435 -3.055 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CA . . . . . . . . . c30226_5ug5 1 . 4 . 876 . 1 1 2 ARG CB C 5.696 0.818 -1.570 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CB . . . . . . . . . c30226_5ug5 1 . 4 . 877 . 1 1 2 ARG CD C 7.120 2.879 -1.853 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CD . . . . . . . . . c30226_5ug5 1 . 4 . 878 . 1 1 2 ARG CG C 5.815 2.312 -1.314 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CG . . . . . . . . . c30226_5ug5 1 . 4 . 879 . 1 1 2 ARG CZ C 9.493 2.826 -1.179 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CZ . . . . . . . . . c30226_5ug5 1 . 4 . 880 . 1 1 2 ARG H H 3.634 0.769 -3.446 . . . 1.0 . . . . . . . . . . . . A . 2 ARG H . . . . . . . . . c30226_5ug5 1 . 4 . 881 . 1 1 2 ARG HA H 6.568 0.793 -3.531 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HA . . . . . . . . . c30226_5ug5 1 . 4 . 882 . 1 1 2 ARG HB2 H 4.781 0.470 -1.110 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB2 . . . . . . . . . c30226_5ug5 1 . 4 . 883 . 1 1 2 ARG HB3 H 6.533 0.326 -1.098 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB3 . . . . . . . . . c30226_5ug5 1 . 4 . 884 . 1 1 2 ARG HD2 H 7.161 2.709 -2.918 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD2 . . . . . . . . . c30226_5ug5 1 . 4 . 885 . 1 1 2 ARG HD3 H 7.141 3.941 -1.659 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD3 . . . . . . . . . c30226_5ug5 1 . 4 . 886 . 1 1 2 ARG HE H 8.169 1.370 -0.829 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HE . . . . . . . . . c30226_5ug5 1 . 4 . 887 . 1 1 2 ARG HG2 H 4.993 2.814 -1.797 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG2 . . . . . . . . . c30226_5ug5 1 . 4 . 888 . 1 1 2 ARG HG3 H 5.771 2.486 -0.250 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG3 . . . . . . . . . c30226_5ug5 1 . 4 . 889 . 1 1 2 ARG HH11 H 8.927 4.523 -2.136 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH11 . . . . . . . . . c30226_5ug5 1 . 4 . 890 . 1 1 2 ARG HH12 H 10.596 4.453 -1.670 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH12 . . . . . . . . . c30226_5ug5 1 . 4 . 891 . 1 1 2 ARG HH21 H 10.366 1.277 -0.207 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH21 . . . . . . . . . c30226_5ug5 1 . 4 . 892 . 1 1 2 ARG HH22 H 11.414 2.608 -0.576 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH22 . . . . . . . . . c30226_5ug5 1 . 4 . 893 . 1 1 2 ARG N N 4.533 1.044 -3.711 . . . 1.0 . . . . . . . . . . . . A . 2 ARG N . . . . . . . . . c30226_5ug5 1 . 4 . 894 . 1 1 2 ARG NE N 8.289 2.261 -1.227 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NE . . . . . . . . . c30226_5ug5 1 . 4 . 895 . 1 1 2 ARG NH1 N 9.687 4.030 -1.701 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH1 . . . . . . . . . c30226_5ug5 1 . 4 . 896 . 1 1 2 ARG NH2 N 10.504 2.187 -0.606 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH2 . . . . . . . . . c30226_5ug5 1 . 4 . 897 . 1 1 2 ARG O O 4.525 -1.636 -3.385 . . . 1.0 . . . . . . . . . . . . A . 2 ARG O . . . . . . . . . c30226_5ug5 1 . 4 . 898 . 1 1 3 ASP C C 6.612 -3.693 -1.628 . . . 1.0 . . . . . . . . . . . . A . 3 ASP C . . . . . . . . . c30226_5ug5 1 . 4 . 899 . 1 1 3 ASP CA C 6.777 -3.204 -3.052 . . . 1.0 . . . . . . . . . . . . A . 3 ASP CA . . . . . . . . . c30226_5ug5 1 . 4 . 900 . 1 1 3 ASP CB C 8.070 -3.738 -3.677 . . . 1.0 . . . . . . . . . . . . A . 3 ASP CB . . . . . . . . . c30226_5ug5 1 . 4 . 901 . 1 1 3 ASP CG C 8.028 -5.235 -3.912 . . . 1.0 . . . . . . . . . . . . A . 3 ASP CG . . . . . . . . . c30226_5ug5 1 . 4 . 902 . 1 1 3 ASP H H 7.588 -1.244 -2.978 . . . 1.0 . . . . . . . . . . . . A . 3 ASP H . . . . . . . . . c30226_5ug5 1 . 4 . 903 . 1 1 3 ASP HA H 5.936 -3.539 -3.613 . . . 1.0 . . . . . . . . . . . . A . 3 ASP HA . . . . . . . . . c30226_5ug5 1 . 4 . 904 . 1 1 3 ASP HB2 H 8.232 -3.249 -4.627 . . . 1.0 . . . . . . . . . . . . A . 3 ASP HB2 . . . . . . . . . c30226_5ug5 1 . 4 . 905 . 1 1 3 ASP HB3 H 8.898 -3.517 -3.019 . . . 1.0 . . . . . . . . . . . . A . 3 ASP HB3 . . . . . . . . . c30226_5ug5 1 . 4 . 906 . 1 1 3 ASP N N 6.746 -1.744 -3.060 . . . 1.0 . . . . . . . . . . . . A . 3 ASP N . . . . . . . . . c30226_5ug5 1 . 4 . 907 . 1 1 3 ASP O O 6.575 -4.884 -1.330 . . . 1.0 . . . . . . . . . . . . A . 3 ASP O . . . . . . . . . c30226_5ug5 1 . 4 . 908 . 1 1 3 ASP OD1 O 7.418 -5.668 -4.914 . . . 1.0 . . . . . . . . . . . . A . 3 ASP OD1 . . . . . . . . . c30226_5ug5 1 . 4 . 909 . 1 1 3 ASP OD2 O 8.613 -5.990 -3.107 . . . 1.0 . . . . . . . . . . . . A . 3 ASP OD2 . . . . . . . . . c30226_5ug5 1 . 4 . 910 . 1 1 4 GLU C C 4.808 -2.318 0.907 . . . 1.0 . . . . . . . . . . . . A . 4 GLU C . . . . . . . . . c30226_5ug5 1 . 4 . 911 . 1 1 4 GLU CA C 6.184 -2.897 0.633 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CA . . . . . . . . . c30226_5ug5 1 . 4 . 912 . 1 1 4 GLU CB C 7.218 -2.180 1.496 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CB . . . . . . . . . c30226_5ug5 1 . 4 . 913 . 1 1 4 GLU CD C 7.958 -4.041 3.026 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CD . . . . . . . . . c30226_5ug5 1 . 4 . 914 . 1 1 4 GLU CG C 8.371 -3.057 1.953 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CG . . . . . . . . . c30226_5ug5 1 . 4 . 915 . 1 1 4 GLU H H 6.592 -1.813 -1.126 . . . 1.0 . . . . . . . . . . . . A . 4 GLU H . . . . . . . . . c30226_5ug5 1 . 4 . 916 . 1 1 4 GLU HA H 6.187 -3.953 0.856 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HA . . . . . . . . . c30226_5ug5 1 . 4 . 917 . 1 1 4 GLU HB2 H 7.624 -1.354 0.933 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HB2 . . . . . . . . . c30226_5ug5 1 . 4 . 918 . 1 1 4 GLU HB3 H 6.716 -1.794 2.367 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HB3 . . . . . . . . . c30226_5ug5 1 . 4 . 919 . 1 1 4 GLU HG2 H 8.747 -3.609 1.105 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HG2 . . . . . . . . . c30226_5ug5 1 . 4 . 920 . 1 1 4 GLU HG3 H 9.155 -2.425 2.347 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HG3 . . . . . . . . . c30226_5ug5 1 . 4 . 921 . 1 1 4 GLU N N 6.488 -2.715 -0.775 . . . 1.0 . . . . . . . . . . . . A . 4 GLU N . . . . . . . . . c30226_5ug5 1 . 4 . 922 . 1 1 4 GLU O O 4.487 -1.928 2.025 . . . 1.0 . . . . . . . . . . . . A . 4 GLU O . . . . . . . . . c30226_5ug5 1 . 4 . 923 . 1 1 4 GLU OE1 O 7.761 -5.232 2.703 . . . 1.0 . . . . . . . . . . . . A . 4 GLU OE1 . . . . . . . . . c30226_5ug5 1 . 4 . 924 . 1 1 4 GLU OE2 O 7.832 -3.636 4.199 . . . 1.0 . . . . . . . . . . . . A . 4 GLU OE2 . . . . . . . . . c30226_5ug5 1 . 4 . 925 . 1 1 5 CYS C C 1.780 -2.124 0.923 . . . 1.0 . . . . . . . . . . . . A . 5 CYS C . . . . . . . . . c30226_5ug5 1 . 4 . 926 . 1 1 5 CYS CA C 2.732 -1.568 -0.128 . . . 1.0 . . . . . . . . . . . . A . 5 CYS CA . . . . . . . . . c30226_5ug5 1 . 4 . 927 . 1 1 5 CYS CB C 2.077 -1.640 -1.505 . . . 1.0 . . . . . . . . . . . . A . 5 CYS CB . . . . . . . . . c30226_5ug5 1 . 4 . 928 . 1 1 5 CYS H H 4.286 -2.727 -0.957 . . . 1.0 . . . . . . . . . . . . A . 5 CYS H . . . . . . . . . c30226_5ug5 1 . 4 . 929 . 1 1 5 CYS HA H 2.933 -0.534 0.104 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HA . . . . . . . . . c30226_5ug5 1 . 4 . 930 . 1 1 5 CYS HB2 H 2.834 -1.505 -2.264 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HB2 . . . . . . . . . c30226_5ug5 1 . 4 . 931 . 1 1 5 CYS HB3 H 1.620 -2.611 -1.629 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HB3 . . . . . . . . . c30226_5ug5 1 . 4 . 932 . 1 1 5 CYS N N 4.008 -2.270 -0.142 . . . 1.0 . . . . . . . . . . . . A . 5 CYS N . . . . . . . . . c30226_5ug5 1 . 4 . 933 . 1 1 5 CYS O O 1.001 -1.378 1.509 . . . 1.0 . . . . . . . . . . . . A . 5 CYS O . . . . . . . . . c30226_5ug5 1 . 4 . 934 . 1 1 5 CYS SG S 0.790 -0.382 -1.777 . . . 1.0 . . . . . . . . . . . . A . 5 CYS SG . . . . . . . . . c30226_5ug5 1 . 4 . 935 . 1 1 6 CYS C C 1.352 -3.756 3.546 . . . 1.0 . . . . . . . . . . . . A . 6 CYS C . . . . . . . . . c30226_5ug5 1 . 4 . 936 . 1 1 6 CYS CA C 0.929 -4.047 2.111 . . . 1.0 . . . . . . . . . . . . A . 6 CYS CA . . . . . . . . . c30226_5ug5 1 . 4 . 937 . 1 1 6 CYS CB C 0.828 -5.555 1.867 . . . 1.0 . . . . . . . . . . . . A . 6 CYS CB . . . . . . . . . c30226_5ug5 1 . 4 . 938 . 1 1 6 CYS H H 2.550 -3.963 0.753 . . . 1.0 . . . . . . . . . . . . A . 6 CYS H . . . . . . . . . c30226_5ug5 1 . 4 . 939 . 1 1 6 CYS HA H -0.041 -3.602 1.946 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HA . . . . . . . . . c30226_5ug5 1 . 4 . 940 . 1 1 6 CYS HB2 H 0.765 -5.739 0.804 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HB2 . . . . . . . . . c30226_5ug5 1 . 4 . 941 . 1 1 6 CYS HB3 H 1.707 -6.040 2.262 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HB3 . . . . . . . . . c30226_5ug5 1 . 4 . 942 . 1 1 6 CYS N N 1.855 -3.422 1.182 . . . 1.0 . . . . . . . . . . . . A . 6 CYS N . . . . . . . . . c30226_5ug5 1 . 4 . 943 . 1 1 6 CYS O O 0.542 -3.817 4.472 . . . 1.0 . . . . . . . . . . . . A . 6 CYS O . . . . . . . . . c30226_5ug5 1 . 4 . 944 . 1 1 6 CYS SG S -0.630 -6.317 2.649 . . . 1.0 . . . . . . . . . . . . A . 6 CYS SG . . . . . . . . . c30226_5ug5 1 . 4 . 945 . 1 1 7 SER C C 2.787 -1.499 5.170 . . . 1.0 . . . . . . . . . . . . A . 7 SER C . . . . . . . . . c30226_5ug5 1 . 4 . 946 . 1 1 7 SER CA C 3.101 -2.972 5.009 . . . 1.0 . . . . . . . . . . . . A . 7 SER CA . . . . . . . . . c30226_5ug5 1 . 4 . 947 . 1 1 7 SER CB C 4.604 -3.139 5.084 . . . 1.0 . . . . . . . . . . . . A . 7 SER CB . . . . . . . . . c30226_5ug5 1 . 4 . 948 . 1 1 7 SER H H 3.257 -3.516 2.992 . . . 1.0 . . . . . . . . . . . . A . 7 SER H . . . . . . . . . c30226_5ug5 1 . 4 . 949 . 1 1 7 SER HA H 2.628 -3.539 5.792 . . . 1.0 . . . . . . . . . . . . A . 7 SER HA . . . . . . . . . c30226_5ug5 1 . 4 . 950 . 1 1 7 SER HB2 H 5.070 -2.238 4.704 . . . 1.0 . . . . . . . . . . . . A . 7 SER HB2 . . . . . . . . . c30226_5ug5 1 . 4 . 951 . 1 1 7 SER HB3 H 4.891 -3.285 6.107 . . . 1.0 . . . . . . . . . . . . A . 7 SER HB3 . . . . . . . . . c30226_5ug5 1 . 4 . 952 . 1 1 7 SER HG H 5.996 -4.196 4.186 . . . 1.0 . . . . . . . . . . . . A . 7 SER HG . . . . . . . . . c30226_5ug5 1 . 4 . 953 . 1 1 7 SER N N 2.620 -3.431 3.730 . . . 1.0 . . . . . . . . . . . . A . 7 SER N . . . . . . . . . c30226_5ug5 1 . 4 . 954 . 1 1 7 SER O O 2.440 -1.033 6.254 . . . 1.0 . . . . . . . . . . . . A . 7 SER O . . . . . . . . . c30226_5ug5 1 . 4 . 955 . 1 1 7 SER OG O 5.038 -4.256 4.320 . . . 1.0 . . . . . . . . . . . . A . 7 SER OG . . . . . . . . . c30226_5ug5 1 . 4 . 956 . 1 1 8 ASN C C 1.441 1.175 4.105 . . . 1.0 . . . . . . . . . . . . A . 8 ASN C . . . . . . . . . c30226_5ug5 1 . 4 . 957 . 1 1 8 ASN CA C 2.871 0.649 4.075 . . . 1.0 . . . . . . . . . . . . A . 8 ASN CA . . . . . . . . . c30226_5ug5 1 . 4 . 958 . 1 1 8 ASN CB C 3.582 1.150 2.827 . . . 1.0 . . . . . . . . . . . . A . 8 ASN CB . . . . . . . . . c30226_5ug5 1 . 4 . 959 . 1 1 8 ASN CG C 5.099 1.113 2.937 . . . 1.0 . . . . . . . . . . . . A . 8 ASN CG . . . . . . . . . c30226_5ug5 1 . 4 . 960 . 1 1 8 ASN H H 2.977 -1.227 3.196 . . . 1.0 . . . . . . . . . . . . A . 8 ASN H . . . . . . . . . c30226_5ug5 1 . 4 . 961 . 1 1 8 ASN HA H 3.410 0.973 4.949 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HA . . . . . . . . . c30226_5ug5 1 . 4 . 962 . 1 1 8 ASN HB2 H 3.289 0.529 1.994 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HB2 . . . . . . . . . c30226_5ug5 1 . 4 . 963 . 1 1 8 ASN HB3 H 3.272 2.148 2.637 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HB3 . . . . . . . . . c30226_5ug5 1 . 4 . 964 . 1 1 8 ASN HD21 H 5.249 2.669 1.709 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HD21 . . . . . . . . . c30226_5ug5 1 . 4 . 965 . 1 1 8 ASN HD22 H 6.744 2.019 2.293 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HD22 . . . . . . . . . c30226_5ug5 1 . 4 . 966 . 1 1 8 ASN N N 2.894 -0.779 4.063 . . . 1.0 . . . . . . . . . . . . A . 8 ASN N . . . . . . . . . c30226_5ug5 1 . 4 . 967 . 1 1 8 ASN ND2 N 5.764 2.025 2.245 . . . 1.0 . . . . . . . . . . . . A . 8 ASN ND2 . . . . . . . . . c30226_5ug5 1 . 4 . 968 . 1 1 8 ASN O O 0.710 1.058 3.120 . . . 1.0 . . . . . . . . . . . . A . 8 ASN O . . . . . . . . . c30226_5ug5 1 . 4 . 969 . 1 1 8 ASN OD1 O 5.669 0.280 3.640 . . . 1.0 . . . . . . . . . . . . A . 8 ASN OD1 . . . . . . . . . c30226_5ug5 1 . 4 . 970 . 1 1 9 PRO C C -0.696 3.334 4.366 . . . 1.0 . . . . . . . . . . . . A . 9 PRO C . . . . . . . . . c30226_5ug5 1 . 4 . 971 . 1 1 9 PRO CA C -0.328 2.305 5.414 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CA . . . . . . . . . c30226_5ug5 1 . 4 . 972 . 1 1 9 PRO CB C -0.252 2.964 6.791 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CB . . . . . . . . . c30226_5ug5 1 . 4 . 973 . 1 1 9 PRO CD C 1.861 2.059 6.410 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CD . . . . . . . . . c30226_5ug5 1 . 4 . 974 . 1 1 9 PRO CG C 1.179 3.239 7.007 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CG . . . . . . . . . c30226_5ug5 1 . 4 . 975 . 1 1 9 PRO HA H -1.063 1.514 5.425 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HA . . . . . . . . . c30226_5ug5 1 . 4 . 976 . 1 1 9 PRO HB2 H -0.842 3.865 6.813 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HB2 . . . . . . . . . c30226_5ug5 1 . 4 . 977 . 1 1 9 PRO HB3 H -0.597 2.282 7.514 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HB3 . . . . . . . . . c30226_5ug5 1 . 4 . 978 . 1 1 9 PRO HD2 H 2.854 2.314 6.139 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HD2 . . . . . . . . . c30226_5ug5 1 . 4 . 979 . 1 1 9 PRO HD3 H 1.851 1.223 7.092 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HD3 . . . . . . . . . c30226_5ug5 1 . 4 . 980 . 1 1 9 PRO HG2 H 1.467 4.150 6.501 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HG2 . . . . . . . . . c30226_5ug5 1 . 4 . 981 . 1 1 9 PRO HG3 H 1.385 3.302 8.063 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HG3 . . . . . . . . . c30226_5ug5 1 . 4 . 982 . 1 1 9 PRO N N 1.030 1.787 5.228 . . . 1.0 . . . . . . . . . . . . A . 9 PRO N . . . . . . . . . c30226_5ug5 1 . 4 . 983 . 1 1 9 PRO O O -1.781 3.314 3.794 . . . 1.0 . . . . . . . . . . . . A . 9 PRO O . . . . . . . . . c30226_5ug5 1 . 4 . 984 . 1 1 10 ALA C C 0.035 4.760 1.710 . . . 1.0 . . . . . . . . . . . . A . 10 ALA C . . . . . . . . . c30226_5ug5 1 . 4 . 985 . 1 1 10 ALA CA C 0.049 5.287 3.147 . . . 1.0 . . . . . . . . . . . . A . 10 ALA CA . . . . . . . . . c30226_5ug5 1 . 4 . 986 . 1 1 10 ALA CB C 1.124 6.347 3.311 . . . 1.0 . . . . . . . . . . . . A . 10 ALA CB . . . . . . . . . c30226_5ug5 1 . 4 . 987 . 1 1 10 ALA H H 1.071 4.172 4.636 . . . 1.0 . . . . . . . . . . . . A . 10 ALA H . . . . . . . . . c30226_5ug5 1 . 4 . 988 . 1 1 10 ALA HA H -0.904 5.750 3.351 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HA . . . . . . . . . c30226_5ug5 1 . 4 . 989 . 1 1 10 ALA HB1 H 0.908 7.182 2.662 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HB1 . . . . . . . . . c30226_5ug5 1 . 4 . 990 . 1 1 10 ALA HB2 H 2.085 5.929 3.050 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HB2 . . . . . . . . . c30226_5ug5 1 . 4 . 991 . 1 1 10 ALA HB3 H 1.146 6.684 4.338 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HB3 . . . . . . . . . c30226_5ug5 1 . 4 . 992 . 1 1 10 ALA N N 0.235 4.223 4.121 . . . 1.0 . . . . . . . . . . . . A . 10 ALA N . . . . . . . . . c30226_5ug5 1 . 4 . 993 . 1 1 10 ALA O O -0.364 5.475 0.796 . . . 1.0 . . . . . . . . . . . . A . 10 ALA O . . . . . . . . . c30226_5ug5 1 . 4 . 994 . 1 1 11 CYS C C -0.838 2.315 -0.030 . . . 1.0 . . . . . . . . . . . . A . 11 CYS C . . . . . . . . . c30226_5ug5 1 . 4 . 995 . 1 1 11 CYS CA C 0.490 2.969 0.155 . . . 1.0 . . . . . . . . . . . . A . 11 CYS CA . . . . . . . . . c30226_5ug5 1 . 4 . 996 . 1 1 11 CYS CB C 1.623 1.956 -0.021 . . . 1.0 . . . . . . . . . . . . A . 11 CYS CB . . . . . . . . . c30226_5ug5 1 . 4 . 997 . 1 1 11 CYS H H 0.562 2.897 2.260 . . . 1.0 . . . . . . . . . . . . A . 11 CYS H . . . . . . . . . c30226_5ug5 1 . 4 . 998 . 1 1 11 CYS HA H 0.598 3.783 -0.549 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HA . . . . . . . . . c30226_5ug5 1 . 4 . 999 . 1 1 11 CYS HB2 H 2.554 2.412 0.281 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HB2 . . . . . . . . . c30226_5ug5 1 . 4 . 1000 . 1 1 11 CYS HB3 H 1.428 1.096 0.607 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HB3 . . . . . . . . . c30226_5ug5 1 . 4 . 1001 . 1 1 11 CYS N N 0.454 3.513 1.500 . . . 1.0 . . . . . . . . . . . . A . 11 CYS N . . . . . . . . . c30226_5ug5 1 . 4 . 1002 . 1 1 11 CYS O O -1.533 2.459 -1.040 . . . 1.0 . . . . . . . . . . . . A . 11 CYS O . . . . . . . . . c30226_5ug5 1 . 4 . 1003 . 1 1 11 CYS SG S 1.825 1.362 -1.735 . . . 1.0 . . . . . . . . . . . . A . 11 CYS SG . . . . . . . . . c30226_5ug5 1 . 4 . 1004 . 1 1 12 ARG C C -3.578 2.055 1.093 . . . 1.0 . . . . . . . . . . . . A . 12 ARG C . . . . . . . . . c30226_5ug5 1 . 4 . 1005 . 1 1 12 ARG CA C -2.453 1.032 1.245 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CA . . . . . . . . . c30226_5ug5 1 . 4 . 1006 . 1 1 12 ARG CB C -2.445 0.437 2.632 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CB . . . . . . . . . c30226_5ug5 1 . 4 . 1007 . 1 1 12 ARG CD C -1.251 -1.357 3.915 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CD . . . . . . . . . c30226_5ug5 1 . 4 . 1008 . 1 1 12 ARG CG C -2.021 -1.017 2.652 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CG . . . . . . . . . c30226_5ug5 1 . 4 . 1009 . 1 1 12 ARG CZ C -1.888 -1.711 6.279 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CZ . . . . . . . . . c30226_5ug5 1 . 4 . 1010 . 1 1 12 ARG H H -0.472 1.420 1.704 . . . 1.0 . . . . . . . . . . . . A . 12 ARG H . . . . . . . . . c30226_5ug5 1 . 4 . 1011 . 1 1 12 ARG HA H -2.573 0.254 0.534 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HA . . . . . . . . . c30226_5ug5 1 . 4 . 1012 . 1 1 12 ARG HB2 H -1.751 0.999 3.241 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HB2 . . . . . . . . . c30226_5ug5 1 . 4 . 1013 . 1 1 12 ARG HB3 H -3.417 0.527 3.047 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HB3 . . . . . . . . . c30226_5ug5 1 . 4 . 1014 . 1 1 12 ARG HD2 H -1.019 -2.411 3.906 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HD2 . . . . . . . . . c30226_5ug5 1 . 4 . 1015 . 1 1 12 ARG HD3 H -0.330 -0.785 3.916 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HD3 . . . . . . . . . c30226_5ug5 1 . 4 . 1016 . 1 1 12 ARG HE H -2.641 -0.294 5.084 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HE . . . . . . . . . c30226_5ug5 1 . 4 . 1017 . 1 1 12 ARG HG2 H -2.899 -1.635 2.599 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HG2 . . . . . . . . . c30226_5ug5 1 . 4 . 1018 . 1 1 12 ARG HG3 H -1.392 -1.208 1.795 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HG3 . . . . . . . . . c30226_5ug5 1 . 4 . 1019 . 1 1 12 ARG HH11 H -0.520 -3.046 5.587 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH11 . . . . . . . . . c30226_5ug5 1 . 4 . 1020 . 1 1 12 ARG HH12 H -0.974 -3.233 7.255 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH12 . . . . . . . . . c30226_5ug5 1 . 4 . 1021 . 1 1 12 ARG HH21 H -3.234 -0.559 7.261 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH21 . . . . . . . . . c30226_5ug5 1 . 4 . 1022 . 1 1 12 ARG HH22 H -2.519 -1.835 8.199 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH22 . . . . . . . . . c30226_5ug5 1 . 4 . 1023 . 1 1 12 ARG N N -1.166 1.602 1.029 . . . 1.0 . . . . . . . . . . . . A . 12 ARG N . . . . . . . . . c30226_5ug5 1 . 4 . 1024 . 1 1 12 ARG NE N -2.007 -1.048 5.128 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NE . . . . . . . . . c30226_5ug5 1 . 4 . 1025 . 1 1 12 ARG NH1 N -1.064 -2.747 6.382 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NH1 . . . . . . . . . c30226_5ug5 1 . 4 . 1026 . 1 1 12 ARG NH2 N -2.603 -1.340 7.330 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NH2 . . . . . . . . . c30226_5ug5 1 . 4 . 1027 . 1 1 12 ARG O O -4.712 1.701 0.779 . . . 1.0 . . . . . . . . . . . . A . 12 ARG O . . . . . . . . . c30226_5ug5 1 . 4 . 1028 . 1 1 13 TYR C C -4.758 4.410 -0.306 . . . 1.0 . . . . . . . . . . . . A . 13 TYR C . . . . . . . . . c30226_5ug5 1 . 4 . 1029 . 1 1 13 TYR CA C -4.177 4.421 1.109 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CA . . . . . . . . . c30226_5ug5 1 . 4 . 1030 . 1 1 13 TYR CB C -3.444 5.731 1.365 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CB . . . . . . . . . c30226_5ug5 1 . 4 . 1031 . 1 1 13 TYR CD1 C -5.153 7.215 2.421 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CD1 . . . . . . . . . c30226_5ug5 1 . 4 . 1032 . 1 1 13 TYR CD2 C -4.298 7.807 0.293 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CD2 . . . . . . . . . c30226_5ug5 1 . 4 . 1033 . 1 1 13 TYR CE1 C -5.952 8.337 2.417 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CE1 . . . . . . . . . c30226_5ug5 1 . 4 . 1034 . 1 1 13 TYR CE2 C -5.088 8.927 0.275 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CE2 . . . . . . . . . c30226_5ug5 1 . 4 . 1035 . 1 1 13 TYR CG C -4.321 6.939 1.360 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CG . . . . . . . . . c30226_5ug5 1 . 4 . 1036 . 1 1 13 TYR CZ C -5.916 9.194 1.340 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CZ . . . . . . . . . c30226_5ug5 1 . 4 . 1037 . 1 1 13 TYR H H -2.355 3.529 1.643 . . . 1.0 . . . . . . . . . . . . A . 13 TYR H . . . . . . . . . c30226_5ug5 1 . 4 . 1038 . 1 1 13 TYR HA H -4.975 4.323 1.820 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HA . . . . . . . . . c30226_5ug5 1 . 4 . 1039 . 1 1 13 TYR HB2 H -2.951 5.684 2.323 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HB2 . . . . . . . . . c30226_5ug5 1 . 4 . 1040 . 1 1 13 TYR HB3 H -2.709 5.871 0.596 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HB3 . . . . . . . . . c30226_5ug5 1 . 4 . 1041 . 1 1 13 TYR HD1 H -5.170 6.535 3.256 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HD1 . . . . . . . . . c30226_5ug5 1 . 4 . 1042 . 1 1 13 TYR HD2 H -3.648 7.590 -0.537 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HD2 . . . . . . . . . c30226_5ug5 1 . 4 . 1043 . 1 1 13 TYR HE1 H -6.597 8.542 3.252 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HE1 . . . . . . . . . c30226_5ug5 1 . 4 . 1044 . 1 1 13 TYR HE2 H -5.053 9.588 -0.568 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HE2 . . . . . . . . . c30226_5ug5 1 . 4 . 1045 . 1 1 13 TYR HH H -7.226 10.336 0.512 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HH . . . . . . . . . c30226_5ug5 1 . 4 . 1046 . 1 1 13 TYR N N -3.250 3.323 1.309 . . . 1.0 . . . . . . . . . . . . A . 13 TYR N . . . . . . . . . c30226_5ug5 1 . 4 . 1047 . 1 1 13 TYR O O -5.881 4.864 -0.530 . . . 1.0 . . . . . . . . . . . . A . 13 TYR O . . . . . . . . . c30226_5ug5 1 . 4 . 1048 . 1 1 13 TYR OH O -6.712 10.315 1.330 . . . 1.0 . . . . . . . . . . . . A . 13 TYR OH . . . . . . . . . c30226_5ug5 1 . 4 . 1049 . 1 1 14 ASN C C -4.653 2.374 -3.018 . . . 1.0 . . . . . . . . . . . . A . 14 ASN C . . . . . . . . . c30226_5ug5 1 . 4 . 1050 . 1 1 14 ASN CA C -4.440 3.827 -2.645 . . . 1.0 . . . . . . . . . . . . A . 14 ASN CA . . . . . . . . . c30226_5ug5 1 . 4 . 1051 . 1 1 14 ASN CB C -3.398 4.490 -3.557 . . . 1.0 . . . . . . . . . . . . A . 14 ASN CB . . . . . . . . . c30226_5ug5 1 . 4 . 1052 . 1 1 14 ASN CG C -3.860 4.643 -4.997 . . . 1.0 . . . . . . . . . . . . A . 14 ASN CG . . . . . . . . . c30226_5ug5 1 . 4 . 1053 . 1 1 14 ASN H H -3.125 3.468 -1.020 . . . 1.0 . . . . . . . . . . . . A . 14 ASN H . . . . . . . . . c30226_5ug5 1 . 4 . 1054 . 1 1 14 ASN HA H -5.379 4.353 -2.722 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HA . . . . . . . . . c30226_5ug5 1 . 4 . 1055 . 1 1 14 ASN HB2 H -3.170 5.472 -3.171 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HB2 . . . . . . . . . c30226_5ug5 1 . 4 . 1056 . 1 1 14 ASN HB3 H -2.497 3.892 -3.551 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HB3 . . . . . . . . . c30226_5ug5 1 . 4 . 1057 . 1 1 14 ASN HD21 H -4.726 6.377 -4.560 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HD21 . . . . . . . . . c30226_5ug5 1 . 4 . 1058 . 1 1 14 ASN HD22 H -4.863 5.858 -6.205 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HD22 . . . . . . . . . c30226_5ug5 1 . 4 . 1059 . 1 1 14 ASN N N -3.996 3.882 -1.260 . . . 1.0 . . . . . . . . . . . . A . 14 ASN N . . . . . . . . . c30226_5ug5 1 . 4 . 1060 . 1 1 14 ASN ND2 N -4.552 5.735 -5.283 . . . 1.0 . . . . . . . . . . . . A . 14 ASN ND2 . . . . . . . . . c30226_5ug5 1 . 4 . 1061 . 1 1 14 ASN O O -5.092 2.034 -4.113 . . . 1.0 . . . . . . . . . . . . A . 14 ASN O . . . . . . . . . c30226_5ug5 1 . 4 . 1062 . 1 1 14 ASN OD1 O -3.595 3.791 -5.847 . . . 1.0 . . . . . . . . . . . . A . 14 ASN OD1 . . . . . . . . . c30226_5ug5 1 . 4 . 1063 . 1 1 15 ASN C C -4.906 -0.695 -1.125 . . . 1.0 . . . . . . . . . . . . A . 15 ASN C . . . . . . . . . c30226_5ug5 1 . 4 . 1064 . 1 1 15 ASN CA C -4.275 0.094 -2.268 . . . 1.0 . . . . . . . . . . . . A . 15 ASN CA . . . . . . . . . c30226_5ug5 1 . 4 . 1065 . 1 1 15 ASN CB C -2.811 -0.254 -2.376 . . . 1.0 . . . . . . . . . . . . A . 15 ASN CB . . . . . . . . . c30226_5ug5 1 . 4 . 1066 . 1 1 15 ASN CG C -2.208 0.129 -3.714 . . . 1.0 . . . . . . . . . . . . A . 15 ASN CG . . . . . . . . . c30226_5ug5 1 . 4 . 1067 . 1 1 15 ASN H H -4.205 1.872 -1.146 . . . 1.0 . . . . . . . . . . . . A . 15 ASN H . . . . . . . . . c30226_5ug5 1 . 4 . 1068 . 1 1 15 ASN HA H -4.773 -0.142 -3.189 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HA . . . . . . . . . c30226_5ug5 1 . 4 . 1069 . 1 1 15 ASN HB2 H -2.302 0.306 -1.604 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HB2 . . . . . . . . . c30226_5ug5 1 . 4 . 1070 . 1 1 15 ASN HB3 H -2.675 -1.312 -2.214 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HB3 . . . . . . . . . c30226_5ug5 1 . 4 . 1071 . 1 1 15 ASN HD21 H -1.492 1.807 -2.936 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HD21 . . . . . . . . . c30226_5ug5 1 . 4 . 1072 . 1 1 15 ASN HD22 H -1.156 1.550 -4.613 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HD22 . . . . . . . . . c30226_5ug5 1 . 4 . 1073 . 1 1 15 ASN N N -4.367 1.523 -2.048 . . . 1.0 . . . . . . . . . . . . A . 15 ASN N . . . . . . . . . c30226_5ug5 1 . 4 . 1074 . 1 1 15 ASN ND2 N -1.553 1.277 -3.759 . . . 1.0 . . . . . . . . . . . . A . 15 ASN ND2 . . . . . . . . . c30226_5ug5 1 . 4 . 1075 . 1 1 15 ASN O O -4.222 -1.403 -0.385 . . . 1.0 . . . . . . . . . . . . A . 15 ASN O . . . . . . . . . c30226_5ug5 1 . 4 . 1076 . 1 1 15 ASN OD1 O -2.315 -0.609 -4.692 . . . 1.0 . . . . . . . . . . . . A . 15 ASN OD1 . . . . . . . . . c30226_5ug5 1 . 4 . 1077 . 1 1 16 HYP C C -7.450 -2.571 -0.123 . . . 1.0 . . . . . . . . . . . . A . 16 HYP C . . . . . . . . . c30226_5ug5 1 . 4 . 1078 . 1 1 16 HYP CA C -6.969 -1.163 0.156 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CA . . . . . . . . . c30226_5ug5 1 . 4 . 1079 . 1 1 16 HYP CB C -8.116 -0.176 0.233 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CB . . . . . . . . . c30226_5ug5 1 . 4 . 1080 . 1 1 16 HYP CD C -7.114 0.182 -1.864 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CD . . . . . . . . . c30226_5ug5 1 . 4 . 1081 . 1 1 16 HYP CG C -7.969 0.864 -0.861 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CG . . . . . . . . . c30226_5ug5 1 . 4 . 1082 . 1 1 16 HYP HA H -6.401 -1.148 1.056 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HA . . . . . . . . . c30226_5ug5 1 . 4 . 1083 . 1 1 16 HYP HB2 H -8.101 0.319 1.190 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HB2 . . . . . . . . . c30226_5ug5 1 . 4 . 1084 . 1 1 16 HYP HB3 H -9.052 -0.706 0.110 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HB3 . . . . . . . . . c30226_5ug5 1 . 4 . 1085 . 1 1 16 HYP HD1 H -6.276 1.780 -0.495 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HD1 . . . . . . . . . c30226_5ug5 1 . 4 . 1086 . 1 1 16 HYP HD22 H -7.692 -0.466 -2.488 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HD22 . . . . . . . . . c30226_5ug5 1 . 4 . 1087 . 1 1 16 HYP HD23 H -6.559 0.896 -2.452 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HD23 . . . . . . . . . c30226_5ug5 1 . 4 . 1088 . 1 1 16 HYP HG H -8.926 1.152 -1.261 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HG . . . . . . . . . c30226_5ug5 1 . 4 . 1089 . 1 1 16 HYP N N -6.221 -0.578 -0.973 . . . 1.0 . . . . . . . . . . . . A . 16 HYP N . . . . . . . . . c30226_5ug5 1 . 4 . 1090 . 1 1 16 HYP O O -8.009 -3.247 0.739 . . . 1.0 . . . . . . . . . . . . A . 16 HYP O . . . . . . . . . c30226_5ug5 1 . 4 . 1091 . 1 1 16 HYP OD1 O -7.230 1.984 -0.390 . . . 1.0 . . . . . . . . . . . . A . 16 HYP OD1 . . . . . . . . . c30226_5ug5 1 . 4 . 1092 . 1 1 17 HIS C C -6.182 -5.120 -1.916 . . . 1.0 . . . . . . . . . . . . A . 17 HIS C . . . . . . . . . c30226_5ug5 1 . 4 . 1093 . 1 1 17 HIS CA C -7.491 -4.367 -1.744 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CA . . . . . . . . . c30226_5ug5 1 . 4 . 1094 . 1 1 17 HIS CB C -8.305 -4.422 -3.040 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CB . . . . . . . . . c30226_5ug5 1 . 4 . 1095 . 1 1 17 HIS CD2 C -10.730 -4.500 -2.136 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CD2 . . . . . . . . . c30226_5ug5 1 . 4 . 1096 . 1 1 17 HIS CE1 C -11.528 -2.766 -3.203 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CE1 . . . . . . . . . c30226_5ug5 1 . 4 . 1097 . 1 1 17 HIS CG C -9.725 -3.984 -2.879 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CG . . . . . . . . . c30226_5ug5 1 . 4 . 1098 . 1 1 17 HIS H H -6.846 -2.355 -1.981 . . . 1.0 . . . . . . . . . . . . A . 17 HIS H . . . . . . . . . c30226_5ug5 1 . 4 . 1099 . 1 1 17 HIS HA H -8.058 -4.837 -0.953 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HA . . . . . . . . . c30226_5ug5 1 . 4 . 1100 . 1 1 17 HIS HB2 H -7.843 -3.782 -3.776 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HB2 . . . . . . . . . c30226_5ug5 1 . 4 . 1101 . 1 1 17 HIS HB3 H -8.310 -5.438 -3.409 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HB3 . . . . . . . . . c30226_5ug5 1 . 4 . 1102 . 1 1 17 HIS HD1 H -9.776 -2.301 -4.152 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HD1 . . . . . . . . . c30226_5ug5 1 . 4 . 1103 . 1 1 17 HIS HD2 H -10.669 -5.363 -1.490 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HD2 . . . . . . . . . c30226_5ug5 1 . 4 . 1104 . 1 1 17 HIS HE1 H -12.198 -2.000 -3.565 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HE1 . . . . . . . . . c30226_5ug5 1 . 4 . 1105 . 1 1 17 HIS HE2 H -12.641 -3.719 -1.780 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HE2 . . . . . . . . . c30226_5ug5 1 . 4 . 1106 . 1 1 17 HIS N N -7.220 -2.994 -1.337 . . . 1.0 . . . . . . . . . . . . A . 17 HIS N . . . . . . . . . c30226_5ug5 1 . 4 . 1107 . 1 1 17 HIS ND1 N -10.260 -2.899 -3.536 . . . 1.0 . . . . . . . . . . . . A . 17 HIS ND1 . . . . . . . . . c30226_5ug5 1 . 4 . 1108 . 1 1 17 HIS NE2 N -11.841 -3.726 -2.355 . . . 1.0 . . . . . . . . . . . . A . 17 HIS NE2 . . . . . . . . . c30226_5ug5 1 . 4 . 1109 . 1 1 17 HIS O O -6.145 -6.211 -2.477 . . . 1.0 . . . . . . . . . . . . A . 17 HIS O . . . . . . . . . c30226_5ug5 1 . 4 . 1110 . 1 1 18 VAL C C -3.585 -6.019 -0.260 . . . 1.0 . . . . . . . . . . . . A . 18 VAL C . . . . . . . . . c30226_5ug5 1 . 4 . 1111 . 1 1 18 VAL CA C -3.795 -5.122 -1.474 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CA . . . . . . . . . c30226_5ug5 1 . 4 . 1112 . 1 1 18 VAL CB C -2.719 -4.018 -1.555 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CB . . . . . . . . . c30226_5ug5 1 . 4 . 1113 . 1 1 18 VAL CG1 C -1.412 -4.450 -0.933 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CG1 . . . . . . . . . c30226_5ug5 1 . 4 . 1114 . 1 1 18 VAL CG2 C -2.502 -3.608 -2.999 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CG2 . . . . . . . . . c30226_5ug5 1 . 4 . 1115 . 1 1 18 VAL H H -5.192 -3.626 -1.038 . . . 1.0 . . . . . . . . . . . . A . 18 VAL H . . . . . . . . . c30226_5ug5 1 . 4 . 1116 . 1 1 18 VAL HA H -3.737 -5.718 -2.359 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HA . . . . . . . . . c30226_5ug5 1 . 4 . 1117 . 1 1 18 VAL HB H -3.080 -3.160 -1.015 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HB . . . . . . . . . c30226_5ug5 1 . 4 . 1118 . 1 1 18 VAL HG11 H -1.583 -4.700 0.101 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG11 . . . . . . . . . c30226_5ug5 1 . 4 . 1119 . 1 1 18 VAL HG12 H -0.702 -3.641 -0.997 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG12 . . . . . . . . . c30226_5ug5 1 . 4 . 1120 . 1 1 18 VAL HG13 H -1.031 -5.311 -1.456 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG13 . . . . . . . . . c30226_5ug5 1 . 4 . 1121 . 1 1 18 VAL HG21 H -2.195 -4.466 -3.575 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG21 . . . . . . . . . c30226_5ug5 1 . 4 . 1122 . 1 1 18 VAL HG22 H -1.736 -2.847 -3.045 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG22 . . . . . . . . . c30226_5ug5 1 . 4 . 1123 . 1 1 18 VAL HG23 H -3.424 -3.215 -3.401 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG23 . . . . . . . . . c30226_5ug5 1 . 4 . 1124 . 1 1 18 VAL N N -5.106 -4.516 -1.432 . . . 1.0 . . . . . . . . . . . . A . 18 VAL N . . . . . . . . . c30226_5ug5 1 . 4 . 1125 . 1 1 18 VAL O O -2.893 -7.036 -0.321 . . . 1.0 . . . . . . . . . . . . A . 18 VAL O . . . . . . . . . c30226_5ug5 1 . 4 . 1126 . 1 1 19 CYS C C -5.542 -6.875 2.467 . . . 1.0 . . . . . . . . . . . . A . 19 CYS C . . . . . . . . . c30226_5ug5 1 . 4 . 1127 . 1 1 19 CYS CA C -4.150 -6.409 2.061 . . . 1.0 . . . . . . . . . . . . A . 19 CYS CA . . . . . . . . . c30226_5ug5 1 . 4 . 1128 . 1 1 19 CYS CB C -3.537 -5.566 3.180 . . . 1.0 . . . . . . . . . . . . A . 19 CYS CB . . . . . . . . . c30226_5ug5 1 . 4 . 1129 . 1 1 19 CYS H H -4.761 -4.833 0.795 . . . 1.0 . . . . . . . . . . . . A . 19 CYS H . . . . . . . . . c30226_5ug5 1 . 4 . 1130 . 1 1 19 CYS HA H -3.527 -7.273 1.883 . . . 1.0 . . . . . . . . . . . . A . 19 CYS HA . . . . . . . . . c30226_5ug5 1 . 4 . 1131 . 1 1 19 CYS HB2 H -4.227 -4.780 3.448 . . . 1.0 . . . . . . . . . . . . A . 19 CYS HB2 . . . . . . . . . c30226_5ug5 1 . 4 . 1132 . 1 1 19 CYS HB3 H -3.366 -6.195 4.040 . . . 1.0 . . . . . . . . . . . . A . 19 CYS HB3 . . . . . . . . . c30226_5ug5 1 . 4 . 1133 . 1 1 19 CYS N N -4.221 -5.644 0.826 . . . 1.0 . . . . . . . . . . . . A . 19 CYS N . . . . . . . . . c30226_5ug5 1 . 4 . 1134 . 1 1 19 CYS O O -6.242 -6.123 3.176 . . . 1.0 . . . . . . . . . . . . A . 19 CYS O . . . . . . . . . c30226_5ug5 1 . 4 . 1135 . 1 1 19 CYS OXT O -5.942 -7.988 2.062 . . . 1.0 . . . . . . . . . . . . A . 19 CYS OXT . . . . . . . . . c30226_5ug5 1 . 4 . 1136 . 1 1 19 CYS SG S -1.954 -4.780 2.745 . . . 1.0 . . . . . . . . . . . . A . 19 CYS SG . . . . . . . . . c30226_5ug5 1 . 5 . 1137 . 1 1 1 ILE C C 6.595 2.334 -3.493 . . . 1.0 . . . . . . . . . . . . A . 1 ILE C . . . . . . . . . c30226_5ug5 1 . 5 . 1138 . 1 1 1 ILE CA C 5.698 2.941 -4.563 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CA . . . . . . . . . c30226_5ug5 1 . 5 . 1139 . 1 1 1 ILE CB C 5.191 1.821 -5.498 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CB . . . . . . . . . c30226_5ug5 1 . 5 . 1140 . 1 1 1 ILE CD1 C 5.943 0.022 -7.137 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CD1 . . . . . . . . . c30226_5ug5 1 . 5 . 1141 . 1 1 1 ILE CG1 C 6.354 1.191 -6.269 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CG1 . . . . . . . . . c30226_5ug5 1 . 5 . 1142 . 1 1 1 ILE CG2 C 4.142 2.369 -6.456 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CG2 . . . . . . . . . c30226_5ug5 1 . 5 . 1143 . 1 1 1 ILE H1 H 6.711 4.751 -4.669 . . . 1.0 . . . . . . . . . . . . A . 1 ILE H1 . . . . . . . . . c30226_5ug5 1 . 5 . 1144 . 1 1 1 ILE H2 H 5.834 4.378 -6.063 . . . 1.0 . . . . . . . . . . . . A . 1 ILE H2 . . . . . . . . . c30226_5ug5 1 . 5 . 1145 . 1 1 1 ILE H3 H 7.290 3.579 -5.738 . . . 1.0 . . . . . . . . . . . . A . 1 ILE H3 . . . . . . . . . c30226_5ug5 1 . 5 . 1146 . 1 1 1 ILE HA H 4.847 3.401 -4.085 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HA . . . . . . . . . c30226_5ug5 1 . 5 . 1147 . 1 1 1 ILE HB H 4.721 1.064 -4.889 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HB . . . . . . . . . c30226_5ug5 1 . 5 . 1148 . 1 1 1 ILE HD11 H 5.509 -0.749 -6.520 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HD11 . . . . . . . . . c30226_5ug5 1 . 5 . 1149 . 1 1 1 ILE HD12 H 6.810 -0.371 -7.648 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HD12 . . . . . . . . . c30226_5ug5 1 . 5 . 1150 . 1 1 1 ILE HD13 H 5.217 0.353 -7.865 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HD13 . . . . . . . . . c30226_5ug5 1 . 5 . 1151 . 1 1 1 ILE HG12 H 6.799 1.938 -6.908 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG12 . . . . . . . . . c30226_5ug5 1 . 5 . 1152 . 1 1 1 ILE HG13 H 7.095 0.840 -5.566 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG13 . . . . . . . . . c30226_5ug5 1 . 5 . 1153 . 1 1 1 ILE HG21 H 4.577 3.157 -7.054 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG21 . . . . . . . . . c30226_5ug5 1 . 5 . 1154 . 1 1 1 ILE HG22 H 3.311 2.764 -5.891 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG22 . . . . . . . . . c30226_5ug5 1 . 5 . 1155 . 1 1 1 ILE HG23 H 3.795 1.576 -7.102 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG23 . . . . . . . . . c30226_5ug5 1 . 5 . 1156 . 1 1 1 ILE N N 6.433 3.983 -5.311 . . . 1.0 . . . . . . . . . . . . A . 1 ILE N . . . . . . . . . c30226_5ug5 1 . 5 . 1157 . 1 1 1 ILE O O 7.707 2.811 -3.261 . . . 1.0 . . . . . . . . . . . . A . 1 ILE O . . . . . . . . . c30226_5ug5 1 . 5 . 1158 . 1 1 2 ARG C C 6.910 -0.888 -2.100 . . . 1.0 . . . . . . . . . . . . A . 2 ARG C . . . . . . . . . c30226_5ug5 1 . 5 . 1159 . 1 1 2 ARG CA C 6.868 0.605 -1.812 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CA . . . . . . . . . c30226_5ug5 1 . 5 . 1160 . 1 1 2 ARG CB C 6.251 0.834 -0.428 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CB . . . . . . . . . c30226_5ug5 1 . 5 . 1161 . 1 1 2 ARG CD C 7.650 2.811 0.238 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CD . . . . . . . . . c30226_5ug5 1 . 5 . 1162 . 1 1 2 ARG CG C 6.243 2.283 0.023 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CG . . . . . . . . . c30226_5ug5 1 . 5 . 1163 . 1 1 2 ARG CZ C 8.705 4.754 1.332 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CZ . . . . . . . . . c30226_5ug5 1 . 5 . 1164 . 1 1 2 ARG H H 5.207 0.969 -3.050 . . . 1.0 . . . . . . . . . . . . A . 2 ARG H . . . . . . . . . c30226_5ug5 1 . 5 . 1165 . 1 1 2 ARG HA H 7.870 0.996 -1.825 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HA . . . . . . . . . c30226_5ug5 1 . 5 . 1166 . 1 1 2 ARG HB2 H 5.232 0.480 -0.443 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB2 . . . . . . . . . c30226_5ug5 1 . 5 . 1167 . 1 1 2 ARG HB3 H 6.808 0.258 0.297 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB3 . . . . . . . . . c30226_5ug5 1 . 5 . 1168 . 1 1 2 ARG HD2 H 8.163 2.163 0.935 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD2 . . . . . . . . . c30226_5ug5 1 . 5 . 1169 . 1 1 2 ARG HD3 H 8.172 2.807 -0.707 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD3 . . . . . . . . . c30226_5ug5 1 . 5 . 1170 . 1 1 2 ARG HE H 6.800 4.673 0.719 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HE . . . . . . . . . c30226_5ug5 1 . 5 . 1171 . 1 1 2 ARG HG2 H 5.759 2.882 -0.734 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG2 . . . . . . . . . c30226_5ug5 1 . 5 . 1172 . 1 1 2 ARG HG3 H 5.693 2.357 0.950 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG3 . . . . . . . . . c30226_5ug5 1 . 5 . 1173 . 1 1 2 ARG HH11 H 9.959 3.190 1.019 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH11 . . . . . . . . . c30226_5ug5 1 . 5 . 1174 . 1 1 2 ARG HH12 H 10.657 4.556 1.828 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH12 . . . . . . . . . c30226_5ug5 1 . 5 . 1175 . 1 1 2 ARG HH21 H 7.743 6.481 1.764 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH21 . . . . . . . . . c30226_5ug5 1 . 5 . 1176 . 1 1 2 ARG HH22 H 9.408 6.418 2.245 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH22 . . . . . . . . . c30226_5ug5 1 . 5 . 1177 . 1 1 2 ARG N N 6.106 1.291 -2.836 . . . 1.0 . . . . . . . . . . . . A . 2 ARG N . . . . . . . . . c30226_5ug5 1 . 5 . 1178 . 1 1 2 ARG NE N 7.646 4.171 0.772 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NE . . . . . . . . . c30226_5ug5 1 . 5 . 1179 . 1 1 2 ARG NH1 N 9.866 4.117 1.396 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH1 . . . . . . . . . c30226_5ug5 1 . 5 . 1180 . 1 1 2 ARG NH2 N 8.610 5.982 1.818 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH2 . . . . . . . . . c30226_5ug5 1 . 5 . 1181 . 1 1 2 ARG O O 5.979 -1.444 -2.676 . . . 1.0 . . . . . . . . . . . . A . 2 ARG O . . . . . . . . . c30226_5ug5 1 . 5 . 1182 . 1 1 3 ASP C C 7.628 -3.606 -0.526 . . . 1.0 . . . . . . . . . . . . A . 3 ASP C . . . . . . . . . c30226_5ug5 1 . 5 . 1183 . 1 1 3 ASP CA C 8.126 -2.974 -1.805 . . . 1.0 . . . . . . . . . . . . A . 3 ASP CA . . . . . . . . . c30226_5ug5 1 . 5 . 1184 . 1 1 3 ASP CB C 9.582 -3.359 -2.089 . . . 1.0 . . . . . . . . . . . . A . 3 ASP CB . . . . . . . . . c30226_5ug5 1 . 5 . 1185 . 1 1 3 ASP CG C 9.791 -4.852 -2.241 . . . 1.0 . . . . . . . . . . . . A . 3 ASP CG . . . . . . . . . c30226_5ug5 1 . 5 . 1186 . 1 1 3 ASP H H 8.719 -1.006 -1.283 . . . 1.0 . . . . . . . . . . . . A . 3 ASP H . . . . . . . . . c30226_5ug5 1 . 5 . 1187 . 1 1 3 ASP HA H 7.499 -3.288 -2.602 . . . 1.0 . . . . . . . . . . . . A . 3 ASP HA . . . . . . . . . c30226_5ug5 1 . 5 . 1188 . 1 1 3 ASP HB2 H 9.899 -2.880 -3.003 . . . 1.0 . . . . . . . . . . . . A . 3 ASP HB2 . . . . . . . . . c30226_5ug5 1 . 5 . 1189 . 1 1 3 ASP HB3 H 10.202 -3.011 -1.276 . . . 1.0 . . . . . . . . . . . . A . 3 ASP HB3 . . . . . . . . . c30226_5ug5 1 . 5 . 1190 . 1 1 3 ASP N N 7.993 -1.524 -1.687 . . . 1.0 . . . . . . . . . . . . A . 3 ASP N . . . . . . . . . c30226_5ug5 1 . 5 . 1191 . 1 1 3 ASP O O 7.497 -4.820 -0.381 . . . 1.0 . . . . . . . . . . . . A . 3 ASP O . . . . . . . . . c30226_5ug5 1 . 5 . 1192 . 1 1 3 ASP OD1 O 9.425 -5.402 -3.301 . . . 1.0 . . . . . . . . . . . . A . 3 ASP OD1 . . . . . . . . . c30226_5ug5 1 . 5 . 1193 . 1 1 3 ASP OD2 O 10.313 -5.488 -1.297 . . . 1.0 . . . . . . . . . . . . A . 3 ASP OD2 . . . . . . . . . c30226_5ug5 1 . 5 . 1194 . 1 1 4 GLU C C 5.329 -2.420 1.669 . . . 1.0 . . . . . . . . . . . . A . 4 GLU C . . . . . . . . . c30226_5ug5 1 . 5 . 1195 . 1 1 4 GLU CA C 6.720 -3.020 1.648 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CA . . . . . . . . . c30226_5ug5 1 . 5 . 1196 . 1 1 4 GLU CB C 7.549 -2.425 2.768 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CB . . . . . . . . . c30226_5ug5 1 . 5 . 1197 . 1 1 4 GLU CD C 9.800 -2.312 3.896 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CD . . . . . . . . . c30226_5ug5 1 . 5 . 1198 . 1 1 4 GLU CG C 8.911 -3.075 2.938 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CG . . . . . . . . . c30226_5ug5 1 . 5 . 1199 . 1 1 4 GLU H H 7.508 -1.790 0.150 . . . 1.0 . . . . . . . . . . . . A . 4 GLU H . . . . . . . . . c30226_5ug5 1 . 5 . 1200 . 1 1 4 GLU HA H 6.660 -4.092 1.761 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HA . . . . . . . . . c30226_5ug5 1 . 5 . 1201 . 1 1 4 GLU HB2 H 7.696 -1.373 2.570 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HB2 . . . . . . . . . c30226_5ug5 1 . 5 . 1202 . 1 1 4 GLU HB3 H 6.998 -2.534 3.676 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HB3 . . . . . . . . . c30226_5ug5 1 . 5 . 1203 . 1 1 4 GLU HG2 H 8.774 -4.076 3.319 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HG2 . . . . . . . . . c30226_5ug5 1 . 5 . 1204 . 1 1 4 GLU HG3 H 9.398 -3.120 1.975 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HG3 . . . . . . . . . c30226_5ug5 1 . 5 . 1205 . 1 1 4 GLU N N 7.326 -2.718 0.373 . . . 1.0 . . . . . . . . . . . . A . 4 GLU N . . . . . . . . . c30226_5ug5 1 . 5 . 1206 . 1 1 4 GLU O O 4.785 -2.078 2.716 . . . 1.0 . . . . . . . . . . . . A . 4 GLU O . . . . . . . . . c30226_5ug5 1 . 5 . 1207 . 1 1 4 GLU OE1 O 9.750 -2.595 5.114 . . . 1.0 . . . . . . . . . . . . A . 4 GLU OE1 . . . . . . . . . c30226_5ug5 1 . 5 . 1208 . 1 1 4 GLU OE2 O 10.563 -1.434 3.439 . . . 1.0 . . . . . . . . . . . . A . 4 GLU OE2 . . . . . . . . . c30226_5ug5 1 . 5 . 1209 . 1 1 5 CYS C C 2.405 -2.049 1.076 . . . 1.0 . . . . . . . . . . . . A . 5 CYS C . . . . . . . . . c30226_5ug5 1 . 5 . 1210 . 1 1 5 CYS CA C 3.565 -1.545 0.231 . . . 1.0 . . . . . . . . . . . . A . 5 CYS CA . . . . . . . . . c30226_5ug5 1 . 5 . 1211 . 1 1 5 CYS CB C 3.220 -1.636 -1.251 . . . 1.0 . . . . . . . . . . . . A . 5 CYS CB . . . . . . . . . c30226_5ug5 1 . 5 . 1212 . 1 1 5 CYS H H 5.219 -2.720 -0.274 . . . 1.0 . . . . . . . . . . . . A . 5 CYS H . . . . . . . . . c30226_5ug5 1 . 5 . 1213 . 1 1 5 CYS HA H 3.749 -0.511 0.479 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HA . . . . . . . . . c30226_5ug5 1 . 5 . 1214 . 1 1 5 CYS HB2 H 3.977 -2.225 -1.749 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HB2 . . . . . . . . . c30226_5ug5 1 . 5 . 1215 . 1 1 5 CYS HB3 H 2.272 -2.125 -1.357 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HB3 . . . . . . . . . c30226_5ug5 1 . 5 . 1216 . 1 1 5 CYS N N 4.785 -2.283 0.478 . . . 1.0 . . . . . . . . . . . . A . 5 CYS N . . . . . . . . . c30226_5ug5 1 . 5 . 1217 . 1 1 5 CYS O O 1.638 -1.252 1.606 . . . 1.0 . . . . . . . . . . . . A . 5 CYS O . . . . . . . . . c30226_5ug5 1 . 5 . 1218 . 1 1 5 CYS SG S 3.131 -0.025 -2.104 . . . 1.0 . . . . . . . . . . . . A . 5 CYS SG . . . . . . . . . c30226_5ug5 1 . 5 . 1219 . 1 1 6 CYS C C 1.322 -3.643 3.455 . . . 1.0 . . . . . . . . . . . . A . 6 CYS C . . . . . . . . . c30226_5ug5 1 . 5 . 1220 . 1 1 6 CYS CA C 1.189 -3.955 1.972 . . . 1.0 . . . . . . . . . . . . A . 6 CYS CA . . . . . . . . . c30226_5ug5 1 . 5 . 1221 . 1 1 6 CYS CB C 1.124 -5.467 1.738 . . . 1.0 . . . . . . . . . . . . A . 6 CYS CB . . . . . . . . . c30226_5ug5 1 . 5 . 1222 . 1 1 6 CYS H H 2.964 -3.949 0.812 . . . 1.0 . . . . . . . . . . . . A . 6 CYS H . . . . . . . . . c30226_5ug5 1 . 5 . 1223 . 1 1 6 CYS HA H 0.268 -3.505 1.617 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HA . . . . . . . . . c30226_5ug5 1 . 5 . 1224 . 1 1 6 CYS HB2 H 1.051 -5.658 0.677 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HB2 . . . . . . . . . c30226_5ug5 1 . 5 . 1225 . 1 1 6 CYS HB3 H 2.027 -5.920 2.117 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HB3 . . . . . . . . . c30226_5ug5 1 . 5 . 1226 . 1 1 6 CYS N N 2.290 -3.364 1.219 . . . 1.0 . . . . . . . . . . . . A . 6 CYS N . . . . . . . . . c30226_5ug5 1 . 5 . 1227 . 1 1 6 CYS O O 0.323 -3.491 4.156 . . . 1.0 . . . . . . . . . . . . A . 6 CYS O . . . . . . . . . c30226_5ug5 1 . 5 . 1228 . 1 1 6 CYS SG S -0.292 -6.287 2.546 . . . 1.0 . . . . . . . . . . . . A . 6 CYS SG . . . . . . . . . c30226_5ug5 1 . 5 . 1229 . 1 1 7 SER C C 2.555 -1.616 5.420 . . . 1.0 . . . . . . . . . . . . A . 7 SER C . . . . . . . . . c30226_5ug5 1 . 5 . 1230 . 1 1 7 SER CA C 2.801 -3.104 5.290 . . . 1.0 . . . . . . . . . . . . A . 7 SER CA . . . . . . . . . c30226_5ug5 1 . 5 . 1231 . 1 1 7 SER CB C 4.248 -3.358 5.653 . . . 1.0 . . . . . . . . . . . . A . 7 SER CB . . . . . . . . . c30226_5ug5 1 . 5 . 1232 . 1 1 7 SER H H 3.318 -3.716 3.348 . . . 1.0 . . . . . . . . . . . . A . 7 SER H . . . . . . . . . c30226_5ug5 1 . 5 . 1233 . 1 1 7 SER HA H 2.154 -3.649 5.955 . . . 1.0 . . . . . . . . . . . . A . 7 SER HA . . . . . . . . . c30226_5ug5 1 . 5 . 1234 . 1 1 7 SER HB2 H 4.828 -2.487 5.366 . . . 1.0 . . . . . . . . . . . . A . 7 SER HB2 . . . . . . . . . c30226_5ug5 1 . 5 . 1235 . 1 1 7 SER HB3 H 4.324 -3.506 6.714 . . . 1.0 . . . . . . . . . . . . A . 7 SER HB3 . . . . . . . . . c30226_5ug5 1 . 5 . 1236 . 1 1 7 SER HG H 4.030 -5.127 4.820 . . . 1.0 . . . . . . . . . . . . A . 7 SER HG . . . . . . . . . c30226_5ug5 1 . 5 . 1237 . 1 1 7 SER N N 2.553 -3.522 3.927 . . . 1.0 . . . . . . . . . . . . A . 7 SER N . . . . . . . . . c30226_5ug5 1 . 5 . 1238 . 1 1 7 SER O O 2.242 -1.111 6.499 . . . 1.0 . . . . . . . . . . . . A . 7 SER O . . . . . . . . . c30226_5ug5 1 . 5 . 1239 . 1 1 7 SER OG O 4.755 -4.510 4.993 . . . 1.0 . . . . . . . . . . . . A . 7 SER OG . . . . . . . . . c30226_5ug5 1 . 5 . 1240 . 1 1 8 ASN C C 1.371 1.125 4.152 . . . 1.0 . . . . . . . . . . . . A . 8 ASN C . . . . . . . . . c30226_5ug5 1 . 5 . 1241 . 1 1 8 ASN CA C 2.761 0.522 4.329 . . . 1.0 . . . . . . . . . . . . A . 8 ASN CA . . . . . . . . . c30226_5ug5 1 . 5 . 1242 . 1 1 8 ASN CB C 3.701 1.030 3.232 . . . 1.0 . . . . . . . . . . . . A . 8 ASN CB . . . . . . . . . c30226_5ug5 1 . 5 . 1243 . 1 1 8 ASN CG C 3.823 2.544 3.218 . . . 1.0 . . . . . . . . . . . . A . 8 ASN CG . . . . . . . . . c30226_5ug5 1 . 5 . 1244 . 1 1 8 ASN H H 2.745 -1.388 3.442 . . . 1.0 . . . . . . . . . . . . A . 8 ASN H . . . . . . . . . c30226_5ug5 1 . 5 . 1245 . 1 1 8 ASN HA H 3.162 0.798 5.291 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HA . . . . . . . . . c30226_5ug5 1 . 5 . 1246 . 1 1 8 ASN HB2 H 4.684 0.610 3.386 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HB2 . . . . . . . . . c30226_5ug5 1 . 5 . 1247 . 1 1 8 ASN HB3 H 3.322 0.707 2.273 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HB3 . . . . . . . . . c30226_5ug5 1 . 5 . 1248 . 1 1 8 ASN HD21 H 5.278 2.477 4.566 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HD21 . . . . . . . . . c30226_5ug5 1 . 5 . 1249 . 1 1 8 ASN HD22 H 4.823 4.056 4.024 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HD22 . . . . . . . . . c30226_5ug5 1 . 5 . 1250 . 1 1 8 ASN N N 2.701 -0.918 4.307 . . . 1.0 . . . . . . . . . . . . A . 8 ASN N . . . . . . . . . c30226_5ug5 1 . 5 . 1251 . 1 1 8 ASN ND2 N 4.732 3.079 4.014 . . . 1.0 . . . . . . . . . . . . A . 8 ASN ND2 . . . . . . . . . c30226_5ug5 1 . 5 . 1252 . 1 1 8 ASN O O 0.755 0.997 3.090 . . . 1.0 . . . . . . . . . . . . A . 8 ASN O . . . . . . . . . c30226_5ug5 1 . 5 . 1253 . 1 1 8 ASN OD1 O 3.104 3.227 2.497 . . . 1.0 . . . . . . . . . . . . A . 8 ASN OD1 . . . . . . . . . c30226_5ug5 1 . 5 . 1254 . 1 1 9 PRO C C -0.669 3.433 4.119 . . . 1.0 . . . . . . . . . . . . A . 9 PRO C . . . . . . . . . c30226_5ug5 1 . 5 . 1255 . 1 1 9 PRO CA C -0.482 2.385 5.196 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CA . . . . . . . . . c30226_5ug5 1 . 5 . 1256 . 1 1 9 PRO CB C -0.555 3.037 6.575 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CB . . . . . . . . . c30226_5ug5 1 . 5 . 1257 . 1 1 9 PRO CD C 1.576 2.111 6.442 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CD . . . . . . . . . c30226_5ug5 1 . 5 . 1258 . 1 1 9 PRO CG C 0.845 3.309 6.937 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CG . . . . . . . . . c30226_5ug5 1 . 5 . 1259 . 1 1 9 PRO HA H -1.245 1.624 5.106 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HA . . . . . . . . . c30226_5ug5 1 . 5 . 1260 . 1 1 9 PRO HB2 H -1.145 3.937 6.538 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HB2 . . . . . . . . . c30226_5ug5 1 . 5 . 1261 . 1 1 9 PRO HB3 H -0.971 2.350 7.252 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HB3 . . . . . . . . . c30226_5ug5 1 . 5 . 1262 . 1 1 9 PRO HD2 H 2.593 2.354 6.262 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HD2 . . . . . . . . . c30226_5ug5 1 . 5 . 1263 . 1 1 9 PRO HD3 H 1.492 1.292 7.140 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HD3 . . . . . . . . . c30226_5ug5 1 . 5 . 1264 . 1 1 9 PRO HG2 H 1.193 4.206 6.447 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HG2 . . . . . . . . . c30226_5ug5 1 . 5 . 1265 . 1 1 9 PRO HG3 H 0.937 3.392 8.007 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HG3 . . . . . . . . . c30226_5ug5 1 . 5 . 1266 . 1 1 9 PRO N N 0.867 1.810 5.187 . . . 1.0 . . . . . . . . . . . . A . 9 PRO N . . . . . . . . . c30226_5ug5 1 . 5 . 1267 . 1 1 9 PRO O O -1.714 3.526 3.492 . . . 1.0 . . . . . . . . . . . . A . 9 PRO O . . . . . . . . . c30226_5ug5 1 . 5 . 1268 . 1 1 10 ALA C C 0.235 4.710 1.498 . . . 1.0 . . . . . . . . . . . . A . 10 ALA C . . . . . . . . . c30226_5ug5 1 . 5 . 1269 . 1 1 10 ALA CA C 0.378 5.269 2.919 . . . 1.0 . . . . . . . . . . . . A . 10 ALA CA . . . . . . . . . c30226_5ug5 1 . 5 . 1270 . 1 1 10 ALA CB C 1.650 6.092 3.033 . . . 1.0 . . . . . . . . . . . . A . 10 ALA CB . . . . . . . . . c30226_5ug5 1 . 5 . 1271 . 1 1 10 ALA H H 1.134 4.108 4.531 . . . 1.0 . . . . . . . . . . . . A . 10 ALA H . . . . . . . . . c30226_5ug5 1 . 5 . 1272 . 1 1 10 ALA HA H -0.457 5.923 3.114 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HA . . . . . . . . . c30226_5ug5 1 . 5 . 1273 . 1 1 10 ALA HB1 H 1.636 6.884 2.299 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HB1 . . . . . . . . . c30226_5ug5 1 . 5 . 1274 . 1 1 10 ALA HB2 H 2.507 5.457 2.859 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HB2 . . . . . . . . . c30226_5ug5 1 . 5 . 1275 . 1 1 10 ALA HB3 H 1.713 6.520 4.021 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HB3 . . . . . . . . . c30226_5ug5 1 . 5 . 1276 . 1 1 10 ALA N N 0.363 4.219 3.934 . . . 1.0 . . . . . . . . . . . . A . 10 ALA N . . . . . . . . . c30226_5ug5 1 . 5 . 1277 . 1 1 10 ALA O O -0.191 5.421 0.590 . . . 1.0 . . . . . . . . . . . . A . 10 ALA O . . . . . . . . . c30226_5ug5 1 . 5 . 1278 . 1 1 11 CYS C C -0.859 2.270 -0.130 . . . 1.0 . . . . . . . . . . . . A . 11 CYS C . . . . . . . . . c30226_5ug5 1 . 5 . 1279 . 1 1 11 CYS CA C 0.509 2.850 -0.021 . . . 1.0 . . . . . . . . . . . . A . 11 CYS CA . . . . . . . . . c30226_5ug5 1 . 5 . 1280 . 1 1 11 CYS CB C 1.573 1.763 -0.203 . . . 1.0 . . . . . . . . . . . . A . 11 CYS CB . . . . . . . . . c30226_5ug5 1 . 5 . 1281 . 1 1 11 CYS H H 0.728 2.847 2.068 . . . 1.0 . . . . . . . . . . . . A . 11 CYS H . . . . . . . . . c30226_5ug5 1 . 5 . 1282 . 1 1 11 CYS HA H 0.639 3.628 -0.759 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HA . . . . . . . . . c30226_5ug5 1 . 5 . 1283 . 1 1 11 CYS HB2 H 2.538 2.229 -0.327 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HB2 . . . . . . . . . c30226_5ug5 1 . 5 . 1284 . 1 1 11 CYS HB3 H 1.591 1.137 0.678 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HB3 . . . . . . . . . c30226_5ug5 1 . 5 . 1285 . 1 1 11 CYS N N 0.579 3.440 1.299 . . . 1.0 . . . . . . . . . . . . A . 11 CYS N . . . . . . . . . c30226_5ug5 1 . 5 . 1286 . 1 1 11 CYS O O -1.606 2.476 -1.088 . . . 1.0 . . . . . . . . . . . . A . 11 CYS O . . . . . . . . . c30226_5ug5 1 . 5 . 1287 . 1 1 11 CYS SG S 1.287 0.684 -1.644 . . . 1.0 . . . . . . . . . . . . A . 11 CYS SG . . . . . . . . . c30226_5ug5 1 . 5 . 1288 . 1 1 12 ARG C C -3.563 2.041 1.064 . . . 1.0 . . . . . . . . . . . . A . 12 ARG C . . . . . . . . . c30226_5ug5 1 . 5 . 1289 . 1 1 12 ARG CA C -2.456 0.998 1.159 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CA . . . . . . . . . c30226_5ug5 1 . 5 . 1290 . 1 1 12 ARG CB C -2.435 0.374 2.526 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CB . . . . . . . . . c30226_5ug5 1 . 5 . 1291 . 1 1 12 ARG CD C -1.310 -1.811 1.934 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CD . . . . . . . . . c30226_5ug5 1 . 5 . 1292 . 1 1 12 ARG CG C -2.541 -1.128 2.504 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CG . . . . . . . . . c30226_5ug5 1 . 5 . 1293 . 1 1 12 ARG CZ C -0.814 -2.327 -0.435 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CZ . . . . . . . . . c30226_5ug5 1 . 5 . 1294 . 1 1 12 ARG H H -0.450 1.330 1.576 . . . 1.0 . . . . . . . . . . . . A . 12 ARG H . . . . . . . . . c30226_5ug5 1 . 5 . 1295 . 1 1 12 ARG HA H -2.619 0.241 0.433 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HA . . . . . . . . . c30226_5ug5 1 . 5 . 1296 . 1 1 12 ARG HB2 H -1.505 0.637 3.012 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HB2 . . . . . . . . . c30226_5ug5 1 . 5 . 1297 . 1 1 12 ARG HB3 H -3.246 0.774 3.097 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HB3 . . . . . . . . . c30226_5ug5 1 . 5 . 1298 . 1 1 12 ARG HD2 H -0.463 -1.544 2.550 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HD2 . . . . . . . . . c30226_5ug5 1 . 5 . 1299 . 1 1 12 ARG HD3 H -1.462 -2.879 1.988 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HD3 . . . . . . . . . c30226_5ug5 1 . 5 . 1300 . 1 1 12 ARG HE H -0.847 -0.495 0.362 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HE . . . . . . . . . c30226_5ug5 1 . 5 . 1301 . 1 1 12 ARG HG2 H -2.661 -1.462 3.508 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HG2 . . . . . . . . . c30226_5ug5 1 . 5 . 1302 . 1 1 12 ARG HG3 H -3.397 -1.402 1.919 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HG3 . . . . . . . . . c30226_5ug5 1 . 5 . 1303 . 1 1 12 ARG HH11 H -1.513 -3.913 0.612 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH11 . . . . . . . . . c30226_5ug5 1 . 5 . 1304 . 1 1 12 ARG HH12 H -0.965 -4.263 -0.996 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH12 . . . . . . . . . c30226_5ug5 1 . 5 . 1305 . 1 1 12 ARG HH21 H -0.131 -0.962 -1.770 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH21 . . . . . . . . . c30226_5ug5 1 . 5 . 1306 . 1 1 12 ARG HH22 H -0.189 -2.598 -2.342 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH22 . . . . . . . . . c30226_5ug5 1 . 5 . 1307 . 1 1 12 ARG N N -1.163 1.542 0.922 . . . 1.0 . . . . . . . . . . . . A . 12 ARG N . . . . . . . . . c30226_5ug5 1 . 5 . 1308 . 1 1 12 ARG NE N -1.000 -1.445 0.547 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NE . . . . . . . . . c30226_5ug5 1 . 5 . 1309 . 1 1 12 ARG NH1 N -1.126 -3.601 -0.261 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NH1 . . . . . . . . . c30226_5ug5 1 . 5 . 1310 . 1 1 12 ARG NH2 N -0.346 -1.928 -1.611 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NH2 . . . . . . . . . c30226_5ug5 1 . 5 . 1311 . 1 1 12 ARG O O -4.710 1.712 0.773 . . . 1.0 . . . . . . . . . . . . A . 12 ARG O . . . . . . . . . c30226_5ug5 1 . 5 . 1312 . 1 1 13 TYR C C -4.916 4.397 -0.083 . . . 1.0 . . . . . . . . . . . . A . 13 TYR C . . . . . . . . . c30226_5ug5 1 . 5 . 1313 . 1 1 13 TYR CA C -4.118 4.408 1.222 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CA . . . . . . . . . c30226_5ug5 1 . 5 . 1314 . 1 1 13 TYR CB C -3.322 5.699 1.349 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CB . . . . . . . . . c30226_5ug5 1 . 5 . 1315 . 1 1 13 TYR CD1 C -5.093 7.262 2.166 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CD1 . . . . . . . . . c30226_5ug5 1 . 5 . 1316 . 1 1 13 TYR CD2 C -3.972 7.765 0.143 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CD2 . . . . . . . . . c30226_5ug5 1 . 5 . 1317 . 1 1 13 TYR CE1 C -5.857 8.403 2.035 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CE1 . . . . . . . . . c30226_5ug5 1 . 5 . 1318 . 1 1 13 TYR CE2 C -4.720 8.905 -0.002 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CE2 . . . . . . . . . c30226_5ug5 1 . 5 . 1319 . 1 1 13 TYR CG C -4.150 6.933 1.220 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CG . . . . . . . . . c30226_5ug5 1 . 5 . 1320 . 1 1 13 TYR CZ C -5.665 9.225 0.945 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CZ . . . . . . . . . c30226_5ug5 1 . 5 . 1321 . 1 1 13 TYR H H -2.296 3.458 1.633 . . . 1.0 . . . . . . . . . . . . A . 13 TYR H . . . . . . . . . c30226_5ug5 1 . 5 . 1322 . 1 1 13 TYR HA H -4.803 4.350 2.045 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HA . . . . . . . . . c30226_5ug5 1 . 5 . 1323 . 1 1 13 TYR HB2 H -2.832 5.725 2.309 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HB2 . . . . . . . . . c30226_5ug5 1 . 5 . 1324 . 1 1 13 TYR HB3 H -2.583 5.728 0.570 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HB3 . . . . . . . . . c30226_5ug5 1 . 5 . 1325 . 1 1 13 TYR HD1 H -5.231 6.607 3.012 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HD1 . . . . . . . . . c30226_5ug5 1 . 5 . 1326 . 1 1 13 TYR HD2 H -3.232 7.506 -0.596 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HD2 . . . . . . . . . c30226_5ug5 1 . 5 . 1327 . 1 1 13 TYR HE1 H -6.590 8.647 2.779 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HE1 . . . . . . . . . c30226_5ug5 1 . 5 . 1328 . 1 1 13 TYR HE2 H -4.562 9.538 -0.851 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HE2 . . . . . . . . . c30226_5ug5 1 . 5 . 1329 . 1 1 13 TYR HH H -6.432 10.850 1.634 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HH . . . . . . . . . c30226_5ug5 1 . 5 . 1330 . 1 1 13 TYR N N -3.208 3.286 1.322 . . . 1.0 . . . . . . . . . . . . A . 13 TYR N . . . . . . . . . c30226_5ug5 1 . 5 . 1331 . 1 1 13 TYR O O -6.113 4.683 -0.083 . . . 1.0 . . . . . . . . . . . . A . 13 TYR O . . . . . . . . . c30226_5ug5 1 . 5 . 1332 . 1 1 13 TYR OH O -6.427 10.364 0.799 . . . 1.0 . . . . . . . . . . . . A . 13 TYR OH . . . . . . . . . c30226_5ug5 1 . 5 . 1333 . 1 1 14 ASN C C -5.004 2.582 -2.957 . . . 1.0 . . . . . . . . . . . . A . 14 ASN C . . . . . . . . . c30226_5ug5 1 . 5 . 1334 . 1 1 14 ASN CA C -4.957 4.017 -2.473 . . . 1.0 . . . . . . . . . . . . A . 14 ASN CA . . . . . . . . . c30226_5ug5 1 . 5 . 1335 . 1 1 14 ASN CB C -4.270 4.923 -3.503 . . . 1.0 . . . . . . . . . . . . A . 14 ASN CB . . . . . . . . . c30226_5ug5 1 . 5 . 1336 . 1 1 14 ASN CG C -2.845 4.509 -3.812 . . . 1.0 . . . . . . . . . . . . A . 14 ASN CG . . . . . . . . . c30226_5ug5 1 . 5 . 1337 . 1 1 14 ASN H H -3.317 3.781 -1.142 . . . 1.0 . . . . . . . . . . . . A . 14 ASN H . . . . . . . . . c30226_5ug5 1 . 5 . 1338 . 1 1 14 ASN HA H -5.968 4.362 -2.315 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HA . . . . . . . . . c30226_5ug5 1 . 5 . 1339 . 1 1 14 ASN HB2 H -4.835 4.898 -4.420 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HB2 . . . . . . . . . c30226_5ug5 1 . 5 . 1340 . 1 1 14 ASN HB3 H -4.256 5.936 -3.126 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HB3 . . . . . . . . . c30226_5ug5 1 . 5 . 1341 . 1 1 14 ASN HD21 H -3.460 3.429 -5.361 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HD21 . . . . . . . . . c30226_5ug5 1 . 5 . 1342 . 1 1 14 ASN HD22 H -1.755 3.427 -5.069 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HD22 . . . . . . . . . c30226_5ug5 1 . 5 . 1343 . 1 1 14 ASN N N -4.266 4.061 -1.190 . . . 1.0 . . . . . . . . . . . . A . 14 ASN N . . . . . . . . . c30226_5ug5 1 . 5 . 1344 . 1 1 14 ASN ND2 N -2.669 3.710 -4.850 . . . 1.0 . . . . . . . . . . . . A . 14 ASN ND2 . . . . . . . . . c30226_5ug5 1 . 5 . 1345 . 1 1 14 ASN O O -5.448 2.284 -4.064 . . . 1.0 . . . . . . . . . . . . A . 14 ASN O . . . . . . . . . c30226_5ug5 1 . 5 . 1346 . 1 1 14 ASN OD1 O -1.907 4.921 -3.132 . . . 1.0 . . . . . . . . . . . . A . 14 ASN OD1 . . . . . . . . . c30226_5ug5 1 . 5 . 1347 . 1 1 15 ASN C C -4.722 -0.597 -1.236 . . . 1.0 . . . . . . . . . . . . A . 15 ASN C . . . . . . . . . c30226_5ug5 1 . 5 . 1348 . 1 1 15 ASN CA C -4.340 0.301 -2.414 . . . 1.0 . . . . . . . . . . . . A . 15 ASN CA . . . . . . . . . c30226_5ug5 1 . 5 . 1349 . 1 1 15 ASN CB C -2.868 0.126 -2.734 . . . 1.0 . . . . . . . . . . . . A . 15 ASN CB . . . . . . . . . c30226_5ug5 1 . 5 . 1350 . 1 1 15 ASN CG C -2.495 0.559 -4.144 . . . 1.0 . . . . . . . . . . . . A . 15 ASN CG . . . . . . . . . c30226_5ug5 1 . 5 . 1351 . 1 1 15 ASN H H -4.326 2.007 -1.180 . . . 1.0 . . . . . . . . . . . . A . 15 ASN H . . . . . . . . . c30226_5ug5 1 . 5 . 1352 . 1 1 15 ASN HA H -4.935 0.054 -3.274 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HA . . . . . . . . . c30226_5ug5 1 . 5 . 1353 . 1 1 15 ASN HB2 H -2.329 0.744 -2.039 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HB2 . . . . . . . . . c30226_5ug5 1 . 5 . 1354 . 1 1 15 ASN HB3 H -2.587 -0.907 -2.596 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HB3 . . . . . . . . . c30226_5ug5 1 . 5 . 1355 . 1 1 15 ASN HD21 H -0.674 1.084 -3.541 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HD21 . . . . . . . . . c30226_5ug5 1 . 5 . 1356 . 1 1 15 ASN HD22 H -1.006 1.318 -5.221 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HD22 . . . . . . . . . c30226_5ug5 1 . 5 . 1357 . 1 1 15 ASN N N -4.548 1.700 -2.085 . . . 1.0 . . . . . . . . . . . . A . 15 ASN N . . . . . . . . . c30226_5ug5 1 . 5 . 1358 . 1 1 15 ASN ND2 N -1.270 1.033 -4.317 . . . 1.0 . . . . . . . . . . . . A . 15 ASN ND2 . . . . . . . . . c30226_5ug5 1 . 5 . 1359 . 1 1 15 ASN O O -3.881 -1.290 -0.670 . . . 1.0 . . . . . . . . . . . . A . 15 ASN O . . . . . . . . . c30226_5ug5 1 . 5 . 1360 . 1 1 15 ASN OD1 O -3.302 0.469 -5.068 . . . 1.0 . . . . . . . . . . . . A . 15 ASN OD1 . . . . . . . . . c30226_5ug5 1 . 5 . 1361 . 1 1 16 HYP C C -6.969 -2.631 0.240 . . . 1.0 . . . . . . . . . . . . A . 16 HYP C . . . . . . . . . c30226_5ug5 1 . 5 . 1362 . 1 1 16 HYP CA C -6.496 -1.196 0.395 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CA . . . . . . . . . c30226_5ug5 1 . 5 . 1363 . 1 1 16 HYP CB C -7.652 -0.260 0.683 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CB . . . . . . . . . c30226_5ug5 1 . 5 . 1364 . 1 1 16 HYP CD C -7.104 0.056 -1.596 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CD . . . . . . . . . c30226_5ug5 1 . 5 . 1365 . 1 1 16 HYP CG C -7.847 0.699 -0.480 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CG . . . . . . . . . c30226_5ug5 1 . 5 . 1366 . 1 1 16 HYP HA H -5.769 -1.138 1.172 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HA . . . . . . . . . c30226_5ug5 1 . 5 . 1367 . 1 1 16 HYP HB2 H -7.440 0.309 1.573 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HB2 . . . . . . . . . c30226_5ug5 1 . 5 . 1368 . 1 1 16 HYP HB3 H -8.551 -0.844 0.829 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HB3 . . . . . . . . . c30226_5ug5 1 . 5 . 1369 . 1 1 16 HYP HD1 H -6.251 1.825 -0.400 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HD1 . . . . . . . . . c30226_5ug5 1 . 5 . 1370 . 1 1 16 HYP HD22 H -7.714 -0.664 -2.096 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HD22 . . . . . . . . . c30226_5ug5 1 . 5 . 1371 . 1 1 16 HYP HD23 H -6.729 0.795 -2.286 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HD23 . . . . . . . . . c30226_5ug5 1 . 5 . 1372 . 1 1 16 HYP HG H -8.894 0.832 -0.707 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HG . . . . . . . . . c30226_5ug5 1 . 5 . 1373 . 1 1 16 HYP N N -6.003 -0.588 -0.859 . . . 1.0 . . . . . . . . . . . . A . 16 HYP N . . . . . . . . . c30226_5ug5 1 . 5 . 1374 . 1 1 16 HYP O O -7.384 -3.278 1.202 . . . 1.0 . . . . . . . . . . . . A . 16 HYP O . . . . . . . . . c30226_5ug5 1 . 5 . 1375 . 1 1 16 HYP OD1 O -7.205 1.941 -0.220 . . . 1.0 . . . . . . . . . . . . A . 16 HYP OD1 . . . . . . . . . c30226_5ug5 1 . 5 . 1376 . 1 1 17 HIS C C -6.254 -5.006 -2.343 . . . 1.0 . . . . . . . . . . . . A . 17 HIS C . . . . . . . . . c30226_5ug5 1 . 5 . 1377 . 1 1 17 HIS CA C -7.228 -4.495 -1.283 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CA . . . . . . . . . c30226_5ug5 1 . 5 . 1378 . 1 1 17 HIS CB C -8.683 -4.616 -1.759 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CB . . . . . . . . . c30226_5ug5 1 . 5 . 1379 . 1 1 17 HIS CD2 C -9.248 -7.039 -1.021 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CD2 . . . . . . . . . c30226_5ug5 1 . 5 . 1380 . 1 1 17 HIS CE1 C -9.991 -7.793 -2.938 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CE1 . . . . . . . . . c30226_5ug5 1 . 5 . 1381 . 1 1 17 HIS CG C -9.165 -6.028 -1.916 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CG . . . . . . . . . c30226_5ug5 1 . 5 . 1382 . 1 1 17 HIS H H -6.651 -2.491 -1.691 . . . 1.0 . . . . . . . . . . . . A . 17 HIS H . . . . . . . . . c30226_5ug5 1 . 5 . 1383 . 1 1 17 HIS HA H -7.099 -5.074 -0.380 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HA . . . . . . . . . c30226_5ug5 1 . 5 . 1384 . 1 1 17 HIS HB2 H -9.329 -4.125 -1.046 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HB2 . . . . . . . . . c30226_5ug5 1 . 5 . 1385 . 1 1 17 HIS HB3 H -8.780 -4.124 -2.715 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HB3 . . . . . . . . . c30226_5ug5 1 . 5 . 1386 . 1 1 17 HIS HD1 H -9.709 -6.036 -3.955 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HD1 . . . . . . . . . c30226_5ug5 1 . 5 . 1387 . 1 1 17 HIS HD2 H -8.959 -6.999 0.018 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HD2 . . . . . . . . . c30226_5ug5 1 . 5 . 1388 . 1 1 17 HIS HE1 H -10.392 -8.443 -3.699 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HE1 . . . . . . . . . c30226_5ug5 1 . 5 . 1389 . 1 1 17 HIS HE2 H -9.812 -9.039 -1.323 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HE2 . . . . . . . . . c30226_5ug5 1 . 5 . 1390 . 1 1 17 HIS N N -6.910 -3.103 -0.974 . . . 1.0 . . . . . . . . . . . . A . 17 HIS N . . . . . . . . . c30226_5ug5 1 . 5 . 1391 . 1 1 17 HIS ND1 N -9.638 -6.533 -3.106 . . . 1.0 . . . . . . . . . . . . A . 17 HIS ND1 . . . . . . . . . c30226_5ug5 1 . 5 . 1392 . 1 1 17 HIS NE2 N -9.763 -8.125 -1.683 . . . 1.0 . . . . . . . . . . . . A . 17 HIS NE2 . . . . . . . . . c30226_5ug5 1 . 5 . 1393 . 1 1 17 HIS O O -6.596 -5.816 -3.203 . . . 1.0 . . . . . . . . . . . . A . 17 HIS O . . . . . . . . . c30226_5ug5 1 . 5 . 1394 . 1 1 18 VAL C C -3.166 -5.992 -2.918 . . . 1.0 . . . . . . . . . . . . A . 18 VAL C . . . . . . . . . c30226_5ug5 1 . 5 . 1395 . 1 1 18 VAL CA C -4.028 -4.781 -3.264 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CA . . . . . . . . . c30226_5ug5 1 . 5 . 1396 . 1 1 18 VAL CB C -3.191 -3.507 -3.455 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CB . . . . . . . . . c30226_5ug5 1 . 5 . 1397 . 1 1 18 VAL CG1 C -1.835 -3.796 -4.043 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CG1 . . . . . . . . . c30226_5ug5 1 . 5 . 1398 . 1 1 18 VAL CG2 C -3.955 -2.543 -4.335 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CG2 . . . . . . . . . c30226_5ug5 1 . 5 . 1399 . 1 1 18 VAL H H -4.774 -3.988 -1.476 . . . 1.0 . . . . . . . . . . . . A . 18 VAL H . . . . . . . . . c30226_5ug5 1 . 5 . 1400 . 1 1 18 VAL HA H -4.540 -4.982 -4.181 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HA . . . . . . . . . c30226_5ug5 1 . 5 . 1401 . 1 1 18 VAL HB H -3.054 -3.041 -2.493 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HB . . . . . . . . . c30226_5ug5 1 . 5 . 1402 . 1 1 18 VAL HG11 H -1.318 -4.486 -3.400 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG11 . . . . . . . . . c30226_5ug5 1 . 5 . 1403 . 1 1 18 VAL HG12 H -1.276 -2.876 -4.115 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG12 . . . . . . . . . c30226_5ug5 1 . 5 . 1404 . 1 1 18 VAL HG13 H -1.952 -4.230 -5.021 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG13 . . . . . . . . . c30226_5ug5 1 . 5 . 1405 . 1 1 18 VAL HG21 H -3.430 -1.597 -4.371 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG21 . . . . . . . . . c30226_5ug5 1 . 5 . 1406 . 1 1 18 VAL HG22 H -4.943 -2.391 -3.927 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG22 . . . . . . . . . c30226_5ug5 1 . 5 . 1407 . 1 1 18 VAL HG23 H -4.033 -2.949 -5.331 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG23 . . . . . . . . . c30226_5ug5 1 . 5 . 1408 . 1 1 18 VAL N N -5.025 -4.529 -2.254 . . . 1.0 . . . . . . . . . . . . A . 18 VAL N . . . . . . . . . c30226_5ug5 1 . 5 . 1409 . 1 1 18 VAL O O -2.605 -6.650 -3.796 . . . 1.0 . . . . . . . . . . . . A . 18 VAL O . . . . . . . . . c30226_5ug5 1 . 5 . 1410 . 1 1 19 CYS C C -3.391 -8.503 -0.628 . . . 1.0 . . . . . . . . . . . . A . 19 CYS C . . . . . . . . . c30226_5ug5 1 . 5 . 1411 . 1 1 19 CYS CA C -2.394 -7.501 -1.201 . . . 1.0 . . . . . . . . . . . . A . 19 CYS CA . . . . . . . . . c30226_5ug5 1 . 5 . 1412 . 1 1 19 CYS CB C -1.286 -7.170 -0.189 . . . 1.0 . . . . . . . . . . . . A . 19 CYS CB . . . . . . . . . c30226_5ug5 1 . 5 . 1413 . 1 1 19 CYS H H -3.523 -5.720 -0.986 . . . 1.0 . . . . . . . . . . . . A . 19 CYS H . . . . . . . . . c30226_5ug5 1 . 5 . 1414 . 1 1 19 CYS HA H -1.938 -7.945 -2.076 . . . 1.0 . . . . . . . . . . . . A . 19 CYS HA . . . . . . . . . c30226_5ug5 1 . 5 . 1415 . 1 1 19 CYS HB2 H -0.905 -8.091 0.228 . . . 1.0 . . . . . . . . . . . . A . 19 CYS HB2 . . . . . . . . . c30226_5ug5 1 . 5 . 1416 . 1 1 19 CYS HB3 H -0.484 -6.661 -0.703 . . . 1.0 . . . . . . . . . . . . A . 19 CYS HB3 . . . . . . . . . c30226_5ug5 1 . 5 . 1417 . 1 1 19 CYS N N -3.088 -6.301 -1.643 . . . 1.0 . . . . . . . . . . . . A . 19 CYS N . . . . . . . . . c30226_5ug5 1 . 5 . 1418 . 1 1 19 CYS O O -3.685 -8.445 0.582 . . . 1.0 . . . . . . . . . . . . A . 19 CYS O . . . . . . . . . c30226_5ug5 1 . 5 . 1419 . 1 1 19 CYS OXT O -3.912 -9.328 -1.412 . . . 1.0 . . . . . . . . . . . . A . 19 CYS OXT . . . . . . . . . c30226_5ug5 1 . 5 . 1420 . 1 1 19 CYS SG S -1.808 -6.115 1.206 . . . 1.0 . . . . . . . . . . . . A . 19 CYS SG . . . . . . . . . c30226_5ug5 1 . 6 . 1421 . 1 1 1 ILE C C 4.578 1.915 -3.302 . . . 1.0 . . . . . . . . . . . . A . 1 ILE C . . . . . . . . . c30226_5ug5 1 . 6 . 1422 . 1 1 1 ILE CA C 4.004 2.717 -4.460 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CA . . . . . . . . . c30226_5ug5 1 . 6 . 1423 . 1 1 1 ILE CB C 4.265 4.218 -4.209 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CB . . . . . . . . . c30226_5ug5 1 . 6 . 1424 . 1 1 1 ILE CD1 C 3.892 6.105 -2.535 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CD1 . . . . . . . . . c30226_5ug5 1 . 6 . 1425 . 1 1 1 ILE CG1 C 3.593 4.670 -2.907 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CG1 . . . . . . . . . c30226_5ug5 1 . 6 . 1426 . 1 1 1 ILE CG2 C 3.770 5.045 -5.387 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CG2 . . . . . . . . . c30226_5ug5 1 . 6 . 1427 . 1 1 1 ILE H1 H 2.176 2.956 -5.430 . . . 1.0 . . . . . . . . . . . . A . 1 ILE H1 . . . . . . . . . c30226_5ug5 1 . 6 . 1428 . 1 1 1 ILE H2 H 2.040 2.698 -3.765 . . . 1.0 . . . . . . . . . . . . A . 1 ILE H2 . . . . . . . . . c30226_5ug5 1 . 6 . 1429 . 1 1 1 ILE H3 H 2.422 1.411 -4.791 . . . 1.0 . . . . . . . . . . . . A . 1 ILE H3 . . . . . . . . . c30226_5ug5 1 . 6 . 1430 . 1 1 1 ILE HA H 4.514 2.431 -5.369 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HA . . . . . . . . . c30226_5ug5 1 . 6 . 1431 . 1 1 1 ILE HB H 5.332 4.364 -4.124 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HB . . . . . . . . . c30226_5ug5 1 . 6 . 1432 . 1 1 1 ILE HD11 H 3.515 6.763 -3.304 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HD11 . . . . . . . . . c30226_5ug5 1 . 6 . 1433 . 1 1 1 ILE HD12 H 4.960 6.237 -2.441 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HD12 . . . . . . . . . c30226_5ug5 1 . 6 . 1434 . 1 1 1 ILE HD13 H 3.418 6.338 -1.594 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HD13 . . . . . . . . . c30226_5ug5 1 . 6 . 1435 . 1 1 1 ILE HG12 H 2.524 4.571 -3.010 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG12 . . . . . . . . . c30226_5ug5 1 . 6 . 1436 . 1 1 1 ILE HG13 H 3.932 4.039 -2.098 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG13 . . . . . . . . . c30226_5ug5 1 . 6 . 1437 . 1 1 1 ILE HG21 H 3.960 6.091 -5.198 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG21 . . . . . . . . . c30226_5ug5 1 . 6 . 1438 . 1 1 1 ILE HG22 H 2.709 4.889 -5.515 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG22 . . . . . . . . . c30226_5ug5 1 . 6 . 1439 . 1 1 1 ILE HG23 H 4.289 4.740 -6.283 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG23 . . . . . . . . . c30226_5ug5 1 . 6 . 1440 . 1 1 1 ILE N N 2.561 2.428 -4.623 . . . 1.0 . . . . . . . . . . . . A . 1 ILE N . . . . . . . . . c30226_5ug5 1 . 6 . 1441 . 1 1 1 ILE O O 3.834 1.473 -2.427 . . . 1.0 . . . . . . . . . . . . A . 1 ILE O . . . . . . . . . c30226_5ug5 1 . 6 . 1442 . 1 1 2 ARG C C 6.327 -0.510 -2.432 . . . 1.0 . . . . . . . . . . . . A . 2 ARG C . . . . . . . . . c30226_5ug5 1 . 6 . 1443 . 1 1 2 ARG CA C 6.616 0.990 -2.291 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CA . . . . . . . . . c30226_5ug5 1 . 6 . 1444 . 1 1 2 ARG CB C 6.221 1.497 -0.912 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CB . . . . . . . . . c30226_5ug5 1 . 6 . 1445 . 1 1 2 ARG CD C 8.463 1.630 0.215 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CD . . . . . . . . . c30226_5ug5 1 . 6 . 1446 . 1 1 2 ARG CG C 7.082 0.988 0.231 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CG . . . . . . . . . c30226_5ug5 1 . 6 . 1447 . 1 1 2 ARG CZ C 9.432 3.902 0.185 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CZ . . . . . . . . . c30226_5ug5 1 . 6 . 1448 . 1 1 2 ARG H H 6.413 2.172 -3.997 . . . 1.0 . . . . . . . . . . . . A . 2 ARG H . . . . . . . . . c30226_5ug5 1 . 6 . 1449 . 1 1 2 ARG HA H 7.672 1.154 -2.437 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HA . . . . . . . . . c30226_5ug5 1 . 6 . 1450 . 1 1 2 ARG HB2 H 6.274 2.574 -0.916 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB2 . . . . . . . . . c30226_5ug5 1 . 6 . 1451 . 1 1 2 ARG HB3 H 5.206 1.201 -0.742 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB3 . . . . . . . . . c30226_5ug5 1 . 6 . 1452 . 1 1 2 ARG HD2 H 9.047 1.211 1.018 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD2 . . . . . . . . . c30226_5ug5 1 . 6 . 1453 . 1 1 2 ARG HD3 H 8.938 1.406 -0.728 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD3 . . . . . . . . . c30226_5ug5 1 . 6 . 1454 . 1 1 2 ARG HE H 7.533 3.467 0.659 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HE . . . . . . . . . c30226_5ug5 1 . 6 . 1455 . 1 1 2 ARG HG2 H 6.598 1.223 1.167 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG2 . . . . . . . . . c30226_5ug5 1 . 6 . 1456 . 1 1 2 ARG HG3 H 7.192 -0.081 0.139 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG3 . . . . . . . . . c30226_5ug5 1 . 6 . 1457 . 1 1 2 ARG HH11 H 10.724 2.435 -0.351 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH11 . . . . . . . . . c30226_5ug5 1 . 6 . 1458 . 1 1 2 ARG HH12 H 11.382 4.040 -0.347 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH12 . . . . . . . . . c30226_5ug5 1 . 6 . 1459 . 1 1 2 ARG HH21 H 8.407 5.588 0.651 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH21 . . . . . . . . . c30226_5ug5 1 . 6 . 1460 . 1 1 2 ARG HH22 H 10.068 5.827 0.211 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH22 . . . . . . . . . c30226_5ug5 1 . 6 . 1461 . 1 1 2 ARG N N 5.901 1.751 -3.301 . . . 1.0 . . . . . . . . . . . . A . 2 ARG N . . . . . . . . . c30226_5ug5 1 . 6 . 1462 . 1 1 2 ARG NE N 8.398 3.082 0.382 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NE . . . . . . . . . c30226_5ug5 1 . 6 . 1463 . 1 1 2 ARG NH1 N 10.606 3.421 -0.203 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH1 . . . . . . . . . c30226_5ug5 1 . 6 . 1464 . 1 1 2 ARG NH2 N 9.290 5.209 0.365 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH2 . . . . . . . . . c30226_5ug5 1 . 6 . 1465 . 1 1 2 ARG O O 5.203 -0.919 -2.723 . . . 1.0 . . . . . . . . . . . . A . 2 ARG O . . . . . . . . . c30226_5ug5 1 . 6 . 1466 . 1 1 3 ASP C C 6.861 -3.404 -1.030 . . . 1.0 . . . . . . . . . . . . A . 3 ASP C . . . . . . . . . c30226_5ug5 1 . 6 . 1467 . 1 1 3 ASP CA C 7.218 -2.781 -2.365 . . . 1.0 . . . . . . . . . . . . A . 3 ASP CA . . . . . . . . . c30226_5ug5 1 . 6 . 1468 . 1 1 3 ASP CB C 8.504 -3.387 -2.938 . . . 1.0 . . . . . . . . . . . . A . 3 ASP CB . . . . . . . . . c30226_5ug5 1 . 6 . 1469 . 1 1 3 ASP CG C 8.374 -4.863 -3.263 . . . 1.0 . . . . . . . . . . . . A . 3 ASP CG . . . . . . . . . c30226_5ug5 1 . 6 . 1470 . 1 1 3 ASP H H 8.215 -0.948 -1.955 . . . 1.0 . . . . . . . . . . . . A . 3 ASP H . . . . . . . . . c30226_5ug5 1 . 6 . 1471 . 1 1 3 ASP HA H 6.407 -2.956 -3.039 . . . 1.0 . . . . . . . . . . . . A . 3 ASP HA . . . . . . . . . c30226_5ug5 1 . 6 . 1472 . 1 1 3 ASP HB2 H 8.768 -2.863 -3.843 . . . 1.0 . . . . . . . . . . . . A . 3 ASP HB2 . . . . . . . . . c30226_5ug5 1 . 6 . 1473 . 1 1 3 ASP HB3 H 9.298 -3.267 -2.216 . . . 1.0 . . . . . . . . . . . . A . 3 ASP HB3 . . . . . . . . . c30226_5ug5 1 . 6 . 1474 . 1 1 3 ASP N N 7.350 -1.327 -2.220 . . . 1.0 . . . . . . . . . . . . A . 3 ASP N . . . . . . . . . c30226_5ug5 1 . 6 . 1475 . 1 1 3 ASP O O 6.862 -4.619 -0.836 . . . 1.0 . . . . . . . . . . . . A . 3 ASP O . . . . . . . . . c30226_5ug5 1 . 6 . 1476 . 1 1 3 ASP OD1 O 7.750 -5.202 -4.293 . . . 1.0 . . . . . . . . . . . . A . 3 ASP OD1 . . . . . . . . . c30226_5ug5 1 . 6 . 1477 . 1 1 3 ASP OD2 O 8.887 -5.694 -2.486 . . . 1.0 . . . . . . . . . . . . A . 3 ASP OD2 . . . . . . . . . c30226_5ug5 1 . 6 . 1478 . 1 1 4 GLU C C 4.625 -2.446 1.346 . . . 1.0 . . . . . . . . . . . . A . 4 GLU C . . . . . . . . . c30226_5ug5 1 . 6 . 1479 . 1 1 4 GLU CA C 6.068 -2.886 1.195 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CA . . . . . . . . . c30226_5ug5 1 . 6 . 1480 . 1 1 4 GLU CB C 6.912 -2.203 2.258 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CB . . . . . . . . . c30226_5ug5 1 . 6 . 1481 . 1 1 4 GLU CD C 8.378 -4.210 2.731 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CD . . . . . . . . . c30226_5ug5 1 . 6 . 1482 . 1 1 4 GLU CG C 8.331 -2.738 2.380 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CG . . . . . . . . . c30226_5ug5 1 . 6 . 1483 . 1 1 4 GLU H H 6.591 -1.592 -0.366 . . . 1.0 . . . . . . . . . . . . A . 4 GLU H . . . . . . . . . c30226_5ug5 1 . 6 . 1484 . 1 1 4 GLU HA H 6.135 -3.957 1.307 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HA . . . . . . . . . c30226_5ug5 1 . 6 . 1485 . 1 1 4 GLU HB2 H 6.968 -1.148 2.032 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HB2 . . . . . . . . . c30226_5ug5 1 . 6 . 1486 . 1 1 4 GLU HB3 H 6.415 -2.329 3.195 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HB3 . . . . . . . . . c30226_5ug5 1 . 6 . 1487 . 1 1 4 GLU HG2 H 8.837 -2.594 1.438 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HG2 . . . . . . . . . c30226_5ug5 1 . 6 . 1488 . 1 1 4 GLU HG3 H 8.846 -2.182 3.151 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HG3 . . . . . . . . . c30226_5ug5 1 . 6 . 1489 . 1 1 4 GLU N N 6.535 -2.529 -0.125 . . . 1.0 . . . . . . . . . . . . A . 4 GLU N . . . . . . . . . c30226_5ug5 1 . 6 . 1490 . 1 1 4 GLU O O 4.151 -2.195 2.444 . . . 1.0 . . . . . . . . . . . . A . 4 GLU O . . . . . . . . . c30226_5ug5 1 . 6 . 1491 . 1 1 4 GLU OE1 O 8.105 -4.556 3.899 . . . 1.0 . . . . . . . . . . . . A . 4 GLU OE1 . . . . . . . . . c30226_5ug5 1 . 6 . 1492 . 1 1 4 GLU OE2 O 8.694 -5.031 1.843 . . . 1.0 . . . . . . . . . . . . A . 4 GLU OE2 . . . . . . . . . c30226_5ug5 1 . 6 . 1493 . 1 1 5 CYS C C 1.628 -2.294 1.130 . . . 1.0 . . . . . . . . . . . . A . 5 CYS C . . . . . . . . . c30226_5ug5 1 . 6 . 1494 . 1 1 5 CYS CA C 2.626 -1.738 0.116 . . . 1.0 . . . . . . . . . . . . A . 5 CYS CA . . . . . . . . . c30226_5ug5 1 . 6 . 1495 . 1 1 5 CYS CB C 2.065 -1.905 -1.297 . . . 1.0 . . . . . . . . . . . . A . 5 CYS CB . . . . . . . . . c30226_5ug5 1 . 6 . 1496 . 1 1 5 CYS H H 4.361 -2.722 -0.592 . . . 1.0 . . . . . . . . . . . . A . 5 CYS H . . . . . . . . . c30226_5ug5 1 . 6 . 1497 . 1 1 5 CYS HA H 2.748 -0.683 0.309 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HA . . . . . . . . . c30226_5ug5 1 . 6 . 1498 . 1 1 5 CYS HB2 H 2.775 -1.511 -2.007 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HB2 . . . . . . . . . c30226_5ug5 1 . 6 . 1499 . 1 1 5 CYS HB3 H 1.909 -2.955 -1.493 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HB3 . . . . . . . . . c30226_5ug5 1 . 6 . 1500 . 1 1 5 CYS N N 3.950 -2.354 0.215 . . . 1.0 . . . . . . . . . . . . A . 5 CYS N . . . . . . . . . c30226_5ug5 1 . 6 . 1501 . 1 1 5 CYS O O 0.820 -1.546 1.675 . . . 1.0 . . . . . . . . . . . . A . 5 CYS O . . . . . . . . . c30226_5ug5 1 . 6 . 1502 . 1 1 5 CYS SG S 0.478 -1.049 -1.570 . . . 1.0 . . . . . . . . . . . . A . 5 CYS SG . . . . . . . . . c30226_5ug5 1 . 6 . 1503 . 1 1 6 CYS C C 0.994 -3.822 3.741 . . . 1.0 . . . . . . . . . . . . A . 6 CYS C . . . . . . . . . c30226_5ug5 1 . 6 . 1504 . 1 1 6 CYS CA C 0.727 -4.224 2.293 . . . 1.0 . . . . . . . . . . . . A . 6 CYS CA . . . . . . . . . c30226_5ug5 1 . 6 . 1505 . 1 1 6 CYS CB C 0.767 -5.748 2.146 . . . 1.0 . . . . . . . . . . . . A . 6 CYS CB . . . . . . . . . c30226_5ug5 1 . 6 . 1506 . 1 1 6 CYS H H 2.426 -4.126 1.026 . . . 1.0 . . . . . . . . . . . . A . 6 CYS H . . . . . . . . . c30226_5ug5 1 . 6 . 1507 . 1 1 6 CYS HA H -0.253 -3.869 2.012 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HA . . . . . . . . . c30226_5ug5 1 . 6 . 1508 . 1 1 6 CYS HB2 H 0.769 -6.002 1.096 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HB2 . . . . . . . . . c30226_5ug5 1 . 6 . 1509 . 1 1 6 CYS HB3 H 1.669 -6.124 2.604 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HB3 . . . . . . . . . c30226_5ug5 1 . 6 . 1510 . 1 1 6 CYS N N 1.697 -3.591 1.405 . . . 1.0 . . . . . . . . . . . . A . 6 CYS N . . . . . . . . . c30226_5ug5 1 . 6 . 1511 . 1 1 6 CYS O O 0.098 -3.844 4.587 . . . 1.0 . . . . . . . . . . . . A . 6 CYS O . . . . . . . . . c30226_5ug5 1 . 6 . 1512 . 1 1 6 CYS SG S -0.644 -6.600 2.922 . . . 1.0 . . . . . . . . . . . . A . 6 CYS SG . . . . . . . . . c30226_5ug5 1 . 6 . 1513 . 1 1 7 SER C C 2.454 -1.426 5.350 . . . 1.0 . . . . . . . . . . . . A . 7 SER C . . . . . . . . . c30226_5ug5 1 . 6 . 1514 . 1 1 7 SER CA C 2.595 -2.936 5.327 . . . 1.0 . . . . . . . . . . . . A . 7 SER CA . . . . . . . . . c30226_5ug5 1 . 6 . 1515 . 1 1 7 SER CB C 4.043 -3.277 5.646 . . . 1.0 . . . . . . . . . . . . A . 7 SER CB . . . . . . . . . c30226_5ug5 1 . 6 . 1516 . 1 1 7 SER H H 2.916 -3.498 3.317 . . . 1.0 . . . . . . . . . . . . A . 7 SER H . . . . . . . . . c30226_5ug5 1 . 6 . 1517 . 1 1 7 SER HA H 1.945 -3.376 6.065 . . . 1.0 . . . . . . . . . . . . A . 7 SER HA . . . . . . . . . c30226_5ug5 1 . 6 . 1518 . 1 1 7 SER HB2 H 4.321 -4.197 5.152 . . . 1.0 . . . . . . . . . . . . A . 7 SER HB2 . . . . . . . . . c30226_5ug5 1 . 6 . 1519 . 1 1 7 SER HB3 H 4.666 -2.465 5.289 . . . 1.0 . . . . . . . . . . . . A . 7 SER HB3 . . . . . . . . . c30226_5ug5 1 . 6 . 1520 . 1 1 7 SER HG H 3.847 -4.246 7.340 . . . 1.0 . . . . . . . . . . . . A . 7 SER HG . . . . . . . . . c30226_5ug5 1 . 6 . 1521 . 1 1 7 SER N N 2.228 -3.440 4.017 . . . 1.0 . . . . . . . . . . . . A . 7 SER N . . . . . . . . . c30226_5ug5 1 . 6 . 1522 . 1 1 7 SER O O 2.079 -0.837 6.361 . . . 1.0 . . . . . . . . . . . . A . 7 SER O . . . . . . . . . c30226_5ug5 1 . 6 . 1523 . 1 1 7 SER OG O 4.247 -3.420 7.044 . . . 1.0 . . . . . . . . . . . . A . 7 SER OG . . . . . . . . . c30226_5ug5 1 . 6 . 1524 . 1 1 8 ASN C C 1.561 1.326 4.111 . . . 1.0 . . . . . . . . . . . . A . 8 ASN C . . . . . . . . . c30226_5ug5 1 . 6 . 1525 . 1 1 8 ASN CA C 2.907 0.617 4.120 . . . 1.0 . . . . . . . . . . . . A . 8 ASN CA . . . . . . . . . c30226_5ug5 1 . 6 . 1526 . 1 1 8 ASN CB C 3.694 0.971 2.854 . . . 1.0 . . . . . . . . . . . . A . 8 ASN CB . . . . . . . . . c30226_5ug5 1 . 6 . 1527 . 1 1 8 ASN CG C 3.875 2.468 2.658 . . . 1.0 . . . . . . . . . . . . A . 8 ASN CG . . . . . . . . . c30226_5ug5 1 . 6 . 1528 . 1 1 8 ASN H H 2.810 -1.354 3.387 . . . 1.0 . . . . . . . . . . . . A . 8 ASN H . . . . . . . . . c30226_5ug5 1 . 6 . 1529 . 1 1 8 ASN HA H 3.475 0.922 4.984 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HA . . . . . . . . . c30226_5ug5 1 . 6 . 1530 . 1 1 8 ASN HB2 H 4.671 0.515 2.908 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HB2 . . . . . . . . . c30226_5ug5 1 . 6 . 1531 . 1 1 8 ASN HB3 H 3.165 0.579 1.999 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HB3 . . . . . . . . . c30226_5ug5 1 . 6 . 1532 . 1 1 8 ASN HD21 H 4.031 2.217 0.693 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HD21 . . . . . . . . . c30226_5ug5 1 . 6 . 1533 . 1 1 8 ASN HD22 H 4.175 3.844 1.255 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HD22 . . . . . . . . . c30226_5ug5 1 . 6 . 1534 . 1 1 8 ASN N N 2.734 -0.817 4.207 . . . 1.0 . . . . . . . . . . . . A . 8 ASN N . . . . . . . . . c30226_5ug5 1 . 6 . 1535 . 1 1 8 ASN ND2 N 4.038 2.884 1.410 . . . 1.0 . . . . . . . . . . . . A . 8 ASN ND2 . . . . . . . . . c30226_5ug5 1 . 6 . 1536 . 1 1 8 ASN O O 0.833 1.273 3.115 . . . 1.0 . . . . . . . . . . . . A . 8 ASN O . . . . . . . . . c30226_5ug5 1 . 6 . 1537 . 1 1 8 ASN OD1 O 3.880 3.242 3.614 . . . 1.0 . . . . . . . . . . . . A . 8 ASN OD1 . . . . . . . . . c30226_5ug5 1 . 6 . 1538 . 1 1 9 PRO C C -0.298 3.719 4.258 . . . 1.0 . . . . . . . . . . . . A . 9 PRO C . . . . . . . . . c30226_5ug5 1 . 6 . 1539 . 1 1 9 PRO CA C -0.056 2.708 5.369 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CA . . . . . . . . . c30226_5ug5 1 . 6 . 1540 . 1 1 9 PRO CB C 0.114 3.417 6.714 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CB . . . . . . . . . c30226_5ug5 1 . 6 . 1541 . 1 1 9 PRO CD C 2.068 2.188 6.407 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CD . . . . . . . . . c30226_5ug5 1 . 6 . 1542 . 1 1 9 PRO CG C 1.079 2.589 7.447 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CG . . . . . . . . . c30226_5ug5 1 . 6 . 1543 . 1 1 9 PRO HA H -0.882 2.016 5.420 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HA . . . . . . . . . c30226_5ug5 1 . 6 . 1544 . 1 1 9 PRO HB2 H 0.523 4.390 6.552 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HB2 . . . . . . . . . c30226_5ug5 1 . 6 . 1545 . 1 1 9 PRO HB3 H -0.832 3.481 7.229 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HB3 . . . . . . . . . c30226_5ug5 1 . 6 . 1546 . 1 1 9 PRO HD2 H 2.804 2.967 6.258 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HD2 . . . . . . . . . c30226_5ug5 1 . 6 . 1547 . 1 1 9 PRO HD3 H 2.536 1.276 6.682 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HD3 . . . . . . . . . c30226_5ug5 1 . 6 . 1548 . 1 1 9 PRO HG2 H 1.551 3.178 8.215 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HG2 . . . . . . . . . c30226_5ug5 1 . 6 . 1549 . 1 1 9 PRO HG3 H 0.593 1.722 7.865 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HG3 . . . . . . . . . c30226_5ug5 1 . 6 . 1550 . 1 1 9 PRO N N 1.223 2.015 5.212 . . . 1.0 . . . . . . . . . . . . A . 9 PRO N . . . . . . . . . c30226_5ug5 1 . 6 . 1551 . 1 1 9 PRO O O -1.435 3.954 3.850 . . . 1.0 . . . . . . . . . . . . A . 9 PRO O . . . . . . . . . c30226_5ug5 1 . 6 . 1552 . 1 1 10 ALA C C 0.314 4.678 1.365 . . . 1.0 . . . . . . . . . . . . A . 10 ALA C . . . . . . . . . c30226_5ug5 1 . 6 . 1553 . 1 1 10 ALA CA C 0.708 5.294 2.706 . . . 1.0 . . . . . . . . . . . . A . 10 ALA CA . . . . . . . . . c30226_5ug5 1 . 6 . 1554 . 1 1 10 ALA CB C 2.034 6.026 2.575 . . . 1.0 . . . . . . . . . . . . A . 10 ALA CB . . . . . . . . . c30226_5ug5 1 . 6 . 1555 . 1 1 10 ALA H H 1.665 4.047 4.122 . . . 1.0 . . . . . . . . . . . . A . 10 ALA H . . . . . . . . . c30226_5ug5 1 . 6 . 1556 . 1 1 10 ALA HA H -0.044 6.015 2.993 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HA . . . . . . . . . c30226_5ug5 1 . 6 . 1557 . 1 1 10 ALA HB1 H 2.803 5.328 2.282 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HB1 . . . . . . . . . c30226_5ug5 1 . 6 . 1558 . 1 1 10 ALA HB2 H 2.294 6.473 3.523 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HB2 . . . . . . . . . c30226_5ug5 1 . 6 . 1559 . 1 1 10 ALA HB3 H 1.945 6.799 1.826 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HB3 . . . . . . . . . c30226_5ug5 1 . 6 . 1560 . 1 1 10 ALA N N 0.785 4.295 3.760 . . . 1.0 . . . . . . . . . . . . A . 10 ALA N . . . . . . . . . c30226_5ug5 1 . 6 . 1561 . 1 1 10 ALA O O -0.252 5.360 0.514 . . . 1.0 . . . . . . . . . . . . A . 10 ALA O . . . . . . . . . c30226_5ug5 1 . 6 . 1562 . 1 1 11 CYS C C -1.040 2.251 -0.049 . . . 1.0 . . . . . . . . . . . . A . 11 CYS C . . . . . . . . . c30226_5ug5 1 . 6 . 1563 . 1 1 11 CYS CA C 0.344 2.778 -0.118 . . . 1.0 . . . . . . . . . . . . A . 11 CYS CA . . . . . . . . . c30226_5ug5 1 . 6 . 1564 . 1 1 11 CYS CB C 1.315 1.638 -0.410 . . . 1.0 . . . . . . . . . . . . A . 11 CYS CB . . . . . . . . . c30226_5ug5 1 . 6 . 1565 . 1 1 11 CYS H H 0.769 2.802 1.943 . . . 1.0 . . . . . . . . . . . . A . 11 CYS H . . . . . . . . . c30226_5ug5 1 . 6 . 1566 . 1 1 11 CYS HA H 0.411 3.535 -0.886 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HA . . . . . . . . . c30226_5ug5 1 . 6 . 1567 . 1 1 11 CYS HB2 H 2.325 2.020 -0.400 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HB2 . . . . . . . . . c30226_5ug5 1 . 6 . 1568 . 1 1 11 CYS HB3 H 1.207 0.879 0.357 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HB3 . . . . . . . . . c30226_5ug5 1 . 6 . 1569 . 1 1 11 CYS N N 0.588 3.388 1.172 . . . 1.0 . . . . . . . . . . . . A . 11 CYS N . . . . . . . . . c30226_5ug5 1 . 6 . 1570 . 1 1 11 CYS O O -1.880 2.455 -0.926 . . . 1.0 . . . . . . . . . . . . A . 11 CYS O . . . . . . . . . c30226_5ug5 1 . 6 . 1571 . 1 1 11 CYS SG S 1.030 0.847 -2.031 . . . 1.0 . . . . . . . . . . . . A . 11 CYS SG . . . . . . . . . c30226_5ug5 1 . 6 . 1572 . 1 1 12 ARG C C -3.627 2.054 1.330 . . . 1.0 . . . . . . . . . . . . A . 12 ARG C . . . . . . . . . c30226_5ug5 1 . 6 . 1573 . 1 1 12 ARG CA C -2.488 1.052 1.482 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CA . . . . . . . . . c30226_5ug5 1 . 6 . 1574 . 1 1 12 ARG CB C -2.329 0.636 2.922 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CB . . . . . . . . . c30226_5ug5 1 . 6 . 1575 . 1 1 12 ARG CD C -1.083 -1.052 4.281 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CD . . . . . . . . . c30226_5ug5 1 . 6 . 1576 . 1 1 12 ARG CG C -1.979 -0.825 3.082 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CG . . . . . . . . . c30226_5ug5 1 . 6 . 1577 . 1 1 12 ARG CZ C -1.575 -1.202 6.697 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CZ . . . . . . . . . c30226_5ug5 1 . 6 . 1578 . 1 1 12 ARG H H -0.446 1.379 1.630 . . . 1.0 . . . . . . . . . . . . A . 12 ARG H . . . . . . . . . c30226_5ug5 1 . 6 . 1579 . 1 1 12 ARG HA H -2.682 0.191 0.893 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HA . . . . . . . . . c30226_5ug5 1 . 6 . 1580 . 1 1 12 ARG HB2 H -1.536 1.224 3.365 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HB2 . . . . . . . . . c30226_5ug5 1 . 6 . 1581 . 1 1 12 ARG HB3 H -3.235 0.840 3.436 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HB3 . . . . . . . . . c30226_5ug5 1 . 6 . 1582 . 1 1 12 ARG HD2 H -0.887 -2.109 4.371 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HD2 . . . . . . . . . c30226_5ug5 1 . 6 . 1583 . 1 1 12 ARG HD3 H -0.149 -0.526 4.111 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HD3 . . . . . . . . . c30226_5ug5 1 . 6 . 1584 . 1 1 12 ARG HE H -2.188 0.271 5.490 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HE . . . . . . . . . c30226_5ug5 1 . 6 . 1585 . 1 1 12 ARG HG2 H -2.885 -1.388 3.207 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HG2 . . . . . . . . . c30226_5ug5 1 . 6 . 1586 . 1 1 12 ARG HG3 H -1.464 -1.161 2.193 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HG3 . . . . . . . . . c30226_5ug5 1 . 6 . 1587 . 1 1 12 ARG HH11 H -0.553 -2.793 5.950 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH11 . . . . . . . . . c30226_5ug5 1 . 6 . 1588 . 1 1 12 ARG HH12 H -0.871 -2.846 7.654 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH12 . . . . . . . . . c30226_5ug5 1 . 6 . 1589 . 1 1 12 ARG HH21 H -2.613 0.206 7.721 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH21 . . . . . . . . . c30226_5ug5 1 . 6 . 1590 . 1 1 12 ARG HH22 H -2.050 -1.138 8.668 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH22 . . . . . . . . . c30226_5ug5 1 . 6 . 1591 . 1 1 12 ARG N N -1.231 1.570 1.060 . . . 1.0 . . . . . . . . . . . . A . 12 ARG N . . . . . . . . . c30226_5ug5 1 . 6 . 1592 . 1 1 12 ARG NE N -1.683 -0.574 5.526 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NE . . . . . . . . . c30226_5ug5 1 . 6 . 1593 . 1 1 12 ARG NH1 N -0.948 -2.373 6.775 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NH1 . . . . . . . . . c30226_5ug5 1 . 6 . 1594 . 1 1 12 ARG NH2 N -2.121 -0.669 7.783 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NH2 . . . . . . . . . c30226_5ug5 1 . 6 . 1595 . 1 1 12 ARG O O -4.749 1.678 0.998 . . . 1.0 . . . . . . . . . . . . A . 12 ARG O . . . . . . . . . c30226_5ug5 1 . 6 . 1596 . 1 1 13 TYR C C -4.974 4.375 0.054 . . . 1.0 . . . . . . . . . . . . A . 13 TYR C . . . . . . . . . c30226_5ug5 1 . 6 . 1597 . 1 1 13 TYR CA C -4.282 4.405 1.420 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CA . . . . . . . . . c30226_5ug5 1 . 6 . 1598 . 1 1 13 TYR CB C -3.555 5.729 1.623 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CB . . . . . . . . . c30226_5ug5 1 . 6 . 1599 . 1 1 13 TYR CD1 C -5.363 7.302 2.354 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CD1 . . . . . . . . . c30226_5ug5 1 . 6 . 1600 . 1 1 13 TYR CD2 C -4.234 7.727 0.316 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CD2 . . . . . . . . . c30226_5ug5 1 . 6 . 1601 . 1 1 13 TYR CE1 C -6.137 8.429 2.168 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CE1 . . . . . . . . . c30226_5ug5 1 . 6 . 1602 . 1 1 13 TYR CE2 C -4.994 8.849 0.116 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CE2 . . . . . . . . . c30226_5ug5 1 . 6 . 1603 . 1 1 13 TYR CG C -4.408 6.940 1.429 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CG . . . . . . . . . c30226_5ug5 1 . 6 . 1604 . 1 1 13 TYR CZ C -5.946 9.203 1.045 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CZ . . . . . . . . . c30226_5ug5 1 . 6 . 1605 . 1 1 13 TYR H H -2.417 3.553 1.852 . . . 1.0 . . . . . . . . . . . . A . 13 TYR H . . . . . . . . . c30226_5ug5 1 . 6 . 1606 . 1 1 13 TYR HA H -5.023 4.298 2.188 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HA . . . . . . . . . c30226_5ug5 1 . 6 . 1607 . 1 1 13 TYR HB2 H -3.151 5.763 2.622 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HB2 . . . . . . . . . c30226_5ug5 1 . 6 . 1608 . 1 1 13 TYR HB3 H -2.750 5.792 0.914 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HB3 . . . . . . . . . c30226_5ug5 1 . 6 . 1609 . 1 1 13 TYR HD1 H -5.501 6.685 3.227 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HD1 . . . . . . . . . c30226_5ug5 1 . 6 . 1610 . 1 1 13 TYR HD2 H -3.487 7.441 -0.405 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HD2 . . . . . . . . . c30226_5ug5 1 . 6 . 1611 . 1 1 13 TYR HE1 H -6.878 8.700 2.897 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HE1 . . . . . . . . . c30226_5ug5 1 . 6 . 1612 . 1 1 13 TYR HE2 H -4.839 9.445 -0.759 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HE2 . . . . . . . . . c30226_5ug5 1 . 6 . 1613 . 1 1 13 TYR HH H -7.067 10.322 -0.047 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HH . . . . . . . . . c30226_5ug5 1 . 6 . 1614 . 1 1 13 TYR N N -3.323 3.326 1.563 . . . 1.0 . . . . . . . . . . . . A . 13 TYR N . . . . . . . . . c30226_5ug5 1 . 6 . 1615 . 1 1 13 TYR O O -6.145 4.734 -0.066 . . . 1.0 . . . . . . . . . . . . A . 13 TYR O . . . . . . . . . c30226_5ug5 1 . 6 . 1616 . 1 1 13 TYR OH O -6.709 10.332 0.850 . . . 1.0 . . . . . . . . . . . . A . 13 TYR OH . . . . . . . . . c30226_5ug5 1 . 6 . 1617 . 1 1 14 ASN C C -4.961 2.471 -2.762 . . . 1.0 . . . . . . . . . . . . A . 14 ASN C . . . . . . . . . c30226_5ug5 1 . 6 . 1618 . 1 1 14 ASN CA C -4.794 3.913 -2.320 . . . 1.0 . . . . . . . . . . . . A . 14 ASN CA . . . . . . . . . c30226_5ug5 1 . 6 . 1619 . 1 1 14 ASN CB C -3.852 4.673 -3.264 . . . 1.0 . . . . . . . . . . . . A . 14 ASN CB . . . . . . . . . c30226_5ug5 1 . 6 . 1620 . 1 1 14 ASN CG C -4.365 4.759 -4.691 . . . 1.0 . . . . . . . . . . . . A . 14 ASN CG . . . . . . . . . c30226_5ug5 1 . 6 . 1621 . 1 1 14 ASN H H -3.356 3.539 -0.809 . . . 1.0 . . . . . . . . . . . . A . 14 ASN H . . . . . . . . . c30226_5ug5 1 . 6 . 1622 . 1 1 14 ASN HA H -5.761 4.395 -2.308 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HA . . . . . . . . . c30226_5ug5 1 . 6 . 1623 . 1 1 14 ASN HB2 H -3.720 5.678 -2.892 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HB2 . . . . . . . . . c30226_5ug5 1 . 6 . 1624 . 1 1 14 ASN HB3 H -2.892 4.175 -3.277 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HB3 . . . . . . . . . c30226_5ug5 1 . 6 . 1625 . 1 1 14 ASN HD21 H -5.330 6.446 -4.273 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HD21 . . . . . . . . . c30226_5ug5 1 . 6 . 1626 . 1 1 14 ASN HD22 H -5.480 5.871 -5.896 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HD22 . . . . . . . . . c30226_5ug5 1 . 6 . 1627 . 1 1 14 ASN N N -4.256 3.928 -0.970 . . . 1.0 . . . . . . . . . . . . A . 14 ASN N . . . . . . . . . c30226_5ug5 1 . 6 . 1628 . 1 1 14 ASN ND2 N -5.134 5.795 -4.982 . . . 1.0 . . . . . . . . . . . . A . 14 ASN ND2 . . . . . . . . . c30226_5ug5 1 . 6 . 1629 . 1 1 14 ASN O O -5.483 2.170 -3.832 . . . 1.0 . . . . . . . . . . . . A . 14 ASN O . . . . . . . . . c30226_5ug5 1 . 6 . 1630 . 1 1 14 ASN OD1 O -4.061 3.906 -5.528 . . . 1.0 . . . . . . . . . . . . A . 14 ASN OD1 . . . . . . . . . c30226_5ug5 1 . 6 . 1631 . 1 1 15 ASN C C -4.827 -0.742 -1.126 . . . 1.0 . . . . . . . . . . . . A . 15 ASN C . . . . . . . . . c30226_5ug5 1 . 6 . 1632 . 1 1 15 ASN CA C -4.352 0.184 -2.235 . . . 1.0 . . . . . . . . . . . . A . 15 ASN CA . . . . . . . . . c30226_5ug5 1 . 6 . 1633 . 1 1 15 ASN CB C -2.879 -0.040 -2.484 . . . 1.0 . . . . . . . . . . . . A . 15 ASN CB . . . . . . . . . c30226_5ug5 1 . 6 . 1634 . 1 1 15 ASN CG C -2.402 0.537 -3.803 . . . 1.0 . . . . . . . . . . . . A . 15 ASN CG . . . . . . . . . c30226_5ug5 1 . 6 . 1635 . 1 1 15 ASN H H -4.348 1.866 -0.966 . . . 1.0 . . . . . . . . . . . . A . 15 ASN H . . . . . . . . . c30226_5ug5 1 . 6 . 1636 . 1 1 15 ASN HA H -4.906 -0.018 -3.132 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HA . . . . . . . . . c30226_5ug5 1 . 6 . 1637 . 1 1 15 ASN HB2 H -2.351 0.462 -1.685 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HB2 . . . . . . . . . c30226_5ug5 1 . 6 . 1638 . 1 1 15 ASN HB3 H -2.663 -1.097 -2.459 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HB3 . . . . . . . . . c30226_5ug5 1 . 6 . 1639 . 1 1 15 ASN HD21 H -1.764 2.177 -2.885 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HD21 . . . . . . . . . c30226_5ug5 1 . 6 . 1640 . 1 1 15 ASN HD22 H -1.523 2.133 -4.598 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HD22 . . . . . . . . . c30226_5ug5 1 . 6 . 1641 . 1 1 15 ASN N N -4.538 1.578 -1.885 . . . 1.0 . . . . . . . . . . . . A . 15 ASN N . . . . . . . . . c30226_5ug5 1 . 6 . 1642 . 1 1 15 ASN ND2 N -1.840 1.735 -3.760 . . . 1.0 . . . . . . . . . . . . A . 15 ASN ND2 . . . . . . . . . c30226_5ug5 1 . 6 . 1643 . 1 1 15 ASN O O -4.034 -1.435 -0.493 . . . 1.0 . . . . . . . . . . . . A . 15 ASN O . . . . . . . . . c30226_5ug5 1 . 6 . 1644 . 1 1 15 ASN OD1 O -2.520 -0.095 -4.852 . . . 1.0 . . . . . . . . . . . . A . 15 ASN OD1 . . . . . . . . . c30226_5ug5 1 . 6 . 1645 . 1 1 16 HYP C C -7.170 -2.909 -0.236 . . . 1.0 . . . . . . . . . . . . A . 16 HYP C . . . . . . . . . c30226_5ug5 1 . 6 . 1646 . 1 1 16 HYP CA C -6.737 -1.531 0.215 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CA . . . . . . . . . c30226_5ug5 1 . 6 . 1647 . 1 1 16 HYP CB C -7.919 -0.629 0.525 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CB . . . . . . . . . c30226_5ug5 1 . 6 . 1648 . 1 1 16 HYP CD C -7.152 0.015 -1.605 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CD . . . . . . . . . c30226_5ug5 1 . 6 . 1649 . 1 1 16 HYP CG C -7.954 0.525 -0.463 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CG . . . . . . . . . c30226_5ug5 1 . 6 . 1650 . 1 1 16 HYP HA H -6.088 -1.609 1.058 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HA . . . . . . . . . c30226_5ug5 1 . 6 . 1651 . 1 1 16 HYP HB2 H -7.818 -0.233 1.523 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HB2 . . . . . . . . . c30226_5ug5 1 . 6 . 1652 . 1 1 16 HYP HB3 H -8.834 -1.202 0.450 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HB3 . . . . . . . . . c30226_5ug5 1 . 6 . 1653 . 1 1 16 HYP HD1 H -6.295 1.511 -0.120 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HD1 . . . . . . . . . c30226_5ug5 1 . 6 . 1654 . 1 1 16 HYP HD22 H -7.742 -0.611 -2.240 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HD22 . . . . . . . . . c30226_5ug5 1 . 6 . 1655 . 1 1 16 HYP HD23 H -6.706 0.826 -2.158 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HD23 . . . . . . . . . c30226_5ug5 1 . 6 . 1656 . 1 1 16 HYP HG H -8.965 0.778 -0.743 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HG . . . . . . . . . c30226_5ug5 1 . 6 . 1657 . 1 1 16 HYP N N -6.130 -0.759 -0.878 . . . 1.0 . . . . . . . . . . . . A . 16 HYP N . . . . . . . . . c30226_5ug5 1 . 6 . 1658 . 1 1 16 HYP O O -7.561 -3.762 0.558 . . . 1.0 . . . . . . . . . . . . A . 16 HYP O . . . . . . . . . c30226_5ug5 1 . 6 . 1659 . 1 1 16 HYP OD1 O -7.250 1.649 0.051 . . . 1.0 . . . . . . . . . . . . A . 16 HYP OD1 . . . . . . . . . c30226_5ug5 1 . 6 . 1660 . 1 1 17 HIS C C -6.082 -5.093 -2.513 . . . 1.0 . . . . . . . . . . . . A . 17 HIS C . . . . . . . . . c30226_5ug5 1 . 6 . 1661 . 1 1 17 HIS CA C -7.384 -4.381 -2.153 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CA . . . . . . . . . c30226_5ug5 1 . 6 . 1662 . 1 1 17 HIS CB C -8.246 -4.145 -3.403 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CB . . . . . . . . . c30226_5ug5 1 . 6 . 1663 . 1 1 17 HIS CD2 C -10.000 -6.050 -3.472 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CD2 . . . . . . . . . c30226_5ug5 1 . 6 . 1664 . 1 1 17 HIS CE1 C -9.292 -7.077 -5.269 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CE1 . . . . . . . . . c30226_5ug5 1 . 6 . 1665 . 1 1 17 HIS CG C -8.920 -5.375 -3.926 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CG . . . . . . . . . c30226_5ug5 1 . 6 . 1666 . 1 1 17 HIS H H -6.740 -2.367 -2.077 . . . 1.0 . . . . . . . . . . . . A . 17 HIS H . . . . . . . . . c30226_5ug5 1 . 6 . 1667 . 1 1 17 HIS HA H -7.934 -4.980 -1.441 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HA . . . . . . . . . c30226_5ug5 1 . 6 . 1668 . 1 1 17 HIS HB2 H -9.013 -3.423 -3.169 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HB2 . . . . . . . . . c30226_5ug5 1 . 6 . 1669 . 1 1 17 HIS HB3 H -7.619 -3.751 -4.189 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HB3 . . . . . . . . . c30226_5ug5 1 . 6 . 1670 . 1 1 17 HIS HD1 H -7.732 -5.797 -5.616 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HD1 . . . . . . . . . c30226_5ug5 1 . 6 . 1671 . 1 1 17 HIS HD2 H -10.588 -5.803 -2.599 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HD2 . . . . . . . . . c30226_5ug5 1 . 6 . 1672 . 1 1 17 HIS HE1 H -9.203 -7.781 -6.083 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HE1 . . . . . . . . . c30226_5ug5 1 . 6 . 1673 . 1 1 17 HIS HE2 H -10.771 -7.887 -4.113 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HE2 . . . . . . . . . c30226_5ug5 1 . 6 . 1674 . 1 1 17 HIS N N -7.062 -3.109 -1.526 . . . 1.0 . . . . . . . . . . . . A . 17 HIS N . . . . . . . . . c30226_5ug5 1 . 6 . 1675 . 1 1 17 HIS ND1 N -8.500 -6.045 -5.053 . . . 1.0 . . . . . . . . . . . . A . 17 HIS ND1 . . . . . . . . . c30226_5ug5 1 . 6 . 1676 . 1 1 17 HIS NE2 N -10.212 -7.106 -4.322 . . . 1.0 . . . . . . . . . . . . A . 17 HIS NE2 . . . . . . . . . c30226_5ug5 1 . 6 . 1677 . 1 1 17 HIS O O -6.070 -6.103 -3.214 . . . 1.0 . . . . . . . . . . . . A . 17 HIS O . . . . . . . . . c30226_5ug5 1 . 6 . 1678 . 1 1 18 VAL C C -3.335 -6.224 -1.346 . . . 1.0 . . . . . . . . . . . . A . 18 VAL C . . . . . . . . . c30226_5ug5 1 . 6 . 1679 . 1 1 18 VAL CA C -3.660 -5.064 -2.278 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CA . . . . . . . . . c30226_5ug5 1 . 6 . 1680 . 1 1 18 VAL CB C -2.625 -3.922 -2.147 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CB . . . . . . . . . c30226_5ug5 1 . 6 . 1681 . 1 1 18 VAL CG1 C -1.330 -4.378 -1.505 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CG1 . . . . . . . . . c30226_5ug5 1 . 6 . 1682 . 1 1 18 VAL CG2 C -2.357 -3.314 -3.510 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CG2 . . . . . . . . . c30226_5ug5 1 . 6 . 1683 . 1 1 18 VAL H H -5.066 -3.753 -1.443 . . . 1.0 . . . . . . . . . . . . A . 18 VAL H . . . . . . . . . c30226_5ug5 1 . 6 . 1684 . 1 1 18 VAL HA H -3.644 -5.420 -3.288 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HA . . . . . . . . . c30226_5ug5 1 . 6 . 1685 . 1 1 18 VAL HB H -3.054 -3.156 -1.523 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HB . . . . . . . . . c30226_5ug5 1 . 6 . 1686 . 1 1 18 VAL HG11 H -0.860 -5.124 -2.126 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG11 . . . . . . . . . c30226_5ug5 1 . 6 . 1687 . 1 1 18 VAL HG12 H -1.545 -4.796 -0.536 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG12 . . . . . . . . . c30226_5ug5 1 . 6 . 1688 . 1 1 18 VAL HG13 H -0.671 -3.529 -1.394 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG13 . . . . . . . . . c30226_5ug5 1 . 6 . 1689 . 1 1 18 VAL HG21 H -1.951 -4.067 -4.167 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG21 . . . . . . . . . c30226_5ug5 1 . 6 . 1690 . 1 1 18 VAL HG22 H -1.650 -2.503 -3.408 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG22 . . . . . . . . . c30226_5ug5 1 . 6 . 1691 . 1 1 18 VAL HG23 H -3.280 -2.937 -3.920 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG23 . . . . . . . . . c30226_5ug5 1 . 6 . 1692 . 1 1 18 VAL N N -4.984 -4.543 -2.013 . . . 1.0 . . . . . . . . . . . . A . 18 VAL N . . . . . . . . . c30226_5ug5 1 . 6 . 1693 . 1 1 18 VAL O O -2.639 -7.170 -1.717 . . . 1.0 . . . . . . . . . . . . A . 18 VAL O . . . . . . . . . c30226_5ug5 1 . 6 . 1694 . 1 1 19 CYS C C -4.810 -8.207 0.787 . . . 1.0 . . . . . . . . . . . . A . 19 CYS C . . . . . . . . . c30226_5ug5 1 . 6 . 1695 . 1 1 19 CYS CA C -3.678 -7.189 0.848 . . . 1.0 . . . . . . . . . . . . A . 19 CYS CA . . . . . . . . . c30226_5ug5 1 . 6 . 1696 . 1 1 19 CYS CB C -3.598 -6.581 2.248 . . . 1.0 . . . . . . . . . . . . A . 19 CYS CB . . . . . . . . . c30226_5ug5 1 . 6 . 1697 . 1 1 19 CYS H H -4.428 -5.376 0.060 . . . 1.0 . . . . . . . . . . . . A . 19 CYS H . . . . . . . . . c30226_5ug5 1 . 6 . 1698 . 1 1 19 CYS HA H -2.748 -7.690 0.626 . . . 1.0 . . . . . . . . . . . . A . 19 CYS HA . . . . . . . . . c30226_5ug5 1 . 6 . 1699 . 1 1 19 CYS HB2 H -4.515 -6.053 2.456 . . . 1.0 . . . . . . . . . . . . A . 19 CYS HB2 . . . . . . . . . c30226_5ug5 1 . 6 . 1700 . 1 1 19 CYS HB3 H -3.475 -7.374 2.972 . . . 1.0 . . . . . . . . . . . . A . 19 CYS HB3 . . . . . . . . . c30226_5ug5 1 . 6 . 1701 . 1 1 19 CYS N N -3.875 -6.149 -0.152 . . . 1.0 . . . . . . . . . . . . A . 19 CYS N . . . . . . . . . c30226_5ug5 1 . 6 . 1702 . 1 1 19 CYS O O -5.823 -8.015 1.493 . . . 1.0 . . . . . . . . . . . . A . 19 CYS O . . . . . . . . . c30226_5ug5 1 . 6 . 1703 . 1 1 19 CYS OXT O -4.693 -9.190 0.025 . . . 1.0 . . . . . . . . . . . . A . 19 CYS OXT . . . . . . . . . c30226_5ug5 1 . 6 . 1704 . 1 1 19 CYS SG S -2.223 -5.408 2.473 . . . 1.0 . . . . . . . . . . . . A . 19 CYS SG . . . . . . . . . c30226_5ug5 1 . 7 . 1705 . 1 1 1 ILE C C 3.221 -0.085 -5.241 . . . 1.0 . . . . . . . . . . . . A . 1 ILE C . . . . . . . . . c30226_5ug5 1 . 7 . 1706 . 1 1 1 ILE CA C 1.822 0.106 -5.810 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CA . . . . . . . . . c30226_5ug5 1 . 7 . 1707 . 1 1 1 ILE CB C 1.336 -1.204 -6.483 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CB . . . . . . . . . c30226_5ug5 1 . 7 . 1708 . 1 1 1 ILE CD1 C 3.418 -2.293 -7.515 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CD1 . . . . . . . . . c30226_5ug5 1 . 7 . 1709 . 1 1 1 ILE CG1 C 2.132 -1.526 -7.758 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CG1 . . . . . . . . . c30226_5ug5 1 . 7 . 1710 . 1 1 1 ILE CG2 C -0.146 -1.113 -6.801 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CG2 . . . . . . . . . c30226_5ug5 1 . 7 . 1711 . 1 1 1 ILE H1 H 2.501 1.110 -7.499 . . . 1.0 . . . . . . . . . . . . A . 1 ILE H1 . . . . . . . . . c30226_5ug5 1 . 7 . 1712 . 1 1 1 ILE H2 H 2.014 2.130 -6.243 . . . 1.0 . . . . . . . . . . . . A . 1 ILE H2 . . . . . . . . . c30226_5ug5 1 . 7 . 1713 . 1 1 1 ILE H3 H 0.856 1.335 -7.184 . . . 1.0 . . . . . . . . . . . . A . 1 ILE H3 . . . . . . . . . c30226_5ug5 1 . 7 . 1714 . 1 1 1 ILE HA H 1.151 0.333 -4.993 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HA . . . . . . . . . c30226_5ug5 1 . 7 . 1715 . 1 1 1 ILE HB H 1.472 -2.008 -5.774 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HB . . . . . . . . . c30226_5ug5 1 . 7 . 1716 . 1 1 1 ILE HD11 H 3.191 -3.228 -7.024 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HD11 . . . . . . . . . c30226_5ug5 1 . 7 . 1717 . 1 1 1 ILE HD12 H 4.074 -1.707 -6.888 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HD12 . . . . . . . . . c30226_5ug5 1 . 7 . 1718 . 1 1 1 ILE HD13 H 3.902 -2.492 -8.458 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HD13 . . . . . . . . . c30226_5ug5 1 . 7 . 1719 . 1 1 1 ILE HG12 H 1.517 -2.120 -8.416 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG12 . . . . . . . . . c30226_5ug5 1 . 7 . 1720 . 1 1 1 ILE HG13 H 2.388 -0.602 -8.254 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG13 . . . . . . . . . c30226_5ug5 1 . 7 . 1721 . 1 1 1 ILE HG21 H -0.704 -0.973 -5.886 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG21 . . . . . . . . . c30226_5ug5 1 . 7 . 1722 . 1 1 1 ILE HG22 H -0.468 -2.023 -7.283 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG22 . . . . . . . . . c30226_5ug5 1 . 7 . 1723 . 1 1 1 ILE HG23 H -0.322 -0.277 -7.460 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG23 . . . . . . . . . c30226_5ug5 1 . 7 . 1724 . 1 1 1 ILE N N 1.796 1.248 -6.749 . . . 1.0 . . . . . . . . . . . . A . 1 ILE N . . . . . . . . . c30226_5ug5 1 . 7 . 1725 . 1 1 1 ILE O O 4.192 0.454 -5.767 . . . 1.0 . . . . . . . . . . . . A . 1 ILE O . . . . . . . . . c30226_5ug5 1 . 7 . 1726 . 1 1 2 ARG C C 4.717 -2.605 -3.213 . . . 1.0 . . . . . . . . . . . . A . 2 ARG C . . . . . . . . . c30226_5ug5 1 . 7 . 1727 . 1 1 2 ARG CA C 4.597 -1.122 -3.527 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CA . . . . . . . . . c30226_5ug5 1 . 7 . 1728 . 1 1 2 ARG CB C 4.734 -0.311 -2.233 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CB . . . . . . . . . c30226_5ug5 1 . 7 . 1729 . 1 1 2 ARG CD C 5.998 1.618 -3.222 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CD . . . . . . . . . c30226_5ug5 1 . 7 . 1730 . 1 1 2 ARG CG C 4.769 1.191 -2.442 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CG . . . . . . . . . c30226_5ug5 1 . 7 . 1731 . 1 1 2 ARG CZ C 7.181 3.738 -3.629 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CZ . . . . . . . . . c30226_5ug5 1 . 7 . 1732 . 1 1 2 ARG H H 2.511 -1.251 -3.789 . . . 1.0 . . . . . . . . . . . . A . 2 ARG H . . . . . . . . . c30226_5ug5 1 . 7 . 1733 . 1 1 2 ARG HA H 5.375 -0.839 -4.212 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HA . . . . . . . . . c30226_5ug5 1 . 7 . 1734 . 1 1 2 ARG HB2 H 3.899 -0.541 -1.591 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB2 . . . . . . . . . c30226_5ug5 1 . 7 . 1735 . 1 1 2 ARG HB3 H 5.646 -0.604 -1.737 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB3 . . . . . . . . . c30226_5ug5 1 . 7 . 1736 . 1 1 2 ARG HD2 H 6.879 1.292 -2.690 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD2 . . . . . . . . . c30226_5ug5 1 . 7 . 1737 . 1 1 2 ARG HD3 H 5.972 1.152 -4.196 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD3 . . . . . . . . . c30226_5ug5 1 . 7 . 1738 . 1 1 2 ARG HE H 5.208 3.562 -3.326 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HE . . . . . . . . . c30226_5ug5 1 . 7 . 1739 . 1 1 2 ARG HG2 H 3.887 1.489 -2.989 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG2 . . . . . . . . . c30226_5ug5 1 . 7 . 1740 . 1 1 2 ARG HG3 H 4.778 1.678 -1.478 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG3 . . . . . . . . . c30226_5ug5 1 . 7 . 1741 . 1 1 2 ARG HH11 H 8.364 2.091 -3.640 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH11 . . . . . . . . . c30226_5ug5 1 . 7 . 1742 . 1 1 2 ARG HH12 H 9.182 3.594 -3.915 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH12 . . . . . . . . . c30226_5ug5 1 . 7 . 1743 . 1 1 2 ARG HH21 H 6.287 5.553 -3.683 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH21 . . . . . . . . . c30226_5ug5 1 . 7 . 1744 . 1 1 2 ARG HH22 H 8.002 5.564 -3.931 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH22 . . . . . . . . . c30226_5ug5 1 . 7 . 1745 . 1 1 2 ARG N N 3.318 -0.851 -4.164 . . . 1.0 . . . . . . . . . . . . A . 2 ARG N . . . . . . . . . c30226_5ug5 1 . 7 . 1746 . 1 1 2 ARG NE N 6.057 3.066 -3.393 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NE . . . . . . . . . c30226_5ug5 1 . 7 . 1747 . 1 1 2 ARG NH1 N 8.334 3.090 -3.736 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH1 . . . . . . . . . c30226_5ug5 1 . 7 . 1748 . 1 1 2 ARG NH2 N 7.154 5.057 -3.759 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH2 . . . . . . . . . c30226_5ug5 1 . 7 . 1749 . 1 1 2 ARG O O 3.711 -3.307 -3.109 . . . 1.0 . . . . . . . . . . . . A . 2 ARG O . . . . . . . . . c30226_5ug5 1 . 7 . 1750 . 1 1 3 ASP C C 6.155 -4.614 -1.191 . . . 1.0 . . . . . . . . . . . . A . 3 ASP C . . . . . . . . . c30226_5ug5 1 . 7 . 1751 . 1 1 3 ASP CA C 6.203 -4.464 -2.696 . . . 1.0 . . . . . . . . . . . . A . 3 ASP CA . . . . . . . . . c30226_5ug5 1 . 7 . 1752 . 1 1 3 ASP CB C 7.556 -4.916 -3.259 . . . 1.0 . . . . . . . . . . . . A . 3 ASP CB . . . . . . . . . c30226_5ug5 1 . 7 . 1753 . 1 1 3 ASP CG C 7.904 -6.345 -2.901 . . . 1.0 . . . . . . . . . . . . A . 3 ASP CG . . . . . . . . . c30226_5ug5 1 . 7 . 1754 . 1 1 3 ASP H H 6.711 -2.467 -3.202 . . . 1.0 . . . . . . . . . . . . A . 3 ASP H . . . . . . . . . c30226_5ug5 1 . 7 . 1755 . 1 1 3 ASP HA H 5.422 -5.048 -3.113 . . . 1.0 . . . . . . . . . . . . A . 3 ASP HA . . . . . . . . . c30226_5ug5 1 . 7 . 1756 . 1 1 3 ASP HB2 H 7.534 -4.834 -4.335 . . . 1.0 . . . . . . . . . . . . A . 3 ASP HB2 . . . . . . . . . c30226_5ug5 1 . 7 . 1757 . 1 1 3 ASP HB3 H 8.331 -4.270 -2.873 . . . 1.0 . . . . . . . . . . . . A . 3 ASP HB3 . . . . . . . . . c30226_5ug5 1 . 7 . 1758 . 1 1 3 ASP N N 5.947 -3.073 -3.060 . . . 1.0 . . . . . . . . . . . . A . 3 ASP N . . . . . . . . . c30226_5ug5 1 . 7 . 1759 . 1 1 3 ASP O O 6.201 -5.705 -0.624 . . . 1.0 . . . . . . . . . . . . A . 3 ASP O . . . . . . . . . c30226_5ug5 1 . 7 . 1760 . 1 1 3 ASP OD1 O 7.345 -7.274 -3.522 . . . 1.0 . . . . . . . . . . . . A . 3 ASP OD1 . . . . . . . . . c30226_5ug5 1 . 7 . 1761 . 1 1 3 ASP OD2 O 8.748 -6.550 -2.005 . . . 1.0 . . . . . . . . . . . . A . 3 ASP OD2 . . . . . . . . . c30226_5ug5 1 . 7 . 1762 . 1 1 4 GLU C C 4.512 -2.779 1.177 . . . 1.0 . . . . . . . . . . . . A . 4 GLU C . . . . . . . . . c30226_5ug5 1 . 7 . 1763 . 1 1 4 GLU CA C 5.887 -3.346 0.861 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CA . . . . . . . . . c30226_5ug5 1 . 7 . 1764 . 1 1 4 GLU CB C 6.949 -2.405 1.393 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CB . . . . . . . . . c30226_5ug5 1 . 7 . 1765 . 1 1 4 GLU CD C 9.404 -1.847 1.460 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CD . . . . . . . . . c30226_5ug5 1 . 7 . 1766 . 1 1 4 GLU CG C 8.367 -2.932 1.260 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CG . . . . . . . . . c30226_5ug5 1 . 7 . 1767 . 1 1 4 GLU H H 6.054 -2.672 -1.123 . . . 1.0 . . . . . . . . . . . . A . 4 GLU H . . . . . . . . . c30226_5ug5 1 . 7 . 1768 . 1 1 4 GLU HA H 5.997 -4.319 1.314 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HA . . . . . . . . . c30226_5ug5 1 . 7 . 1769 . 1 1 4 GLU HB2 H 6.884 -1.470 0.854 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HB2 . . . . . . . . . c30226_5ug5 1 . 7 . 1770 . 1 1 4 GLU HB3 H 6.743 -2.223 2.425 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HB3 . . . . . . . . . c30226_5ug5 1 . 7 . 1771 . 1 1 4 GLU HG2 H 8.524 -3.701 2.001 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HG2 . . . . . . . . . c30226_5ug5 1 . 7 . 1772 . 1 1 4 GLU HG3 H 8.490 -3.352 0.273 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HG3 . . . . . . . . . c30226_5ug5 1 . 7 . 1773 . 1 1 4 GLU N N 6.037 -3.475 -0.574 . . . 1.0 . . . . . . . . . . . . A . 4 GLU N . . . . . . . . . c30226_5ug5 1 . 7 . 1774 . 1 1 4 GLU O O 4.219 -2.402 2.307 . . . 1.0 . . . . . . . . . . . . A . 4 GLU O . . . . . . . . . c30226_5ug5 1 . 7 . 1775 . 1 1 4 GLU OE1 O 9.930 -1.713 2.584 . . . 1.0 . . . . . . . . . . . . A . 4 GLU OE1 . . . . . . . . . c30226_5ug5 1 . 7 . 1776 . 1 1 4 GLU OE2 O 9.702 -1.119 0.489 . . . 1.0 . . . . . . . . . . . . A . 4 GLU OE2 . . . . . . . . . c30226_5ug5 1 . 7 . 1777 . 1 1 5 CYS C C 1.499 -2.530 1.327 . . . 1.0 . . . . . . . . . . . . A . 5 CYS C . . . . . . . . . c30226_5ug5 1 . 7 . 1778 . 1 1 5 CYS CA C 2.399 -2.040 0.196 . . . 1.0 . . . . . . . . . . . . A . 5 CYS CA . . . . . . . . . c30226_5ug5 1 . 7 . 1779 . 1 1 5 CYS CB C 1.674 -2.196 -1.138 . . . 1.0 . . . . . . . . . . . . A . 5 CYS CB . . . . . . . . . c30226_5ug5 1 . 7 . 1780 . 1 1 5 CYS H H 3.936 -3.214 -0.660 . . . 1.0 . . . . . . . . . . . . A . 5 CYS H . . . . . . . . . c30226_5ug5 1 . 7 . 1781 . 1 1 5 CYS HA H 2.607 -0.994 0.351 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HA . . . . . . . . . c30226_5ug5 1 . 7 . 1782 . 1 1 5 CYS HB2 H 2.380 -2.050 -1.942 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HB2 . . . . . . . . . c30226_5ug5 1 . 7 . 1783 . 1 1 5 CYS HB3 H 1.268 -3.195 -1.202 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HB3 . . . . . . . . . c30226_5ug5 1 . 7 . 1784 . 1 1 5 CYS N N 3.680 -2.744 0.155 . . . 1.0 . . . . . . . . . . . . A . 5 CYS N . . . . . . . . . c30226_5ug5 1 . 7 . 1785 . 1 1 5 CYS O O 0.761 -1.746 1.913 . . . 1.0 . . . . . . . . . . . . A . 5 CYS O . . . . . . . . . c30226_5ug5 1 . 7 . 1786 . 1 1 5 CYS SG S 0.306 -1.021 -1.385 . . . 1.0 . . . . . . . . . . . . A . 5 CYS SG . . . . . . . . . c30226_5ug5 1 . 7 . 1787 . 1 1 6 CYS C C 1.094 -3.844 4.042 . . . 1.0 . . . . . . . . . . . . A . 6 CYS C . . . . . . . . . c30226_5ug5 1 . 7 . 1788 . 1 1 6 CYS CA C 0.726 -4.399 2.671 . . . 1.0 . . . . . . . . . . . . A . 6 CYS CA . . . . . . . . . c30226_5ug5 1 . 7 . 1789 . 1 1 6 CYS CB C 0.839 -5.925 2.672 . . . 1.0 . . . . . . . . . . . . A . 6 CYS CB . . . . . . . . . c30226_5ug5 1 . 7 . 1790 . 1 1 6 CYS H H 2.233 -4.380 1.183 . . . 1.0 . . . . . . . . . . . . A . 6 CYS H . . . . . . . . . c30226_5ug5 1 . 7 . 1791 . 1 1 6 CYS HA H -0.294 -4.122 2.450 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HA . . . . . . . . . c30226_5ug5 1 . 7 . 1792 . 1 1 6 CYS HB2 H 0.566 -6.301 1.697 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HB2 . . . . . . . . . c30226_5ug5 1 . 7 . 1793 . 1 1 6 CYS HB3 H 1.860 -6.202 2.886 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HB3 . . . . . . . . . c30226_5ug5 1 . 7 . 1794 . 1 1 6 CYS N N 1.577 -3.814 1.643 . . . 1.0 . . . . . . . . . . . . A . 6 CYS N . . . . . . . . . c30226_5ug5 1 . 7 . 1795 . 1 1 6 CYS O O 0.241 -3.695 4.917 . . . 1.0 . . . . . . . . . . . . A . 6 CYS O . . . . . . . . . c30226_5ug5 1 . 7 . 1796 . 1 1 6 CYS SG S -0.230 -6.746 3.900 . . . 1.0 . . . . . . . . . . . . A . 6 CYS SG . . . . . . . . . c30226_5ug5 1 . 7 . 1797 . 1 1 7 SER C C 2.630 -1.420 5.386 . . . 1.0 . . . . . . . . . . . . A . 7 SER C . . . . . . . . . c30226_5ug5 1 . 7 . 1798 . 1 1 7 SER CA C 2.845 -2.921 5.432 . . . 1.0 . . . . . . . . . . . . A . 7 SER CA . . . . . . . . . c30226_5ug5 1 . 7 . 1799 . 1 1 7 SER CB C 4.332 -3.176 5.569 . . . 1.0 . . . . . . . . . . . . A . 7 SER CB . . . . . . . . . c30226_5ug5 1 . 7 . 1800 . 1 1 7 SER H H 3.015 -3.735 3.511 . . . 1.0 . . . . . . . . . . . . A . 7 SER H . . . . . . . . . c30226_5ug5 1 . 7 . 1801 . 1 1 7 SER HA H 2.323 -3.344 6.272 . . . 1.0 . . . . . . . . . . . . A . 7 SER HA . . . . . . . . . c30226_5ug5 1 . 7 . 1802 . 1 1 7 SER HB2 H 4.867 -2.381 5.063 . . . 1.0 . . . . . . . . . . . . A . 7 SER HB2 . . . . . . . . . c30226_5ug5 1 . 7 . 1803 . 1 1 7 SER HB3 H 4.594 -3.180 6.609 . . . 1.0 . . . . . . . . . . . . A . 7 SER HB3 . . . . . . . . . c30226_5ug5 1 . 7 . 1804 . 1 1 7 SER HG H 5.655 -4.480 4.927 . . . 1.0 . . . . . . . . . . . . A . 7 SER HG . . . . . . . . . c30226_5ug5 1 . 7 . 1805 . 1 1 7 SER N N 2.367 -3.533 4.215 . . . 1.0 . . . . . . . . . . . . A . 7 SER N . . . . . . . . . c30226_5ug5 1 . 7 . 1806 . 1 1 7 SER O O 2.368 -0.785 6.404 . . . 1.0 . . . . . . . . . . . . A . 7 SER O . . . . . . . . . c30226_5ug5 1 . 7 . 1807 . 1 1 7 SER OG O 4.692 -4.430 4.999 . . . 1.0 . . . . . . . . . . . . A . 7 SER OG . . . . . . . . . c30226_5ug5 1 . 7 . 1808 . 1 1 8 ASN C C 1.465 1.217 4.024 . . . 1.0 . . . . . . . . . . . . A . 8 ASN C . . . . . . . . . c30226_5ug5 1 . 7 . 1809 . 1 1 8 ASN CA C 2.833 0.554 4.014 . . . 1.0 . . . . . . . . . . . . A . 8 ASN CA . . . . . . . . . c30226_5ug5 1 . 7 . 1810 . 1 1 8 ASN CB C 3.531 0.840 2.695 . . . 1.0 . . . . . . . . . . . . A . 8 ASN CB . . . . . . . . . c30226_5ug5 1 . 7 . 1811 . 1 1 8 ASN CG C 5.043 0.772 2.799 . . . 1.0 . . . . . . . . . . . . A . 8 ASN CG . . . . . . . . . c30226_5ug5 1 . 7 . 1812 . 1 1 8 ASN H H 2.732 -1.426 3.384 . . . 1.0 . . . . . . . . . . . . A . 8 ASN H . . . . . . . . . c30226_5ug5 1 . 7 . 1813 . 1 1 8 ASN HA H 3.436 0.931 4.821 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HA . . . . . . . . . c30226_5ug5 1 . 7 . 1814 . 1 1 8 ASN HB2 H 3.203 0.114 1.968 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HB2 . . . . . . . . . c30226_5ug5 1 . 7 . 1815 . 1 1 8 ASN HB3 H 3.250 1.811 2.364 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HB3 . . . . . . . . . c30226_5ug5 1 . 7 . 1816 . 1 1 8 ASN HD21 H 5.239 2.087 1.319 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HD21 . . . . . . . . . c30226_5ug5 1 . 7 . 1817 . 1 1 8 ASN HD22 H 6.714 1.495 2.004 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HD22 . . . . . . . . . c30226_5ug5 1 . 7 . 1818 . 1 1 8 ASN N N 2.734 -0.865 4.187 . . . 1.0 . . . . . . . . . . . . A . 8 ASN N . . . . . . . . . c30226_5ug5 1 . 7 . 1819 . 1 1 8 ASN ND2 N 5.732 1.527 1.957 . . . 1.0 . . . . . . . . . . . . A . 8 ASN ND2 . . . . . . . . . c30226_5ug5 1 . 7 . 1820 . 1 1 8 ASN O O 0.707 1.097 3.061 . . . 1.0 . . . . . . . . . . . . A . 8 ASN O . . . . . . . . . c30226_5ug5 1 . 7 . 1821 . 1 1 8 ASN OD1 O 5.589 0.049 3.631 . . . 1.0 . . . . . . . . . . . . A . 8 ASN OD1 . . . . . . . . . c30226_5ug5 1 . 7 . 1822 . 1 1 9 PRO C C -0.413 3.613 4.143 . . . 1.0 . . . . . . . . . . . . A . 9 PRO C . . . . . . . . . c30226_5ug5 1 . 7 . 1823 . 1 1 9 PRO CA C -0.150 2.624 5.257 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CA . . . . . . . . . c30226_5ug5 1 . 7 . 1824 . 1 1 9 PRO CB C 0.016 3.360 6.586 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CB . . . . . . . . . c30226_5ug5 1 . 7 . 1825 . 1 1 9 PRO CD C 2.034 2.255 6.231 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CD . . . . . . . . . c30226_5ug5 1 . 7 . 1826 . 1 1 9 PRO CG C 1.468 3.531 6.750 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CG . . . . . . . . . c30226_5ug5 1 . 7 . 1827 . 1 1 9 PRO HA H -0.962 1.916 5.323 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HA . . . . . . . . . c30226_5ug5 1 . 7 . 1828 . 1 1 9 PRO HB2 H -0.502 4.305 6.563 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HB2 . . . . . . . . . c30226_5ug5 1 . 7 . 1829 . 1 1 9 PRO HB3 H -0.362 2.753 7.358 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HB3 . . . . . . . . . c30226_5ug5 1 . 7 . 1830 . 1 1 9 PRO HD2 H 3.035 2.405 5.914 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HD2 . . . . . . . . . c30226_5ug5 1 . 7 . 1831 . 1 1 9 PRO HD3 H 1.978 1.476 6.977 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HD3 . . . . . . . . . c30226_5ug5 1 . 7 . 1832 . 1 1 9 PRO HG2 H 1.816 4.374 6.169 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HG2 . . . . . . . . . c30226_5ug5 1 . 7 . 1833 . 1 1 9 PRO HG3 H 1.708 3.653 7.792 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HG3 . . . . . . . . . c30226_5ug5 1 . 7 . 1834 . 1 1 9 PRO N N 1.147 1.961 5.094 . . . 1.0 . . . . . . . . . . . . A . 9 PRO N . . . . . . . . . c30226_5ug5 1 . 7 . 1835 . 1 1 9 PRO O O -1.518 3.723 3.622 . . . 1.0 . . . . . . . . . . . . A . 9 PRO O . . . . . . . . . c30226_5ug5 1 . 7 . 1836 . 1 1 10 ALA C C 0.318 4.665 1.363 . . . 1.0 . . . . . . . . . . . . A . 10 ALA C . . . . . . . . . c30226_5ug5 1 . 7 . 1837 . 1 1 10 ALA CA C 0.607 5.302 2.724 . . . 1.0 . . . . . . . . . . . . A . 10 ALA CA . . . . . . . . . c30226_5ug5 1 . 7 . 1838 . 1 1 10 ALA CB C 1.924 6.060 2.679 . . . 1.0 . . . . . . . . . . . . A . 10 ALA CB . . . . . . . . . c30226_5ug5 1 . 7 . 1839 . 1 1 10 ALA H H 1.459 4.199 4.320 . . . 1.0 . . . . . . . . . . . . A . 10 ALA H . . . . . . . . . c30226_5ug5 1 . 7 . 1840 . 1 1 10 ALA HA H -0.176 6.012 2.946 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HA . . . . . . . . . c30226_5ug5 1 . 7 . 1841 . 1 1 10 ALA HB1 H 2.727 5.372 2.453 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HB1 . . . . . . . . . c30226_5ug5 1 . 7 . 1842 . 1 1 10 ALA HB2 H 2.106 6.523 3.636 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HB2 . . . . . . . . . c30226_5ug5 1 . 7 . 1843 . 1 1 10 ALA HB3 H 1.877 6.820 1.914 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HB3 . . . . . . . . . c30226_5ug5 1 . 7 . 1844 . 1 1 10 ALA N N 0.636 4.321 3.800 . . . 1.0 . . . . . . . . . . . . A . 10 ALA N . . . . . . . . . c30226_5ug5 1 . 7 . 1845 . 1 1 10 ALA O O -0.166 5.337 0.455 . . . 1.0 . . . . . . . . . . . . A . 10 ALA O . . . . . . . . . c30226_5ug5 1 . 7 . 1846 . 1 1 11 CYS C C -0.972 2.209 -0.056 . . . 1.0 . . . . . . . . . . . . A . 11 CYS C . . . . . . . . . c30226_5ug5 1 . 7 . 1847 . 1 1 11 CYS CA C 0.422 2.726 -0.065 . . . 1.0 . . . . . . . . . . . . A . 11 CYS CA . . . . . . . . . c30226_5ug5 1 . 7 . 1848 . 1 1 11 CYS CB C 1.416 1.582 -0.260 . . . 1.0 . . . . . . . . . . . . A . 11 CYS CB . . . . . . . . . c30226_5ug5 1 . 7 . 1849 . 1 1 11 CYS H H 0.725 2.799 2.012 . . . 1.0 . . . . . . . . . . . . A . 11 CYS H . . . . . . . . . c30226_5ug5 1 . 7 . 1850 . 1 1 11 CYS HA H 0.535 3.464 -0.845 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HA . . . . . . . . . c30226_5ug5 1 . 7 . 1851 . 1 1 11 CYS HB2 H 2.421 1.975 -0.204 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HB2 . . . . . . . . . c30226_5ug5 1 . 7 . 1852 . 1 1 11 CYS HB3 H 1.273 0.853 0.529 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HB3 . . . . . . . . . c30226_5ug5 1 . 7 . 1853 . 1 1 11 CYS N N 0.593 3.368 1.218 . . . 1.0 . . . . . . . . . . . . A . 11 CYS N . . . . . . . . . c30226_5ug5 1 . 7 . 1854 . 1 1 11 CYS O O -1.778 2.430 -0.961 . . . 1.0 . . . . . . . . . . . . A . 11 CYS O . . . . . . . . . c30226_5ug5 1 . 7 . 1855 . 1 1 11 CYS SG S 1.246 0.715 -1.857 . . . 1.0 . . . . . . . . . . . . A . 11 CYS SG . . . . . . . . . c30226_5ug5 1 . 7 . 1856 . 1 1 12 ARG C C -3.611 2.062 1.269 . . . 1.0 . . . . . . . . . . . . A . 12 ARG C . . . . . . . . . c30226_5ug5 1 . 7 . 1857 . 1 1 12 ARG CA C -2.499 1.030 1.412 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CA . . . . . . . . . c30226_5ug5 1 . 7 . 1858 . 1 1 12 ARG CB C -2.395 0.561 2.841 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CB . . . . . . . . . c30226_5ug5 1 . 7 . 1859 . 1 1 12 ARG CD C -1.248 -1.172 4.225 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CD . . . . . . . . . c30226_5ug5 1 . 7 . 1860 . 1 1 12 ARG CG C -2.055 -0.907 2.970 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CG . . . . . . . . . c30226_5ug5 1 . 7 . 1861 . 1 1 12 ARG CZ C -1.599 -1.004 6.662 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CZ . . . . . . . . . c30226_5ug5 1 . 7 . 1862 . 1 1 12 ARG H H -0.483 1.372 1.678 . . . 1.0 . . . . . . . . . . . . A . 12 ARG H . . . . . . . . . c30226_5ug5 1 . 7 . 1863 . 1 1 12 ARG HA H -2.689 0.196 0.786 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HA . . . . . . . . . c30226_5ug5 1 . 7 . 1864 . 1 1 12 ARG HB2 H -1.616 1.129 3.331 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HB2 . . . . . . . . . c30226_5ug5 1 . 7 . 1865 . 1 1 12 ARG HB3 H -3.317 0.753 3.330 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HB3 . . . . . . . . . c30226_5ug5 1 . 7 . 1866 . 1 1 12 ARG HD2 H -1.130 -2.239 4.343 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HD2 . . . . . . . . . c30226_5ug5 1 . 7 . 1867 . 1 1 12 ARG HD3 H -0.273 -0.712 4.105 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HD3 . . . . . . . . . c30226_5ug5 1 . 7 . 1868 . 1 1 12 ARG HE H -2.574 0.065 5.283 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HE . . . . . . . . . c30226_5ug5 1 . 7 . 1869 . 1 1 12 ARG HG2 H -2.968 -1.474 3.010 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HG2 . . . . . . . . . c30226_5ug5 1 . 7 . 1870 . 1 1 12 ARG HG3 H -1.477 -1.211 2.109 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HG3 . . . . . . . . . c30226_5ug5 1 . 7 . 1871 . 1 1 12 ARG HH11 H -0.262 -2.430 6.119 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH11 . . . . . . . . . c30226_5ug5 1 . 7 . 1872 . 1 1 12 ARG HH12 H -0.498 -2.241 7.830 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH12 . . . . . . . . . c30226_5ug5 1 . 7 . 1873 . 1 1 12 ARG HH21 H -2.891 0.302 7.516 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH21 . . . . . . . . . c30226_5ug5 1 . 7 . 1874 . 1 1 12 ARG HH22 H -2.001 -0.696 8.625 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH22 . . . . . . . . . c30226_5ug5 1 . 7 . 1875 . 1 1 12 ARG N N -1.225 1.544 1.055 . . . 1.0 . . . . . . . . . . . . A . 12 ARG N . . . . . . . . . c30226_5ug5 1 . 7 . 1876 . 1 1 12 ARG NE N -1.890 -0.630 5.418 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NE . . . . . . . . . c30226_5ug5 1 . 7 . 1877 . 1 1 12 ARG NH1 N -0.717 -1.969 6.888 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NH1 . . . . . . . . . c30226_5ug5 1 . 7 . 1878 . 1 1 12 ARG NH2 N -2.211 -0.419 7.682 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NH2 . . . . . . . . . c30226_5ug5 1 . 7 . 1879 . 1 1 12 ARG O O -4.742 1.720 0.935 . . . 1.0 . . . . . . . . . . . . A . 12 ARG O . . . . . . . . . c30226_5ug5 1 . 7 . 1880 . 1 1 13 TYR C C -4.939 4.419 0.072 . . . 1.0 . . . . . . . . . . . . A . 13 TYR C . . . . . . . . . c30226_5ug5 1 . 7 . 1881 . 1 1 13 TYR CA C -4.196 4.431 1.407 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CA . . . . . . . . . c30226_5ug5 1 . 7 . 1882 . 1 1 13 TYR CB C -3.420 5.734 1.561 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CB . . . . . . . . . c30226_5ug5 1 . 7 . 1883 . 1 1 13 TYR CD1 C -4.790 7.205 3.031 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CD1 . . . . . . . . . c30226_5ug5 1 . 7 . 1884 . 1 1 13 TYR CD2 C -4.591 7.787 0.742 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CD2 . . . . . . . . . c30226_5ug5 1 . 7 . 1885 . 1 1 13 TYR CE1 C -5.590 8.297 3.248 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CE1 . . . . . . . . . c30226_5ug5 1 . 7 . 1886 . 1 1 13 TYR CE2 C -5.393 8.890 0.946 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CE2 . . . . . . . . . c30226_5ug5 1 . 7 . 1887 . 1 1 13 TYR CG C -4.281 6.935 1.781 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CG . . . . . . . . . c30226_5ug5 1 . 7 . 1888 . 1 1 13 TYR CZ C -5.858 9.174 2.169 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CZ . . . . . . . . . c30226_5ug5 1 . 7 . 1889 . 1 1 13 TYR H H -2.355 3.511 1.814 . . . 1.0 . . . . . . . . . . . . A . 13 TYR H . . . . . . . . . c30226_5ug5 1 . 7 . 1890 . 1 1 13 TYR HA H -4.908 4.357 2.206 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HA . . . . . . . . . c30226_5ug5 1 . 7 . 1891 . 1 1 13 TYR HB2 H -2.745 5.651 2.397 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HB2 . . . . . . . . . c30226_5ug5 1 . 7 . 1892 . 1 1 13 TYR HB3 H -2.856 5.908 0.664 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HB3 . . . . . . . . . c30226_5ug5 1 . 7 . 1893 . 1 1 13 TYR HD1 H -4.549 6.542 3.844 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HD1 . . . . . . . . . c30226_5ug5 1 . 7 . 1894 . 1 1 13 TYR HD2 H -4.193 7.576 -0.238 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HD2 . . . . . . . . . c30226_5ug5 1 . 7 . 1895 . 1 1 13 TYR HE1 H -5.972 8.485 4.229 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HE1 . . . . . . . . . c30226_5ug5 1 . 7 . 1896 . 1 1 13 TYR HE2 H -5.628 9.545 0.127 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HE2 . . . . . . . . . c30226_5ug5 1 . 7 . 1897 . 1 1 13 TYR HH H -7.319 10.325 1.689 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HH . . . . . . . . . c30226_5ug5 1 . 7 . 1898 . 1 1 13 TYR N N -3.269 3.320 1.518 . . . 1.0 . . . . . . . . . . . . A . 13 TYR N . . . . . . . . . c30226_5ug5 1 . 7 . 1899 . 1 1 13 TYR O O -6.111 4.786 0.005 . . . 1.0 . . . . . . . . . . . . A . 13 TYR O . . . . . . . . . c30226_5ug5 1 . 7 . 1900 . 1 1 13 TYR OH O -6.697 10.238 2.420 . . . 1.0 . . . . . . . . . . . . A . 13 TYR OH . . . . . . . . . c30226_5ug5 1 . 7 . 1901 . 1 1 14 ASN C C -5.037 2.547 -2.772 . . . 1.0 . . . . . . . . . . . . A . 14 ASN C . . . . . . . . . c30226_5ug5 1 . 7 . 1902 . 1 1 14 ASN CA C -4.865 3.978 -2.313 . . . 1.0 . . . . . . . . . . . . A . 14 ASN CA . . . . . . . . . c30226_5ug5 1 . 7 . 1903 . 1 1 14 ASN CB C -3.991 4.737 -3.316 . . . 1.0 . . . . . . . . . . . . A . 14 ASN CB . . . . . . . . . c30226_5ug5 1 . 7 . 1904 . 1 1 14 ASN CG C -3.833 6.205 -2.975 . . . 1.0 . . . . . . . . . . . . A . 14 ASN CG . . . . . . . . . c30226_5ug5 1 . 7 . 1905 . 1 1 14 ASN H H -3.356 3.598 -0.868 . . . 1.0 . . . . . . . . . . . . A . 14 ASN H . . . . . . . . . c30226_5ug5 1 . 7 . 1906 . 1 1 14 ASN HA H -5.833 4.451 -2.249 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HA . . . . . . . . . c30226_5ug5 1 . 7 . 1907 . 1 1 14 ASN HB2 H -3.009 4.287 -3.339 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HB2 . . . . . . . . . c30226_5ug5 1 . 7 . 1908 . 1 1 14 ASN HB3 H -4.437 4.661 -4.296 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HB3 . . . . . . . . . c30226_5ug5 1 . 7 . 1909 . 1 1 14 ASN HD21 H -2.151 5.830 -1.984 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HD21 . . . . . . . . . c30226_5ug5 1 . 7 . 1910 . 1 1 14 ASN HD22 H -2.647 7.486 -2.024 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HD22 . . . . . . . . . c30226_5ug5 1 . 7 . 1911 . 1 1 14 ASN N N -4.263 3.984 -0.987 . . . 1.0 . . . . . . . . . . . . A . 14 ASN N . . . . . . . . . c30226_5ug5 1 . 7 . 1912 . 1 1 14 ASN ND2 N -2.772 6.540 -2.255 . . . 1.0 . . . . . . . . . . . . A . 14 ASN ND2 . . . . . . . . . c30226_5ug5 1 . 7 . 1913 . 1 1 14 ASN O O -5.543 2.274 -3.862 . . . 1.0 . . . . . . . . . . . . A . 14 ASN O . . . . . . . . . c30226_5ug5 1 . 7 . 1914 . 1 1 14 ASN OD1 O -4.651 7.037 -3.370 . . . 1.0 . . . . . . . . . . . . A . 14 ASN OD1 . . . . . . . . . c30226_5ug5 1 . 7 . 1915 . 1 1 15 ASN C C -4.887 -0.695 -1.180 . . . 1.0 . . . . . . . . . . . . A . 15 ASN C . . . . . . . . . c30226_5ug5 1 . 7 . 1916 . 1 1 15 ASN CA C -4.429 0.251 -2.281 . . . 1.0 . . . . . . . . . . . . A . 15 ASN CA . . . . . . . . . c30226_5ug5 1 . 7 . 1917 . 1 1 15 ASN CB C -2.953 0.035 -2.532 . . . 1.0 . . . . . . . . . . . . A . 15 ASN CB . . . . . . . . . c30226_5ug5 1 . 7 . 1918 . 1 1 15 ASN CG C -2.465 0.634 -3.840 . . . 1.0 . . . . . . . . . . . . A . 15 ASN CG . . . . . . . . . c30226_5ug5 1 . 7 . 1919 . 1 1 15 ASN H H -4.433 1.913 -0.985 . . . 1.0 . . . . . . . . . . . . A . 15 ASN H . . . . . . . . . c30226_5ug5 1 . 7 . 1920 . 1 1 15 ASN HA H -4.982 0.060 -3.178 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HA . . . . . . . . . c30226_5ug5 1 . 7 . 1921 . 1 1 15 ASN HB2 H -2.426 0.522 -1.724 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HB2 . . . . . . . . . c30226_5ug5 1 . 7 . 1922 . 1 1 15 ASN HB3 H -2.736 -1.022 -2.525 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HB3 . . . . . . . . . c30226_5ug5 1 . 7 . 1923 . 1 1 15 ASN HD21 H -1.762 2.224 -2.878 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HD21 . . . . . . . . . c30226_5ug5 1 . 7 . 1924 . 1 1 15 ASN HD22 H -1.532 2.215 -4.593 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HD22 . . . . . . . . . c30226_5ug5 1 . 7 . 1925 . 1 1 15 ASN N N -4.620 1.639 -1.909 . . . 1.0 . . . . . . . . . . . . A . 15 ASN N . . . . . . . . . c30226_5ug5 1 . 7 . 1926 . 1 1 15 ASN ND2 N -1.861 1.809 -3.764 . . . 1.0 . . . . . . . . . . . . A . 15 ASN ND2 . . . . . . . . . c30226_5ug5 1 . 7 . 1927 . 1 1 15 ASN O O -4.086 -1.427 -0.598 . . . 1.0 . . . . . . . . . . . . A . 15 ASN O . . . . . . . . . c30226_5ug5 1 . 7 . 1928 . 1 1 15 ASN OD1 O -2.600 0.031 -4.902 . . . 1.0 . . . . . . . . . . . . A . 15 ASN OD1 . . . . . . . . . c30226_5ug5 1 . 7 . 1929 . 1 1 16 HYP C C -7.161 -2.873 -0.187 . . . 1.0 . . . . . . . . . . . . A . 16 HYP C . . . . . . . . . c30226_5ug5 1 . 7 . 1930 . 1 1 16 HYP CA C -6.751 -1.475 0.228 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CA . . . . . . . . . c30226_5ug5 1 . 7 . 1931 . 1 1 16 HYP CB C -7.945 -0.604 0.563 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CB . . . . . . . . . c30226_5ug5 1 . 7 . 1932 . 1 1 16 HYP CD C -7.221 0.096 -1.564 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CD . . . . . . . . . c30226_5ug5 1 . 7 . 1933 . 1 1 16 HYP CG C -8.005 0.570 -0.396 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CG . . . . . . . . . c30226_5ug5 1 . 7 . 1934 . 1 1 16 HYP HA H -6.083 -1.529 1.056 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HA . . . . . . . . . c30226_5ug5 1 . 7 . 1935 . 1 1 16 HYP HB2 H -7.849 -0.230 1.569 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HB2 . . . . . . . . . c30226_5ug5 1 . 7 . 1936 . 1 1 16 HYP HB3 H -8.851 -1.191 0.476 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HB3 . . . . . . . . . c30226_5ug5 1 . 7 . 1937 . 1 1 16 HYP HD1 H -6.370 1.618 -0.161 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HD1 . . . . . . . . . c30226_5ug5 1 . 7 . 1938 . 1 1 16 HYP HD22 H -7.820 -0.510 -2.208 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HD22 . . . . . . . . . c30226_5ug5 1 . 7 . 1939 . 1 1 16 HYP HD23 H -6.786 0.925 -2.102 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HD23 . . . . . . . . . c30226_5ug5 1 . 7 . 1940 . 1 1 16 HYP HG H -9.021 0.823 -0.650 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HG . . . . . . . . . c30226_5ug5 1 . 7 . 1941 . 1 1 16 HYP N N -6.180 -0.698 -0.883 . . . 1.0 . . . . . . . . . . . . A . 16 HYP N . . . . . . . . . c30226_5ug5 1 . 7 . 1942 . 1 1 16 HYP O O -7.522 -3.712 0.635 . . . 1.0 . . . . . . . . . . . . A . 16 HYP O . . . . . . . . . c30226_5ug5 1 . 7 . 1943 . 1 1 16 HYP OD1 O -7.301 1.684 0.137 . . . 1.0 . . . . . . . . . . . . A . 16 HYP OD1 . . . . . . . . . c30226_5ug5 1 . 7 . 1944 . 1 1 17 HIS C C -6.035 -5.059 -2.507 . . . 1.0 . . . . . . . . . . . . A . 17 HIS C . . . . . . . . . c30226_5ug5 1 . 7 . 1945 . 1 1 17 HIS CA C -7.339 -4.427 -2.043 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CA . . . . . . . . . c30226_5ug5 1 . 7 . 1946 . 1 1 17 HIS CB C -8.325 -4.355 -3.214 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CB . . . . . . . . . c30226_5ug5 1 . 7 . 1947 . 1 1 17 HIS CD2 C -10.492 -3.271 -2.287 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CD2 . . . . . . . . . c30226_5ug5 1 . 7 . 1948 . 1 1 17 HIS CE1 C -11.819 -5.003 -2.476 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CE1 . . . . . . . . . c30226_5ug5 1 . 7 . 1949 . 1 1 17 HIS CG C -9.761 -4.289 -2.799 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CG . . . . . . . . . c30226_5ug5 1 . 7 . 1950 . 1 1 17 HIS H H -6.846 -2.358 -2.061 . . . 1.0 . . . . . . . . . . . . A . 17 HIS H . . . . . . . . . c30226_5ug5 1 . 7 . 1951 . 1 1 17 HIS HA H -7.764 -5.044 -1.264 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HA . . . . . . . . . c30226_5ug5 1 . 7 . 1952 . 1 1 17 HIS HB2 H -8.112 -3.475 -3.800 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HB2 . . . . . . . . . c30226_5ug5 1 . 7 . 1953 . 1 1 17 HIS HB3 H -8.199 -5.231 -3.833 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HB3 . . . . . . . . . c30226_5ug5 1 . 7 . 1954 . 1 1 17 HIS HD1 H -10.389 -6.254 -3.246 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HD1 . . . . . . . . . c30226_5ug5 1 . 7 . 1955 . 1 1 17 HIS HD2 H -10.136 -2.274 -2.068 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HD2 . . . . . . . . . c30226_5ug5 1 . 7 . 1956 . 1 1 17 HIS HE1 H -12.693 -5.638 -2.441 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HE1 . . . . . . . . . c30226_5ug5 1 . 7 . 1957 . 1 1 17 HIS HE2 H -12.498 -3.251 -1.659 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HE2 . . . . . . . . . c30226_5ug5 1 . 7 . 1958 . 1 1 17 HIS N N -7.087 -3.106 -1.474 . . . 1.0 . . . . . . . . . . . . A . 17 HIS N . . . . . . . . . c30226_5ug5 1 . 7 . 1959 . 1 1 17 HIS ND1 N -10.622 -5.360 -2.905 . . . 1.0 . . . . . . . . . . . . A . 17 HIS ND1 . . . . . . . . . c30226_5ug5 1 . 7 . 1960 . 1 1 17 HIS NE2 N -11.766 -3.741 -2.096 . . . 1.0 . . . . . . . . . . . . A . 17 HIS NE2 . . . . . . . . . c30226_5ug5 1 . 7 . 1961 . 1 1 17 HIS O O -6.033 -6.093 -3.170 . . . 1.0 . . . . . . . . . . . . A . 17 HIS O . . . . . . . . . c30226_5ug5 1 . 7 . 1962 . 1 1 18 VAL C C -3.194 -6.073 -1.619 . . . 1.0 . . . . . . . . . . . . A . 18 VAL C . . . . . . . . . c30226_5ug5 1 . 7 . 1963 . 1 1 18 VAL CA C -3.613 -4.916 -2.515 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CA . . . . . . . . . c30226_5ug5 1 . 7 . 1964 . 1 1 18 VAL CB C -2.595 -3.761 -2.449 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CB . . . . . . . . . c30226_5ug5 1 . 7 . 1965 . 1 1 18 VAL CG1 C -1.224 -4.231 -2.015 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CG1 . . . . . . . . . c30226_5ug5 1 . 7 . 1966 . 1 1 18 VAL CG2 C -2.510 -3.071 -3.793 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CG2 . . . . . . . . . c30226_5ug5 1 . 7 . 1967 . 1 1 18 VAL H H -4.987 -3.612 -1.613 . . . 1.0 . . . . . . . . . . . . A . 18 VAL H . . . . . . . . . c30226_5ug5 1 . 7 . 1968 . 1 1 18 VAL HA H -3.664 -5.264 -3.525 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HA . . . . . . . . . c30226_5ug5 1 . 7 . 1969 . 1 1 18 VAL HB H -2.947 -3.043 -1.727 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HB . . . . . . . . . c30226_5ug5 1 . 7 . 1970 . 1 1 18 VAL HG11 H -0.564 -3.381 -1.949 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG11 . . . . . . . . . c30226_5ug5 1 . 7 . 1971 . 1 1 18 VAL HG12 H -0.839 -4.935 -2.734 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG12 . . . . . . . . . c30226_5ug5 1 . 7 . 1972 . 1 1 18 VAL HG13 H -1.303 -4.701 -1.050 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG13 . . . . . . . . . c30226_5ug5 1 . 7 . 1973 . 1 1 18 VAL HG21 H -2.226 -3.788 -4.548 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG21 . . . . . . . . . c30226_5ug5 1 . 7 . 1974 . 1 1 18 VAL HG22 H -1.773 -2.282 -3.748 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG22 . . . . . . . . . c30226_5ug5 1 . 7 . 1975 . 1 1 18 VAL HG23 H -3.473 -2.649 -4.040 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG23 . . . . . . . . . c30226_5ug5 1 . 7 . 1976 . 1 1 18 VAL N N -4.925 -4.430 -2.146 . . . 1.0 . . . . . . . . . . . . A . 18 VAL N . . . . . . . . . c30226_5ug5 1 . 7 . 1977 . 1 1 18 VAL O O -2.571 -7.038 -2.065 . . . 1.0 . . . . . . . . . . . . A . 18 VAL O . . . . . . . . . c30226_5ug5 1 . 7 . 1978 . 1 1 19 CYS C C -4.539 -7.423 1.326 . . . 1.0 . . . . . . . . . . . . A . 19 CYS C . . . . . . . . . c30226_5ug5 1 . 7 . 1979 . 1 1 19 CYS CA C -3.264 -6.995 0.617 . . . 1.0 . . . . . . . . . . . . A . 19 CYS CA . . . . . . . . . c30226_5ug5 1 . 7 . 1980 . 1 1 19 CYS CB C -2.241 -6.468 1.628 . . . 1.0 . . . . . . . . . . . . A . 19 CYS CB . . . . . . . . . c30226_5ug5 1 . 7 . 1981 . 1 1 19 CYS H H -4.102 -5.198 -0.102 . . . 1.0 . . . . . . . . . . . . A . 19 CYS H . . . . . . . . . c30226_5ug5 1 . 7 . 1982 . 1 1 19 CYS HA H -2.847 -7.845 0.098 . . . 1.0 . . . . . . . . . . . . A . 19 CYS HA . . . . . . . . . c30226_5ug5 1 . 7 . 1983 . 1 1 19 CYS HB2 H -1.394 -6.064 1.095 . . . 1.0 . . . . . . . . . . . . A . 19 CYS HB2 . . . . . . . . . c30226_5ug5 1 . 7 . 1984 . 1 1 19 CYS HB3 H -2.699 -5.684 2.214 . . . 1.0 . . . . . . . . . . . . A . 19 CYS HB3 . . . . . . . . . c30226_5ug5 1 . 7 . 1985 . 1 1 19 CYS N N -3.577 -5.976 -0.369 . . . 1.0 . . . . . . . . . . . . A . 19 CYS N . . . . . . . . . c30226_5ug5 1 . 7 . 1986 . 1 1 19 CYS O O -4.960 -8.585 1.154 . . . 1.0 . . . . . . . . . . . . A . 19 CYS O . . . . . . . . . c30226_5ug5 1 . 7 . 1987 . 1 1 19 CYS OXT O -5.141 -6.576 2.016 . . . 1.0 . . . . . . . . . . . . A . 19 CYS OXT . . . . . . . . . c30226_5ug5 1 . 7 . 1988 . 1 1 19 CYS SG S -1.613 -7.731 2.785 . . . 1.0 . . . . . . . . . . . . A . 19 CYS SG . . . . . . . . . c30226_5ug5 1 . 8 . 1989 . 1 1 1 ILE C C 6.615 1.806 -3.020 . . . 1.0 . . . . . . . . . . . . A . 1 ILE C . . . . . . . . . c30226_5ug5 1 . 8 . 1990 . 1 1 1 ILE CA C 6.045 2.647 -4.154 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CA . . . . . . . . . c30226_5ug5 1 . 8 . 1991 . 1 1 1 ILE CB C 6.332 1.968 -5.520 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CB . . . . . . . . . c30226_5ug5 1 . 8 . 1992 . 1 1 1 ILE CD1 C 8.610 0.812 -5.259 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CD1 . . . . . . . . . c30226_5ug5 1 . 8 . 1993 . 1 1 1 ILE CG1 C 7.834 1.970 -5.856 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CG1 . . . . . . . . . c30226_5ug5 1 . 8 . 1994 . 1 1 1 ILE CG2 C 5.550 2.660 -6.625 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CG2 . . . . . . . . . c30226_5ug5 1 . 8 . 1995 . 1 1 1 ILE H1 H 6.193 4.599 -4.868 . . . 1.0 . . . . . . . . . . . . A . 1 ILE H1 . . . . . . . . . c30226_5ug5 1 . 8 . 1996 . 1 1 1 ILE H2 H 7.627 3.996 -4.206 . . . 1.0 . . . . . . . . . . . . A . 1 ILE H2 . . . . . . . . . c30226_5ug5 1 . 8 . 1997 . 1 1 1 ILE H3 H 6.362 4.465 -3.192 . . . 1.0 . . . . . . . . . . . . A . 1 ILE H3 . . . . . . . . . c30226_5ug5 1 . 8 . 1998 . 1 1 1 ILE HA H 4.972 2.713 -4.028 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HA . . . . . . . . . c30226_5ug5 1 . 8 . 1999 . 1 1 1 ILE HB H 5.987 0.946 -5.462 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HB . . . . . . . . . c30226_5ug5 1 . 8 . 2000 . 1 1 1 ILE HD11 H 8.502 0.822 -4.185 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HD11 . . . . . . . . . c30226_5ug5 1 . 8 . 2001 . 1 1 1 ILE HD12 H 9.654 0.908 -5.515 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HD12 . . . . . . . . . c30226_5ug5 1 . 8 . 2002 . 1 1 1 ILE HD13 H 8.228 -0.119 -5.652 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HD13 . . . . . . . . . c30226_5ug5 1 . 8 . 2003 . 1 1 1 ILE HG12 H 7.954 1.925 -6.926 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG12 . . . . . . . . . c30226_5ug5 1 . 8 . 2004 . 1 1 1 ILE HG13 H 8.275 2.885 -5.489 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG13 . . . . . . . . . c30226_5ug5 1 . 8 . 2005 . 1 1 1 ILE HG21 H 5.851 3.695 -6.685 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG21 . . . . . . . . . c30226_5ug5 1 . 8 . 2006 . 1 1 1 ILE HG22 H 4.494 2.604 -6.407 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG22 . . . . . . . . . c30226_5ug5 1 . 8 . 2007 . 1 1 1 ILE HG23 H 5.749 2.173 -7.568 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG23 . . . . . . . . . c30226_5ug5 1 . 8 . 2008 . 1 1 1 ILE N N 6.594 4.021 -4.104 . . . 1.0 . . . . . . . . . . . . A . 1 ILE N . . . . . . . . . c30226_5ug5 1 . 8 . 2009 . 1 1 1 ILE O O 7.559 2.227 -2.349 . . . 1.0 . . . . . . . . . . . . A . 1 ILE O . . . . . . . . . c30226_5ug5 1 . 8 . 2010 . 1 1 2 ARG C C 6.224 -1.720 -2.139 . . . 1.0 . . . . . . . . . . . . A . 2 ARG C . . . . . . . . . c30226_5ug5 1 . 8 . 2011 . 1 1 2 ARG CA C 6.525 -0.272 -1.763 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CA . . . . . . . . . c30226_5ug5 1 . 8 . 2012 . 1 1 2 ARG CB C 5.854 0.056 -0.422 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CB . . . . . . . . . c30226_5ug5 1 . 8 . 2013 . 1 1 2 ARG CD C 7.952 0.476 0.895 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CD . . . . . . . . . c30226_5ug5 1 . 8 . 2014 . 1 1 2 ARG CG C 6.675 -0.346 0.792 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CG . . . . . . . . . c30226_5ug5 1 . 8 . 2015 . 1 1 2 ARG CZ C 8.627 2.851 0.835 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CZ . . . . . . . . . c30226_5ug5 1 . 8 . 2016 . 1 1 2 ARG H H 5.292 0.344 -3.362 . . . 1.0 . . . . . . . . . . . . A . 2 ARG H . . . . . . . . . c30226_5ug5 1 . 8 . 2017 . 1 1 2 ARG HA H 7.589 -0.144 -1.672 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HA . . . . . . . . . c30226_5ug5 1 . 8 . 2018 . 1 1 2 ARG HB2 H 5.675 1.117 -0.366 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB2 . . . . . . . . . c30226_5ug5 1 . 8 . 2019 . 1 1 2 ARG HB3 H 4.907 -0.460 -0.373 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB3 . . . . . . . . . c30226_5ug5 1 . 8 . 2020 . 1 1 2 ARG HD2 H 8.447 0.233 1.824 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD2 . . . . . . . . . c30226_5ug5 1 . 8 . 2021 . 1 1 2 ARG HD3 H 8.597 0.223 0.068 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD3 . . . . . . . . . c30226_5ug5 1 . 8 . 2022 . 1 1 2 ARG HE H 6.738 2.196 0.858 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HE . . . . . . . . . c30226_5ug5 1 . 8 . 2023 . 1 1 2 ARG HG2 H 6.086 -0.189 1.681 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG2 . . . . . . . . . c30226_5ug5 1 . 8 . 2024 . 1 1 2 ARG HG3 H 6.935 -1.389 0.708 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG3 . . . . . . . . . c30226_5ug5 1 . 8 . 2025 . 1 1 2 ARG HH11 H 10.179 1.547 0.885 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH11 . . . . . . . . . c30226_5ug5 1 . 8 . 2026 . 1 1 2 ARG HH12 H 10.621 3.223 0.828 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH12 . . . . . . . . . c30226_5ug5 1 . 8 . 2027 . 1 1 2 ARG HH21 H 7.308 4.389 0.783 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH21 . . . . . . . . . c30226_5ug5 1 . 8 . 2028 . 1 1 2 ARG HH22 H 8.983 4.846 0.764 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH22 . . . . . . . . . c30226_5ug5 1 . 8 . 2029 . 1 1 2 ARG N N 6.048 0.624 -2.804 . . . 1.0 . . . . . . . . . . . . A . 2 ARG N . . . . . . . . . c30226_5ug5 1 . 8 . 2030 . 1 1 2 ARG NE N 7.682 1.913 0.865 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NE . . . . . . . . . c30226_5ug5 1 . 8 . 2031 . 1 1 2 ARG NH1 N 9.911 2.514 0.850 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH1 . . . . . . . . . c30226_5ug5 1 . 8 . 2032 . 1 1 2 ARG NH2 N 8.280 4.131 0.792 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH2 . . . . . . . . . c30226_5ug5 1 . 8 . 2033 . 1 1 2 ARG O O 5.136 -2.034 -2.617 . . . 1.0 . . . . . . . . . . . . A . 2 ARG O . . . . . . . . . c30226_5ug5 1 . 8 . 2034 . 1 1 3 ASP C C 6.356 -4.628 -0.921 . . . 1.0 . . . . . . . . . . . . A . 3 ASP C . . . . . . . . . c30226_5ug5 1 . 8 . 2035 . 1 1 3 ASP CA C 6.998 -4.027 -2.152 . . . 1.0 . . . . . . . . . . . . A . 3 ASP CA . . . . . . . . . c30226_5ug5 1 . 8 . 2036 . 1 1 3 ASP CB C 8.325 -4.723 -2.469 . . . 1.0 . . . . . . . . . . . . A . 3 ASP CB . . . . . . . . . c30226_5ug5 1 . 8 . 2037 . 1 1 3 ASP CG C 8.156 -6.204 -2.737 . . . 1.0 . . . . . . . . . . . . A . 3 ASP CG . . . . . . . . . c30226_5ug5 1 . 8 . 2038 . 1 1 3 ASP H H 8.070 -2.273 -1.623 . . . 1.0 . . . . . . . . . . . . A . 3 ASP H . . . . . . . . . c30226_5ug5 1 . 8 . 2039 . 1 1 3 ASP HA H 6.328 -4.137 -2.971 . . . 1.0 . . . . . . . . . . . . A . 3 ASP HA . . . . . . . . . c30226_5ug5 1 . 8 . 2040 . 1 1 3 ASP HB2 H 8.763 -4.267 -3.344 . . . 1.0 . . . . . . . . . . . . A . 3 ASP HB2 . . . . . . . . . c30226_5ug5 1 . 8 . 2041 . 1 1 3 ASP HB3 H 8.995 -4.602 -1.632 . . . 1.0 . . . . . . . . . . . . A . 3 ASP HB3 . . . . . . . . . c30226_5ug5 1 . 8 . 2042 . 1 1 3 ASP N N 7.197 -2.595 -1.932 . . . 1.0 . . . . . . . . . . . . A . 3 ASP N . . . . . . . . . c30226_5ug5 1 . 8 . 2043 . 1 1 3 ASP O O 5.710 -5.676 -0.952 . . . 1.0 . . . . . . . . . . . . A . 3 ASP O . . . . . . . . . c30226_5ug5 1 . 8 . 2044 . 1 1 3 ASP OD1 O 7.798 -6.571 -3.877 . . . 1.0 . . . . . . . . . . . . A . 3 ASP OD1 . . . . . . . . . c30226_5ug5 1 . 8 . 2045 . 1 1 3 ASP OD2 O 8.381 -7.012 -1.813 . . . 1.0 . . . . . . . . . . . . A . 3 ASP OD2 . . . . . . . . . c30226_5ug5 1 . 8 . 2046 . 1 1 4 GLU C C 4.631 -3.349 1.559 . . . 1.0 . . . . . . . . . . . . A . 4 GLU C . . . . . . . . . c30226_5ug5 1 . 8 . 2047 . 1 1 4 GLU CA C 5.906 -4.167 1.431 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CA . . . . . . . . . c30226_5ug5 1 . 8 . 2048 . 1 1 4 GLU CB C 6.852 -3.844 2.572 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CB . . . . . . . . . c30226_5ug5 1 . 8 . 2049 . 1 1 4 GLU CD C 7.449 -6.235 3.133 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CD . . . . . . . . . c30226_5ug5 1 . 8 . 2050 . 1 1 4 GLU CG C 7.968 -4.863 2.749 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CG . . . . . . . . . c30226_5ug5 1 . 8 . 2051 . 1 1 4 GLU H H 7.124 -3.131 0.066 . . . 1.0 . . . . . . . . . . . . A . 4 GLU H . . . . . . . . . c30226_5ug5 1 . 8 . 2052 . 1 1 4 GLU HA H 5.655 -5.216 1.466 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HA . . . . . . . . . c30226_5ug5 1 . 8 . 2053 . 1 1 4 GLU HB2 H 7.299 -2.876 2.392 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HB2 . . . . . . . . . c30226_5ug5 1 . 8 . 2054 . 1 1 4 GLU HB3 H 6.277 -3.802 3.474 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HB3 . . . . . . . . . c30226_5ug5 1 . 8 . 2055 . 1 1 4 GLU HG2 H 8.511 -4.948 1.819 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HG2 . . . . . . . . . c30226_5ug5 1 . 8 . 2056 . 1 1 4 GLU HG3 H 8.634 -4.516 3.524 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HG3 . . . . . . . . . c30226_5ug5 1 . 8 . 2057 . 1 1 4 GLU N N 6.533 -3.902 0.148 . . . 1.0 . . . . . . . . . . . . A . 4 GLU N . . . . . . . . . c30226_5ug5 1 . 8 . 2058 . 1 1 4 GLU O O 4.276 -2.879 2.633 . . . 1.0 . . . . . . . . . . . . A . 4 GLU O . . . . . . . . . c30226_5ug5 1 . 8 . 2059 . 1 1 4 GLU OE1 O 7.550 -6.602 4.323 . . . 1.0 . . . . . . . . . . . . A . 4 GLU OE1 . . . . . . . . . c30226_5ug5 1 . 8 . 2060 . 1 1 4 GLU OE2 O 6.931 -6.953 2.253 . . . 1.0 . . . . . . . . . . . . A . 4 GLU OE2 . . . . . . . . . c30226_5ug5 1 . 8 . 2061 . 1 1 5 CYS C C 1.779 -2.448 1.333 . . . 1.0 . . . . . . . . . . . . A . 5 CYS C . . . . . . . . . c30226_5ug5 1 . 8 . 2062 . 1 1 5 CYS CA C 2.868 -2.238 0.274 . . . 1.0 . . . . . . . . . . . . A . 5 CYS CA . . . . . . . . . c30226_5ug5 1 . 8 . 2063 . 1 1 5 CYS CB C 2.288 -2.427 -1.123 . . . 1.0 . . . . . . . . . . . . A . 5 CYS CB . . . . . . . . . c30226_5ug5 1 . 8 . 2064 . 1 1 5 CYS H H 4.293 -3.635 -0.358 . . . 1.0 . . . . . . . . . . . . A . 5 CYS H . . . . . . . . . c30226_5ug5 1 . 8 . 2065 . 1 1 5 CYS HA H 3.237 -1.229 0.357 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HA . . . . . . . . . c30226_5ug5 1 . 8 . 2066 . 1 1 5 CYS HB2 H 2.907 -3.128 -1.664 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HB2 . . . . . . . . . c30226_5ug5 1 . 8 . 2067 . 1 1 5 CYS HB3 H 1.299 -2.830 -1.037 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HB3 . . . . . . . . . c30226_5ug5 1 . 8 . 2068 . 1 1 5 CYS N N 3.999 -3.139 0.424 . . . 1.0 . . . . . . . . . . . . A . 5 CYS N . . . . . . . . . c30226_5ug5 1 . 8 . 2069 . 1 1 5 CYS O O 1.169 -1.484 1.774 . . . 1.0 . . . . . . . . . . . . A . 5 CYS O . . . . . . . . . c30226_5ug5 1 . 8 . 2070 . 1 1 5 CYS SG S 2.200 -0.899 -2.112 . . . 1.0 . . . . . . . . . . . . A . 5 CYS SG . . . . . . . . . c30226_5ug5 1 . 8 . 2071 . 1 1 6 CYS C C 0.952 -3.562 4.132 . . . 1.0 . . . . . . . . . . . . A . 6 CYS C . . . . . . . . . c30226_5ug5 1 . 8 . 2072 . 1 1 6 CYS CA C 0.524 -4.019 2.741 . . . 1.0 . . . . . . . . . . . . A . 6 CYS CA . . . . . . . . . c30226_5ug5 1 . 8 . 2073 . 1 1 6 CYS CB C 0.263 -5.529 2.730 . . . 1.0 . . . . . . . . . . . . A . 6 CYS CB . . . . . . . . . c30226_5ug5 1 . 8 . 2074 . 1 1 6 CYS H H 2.117 -4.417 1.396 . . . 1.0 . . . . . . . . . . . . A . 6 CYS H . . . . . . . . . c30226_5ug5 1 . 8 . 2075 . 1 1 6 CYS HA H -0.391 -3.492 2.471 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HA . . . . . . . . . c30226_5ug5 1 . 8 . 2076 . 1 1 6 CYS HB2 H 0.017 -5.833 1.724 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HB2 . . . . . . . . . c30226_5ug5 1 . 8 . 2077 . 1 1 6 CYS HB3 H 1.162 -6.041 3.039 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HB3 . . . . . . . . . c30226_5ug5 1 . 8 . 2078 . 1 1 6 CYS N N 1.560 -3.692 1.752 . . . 1.0 . . . . . . . . . . . . A . 6 CYS N . . . . . . . . . c30226_5ug5 1 . 8 . 2079 . 1 1 6 CYS O O 0.118 -3.270 4.992 . . . 1.0 . . . . . . . . . . . . A . 6 CYS O . . . . . . . . . c30226_5ug5 1 . 8 . 2080 . 1 1 6 CYS SG S -1.091 -6.088 3.816 . . . 1.0 . . . . . . . . . . . . A . 6 CYS SG . . . . . . . . . c30226_5ug5 1 . 8 . 2081 . 1 1 7 SER C C 2.644 -1.415 5.512 . . . 1.0 . . . . . . . . . . . . A . 7 SER C . . . . . . . . . c30226_5ug5 1 . 8 . 2082 . 1 1 7 SER CA C 2.799 -2.919 5.557 . . . 1.0 . . . . . . . . . . . . A . 7 SER CA . . . . . . . . . c30226_5ug5 1 . 8 . 2083 . 1 1 7 SER CB C 4.286 -3.224 5.657 . . . 1.0 . . . . . . . . . . . . A . 7 SER CB . . . . . . . . . c30226_5ug5 1 . 8 . 2084 . 1 1 7 SER H H 2.869 -3.834 3.656 . . . 1.0 . . . . . . . . . . . . A . 7 SER H . . . . . . . . . c30226_5ug5 1 . 8 . 2085 . 1 1 7 SER HA H 2.281 -3.323 6.408 . . . 1.0 . . . . . . . . . . . . A . 7 SER HA . . . . . . . . . c30226_5ug5 1 . 8 . 2086 . 1 1 7 SER HB2 H 4.483 -4.217 5.281 . . . 1.0 . . . . . . . . . . . . A . 7 SER HB2 . . . . . . . . . c30226_5ug5 1 . 8 . 2087 . 1 1 7 SER HB3 H 4.816 -2.489 5.054 . . . 1.0 . . . . . . . . . . . . A . 7 SER HB3 . . . . . . . . . c30226_5ug5 1 . 8 . 2088 . 1 1 7 SER HG H 4.844 -4.017 7.363 . . . 1.0 . . . . . . . . . . . . A . 7 SER HG . . . . . . . . . c30226_5ug5 1 . 8 . 2089 . 1 1 7 SER N N 2.252 -3.490 4.341 . . . 1.0 . . . . . . . . . . . . A . 7 SER N . . . . . . . . . c30226_5ug5 1 . 8 . 2090 . 1 1 7 SER O O 2.419 -0.757 6.530 . . . 1.0 . . . . . . . . . . . . A . 7 SER O . . . . . . . . . c30226_5ug5 1 . 8 . 2091 . 1 1 7 SER OG O 4.754 -3.130 6.992 . . . 1.0 . . . . . . . . . . . . A . 7 SER OG . . . . . . . . . c30226_5ug5 1 . 8 . 2092 . 1 1 8 ASN C C 1.603 1.277 4.093 . . . 1.0 . . . . . . . . . . . . A . 8 ASN C . . . . . . . . . c30226_5ug5 1 . 8 . 2093 . 1 1 8 ASN CA C 2.936 0.533 4.115 . . . 1.0 . . . . . . . . . . . . A . 8 ASN CA . . . . . . . . . c30226_5ug5 1 . 8 . 2094 . 1 1 8 ASN CB C 3.691 0.776 2.815 . . . 1.0 . . . . . . . . . . . . A . 8 ASN CB . . . . . . . . . c30226_5ug5 1 . 8 . 2095 . 1 1 8 ASN CG C 4.045 2.234 2.609 . . . 1.0 . . . . . . . . . . . . A . 8 ASN CG . . . . . . . . . c30226_5ug5 1 . 8 . 2096 . 1 1 8 ASN H H 2.687 -1.471 3.519 . . . 1.0 . . . . . . . . . . . . A . 8 ASN H . . . . . . . . . c30226_5ug5 1 . 8 . 2097 . 1 1 8 ASN HA H 3.536 0.883 4.938 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HA . . . . . . . . . c30226_5ug5 1 . 8 . 2098 . 1 1 8 ASN HB2 H 4.603 0.201 2.826 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HB2 . . . . . . . . . c30226_5ug5 1 . 8 . 2099 . 1 1 8 ASN HB3 H 3.074 0.452 1.989 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HB3 . . . . . . . . . c30226_5ug5 1 . 8 . 2100 . 1 1 8 ASN HD21 H 5.707 2.011 3.676 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HD21 . . . . . . . . . c30226_5ug5 1 . 8 . 2101 . 1 1 8 ASN HD22 H 5.421 3.600 3.045 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HD22 . . . . . . . . . c30226_5ug5 1 . 8 . 2102 . 1 1 8 ASN N N 2.750 -0.885 4.307 . . . 1.0 . . . . . . . . . . . . A . 8 ASN N . . . . . . . . . c30226_5ug5 1 . 8 . 2103 . 1 1 8 ASN ND2 N 5.169 2.656 3.163 . . . 1.0 . . . . . . . . . . . . A . 8 ASN ND2 . . . . . . . . . c30226_5ug5 1 . 8 . 2104 . 1 1 8 ASN O O 0.785 1.078 3.193 . . . 1.0 . . . . . . . . . . . . A . 8 ASN O . . . . . . . . . c30226_5ug5 1 . 8 . 2105 . 1 1 8 ASN OD1 O 3.310 2.976 1.962 . . . 1.0 . . . . . . . . . . . . A . 8 ASN OD1 . . . . . . . . . c30226_5ug5 1 . 8 . 2106 . 1 1 9 PRO C C -0.142 3.809 4.012 . . . 1.0 . . . . . . . . . . . . A . 9 PRO C . . . . . . . . . c30226_5ug5 1 . 8 . 2107 . 1 1 9 PRO CA C 0.144 2.937 5.220 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CA . . . . . . . . . c30226_5ug5 1 . 8 . 2108 . 1 1 9 PRO CB C 0.434 3.813 6.437 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CB . . . . . . . . . c30226_5ug5 1 . 8 . 2109 . 1 1 9 PRO CD C 2.344 2.520 6.132 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CD . . . . . . . . . c30226_5ug5 1 . 8 . 2110 . 1 1 9 PRO CG C 1.900 3.887 6.513 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CG . . . . . . . . . c30226_5ug5 1 . 8 . 2111 . 1 1 9 PRO HA H -0.702 2.299 5.420 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HA . . . . . . . . . c30226_5ug5 1 . 8 . 2112 . 1 1 9 PRO HB2 H -0.013 4.786 6.317 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HB2 . . . . . . . . . c30226_5ug5 1 . 8 . 2113 . 1 1 9 PRO HB3 H 0.055 3.338 7.295 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HB3 . . . . . . . . . c30226_5ug5 1 . 8 . 2114 . 1 1 9 PRO HD2 H 3.337 2.551 5.761 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HD2 . . . . . . . . . c30226_5ug5 1 . 8 . 2115 . 1 1 9 PRO HD3 H 2.265 1.843 6.969 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HD3 . . . . . . . . . c30226_5ug5 1 . 8 . 2116 . 1 1 9 PRO HG2 H 2.275 4.623 5.818 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HG2 . . . . . . . . . c30226_5ug5 1 . 8 . 2117 . 1 1 9 PRO HG3 H 2.204 4.116 7.521 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HG3 . . . . . . . . . c30226_5ug5 1 . 8 . 2118 . 1 1 9 PRO N N 1.385 2.167 5.075 . . . 1.0 . . . . . . . . . . . . A . 9 PRO N . . . . . . . . . c30226_5ug5 1 . 8 . 2119 . 1 1 9 PRO O O -1.271 3.896 3.532 . . . 1.0 . . . . . . . . . . . . A . 9 PRO O . . . . . . . . . c30226_5ug5 1 . 8 . 2120 . 1 1 10 ALA C C 0.368 4.579 1.119 . . . 1.0 . . . . . . . . . . . . A . 10 ALA C . . . . . . . . . c30226_5ug5 1 . 8 . 2121 . 1 1 10 ALA CA C 0.814 5.330 2.378 . . . 1.0 . . . . . . . . . . . . A . 10 ALA CA . . . . . . . . . c30226_5ug5 1 . 8 . 2122 . 1 1 10 ALA CB C 2.152 6.013 2.138 . . . 1.0 . . . . . . . . . . . . A . 10 ALA CB . . . . . . . . . c30226_5ug5 1 . 8 . 2123 . 1 1 10 ALA H H 1.749 4.366 4.022 . . . 1.0 . . . . . . . . . . . . A . 10 ALA H . . . . . . . . . c30226_5ug5 1 . 8 . 2124 . 1 1 10 ALA HA H 0.087 6.098 2.595 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HA . . . . . . . . . c30226_5ug5 1 . 8 . 2125 . 1 1 10 ALA HB1 H 2.060 6.707 1.317 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HB1 . . . . . . . . . c30226_5ug5 1 . 8 . 2126 . 1 1 10 ALA HB2 H 2.898 5.269 1.900 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HB2 . . . . . . . . . c30226_5ug5 1 . 8 . 2127 . 1 1 10 ALA HB3 H 2.448 6.546 3.029 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HB3 . . . . . . . . . c30226_5ug5 1 . 8 . 2128 . 1 1 10 ALA N N 0.898 4.457 3.544 . . . 1.0 . . . . . . . . . . . . A . 10 ALA N . . . . . . . . . c30226_5ug5 1 . 8 . 2129 . 1 1 10 ALA O O -0.190 5.180 0.198 . . . 1.0 . . . . . . . . . . . . A . 10 ALA O . . . . . . . . . c30226_5ug5 1 . 8 . 2130 . 1 1 11 CYS C C -1.148 2.029 0.123 . . . 1.0 . . . . . . . . . . . . A . 11 CYS C . . . . . . . . . c30226_5ug5 1 . 8 . 2131 . 1 1 11 CYS CA C 0.248 2.491 -0.092 . . . 1.0 . . . . . . . . . . . . A . 11 CYS CA . . . . . . . . . c30226_5ug5 1 . 8 . 2132 . 1 1 11 CYS CB C 1.181 1.294 -0.274 . . . 1.0 . . . . . . . . . . . . A . 11 CYS CB . . . . . . . . . c30226_5ug5 1 . 8 . 2133 . 1 1 11 CYS H H 0.821 2.783 1.905 . . . 1.0 . . . . . . . . . . . . A . 11 CYS H . . . . . . . . . c30226_5ug5 1 . 8 . 2134 . 1 1 11 CYS HA H 0.291 3.134 -0.959 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HA . . . . . . . . . c30226_5ug5 1 . 8 . 2135 . 1 1 11 CYS HB2 H 2.132 1.639 -0.652 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HB2 . . . . . . . . . c30226_5ug5 1 . 8 . 2136 . 1 1 11 CYS HB3 H 1.332 0.813 0.681 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HB3 . . . . . . . . . c30226_5ug5 1 . 8 . 2137 . 1 1 11 CYS N N 0.588 3.266 1.080 . . . 1.0 . . . . . . . . . . . . A . 11 CYS N . . . . . . . . . c30226_5ug5 1 . 8 . 2138 . 1 1 11 CYS O O -2.036 2.185 -0.713 . . . 1.0 . . . . . . . . . . . . A . 11 CYS O . . . . . . . . . c30226_5ug5 1 . 8 . 2139 . 1 1 11 CYS SG S 0.540 0.040 -1.434 . . . 1.0 . . . . . . . . . . . . A . 11 CYS SG . . . . . . . . . c30226_5ug5 1 . 8 . 2140 . 1 1 12 ARG C C -3.671 2.061 1.532 . . . 1.0 . . . . . . . . . . . . A . 12 ARG C . . . . . . . . . c30226_5ug5 1 . 8 . 2141 . 1 1 12 ARG CA C -2.554 1.084 1.871 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CA . . . . . . . . . c30226_5ug5 1 . 8 . 2142 . 1 1 12 ARG CB C -2.387 1.020 3.373 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CB . . . . . . . . . c30226_5ug5 1 . 8 . 2143 . 1 1 12 ARG CD C -1.288 -1.239 3.190 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CD . . . . . . . . . c30226_5ug5 1 . 8 . 2144 . 1 1 12 ARG CG C -2.246 -0.372 3.963 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CG . . . . . . . . . c30226_5ug5 1 . 8 . 2145 . 1 1 12 ARG CZ C -2.786 -2.919 2.188 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CZ . . . . . . . . . c30226_5ug5 1 . 8 . 2146 . 1 1 12 ARG H H -0.492 1.310 1.856 . . . 1.0 . . . . . . . . . . . . A . 12 ARG H . . . . . . . . . c30226_5ug5 1 . 8 . 2147 . 1 1 12 ARG HA H -2.780 0.120 1.500 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HA . . . . . . . . . c30226_5ug5 1 . 8 . 2148 . 1 1 12 ARG HB2 H -1.506 1.583 3.640 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HB2 . . . . . . . . . c30226_5ug5 1 . 8 . 2149 . 1 1 12 ARG HB3 H -3.234 1.492 3.804 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HB3 . . . . . . . . . c30226_5ug5 1 . 8 . 2150 . 1 1 12 ARG HD2 H -0.474 -0.626 2.821 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HD2 . . . . . . . . . c30226_5ug5 1 . 8 . 2151 . 1 1 12 ARG HD3 H -0.898 -2.002 3.847 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HD3 . . . . . . . . . c30226_5ug5 1 . 8 . 2152 . 1 1 12 ARG HE H -1.808 -1.494 1.173 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HE . . . . . . . . . c30226_5ug5 1 . 8 . 2153 . 1 1 12 ARG HG2 H -1.899 -0.292 4.980 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HG2 . . . . . . . . . c30226_5ug5 1 . 8 . 2154 . 1 1 12 ARG HG3 H -3.200 -0.851 3.949 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HG3 . . . . . . . . . c30226_5ug5 1 . 8 . 2155 . 1 1 12 ARG HH11 H -2.508 -3.145 4.187 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH11 . . . . . . . . . c30226_5ug5 1 . 8 . 2156 . 1 1 12 ARG HH12 H -3.607 -4.274 3.455 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH12 . . . . . . . . . c30226_5ug5 1 . 8 . 2157 . 1 1 12 ARG HH21 H -3.298 -2.968 0.230 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH21 . . . . . . . . . c30226_5ug5 1 . 8 . 2158 . 1 1 12 ARG HH22 H -4.057 -4.172 1.241 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH22 . . . . . . . . . c30226_5ug5 1 . 8 . 2159 . 1 1 12 ARG N N -1.299 1.479 1.315 . . . 1.0 . . . . . . . . . . . . A . 12 ARG N . . . . . . . . . c30226_5ug5 1 . 8 . 2160 . 1 1 12 ARG NE N -1.960 -1.879 2.063 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NE . . . . . . . . . c30226_5ug5 1 . 8 . 2161 . 1 1 12 ARG NH1 N -2.981 -3.489 3.370 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NH1 . . . . . . . . . c30226_5ug5 1 . 8 . 2162 . 1 1 12 ARG NH2 N -3.427 -3.389 1.132 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NH2 . . . . . . . . . c30226_5ug5 1 . 8 . 2163 . 1 1 12 ARG O O -4.732 1.664 1.059 . . . 1.0 . . . . . . . . . . . . A . 12 ARG O . . . . . . . . . c30226_5ug5 1 . 8 . 2164 . 1 1 13 TYR C C -5.025 4.380 0.213 . . . 1.0 . . . . . . . . . . . . A . 13 TYR C . . . . . . . . . c30226_5ug5 1 . 8 . 2165 . 1 1 13 TYR CA C -4.355 4.413 1.586 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CA . . . . . . . . . c30226_5ug5 1 . 8 . 2166 . 1 1 13 TYR CB C -3.641 5.745 1.785 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CB . . . . . . . . . c30226_5ug5 1 . 8 . 2167 . 1 1 13 TYR CD1 C -5.324 7.082 3.044 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CD1 . . . . . . . . . c30226_5ug5 1 . 8 . 2168 . 1 1 13 TYR CD2 C -4.666 7.852 0.903 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CD2 . . . . . . . . . c30226_5ug5 1 . 8 . 2169 . 1 1 13 TYR CE1 C -6.179 8.146 3.176 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CE1 . . . . . . . . . c30226_5ug5 1 . 8 . 2170 . 1 1 13 TYR CE2 C -5.520 8.930 1.024 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CE2 . . . . . . . . . c30226_5ug5 1 . 8 . 2171 . 1 1 13 TYR CG C -4.560 6.919 1.912 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CG . . . . . . . . . c30226_5ug5 1 . 8 . 2172 . 1 1 13 TYR CZ C -6.238 9.105 2.132 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CZ . . . . . . . . . c30226_5ug5 1 . 8 . 2173 . 1 1 13 TYR H H -2.502 3.571 2.097 . . . 1.0 . . . . . . . . . . . . A . 13 TYR H . . . . . . . . . c30226_5ug5 1 . 8 . 2174 . 1 1 13 TYR HA H -5.110 4.315 2.342 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HA . . . . . . . . . c30226_5ug5 1 . 8 . 2175 . 1 1 13 TYR HB2 H -3.036 5.699 2.676 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HB2 . . . . . . . . . c30226_5ug5 1 . 8 . 2176 . 1 1 13 TYR HB3 H -3.009 5.929 0.936 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HB3 . . . . . . . . . c30226_5ug5 1 . 8 . 2177 . 1 1 13 TYR HD1 H -5.243 6.355 3.835 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HD1 . . . . . . . . . c30226_5ug5 1 . 8 . 2178 . 1 1 13 TYR HD2 H -4.067 7.727 0.016 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HD2 . . . . . . . . . c30226_5ug5 1 . 8 . 2179 . 1 1 13 TYR HE1 H -6.763 8.249 4.067 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HE1 . . . . . . . . . c30226_5ug5 1 . 8 . 2180 . 1 1 13 TYR HE2 H -5.592 9.651 0.230 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HE2 . . . . . . . . . c30226_5ug5 1 . 8 . 2181 . 1 1 13 TYR HH H -7.006 10.554 3.159 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HH . . . . . . . . . c30226_5ug5 1 . 8 . 2182 . 1 1 13 TYR N N -3.395 3.338 1.768 . . . 1.0 . . . . . . . . . . . . A . 13 TYR N . . . . . . . . . c30226_5ug5 1 . 8 . 2183 . 1 1 13 TYR O O -6.201 4.717 0.088 . . . 1.0 . . . . . . . . . . . . A . 13 TYR O . . . . . . . . . c30226_5ug5 1 . 8 . 2184 . 1 1 13 TYR OH O -7.137 10.141 2.294 . . . 1.0 . . . . . . . . . . . . A . 13 TYR OH . . . . . . . . . c30226_5ug5 1 . 8 . 2185 . 1 1 14 ASN C C -4.992 2.609 -2.695 . . . 1.0 . . . . . . . . . . . . A . 14 ASN C . . . . . . . . . c30226_5ug5 1 . 8 . 2186 . 1 1 14 ASN CA C -4.812 4.014 -2.167 . . . 1.0 . . . . . . . . . . . . A . 14 ASN CA . . . . . . . . . c30226_5ug5 1 . 8 . 2187 . 1 1 14 ASN CB C -3.872 4.798 -3.090 . . . 1.0 . . . . . . . . . . . . A . 14 ASN CB . . . . . . . . . c30226_5ug5 1 . 8 . 2188 . 1 1 14 ASN CG C -3.697 6.245 -2.664 . . . 1.0 . . . . . . . . . . . . A . 14 ASN CG . . . . . . . . . c30226_5ug5 1 . 8 . 2189 . 1 1 14 ASN H H -3.395 3.567 -0.654 . . . 1.0 . . . . . . . . . . . . A . 14 ASN H . . . . . . . . . c30226_5ug5 1 . 8 . 2190 . 1 1 14 ASN HA H -5.773 4.506 -2.138 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HA . . . . . . . . . c30226_5ug5 1 . 8 . 2191 . 1 1 14 ASN HB2 H -2.902 4.326 -3.088 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HB2 . . . . . . . . . c30226_5ug5 1 . 8 . 2192 . 1 1 14 ASN HB3 H -4.273 4.784 -4.092 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HB3 . . . . . . . . . c30226_5ug5 1 . 8 . 2193 . 1 1 14 ASN HD21 H -2.064 5.779 -1.635 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HD21 . . . . . . . . . c30226_5ug5 1 . 8 . 2194 . 1 1 14 ASN HD22 H -2.521 7.445 -1.607 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HD22 . . . . . . . . . c30226_5ug5 1 . 8 . 2195 . 1 1 14 ASN N N -4.287 3.968 -0.813 . . . 1.0 . . . . . . . . . . . . A . 14 ASN N . . . . . . . . . c30226_5ug5 1 . 8 . 2196 . 1 1 14 ASN ND2 N -2.657 6.515 -1.889 . . . 1.0 . . . . . . . . . . . . A . 14 ASN ND2 . . . . . . . . . c30226_5ug5 1 . 8 . 2197 . 1 1 14 ASN O O -5.443 2.406 -3.822 . . . 1.0 . . . . . . . . . . . . A . 14 ASN O . . . . . . . . . c30226_5ug5 1 . 8 . 2198 . 1 1 14 ASN OD1 O -4.481 7.115 -3.043 . . . 1.0 . . . . . . . . . . . . A . 14 ASN OD1 . . . . . . . . . c30226_5ug5 1 . 8 . 2199 . 1 1 15 ASN C C -4.909 -0.751 -1.256 . . . 1.0 . . . . . . . . . . . . A . 15 ASN C . . . . . . . . . c30226_5ug5 1 . 8 . 2200 . 1 1 15 ASN CA C -4.493 0.266 -2.309 . . . 1.0 . . . . . . . . . . . . A . 15 ASN CA . . . . . . . . . c30226_5ug5 1 . 8 . 2201 . 1 1 15 ASN CB C -3.039 0.053 -2.652 . . . 1.0 . . . . . . . . . . . . A . 15 ASN CB . . . . . . . . . c30226_5ug5 1 . 8 . 2202 . 1 1 15 ASN CG C -2.681 0.472 -4.066 . . . 1.0 . . . . . . . . . . . . A . 15 ASN CG . . . . . . . . . c30226_5ug5 1 . 8 . 2203 . 1 1 15 ASN H H -4.497 1.854 -0.914 . . . 1.0 . . . . . . . . . . . . A . 15 ASN H . . . . . . . . . c30226_5ug5 1 . 8 . 2204 . 1 1 15 ASN HA H -5.091 0.133 -3.185 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HA . . . . . . . . . c30226_5ug5 1 . 8 . 2205 . 1 1 15 ASN HB2 H -2.469 0.655 -1.960 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HB2 . . . . . . . . . c30226_5ug5 1 . 8 . 2206 . 1 1 15 ASN HB3 H -2.786 -0.988 -2.518 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HB3 . . . . . . . . . c30226_5ug5 1 . 8 . 2207 . 1 1 15 ASN HD21 H -0.815 0.848 -3.505 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HD21 . . . . . . . . . c30226_5ug5 1 . 8 . 2208 . 1 1 15 ASN HD22 H -1.171 1.128 -5.175 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HD22 . . . . . . . . . c30226_5ug5 1 . 8 . 2209 . 1 1 15 ASN N N -4.651 1.640 -1.858 . . . 1.0 . . . . . . . . . . . . A . 15 ASN N . . . . . . . . . c30226_5ug5 1 . 8 . 2210 . 1 1 15 ASN ND2 N -1.433 0.855 -4.269 . . . 1.0 . . . . . . . . . . . . A . 15 ASN ND2 . . . . . . . . . c30226_5ug5 1 . 8 . 2211 . 1 1 15 ASN O O -4.079 -1.496 -0.731 . . . 1.0 . . . . . . . . . . . . A . 15 ASN O . . . . . . . . . c30226_5ug5 1 . 8 . 2212 . 1 1 15 ASN OD1 O -3.516 0.440 -4.971 . . . 1.0 . . . . . . . . . . . . A . 15 ASN OD1 . . . . . . . . . c30226_5ug5 1 . 8 . 2213 . 1 1 16 HYP C C -7.160 -3.053 -0.422 . . . 1.0 . . . . . . . . . . . . A . 16 HYP C . . . . . . . . . c30226_5ug5 1 . 8 . 2214 . 1 1 16 HYP CA C -6.748 -1.687 0.096 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CA . . . . . . . . . c30226_5ug5 1 . 8 . 2215 . 1 1 16 HYP CB C -7.936 -0.859 0.533 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CB . . . . . . . . . c30226_5ug5 1 . 8 . 2216 . 1 1 16 HYP CD C -7.251 0.055 -1.520 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CD . . . . . . . . . c30226_5ug5 1 . 8 . 2217 . 1 1 16 HYP CG C -7.997 0.413 -0.286 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CG . . . . . . . . . c30226_5ug5 1 . 8 . 2218 . 1 1 16 HYP HA H -6.065 -1.809 0.901 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HA . . . . . . . . . c30226_5ug5 1 . 8 . 2219 . 1 1 16 HYP HB2 H -7.832 -0.601 1.575 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HB2 . . . . . . . . . c30226_5ug5 1 . 8 . 2220 . 1 1 16 HYP HB3 H -8.842 -1.431 0.389 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HB3 . . . . . . . . . c30226_5ug5 1 . 8 . 2221 . 1 1 16 HYP HD1 H -6.314 1.369 0.083 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HD1 . . . . . . . . . c30226_5ug5 1 . 8 . 2222 . 1 1 16 HYP HD22 H -7.872 -0.486 -2.203 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HD22 . . . . . . . . . c30226_5ug5 1 . 8 . 2223 . 1 1 16 HYP HD23 H -6.828 0.931 -1.985 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HD23 . . . . . . . . . c30226_5ug5 1 . 8 . 2224 . 1 1 16 HYP HG H -9.016 0.708 -0.486 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HG . . . . . . . . . c30226_5ug5 1 . 8 . 2225 . 1 1 16 HYP N N -6.199 -0.803 -0.945 . . . 1.0 . . . . . . . . . . . . A . 16 HYP N . . . . . . . . . c30226_5ug5 1 . 8 . 2226 . 1 1 16 HYP O O -7.439 -3.967 0.346 . . . 1.0 . . . . . . . . . . . . A . 16 HYP O . . . . . . . . . c30226_5ug5 1 . 8 . 2227 . 1 1 16 HYP OD1 O -7.258 1.450 0.355 . . . 1.0 . . . . . . . . . . . . A . 16 HYP OD1 . . . . . . . . . c30226_5ug5 1 . 8 . 2228 . 1 1 17 HIS C C -6.098 -5.052 -2.867 . . . 1.0 . . . . . . . . . . . . A . 17 HIS C . . . . . . . . . c30226_5ug5 1 . 8 . 2229 . 1 1 17 HIS CA C -7.416 -4.489 -2.345 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CA . . . . . . . . . c30226_5ug5 1 . 8 . 2230 . 1 1 17 HIS CB C -8.497 -4.443 -3.446 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CB . . . . . . . . . c30226_5ug5 1 . 8 . 2231 . 1 1 17 HIS CD2 C -8.355 -2.503 -5.170 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CD2 . . . . . . . . . c30226_5ug5 1 . 8 . 2232 . 1 1 17 HIS CE1 C -7.249 -3.555 -6.743 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CE1 . . . . . . . . . c30226_5ug5 1 . 8 . 2233 . 1 1 17 HIS CG C -8.110 -3.758 -4.726 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CG . . . . . . . . . c30226_5ug5 1 . 8 . 2234 . 1 1 17 HIS H H -7.014 -2.394 -2.274 . . . 1.0 . . . . . . . . . . . . A . 17 HIS H . . . . . . . . . c30226_5ug5 1 . 8 . 2235 . 1 1 17 HIS HA H -7.760 -5.146 -1.558 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HA . . . . . . . . . c30226_5ug5 1 . 8 . 2236 . 1 1 17 HIS HB2 H -8.777 -5.454 -3.697 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HB2 . . . . . . . . . c30226_5ug5 1 . 8 . 2237 . 1 1 17 HIS HB3 H -9.364 -3.933 -3.053 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HB3 . . . . . . . . . c30226_5ug5 1 . 8 . 2238 . 1 1 17 HIS HD1 H -7.096 -5.323 -5.718 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HD1 . . . . . . . . . c30226_5ug5 1 . 8 . 2239 . 1 1 17 HIS HD2 H -8.882 -1.725 -4.636 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HD2 . . . . . . . . . c30226_5ug5 1 . 8 . 2240 . 1 1 17 HIS HE1 H -6.741 -3.777 -7.670 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HE1 . . . . . . . . . c30226_5ug5 1 . 8 . 2241 . 1 1 17 HIS HE2 H -7.748 -1.577 -6.958 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HE2 . . . . . . . . . c30226_5ug5 1 . 8 . 2242 . 1 1 17 HIS N N -7.176 -3.186 -1.727 . . . 1.0 . . . . . . . . . . . . A . 17 HIS N . . . . . . . . . c30226_5ug5 1 . 8 . 2243 . 1 1 17 HIS ND1 N -7.416 -4.390 -5.736 . . . 1.0 . . . . . . . . . . . . A . 17 HIS ND1 . . . . . . . . . c30226_5ug5 1 . 8 . 2244 . 1 1 17 HIS NE2 N -7.810 -2.404 -6.425 . . . 1.0 . . . . . . . . . . . . A . 17 HIS NE2 . . . . . . . . . c30226_5ug5 1 . 8 . 2245 . 1 1 17 HIS O O -6.063 -6.016 -3.628 . . . 1.0 . . . . . . . . . . . . A . 17 HIS O . . . . . . . . . c30226_5ug5 1 . 8 . 2246 . 1 1 18 VAL C C -3.330 -5.989 -1.685 . . . 1.0 . . . . . . . . . . . . A . 18 VAL C . . . . . . . . . c30226_5ug5 1 . 8 . 2247 . 1 1 18 VAL CA C -3.666 -4.892 -2.683 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CA . . . . . . . . . c30226_5ug5 1 . 8 . 2248 . 1 1 18 VAL CB C -2.673 -3.709 -2.554 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CB . . . . . . . . . c30226_5ug5 1 . 8 . 2249 . 1 1 18 VAL CG1 C -1.406 -4.089 -1.805 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CG1 . . . . . . . . . c30226_5ug5 1 . 8 . 2250 . 1 1 18 VAL CG2 C -2.331 -3.157 -3.920 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CG2 . . . . . . . . . c30226_5ug5 1 . 8 . 2251 . 1 1 18 VAL H H -5.130 -3.584 -1.941 . . . 1.0 . . . . . . . . . . . . A . 18 VAL H . . . . . . . . . c30226_5ug5 1 . 8 . 2252 . 1 1 18 VAL HA H -3.617 -5.284 -3.681 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HA . . . . . . . . . c30226_5ug5 1 . 8 . 2253 . 1 1 18 VAL HB H -3.164 -2.928 -1.996 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HB . . . . . . . . . c30226_5ug5 1 . 8 . 2254 . 1 1 18 VAL HG11 H -0.925 -4.913 -2.305 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG11 . . . . . . . . . c30226_5ug5 1 . 8 . 2255 . 1 1 18 VAL HG12 H -1.663 -4.379 -0.798 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG12 . . . . . . . . . c30226_5ug5 1 . 8 . 2256 . 1 1 18 VAL HG13 H -0.739 -3.243 -1.776 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG13 . . . . . . . . . c30226_5ug5 1 . 8 . 2257 . 1 1 18 VAL HG21 H -1.746 -3.882 -4.466 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG21 . . . . . . . . . c30226_5ug5 1 . 8 . 2258 . 1 1 18 VAL HG22 H -1.764 -2.241 -3.806 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG22 . . . . . . . . . c30226_5ug5 1 . 8 . 2259 . 1 1 18 VAL HG23 H -3.242 -2.950 -4.456 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG23 . . . . . . . . . c30226_5ug5 1 . 8 . 2260 . 1 1 18 VAL N N -5.015 -4.417 -2.437 . . . 1.0 . . . . . . . . . . . . A . 18 VAL N . . . . . . . . . c30226_5ug5 1 . 8 . 2261 . 1 1 18 VAL O O -2.521 -6.880 -1.944 . . . 1.0 . . . . . . . . . . . . A . 18 VAL O . . . . . . . . . c30226_5ug5 1 . 8 . 2262 . 1 1 19 CYS C C -4.829 -6.526 1.631 . . . 1.0 . . . . . . . . . . . . A . 19 CYS C . . . . . . . . . c30226_5ug5 1 . 8 . 2263 . 1 1 19 CYS CA C -3.782 -6.805 0.565 . . . 1.0 . . . . . . . . . . . . A . 19 CYS CA . . . . . . . . . c30226_5ug5 1 . 8 . 2264 . 1 1 19 CYS CB C -2.372 -6.603 1.128 . . . 1.0 . . . . . . . . . . . . A . 19 CYS CB . . . . . . . . . c30226_5ug5 1 . 8 . 2265 . 1 1 19 CYS H H -4.705 -5.236 -0.490 . . . 1.0 . . . . . . . . . . . . A . 19 CYS H . . . . . . . . . c30226_5ug5 1 . 8 . 2266 . 1 1 19 CYS HA H -3.890 -7.823 0.218 . . . 1.0 . . . . . . . . . . . . A . 19 CYS HA . . . . . . . . . c30226_5ug5 1 . 8 . 2267 . 1 1 19 CYS HB2 H -1.652 -6.949 0.402 . . . 1.0 . . . . . . . . . . . . A . 19 CYS HB2 . . . . . . . . . c30226_5ug5 1 . 8 . 2268 . 1 1 19 CYS HB3 H -2.215 -5.549 1.306 . . . 1.0 . . . . . . . . . . . . A . 19 CYS HB3 . . . . . . . . . c30226_5ug5 1 . 8 . 2269 . 1 1 19 CYS N N -4.008 -5.916 -0.560 . . . 1.0 . . . . . . . . . . . . A . 19 CYS N . . . . . . . . . c30226_5ug5 1 . 8 . 2270 . 1 1 19 CYS O O -5.667 -7.410 1.897 . . . 1.0 . . . . . . . . . . . . A . 19 CYS O . . . . . . . . . c30226_5ug5 1 . 8 . 2271 . 1 1 19 CYS OXT O -4.840 -5.395 2.159 . . . 1.0 . . . . . . . . . . . . A . 19 CYS OXT . . . . . . . . . c30226_5ug5 1 . 8 . 2272 . 1 1 19 CYS SG S -2.040 -7.484 2.688 . . . 1.0 . . . . . . . . . . . . A . 19 CYS SG . . . . . . . . . c30226_5ug5 1 . 9 . 2273 . 1 1 1 ILE C C 5.022 3.297 -4.010 . . . 1.0 . . . . . . . . . . . . A . 1 ILE C . . . . . . . . . c30226_5ug5 1 . 9 . 2274 . 1 1 1 ILE CA C 3.712 3.728 -4.658 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CA . . . . . . . . . c30226_5ug5 1 . 9 . 2275 . 1 1 1 ILE CB C 3.320 2.729 -5.779 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CB . . . . . . . . . c30226_5ug5 1 . 9 . 2276 . 1 1 1 ILE CD1 C 2.635 0.310 -6.236 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CD1 . . . . . . . . . c30226_5ug5 1 . 9 . 2277 . 1 1 1 ILE CG1 C 3.082 1.327 -5.207 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CG1 . . . . . . . . . c30226_5ug5 1 . 9 . 2278 . 1 1 1 ILE CG2 C 4.383 2.692 -6.868 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CG2 . . . . . . . . . c30226_5ug5 1 . 9 . 2279 . 1 1 1 ILE H1 H 4.598 5.153 -5.889 . . . 1.0 . . . . . . . . . . . . A . 1 ILE H1 . . . . . . . . . c30226_5ug5 1 . 9 . 2280 . 1 1 1 ILE H2 H 4.068 5.761 -4.404 . . . 1.0 . . . . . . . . . . . . A . 1 ILE H2 . . . . . . . . . c30226_5ug5 1 . 9 . 2281 . 1 1 1 ILE H3 H 2.949 5.412 -5.619 . . . 1.0 . . . . . . . . . . . . A . 1 ILE H3 . . . . . . . . . c30226_5ug5 1 . 9 . 2282 . 1 1 1 ILE HA H 2.936 3.720 -3.908 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HA . . . . . . . . . c30226_5ug5 1 . 9 . 2283 . 1 1 1 ILE HB H 2.405 3.080 -6.226 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HB . . . . . . . . . c30226_5ug5 1 . 9 . 2284 . 1 1 1 ILE HD11 H 2.497 -0.649 -5.758 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HD11 . . . . . . . . . c30226_5ug5 1 . 9 . 2285 . 1 1 1 ILE HD12 H 3.388 0.222 -7.007 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HD12 . . . . . . . . . c30226_5ug5 1 . 9 . 2286 . 1 1 1 ILE HD13 H 1.704 0.629 -6.677 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HD13 . . . . . . . . . c30226_5ug5 1 . 9 . 2287 . 1 1 1 ILE HG12 H 3.999 0.967 -4.766 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG12 . . . . . . . . . c30226_5ug5 1 . 9 . 2288 . 1 1 1 ILE HG13 H 2.320 1.383 -4.444 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG13 . . . . . . . . . c30226_5ug5 1 . 9 . 2289 . 1 1 1 ILE HG21 H 4.419 3.647 -7.369 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG21 . . . . . . . . . c30226_5ug5 1 . 9 . 2290 . 1 1 1 ILE HG22 H 4.142 1.918 -7.582 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG22 . . . . . . . . . c30226_5ug5 1 . 9 . 2291 . 1 1 1 ILE HG23 H 5.345 2.483 -6.424 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG23 . . . . . . . . . c30226_5ug5 1 . 9 . 2292 . 1 1 1 ILE N N 3.838 5.108 -5.181 . . . 1.0 . . . . . . . . . . . . A . 1 ILE N . . . . . . . . . c30226_5ug5 1 . 9 . 2293 . 1 1 1 ILE O O 6.088 3.814 -4.345 . . . 1.0 . . . . . . . . . . . . A . 1 ILE O . . . . . . . . . c30226_5ug5 1 . 9 . 2294 . 1 1 2 ARG C C 6.195 0.365 -2.484 . . . 1.0 . . . . . . . . . . . . A . 2 ARG C . . . . . . . . . c30226_5ug5 1 . 9 . 2295 . 1 1 2 ARG CA C 6.102 1.876 -2.367 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CA . . . . . . . . . c30226_5ug5 1 . 9 . 2296 . 1 1 2 ARG CB C 6.044 2.280 -0.894 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CB . . . . . . . . . c30226_5ug5 1 . 9 . 2297 . 1 1 2 ARG CD C 6.264 4.110 0.810 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CD . . . . . . . . . c30226_5ug5 1 . 9 . 2298 . 1 1 2 ARG CG C 6.172 3.777 -0.668 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CG . . . . . . . . . c30226_5ug5 1 . 9 . 2299 . 1 1 2 ARG CZ C 6.354 6.110 2.249 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CZ . . . . . . . . . c30226_5ug5 1 . 9 . 2300 . 1 1 2 ARG H H 4.060 1.985 -2.862 . . . 1.0 . . . . . . . . . . . . A . 2 ARG H . . . . . . . . . c30226_5ug5 1 . 9 . 2301 . 1 1 2 ARG HA H 6.969 2.317 -2.822 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HA . . . . . . . . . c30226_5ug5 1 . 9 . 2302 . 1 1 2 ARG HB2 H 5.099 1.954 -0.482 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB2 . . . . . . . . . c30226_5ug5 1 . 9 . 2303 . 1 1 2 ARG HB3 H 6.842 1.788 -0.365 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB3 . . . . . . . . . c30226_5ug5 1 . 9 . 2304 . 1 1 2 ARG HD2 H 5.424 3.662 1.319 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD2 . . . . . . . . . c30226_5ug5 1 . 9 . 2305 . 1 1 2 ARG HD3 H 7.182 3.699 1.204 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD3 . . . . . . . . . c30226_5ug5 1 . 9 . 2306 . 1 1 2 ARG HE H 6.136 6.131 0.259 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HE . . . . . . . . . c30226_5ug5 1 . 9 . 2307 . 1 1 2 ARG HG2 H 7.064 4.132 -1.163 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG2 . . . . . . . . . c30226_5ug5 1 . 9 . 2308 . 1 1 2 ARG HG3 H 5.308 4.270 -1.088 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG3 . . . . . . . . . c30226_5ug5 1 . 9 . 2309 . 1 1 2 ARG HH11 H 6.576 4.360 3.250 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH11 . . . . . . . . . c30226_5ug5 1 . 9 . 2310 . 1 1 2 ARG HH12 H 6.602 5.787 4.236 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH12 . . . . . . . . . c30226_5ug5 1 . 9 . 2311 . 1 1 2 ARG HH21 H 6.163 8.004 1.559 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH21 . . . . . . . . . c30226_5ug5 1 . 9 . 2312 . 1 1 2 ARG HH22 H 6.358 7.855 3.274 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH22 . . . . . . . . . c30226_5ug5 1 . 9 . 2313 . 1 1 2 ARG N N 4.934 2.367 -3.072 . . . 1.0 . . . . . . . . . . . . A . 2 ARG N . . . . . . . . . c30226_5ug5 1 . 9 . 2314 . 1 1 2 ARG NE N 6.248 5.548 1.047 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NE . . . . . . . . . c30226_5ug5 1 . 9 . 2315 . 1 1 2 ARG NH1 N 6.525 5.358 3.330 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH1 . . . . . . . . . c30226_5ug5 1 . 9 . 2316 . 1 1 2 ARG NH2 N 6.290 7.427 2.370 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH2 . . . . . . . . . c30226_5ug5 1 . 9 . 2317 . 1 1 2 ARG O O 5.181 -0.316 -2.630 . . . 1.0 . . . . . . . . . . . . A . 2 ARG O . . . . . . . . . c30226_5ug5 1 . 9 . 2318 . 1 1 3 ASP C C 7.395 -2.287 -1.208 . . . 1.0 . . . . . . . . . . . . A . 3 ASP C . . . . . . . . . c30226_5ug5 1 . 9 . 2319 . 1 1 3 ASP CA C 7.656 -1.585 -2.523 . . . 1.0 . . . . . . . . . . . . A . 3 ASP CA . . . . . . . . . c30226_5ug5 1 . 9 . 2320 . 1 1 3 ASP CB C 9.085 -1.836 -3.001 . . . 1.0 . . . . . . . . . . . . A . 3 ASP CB . . . . . . . . . c30226_5ug5 1 . 9 . 2321 . 1 1 3 ASP CG C 9.303 -1.429 -4.446 . . . 1.0 . . . . . . . . . . . . A . 3 ASP CG . . . . . . . . . c30226_5ug5 1 . 9 . 2322 . 1 1 3 ASP H H 8.175 0.433 -2.222 . . . 1.0 . . . . . . . . . . . . A . 3 ASP H . . . . . . . . . c30226_5ug5 1 . 9 . 2323 . 1 1 3 ASP HA H 6.964 -1.958 -3.242 . . . 1.0 . . . . . . . . . . . . A . 3 ASP HA . . . . . . . . . c30226_5ug5 1 . 9 . 2324 . 1 1 3 ASP HB2 H 9.767 -1.271 -2.384 . . . 1.0 . . . . . . . . . . . . A . 3 ASP HB2 . . . . . . . . . c30226_5ug5 1 . 9 . 2325 . 1 1 3 ASP HB3 H 9.305 -2.879 -2.902 . . . 1.0 . . . . . . . . . . . . A . 3 ASP HB3 . . . . . . . . . c30226_5ug5 1 . 9 . 2326 . 1 1 3 ASP N N 7.413 -0.157 -2.391 . . . 1.0 . . . . . . . . . . . . A . 3 ASP N . . . . . . . . . c30226_5ug5 1 . 9 . 2327 . 1 1 3 ASP O O 7.605 -3.491 -1.051 . . . 1.0 . . . . . . . . . . . . A . 3 ASP O . . . . . . . . . c30226_5ug5 1 . 9 . 2328 . 1 1 3 ASP OD1 O 9.216 -2.303 -5.340 . . . 1.0 . . . . . . . . . . . . A . 3 ASP OD1 . . . . . . . . . c30226_5ug5 1 . 9 . 2329 . 1 1 3 ASP OD2 O 9.565 -0.234 -4.697 . . . 1.0 . . . . . . . . . . . . A . 3 ASP OD2 . . . . . . . . . c30226_5ug5 1 . 9 . 2330 . 1 1 4 GLU C C 4.992 -1.724 1.131 . . . 1.0 . . . . . . . . . . . . A . 4 GLU C . . . . . . . . . c30226_5ug5 1 . 9 . 2331 . 1 1 4 GLU CA C 6.493 -1.927 1.020 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CA . . . . . . . . . c30226_5ug5 1 . 9 . 2332 . 1 1 4 GLU CB C 7.198 -1.101 2.087 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CB . . . . . . . . . c30226_5ug5 1 . 9 . 2333 . 1 1 4 GLU CD C 8.524 -2.948 3.160 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CD . . . . . . . . . c30226_5ug5 1 . 9 . 2334 . 1 1 4 GLU CG C 8.579 -1.610 2.460 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CG . . . . . . . . . c30226_5ug5 1 . 9 . 2335 . 1 1 4 GLU H H 6.854 -0.549 -0.510 . . . 1.0 . . . . . . . . . . . . A . 4 GLU H . . . . . . . . . c30226_5ug5 1 . 9 . 2336 . 1 1 4 GLU HA H 6.735 -2.967 1.141 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HA . . . . . . . . . c30226_5ug5 1 . 9 . 2337 . 1 1 4 GLU HB2 H 7.303 -0.094 1.721 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HB2 . . . . . . . . . c30226_5ug5 1 . 9 . 2338 . 1 1 4 GLU HB3 H 6.588 -1.087 2.967 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HB3 . . . . . . . . . c30226_5ug5 1 . 9 . 2339 . 1 1 4 GLU HG2 H 9.167 -1.715 1.562 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HG2 . . . . . . . . . c30226_5ug5 1 . 9 . 2340 . 1 1 4 GLU HG3 H 9.049 -0.894 3.119 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HG3 . . . . . . . . . c30226_5ug5 1 . 9 . 2341 . 1 1 4 GLU N N 6.925 -1.492 -0.289 . . . 1.0 . . . . . . . . . . . . A . 4 GLU N . . . . . . . . . c30226_5ug5 1 . 9 . 2342 . 1 1 4 GLU O O 4.452 -1.570 2.219 . . . 1.0 . . . . . . . . . . . . A . 4 GLU O . . . . . . . . . c30226_5ug5 1 . 9 . 2343 . 1 1 4 GLU OE1 O 8.747 -3.979 2.496 . . . 1.0 . . . . . . . . . . . . A . 4 GLU OE1 . . . . . . . . . c30226_5ug5 1 . 9 . 2344 . 1 1 4 GLU OE2 O 8.245 -2.974 4.378 . . . 1.0 . . . . . . . . . . . . A . 4 GLU OE2 . . . . . . . . . c30226_5ug5 1 . 9 . 2345 . 1 1 5 CYS C C 2.012 -1.961 0.838 . . . 1.0 . . . . . . . . . . . . A . 5 CYS C . . . . . . . . . c30226_5ug5 1 . 9 . 2346 . 1 1 5 CYS CA C 2.954 -1.281 -0.155 . . . 1.0 . . . . . . . . . . . . A . 5 CYS CA . . . . . . . . . c30226_5ug5 1 . 9 . 2347 . 1 1 5 CYS CB C 2.465 -1.518 -1.585 . . . 1.0 . . . . . . . . . . . . A . 5 CYS CB . . . . . . . . . c30226_5ug5 1 . 9 . 2348 . 1 1 5 CYS H H 4.804 -2.049 -0.823 . . . 1.0 . . . . . . . . . . . . A . 5 CYS H . . . . . . . . . c30226_5ug5 1 . 9 . 2349 . 1 1 5 CYS HA H 2.941 -0.219 0.038 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HA . . . . . . . . . c30226_5ug5 1 . 9 . 2350 . 1 1 5 CYS HB2 H 3.289 -1.379 -2.270 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HB2 . . . . . . . . . c30226_5ug5 1 . 9 . 2351 . 1 1 5 CYS HB3 H 2.100 -2.531 -1.669 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HB3 . . . . . . . . . c30226_5ug5 1 . 9 . 2352 . 1 1 5 CYS N N 4.336 -1.729 -0.023 . . . 1.0 . . . . . . . . . . . . A . 5 CYS N . . . . . . . . . c30226_5ug5 1 . 9 . 2353 . 1 1 5 CYS O O 1.182 -1.300 1.461 . . . 1.0 . . . . . . . . . . . . A . 5 CYS O . . . . . . . . . c30226_5ug5 1 . 9 . 2354 . 1 1 5 CYS SG S 1.122 -0.403 -2.097 . . . 1.0 . . . . . . . . . . . . A . 5 CYS SG . . . . . . . . . c30226_5ug5 1 . 9 . 2355 . 1 1 6 CYS C C 1.410 -3.679 3.297 . . . 1.0 . . . . . . . . . . . . A . 6 CYS C . . . . . . . . . c30226_5ug5 1 . 9 . 2356 . 1 1 6 CYS CA C 1.243 -4.043 1.830 . . . 1.0 . . . . . . . . . . . . A . 6 CYS CA . . . . . . . . . c30226_5ug5 1 . 9 . 2357 . 1 1 6 CYS CB C 1.476 -5.539 1.621 . . . 1.0 . . . . . . . . . . . . A . 6 CYS CB . . . . . . . . . c30226_5ug5 1 . 9 . 2358 . 1 1 6 CYS H H 2.929 -3.716 0.590 . . . 1.0 . . . . . . . . . . . . A . 6 CYS H . . . . . . . . . c30226_5ug5 1 . 9 . 2359 . 1 1 6 CYS HA H 0.238 -3.798 1.523 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HA . . . . . . . . . c30226_5ug5 1 . 9 . 2360 . 1 1 6 CYS HB2 H 1.458 -5.757 0.565 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HB2 . . . . . . . . . c30226_5ug5 1 . 9 . 2361 . 1 1 6 CYS HB3 H 2.443 -5.803 2.021 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HB3 . . . . . . . . . c30226_5ug5 1 . 9 . 2362 . 1 1 6 CYS N N 2.164 -3.266 1.008 . . . 1.0 . . . . . . . . . . . . A . 6 CYS N . . . . . . . . . c30226_5ug5 1 . 9 . 2363 . 1 1 6 CYS O O 0.445 -3.665 4.063 . . . 1.0 . . . . . . . . . . . . A . 6 CYS O . . . . . . . . . c30226_5ug5 1 . 9 . 2364 . 1 1 6 CYS SG S 0.237 -6.605 2.425 . . . 1.0 . . . . . . . . . . . . A . 6 CYS SG . . . . . . . . . c30226_5ug5 1 . 9 . 2365 . 1 1 7 SER C C 2.603 -1.442 5.185 . . . 1.0 . . . . . . . . . . . . A . 7 SER C . . . . . . . . . c30226_5ug5 1 . 9 . 2366 . 1 1 7 SER CA C 2.927 -2.910 5.021 . . . 1.0 . . . . . . . . . . . . A . 7 SER CA . . . . . . . . . c30226_5ug5 1 . 9 . 2367 . 1 1 7 SER CB C 4.401 -3.096 5.335 . . . 1.0 . . . . . . . . . . . . A . 7 SER CB . . . . . . . . . c30226_5ug5 1 . 9 . 2368 . 1 1 7 SER H H 3.376 -3.454 3.032 . . . 1.0 . . . . . . . . . . . . A . 7 SER H . . . . . . . . . c30226_5ug5 1 . 9 . 2369 . 1 1 7 SER HA H 2.342 -3.488 5.713 . . . 1.0 . . . . . . . . . . . . A . 7 SER HA . . . . . . . . . c30226_5ug5 1 . 9 . 2370 . 1 1 7 SER HB2 H 4.975 -2.904 4.441 . . . 1.0 . . . . . . . . . . . . A . 7 SER HB2 . . . . . . . . . c30226_5ug5 1 . 9 . 2371 . 1 1 7 SER HB3 H 4.683 -2.383 6.099 . . . 1.0 . . . . . . . . . . . . A . 7 SER HB3 . . . . . . . . . c30226_5ug5 1 . 9 . 2372 . 1 1 7 SER HG H 3.932 -4.988 5.578 . . . 1.0 . . . . . . . . . . . . A . 7 SER HG . . . . . . . . . c30226_5ug5 1 . 9 . 2373 . 1 1 7 SER N N 2.638 -3.368 3.677 . . . 1.0 . . . . . . . . . . . . A . 7 SER N . . . . . . . . . c30226_5ug5 1 . 9 . 2374 . 1 1 7 SER O O 2.124 -1.011 6.231 . . . 1.0 . . . . . . . . . . . . A . 7 SER O . . . . . . . . . c30226_5ug5 1 . 9 . 2375 . 1 1 7 SER OG O 4.683 -4.414 5.778 . . . 1.0 . . . . . . . . . . . . A . 7 SER OG . . . . . . . . . c30226_5ug5 1 . 9 . 2376 . 1 1 8 ASN C C 1.553 1.395 4.229 . . . 1.0 . . . . . . . . . . . . A . 8 ASN C . . . . . . . . . c30226_5ug5 1 . 9 . 2377 . 1 1 8 ASN CA C 2.937 0.756 4.283 . . . 1.0 . . . . . . . . . . . . A . 8 ASN CA . . . . . . . . . c30226_5ug5 1 . 9 . 2378 . 1 1 8 ASN CB C 3.833 1.334 3.189 . . . 1.0 . . . . . . . . . . . . A . 8 ASN CB . . . . . . . . . c30226_5ug5 1 . 9 . 2379 . 1 1 8 ASN CG C 4.299 2.740 3.499 . . . 1.0 . . . . . . . . . . . . A . 8 ASN CG . . . . . . . . . c30226_5ug5 1 . 9 . 2380 . 1 1 8 ASN H H 2.964 -1.090 3.251 . . . 1.0 . . . . . . . . . . . . A . 8 ASN H . . . . . . . . . c30226_5ug5 1 . 9 . 2381 . 1 1 8 ASN HA H 3.391 0.947 5.247 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HA . . . . . . . . . c30226_5ug5 1 . 9 . 2382 . 1 1 8 ASN HB2 H 4.702 0.703 3.071 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HB2 . . . . . . . . . c30226_5ug5 1 . 9 . 2383 . 1 1 8 ASN HB3 H 3.278 1.352 2.262 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HB3 . . . . . . . . . c30226_5ug5 1 . 9 . 2384 . 1 1 8 ASN HD21 H 2.868 3.513 2.363 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HD21 . . . . . . . . . c30226_5ug5 1 . 9 . 2385 . 1 1 8 ASN HD22 H 3.904 4.652 3.145 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HD22 . . . . . . . . . c30226_5ug5 1 . 9 . 2386 . 1 1 8 ASN N N 2.851 -0.678 4.143 . . . 1.0 . . . . . . . . . . . . A . 8 ASN N . . . . . . . . . c30226_5ug5 1 . 9 . 2387 . 1 1 8 ASN ND2 N 3.623 3.732 2.946 . . . 1.0 . . . . . . . . . . . . A . 8 ASN ND2 . . . . . . . . . c30226_5ug5 1 . 9 . 2388 . 1 1 8 ASN O O 0.886 1.363 3.191 . . . 1.0 . . . . . . . . . . . . A . 8 ASN O . . . . . . . . . c30226_5ug5 1 . 9 . 2389 . 1 1 8 ASN OD1 O 5.291 2.931 4.201 . . . 1.0 . . . . . . . . . . . . A . 8 ASN OD1 . . . . . . . . . c30226_5ug5 1 . 9 . 2390 . 1 1 9 PRO C C -0.545 3.607 4.406 . . . 1.0 . . . . . . . . . . . . A . 9 PRO C . . . . . . . . . c30226_5ug5 1 . 9 . 2391 . 1 1 9 PRO CA C -0.223 2.590 5.493 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CA . . . . . . . . . c30226_5ug5 1 . 9 . 2392 . 1 1 9 PRO CB C -0.131 3.286 6.851 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CB . . . . . . . . . c30226_5ug5 1 . 9 . 2393 . 1 1 9 PRO CD C 1.892 2.156 6.594 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CD . . . . . . . . . c30226_5ug5 1 . 9 . 2394 . 1 1 9 PRO CG C 0.846 2.491 7.602 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CG . . . . . . . . . c30226_5ug5 1 . 9 . 2395 . 1 1 9 PRO HA H -0.994 1.835 5.524 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HA . . . . . . . . . c30226_5ug5 1 . 9 . 2396 . 1 1 9 PRO HB2 H 0.237 4.280 6.712 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HB2 . . . . . . . . . c30226_5ug5 1 . 9 . 2397 . 1 1 9 PRO HB3 H -1.095 3.301 7.332 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HB3 . . . . . . . . . c30226_5ug5 1 . 9 . 2398 . 1 1 9 PRO HD2 H 2.607 2.959 6.507 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HD2 . . . . . . . . . c30226_5ug5 1 . 9 . 2399 . 1 1 9 PRO HD3 H 2.374 1.251 6.861 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HD3 . . . . . . . . . c30226_5ug5 1 . 9 . 2400 . 1 1 9 PRO HG2 H 1.260 3.088 8.398 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HG2 . . . . . . . . . c30226_5ug5 1 . 9 . 2401 . 1 1 9 PRO HG3 H 0.388 1.594 7.989 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HG3 . . . . . . . . . c30226_5ug5 1 . 9 . 2402 . 1 1 9 PRO N N 1.113 1.997 5.350 . . . 1.0 . . . . . . . . . . . . A . 9 PRO N . . . . . . . . . c30226_5ug5 1 . 9 . 2403 . 1 1 9 PRO O O -1.689 3.715 3.967 . . . 1.0 . . . . . . . . . . . . A . 9 PRO O . . . . . . . . . c30226_5ug5 1 . 9 . 2404 . 1 1 10 ALA C C 0.118 4.748 1.565 . . . 1.0 . . . . . . . . . . . . A . 10 ALA C . . . . . . . . . c30226_5ug5 1 . 9 . 2405 . 1 1 10 ALA CA C 0.292 5.363 2.952 . . . 1.0 . . . . . . . . . . . . A . 10 ALA CA . . . . . . . . . c30226_5ug5 1 . 9 . 2406 . 1 1 10 ALA CB C 1.472 6.323 2.961 . . . 1.0 . . . . . . . . . . . . A . 10 ALA CB . . . . . . . . . c30226_5ug5 1 . 9 . 2407 . 1 1 10 ALA H H 1.358 4.208 4.371 . . . 1.0 . . . . . . . . . . . . A . 10 ALA H . . . . . . . . . c30226_5ug5 1 . 9 . 2408 . 1 1 10 ALA HA H -0.597 5.925 3.197 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HA . . . . . . . . . c30226_5ug5 1 . 9 . 2409 . 1 1 10 ALA HB1 H 1.291 7.121 2.257 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HB1 . . . . . . . . . c30226_5ug5 1 . 9 . 2410 . 1 1 10 ALA HB2 H 2.369 5.792 2.683 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HB2 . . . . . . . . . c30226_5ug5 1 . 9 . 2411 . 1 1 10 ALA HB3 H 1.591 6.738 3.952 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HB3 . . . . . . . . . c30226_5ug5 1 . 9 . 2412 . 1 1 10 ALA N N 0.469 4.342 3.976 . . . 1.0 . . . . . . . . . . . . A . 10 ALA N . . . . . . . . . c30226_5ug5 1 . 9 . 2413 . 1 1 10 ALA O O -0.387 5.397 0.654 . . . 1.0 . . . . . . . . . . . . A . 10 ALA O . . . . . . . . . c30226_5ug5 1 . 9 . 2414 . 1 1 11 CYS C C -0.882 2.213 0.049 . . . 1.0 . . . . . . . . . . . . A . 11 CYS C . . . . . . . . . c30226_5ug5 1 . 9 . 2415 . 1 1 11 CYS CA C 0.452 2.854 0.105 . . . 1.0 . . . . . . . . . . . . A . 11 CYS CA . . . . . . . . . c30226_5ug5 1 . 9 . 2416 . 1 1 11 CYS CB C 1.566 1.830 -0.075 . . . 1.0 . . . . . . . . . . . . A . 11 CYS CB . . . . . . . . . c30226_5ug5 1 . 9 . 2417 . 1 1 11 CYS H H 0.656 2.920 2.199 . . . 1.0 . . . . . . . . . . . . A . 11 CYS H . . . . . . . . . c30226_5ug5 1 . 9 . 2418 . 1 1 11 CYS HA H 0.513 3.606 -0.657 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HA . . . . . . . . . c30226_5ug5 1 . 9 . 2419 . 1 1 11 CYS HB2 H 2.474 2.213 0.370 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HB2 . . . . . . . . . c30226_5ug5 1 . 9 . 2420 . 1 1 11 CYS HB3 H 1.284 0.910 0.424 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HB3 . . . . . . . . . c30226_5ug5 1 . 9 . 2421 . 1 1 11 CYS N N 0.509 3.486 1.408 . . . 1.0 . . . . . . . . . . . . A . 11 CYS N . . . . . . . . . c30226_5ug5 1 . 9 . 2422 . 1 1 11 CYS O O -1.604 2.237 -0.944 . . . 1.0 . . . . . . . . . . . . A . 11 CYS O . . . . . . . . . c30226_5ug5 1 . 9 . 2423 . 1 1 11 CYS SG S 1.922 1.438 -1.819 . . . 1.0 . . . . . . . . . . . . A . 11 CYS SG . . . . . . . . . c30226_5ug5 1 . 9 . 2424 . 1 1 12 ARG C C -3.595 2.118 1.308 . . . 1.0 . . . . . . . . . . . . A . 12 ARG C . . . . . . . . . c30226_5ug5 1 . 9 . 2425 . 1 1 12 ARG CA C -2.454 1.120 1.517 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CA . . . . . . . . . c30226_5ug5 1 . 9 . 2426 . 1 1 12 ARG CB C -2.383 0.633 2.943 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CB . . . . . . . . . c30226_5ug5 1 . 9 . 2427 . 1 1 12 ARG CD C -0.984 -0.996 4.252 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CD . . . . . . . . . c30226_5ug5 1 . 9 . 2428 . 1 1 12 ARG CG C -1.871 -0.791 3.041 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CG . . . . . . . . . c30226_5ug5 1 . 9 . 2429 . 1 1 12 ARG CZ C -1.468 -1.519 6.616 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CZ . . . . . . . . . c30226_5ug5 1 . 9 . 2430 . 1 1 12 ARG H H -0.478 1.603 1.885 . . . 1.0 . . . . . . . . . . . . A . 12 ARG H . . . . . . . . . c30226_5ug5 1 . 9 . 2431 . 1 1 12 ARG HA H -2.596 0.283 0.877 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HA . . . . . . . . . c30226_5ug5 1 . 9 . 2432 . 1 1 12 ARG HB2 H -1.712 1.276 3.497 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HB2 . . . . . . . . . c30226_5ug5 1 . 9 . 2433 . 1 1 12 ARG HB3 H -3.349 0.691 3.374 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HB3 . . . . . . . . . c30226_5ug5 1 . 9 . 2434 . 1 1 12 ARG HD2 H -0.588 -2.001 4.222 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HD2 . . . . . . . . . c30226_5ug5 1 . 9 . 2435 . 1 1 12 ARG HD3 H -0.164 -0.287 4.201 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HD3 . . . . . . . . . c30226_5ug5 1 . 9 . 2436 . 1 1 12 ARG HE H -2.403 -0.120 5.531 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HE . . . . . . . . . c30226_5ug5 1 . 9 . 2437 . 1 1 12 ARG HG2 H -2.711 -1.457 3.109 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HG2 . . . . . . . . . c30226_5ug5 1 . 9 . 2438 . 1 1 12 ARG HG3 H -1.303 -1.017 2.151 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HG3 . . . . . . . . . c30226_5ug5 1 . 9 . 2439 . 1 1 12 ARG HH11 H -0.042 -2.699 5.778 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH11 . . . . . . . . . c30226_5ug5 1 . 9 . 2440 . 1 1 12 ARG HH12 H -0.379 -3.018 7.449 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH12 . . . . . . . . . c30226_5ug5 1 . 9 . 2441 . 1 1 12 ARG HH21 H -2.864 -0.553 7.723 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH21 . . . . . . . . . c30226_5ug5 1 . 9 . 2442 . 1 1 12 ARG HH22 H -1.990 -1.803 8.553 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH22 . . . . . . . . . c30226_5ug5 1 . 9 . 2443 . 1 1 12 ARG N N -1.184 1.666 1.202 . . . 1.0 . . . . . . . . . . . . A . 12 ARG N . . . . . . . . . c30226_5ug5 1 . 9 . 2444 . 1 1 12 ARG NE N -1.703 -0.811 5.510 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NE . . . . . . . . . c30226_5ug5 1 . 9 . 2445 . 1 1 12 ARG NH1 N -0.557 -2.489 6.614 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NH1 . . . . . . . . . c30226_5ug5 1 . 9 . 2446 . 1 1 12 ARG NH2 N -2.162 -1.270 7.719 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NH2 . . . . . . . . . c30226_5ug5 1 . 9 . 2447 . 1 1 12 ARG O O -4.745 1.723 1.134 . . . 1.0 . . . . . . . . . . . . A . 12 ARG O . . . . . . . . . c30226_5ug5 1 . 9 . 2448 . 1 1 13 TYR C C -4.766 4.261 -0.441 . . . 1.0 . . . . . . . . . . . . A . 13 TYR C . . . . . . . . . c30226_5ug5 1 . 9 . 2449 . 1 1 13 TYR CA C -4.248 4.432 0.990 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CA . . . . . . . . . c30226_5ug5 1 . 9 . 2450 . 1 1 13 TYR CB C -3.616 5.805 1.167 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CB . . . . . . . . . c30226_5ug5 1 . 9 . 2451 . 1 1 13 TYR CD1 C -5.675 7.170 1.528 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CD1 . . . . . . . . . c30226_5ug5 1 . 9 . 2452 . 1 1 13 TYR CD2 C -4.235 7.743 -0.259 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CD2 . . . . . . . . . c30226_5ug5 1 . 9 . 2453 . 1 1 13 TYR CE1 C -6.519 8.206 1.191 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CE1 . . . . . . . . . c30226_5ug5 1 . 9 . 2454 . 1 1 13 TYR CE2 C -5.062 8.780 -0.608 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CE2 . . . . . . . . . c30226_5ug5 1 . 9 . 2455 . 1 1 13 TYR CG C -4.529 6.929 0.808 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CG . . . . . . . . . c30226_5ug5 1 . 9 . 2456 . 1 1 13 TYR CZ C -6.208 9.011 0.121 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CZ . . . . . . . . . c30226_5ug5 1 . 9 . 2457 . 1 1 13 TYR H H -2.367 3.680 1.533 . . . 1.0 . . . . . . . . . . . . A . 13 TYR H . . . . . . . . . c30226_5ug5 1 . 9 . 2458 . 1 1 13 TYR HA H -5.072 4.335 1.674 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HA . . . . . . . . . c30226_5ug5 1 . 9 . 2459 . 1 1 13 TYR HB2 H -3.316 5.933 2.195 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HB2 . . . . . . . . . c30226_5ug5 1 . 9 . 2460 . 1 1 13 TYR HB3 H -2.754 5.879 0.532 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HB3 . . . . . . . . . c30226_5ug5 1 . 9 . 2461 . 1 1 13 TYR HD1 H -5.905 6.532 2.364 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HD1 . . . . . . . . . c30226_5ug5 1 . 9 . 2462 . 1 1 13 TYR HD2 H -3.336 7.552 -0.824 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HD2 . . . . . . . . . c30226_5ug5 1 . 9 . 2463 . 1 1 13 TYR HE1 H -7.409 8.381 1.765 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HE1 . . . . . . . . . c30226_5ug5 1 . 9 . 2464 . 1 1 13 TYR HE2 H -4.811 9.402 -1.443 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HE2 . . . . . . . . . c30226_5ug5 1 . 9 . 2465 . 1 1 13 TYR HH H -7.237 10.000 -1.170 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HH . . . . . . . . . c30226_5ug5 1 . 9 . 2466 . 1 1 13 TYR N N -3.276 3.406 1.307 . . . 1.0 . . . . . . . . . . . . A . 13 TYR N . . . . . . . . . c30226_5ug5 1 . 9 . 2467 . 1 1 13 TYR O O -5.901 4.613 -0.751 . . . 1.0 . . . . . . . . . . . . A . 13 TYR O . . . . . . . . . c30226_5ug5 1 . 9 . 2468 . 1 1 13 TYR OH O -7.047 10.049 -0.223 . . . 1.0 . . . . . . . . . . . . A . 13 TYR OH . . . . . . . . . c30226_5ug5 1 . 9 . 2469 . 1 1 14 ASN C C -4.397 1.926 -2.866 . . . 1.0 . . . . . . . . . . . . A . 14 ASN C . . . . . . . . . c30226_5ug5 1 . 9 . 2470 . 1 1 14 ASN CA C -4.307 3.434 -2.684 . . . 1.0 . . . . . . . . . . . . A . 14 ASN CA . . . . . . . . . c30226_5ug5 1 . 9 . 2471 . 1 1 14 ASN CB C -3.267 4.027 -3.643 . . . 1.0 . . . . . . . . . . . . A . 14 ASN CB . . . . . . . . . c30226_5ug5 1 . 9 . 2472 . 1 1 14 ASN CG C -3.721 4.008 -5.090 . . . 1.0 . . . . . . . . . . . . A . 14 ASN CG . . . . . . . . . c30226_5ug5 1 . 9 . 2473 . 1 1 14 ASN H H -3.031 3.424 -0.996 . . . 1.0 . . . . . . . . . . . . A . 14 ASN H . . . . . . . . . c30226_5ug5 1 . 9 . 2474 . 1 1 14 ASN HA H -5.273 3.879 -2.869 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HA . . . . . . . . . c30226_5ug5 1 . 9 . 2475 . 1 1 14 ASN HB2 H -3.074 5.052 -3.362 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HB2 . . . . . . . . . c30226_5ug5 1 . 9 . 2476 . 1 1 14 ASN HB3 H -2.352 3.460 -3.563 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HB3 . . . . . . . . . c30226_5ug5 1 . 9 . 2477 . 1 1 14 ASN HD21 H -1.864 3.637 -5.691 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HD21 . . . . . . . . . c30226_5ug5 1 . 9 . 2478 . 1 1 14 ASN HD22 H -3.052 3.757 -6.943 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HD22 . . . . . . . . . c30226_5ug5 1 . 9 . 2479 . 1 1 14 ASN N N -3.928 3.700 -1.302 . . . 1.0 . . . . . . . . . . . . A . 14 ASN N . . . . . . . . . c30226_5ug5 1 . 9 . 2480 . 1 1 14 ASN ND2 N -2.786 3.780 -6.000 . . . 1.0 . . . . . . . . . . . . A . 14 ASN ND2 . . . . . . . . . c30226_5ug5 1 . 9 . 2481 . 1 1 14 ASN O O -4.546 1.403 -3.972 . . . 1.0 . . . . . . . . . . . . A . 14 ASN O . . . . . . . . . c30226_5ug5 1 . 9 . 2482 . 1 1 14 ASN OD1 O -4.903 4.185 -5.387 . . . 1.0 . . . . . . . . . . . . A . 14 ASN OD1 . . . . . . . . . c30226_5ug5 1 . 9 . 2483 . 1 1 15 ASN C C -4.956 -0.788 -0.511 . . . 1.0 . . . . . . . . . . . . A . 15 ASN C . . . . . . . . . c30226_5ug5 1 . 9 . 2484 . 1 1 15 ASN CA C -4.189 -0.207 -1.711 . . . 1.0 . . . . . . . . . . . . A . 15 ASN CA . . . . . . . . . c30226_5ug5 1 . 9 . 2485 . 1 1 15 ASN CB C -2.684 -0.494 -1.712 . . . 1.0 . . . . . . . . . . . . A . 15 ASN CB . . . . . . . . . c30226_5ug5 1 . 9 . 2486 . 1 1 15 ASN CG C -2.193 -1.658 -0.868 . . . 1.0 . . . . . . . . . . . . A . 15 ASN CG . . . . . . . . . c30226_5ug5 1 . 9 . 2487 . 1 1 15 ASN H H -4.324 1.728 -0.890 . . . 1.0 . . . . . . . . . . . . A . 15 ASN H . . . . . . . . . c30226_5ug5 1 . 9 . 2488 . 1 1 15 ASN HA H -4.625 -0.591 -2.617 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HA . . . . . . . . . c30226_5ug5 1 . 9 . 2489 . 1 1 15 ASN HB2 H -2.373 -0.677 -2.728 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HB2 . . . . . . . . . c30226_5ug5 1 . 9 . 2490 . 1 1 15 ASN HB3 H -2.200 0.400 -1.368 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HB3 . . . . . . . . . c30226_5ug5 1 . 9 . 2491 . 1 1 15 ASN HD21 H -0.640 -0.550 -0.308 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HD21 . . . . . . . . . c30226_5ug5 1 . 9 . 2492 . 1 1 15 ASN HD22 H -0.713 -2.152 0.355 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HD22 . . . . . . . . . c30226_5ug5 1 . 9 . 2493 . 1 1 15 ASN N N -4.317 1.239 -1.740 . . . 1.0 . . . . . . . . . . . . A . 15 ASN N . . . . . . . . . c30226_5ug5 1 . 9 . 2494 . 1 1 15 ASN ND2 N -1.071 -1.435 -0.208 . . . 1.0 . . . . . . . . . . . . A . 15 ASN ND2 . . . . . . . . . c30226_5ug5 1 . 9 . 2495 . 1 1 15 ASN O O -4.404 -1.150 0.527 . . . 1.0 . . . . . . . . . . . . A . 15 ASN O . . . . . . . . . c30226_5ug5 1 . 9 . 2496 . 1 1 15 ASN OD1 O -2.803 -2.725 -0.797 . . . 1.0 . . . . . . . . . . . . A . 15 ASN OD1 . . . . . . . . . c30226_5ug5 1 . 9 . 2497 . 1 1 16 HYP C C -7.684 -2.725 -0.100 . . . 1.0 . . . . . . . . . . . . A . 16 HYP C . . . . . . . . . c30226_5ug5 1 . 9 . 2498 . 1 1 16 HYP CA C -7.191 -1.368 0.365 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CA . . . . . . . . . c30226_5ug5 1 . 9 . 2499 . 1 1 16 HYP CB C -8.291 -0.321 0.351 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CB . . . . . . . . . c30226_5ug5 1 . 9 . 2500 . 1 1 16 HYP CD C -7.047 0.001 -1.613 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CD . . . . . . . . . c30226_5ug5 1 . 9 . 2501 . 1 1 16 HYP CG C -7.977 0.723 -0.707 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CG . . . . . . . . . c30226_5ug5 1 . 9 . 2502 . 1 1 16 HYP HA H -6.751 -1.446 1.333 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HA . . . . . . . . . c30226_5ug5 1 . 9 . 2503 . 1 1 16 HYP HB2 H -8.345 0.161 1.314 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HB2 . . . . . . . . . c30226_5ug5 1 . 9 . 2504 . 1 1 16 HYP HB3 H -9.237 -0.798 0.126 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HB3 . . . . . . . . . c30226_5ug5 1 . 9 . 2505 . 1 1 16 HYP HD1 H -6.280 1.581 -0.226 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HD1 . . . . . . . . . c30226_5ug5 1 . 9 . 2506 . 1 1 16 HYP HD22 H -7.578 -0.644 -2.280 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HD22 . . . . . . . . . c30226_5ug5 1 . 9 . 2507 . 1 1 16 HYP HD23 H -6.411 0.687 -2.150 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HD23 . . . . . . . . . c30226_5ug5 1 . 9 . 2508 . 1 1 16 HYP HG H -8.868 1.069 -1.208 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HG . . . . . . . . . c30226_5ug5 1 . 9 . 2509 . 1 1 16 HYP N N -6.281 -0.757 -0.613 . . . 1.0 . . . . . . . . . . . . A . 16 HYP N . . . . . . . . . c30226_5ug5 1 . 9 . 2510 . 1 1 16 HYP O O -8.389 -3.440 0.611 . . . 1.0 . . . . . . . . . . . . A . 16 HYP O . . . . . . . . . c30226_5ug5 1 . 9 . 2511 . 1 1 16 HYP OD1 O -7.232 1.800 -0.144 . . . 1.0 . . . . . . . . . . . . A . 16 HYP OD1 . . . . . . . . . c30226_5ug5 1 . 9 . 2512 . 1 1 17 HIS C C -6.486 -4.655 -2.948 . . . 1.0 . . . . . . . . . . . . A . 17 HIS C . . . . . . . . . c30226_5ug5 1 . 9 . 2513 . 1 1 17 HIS CA C -7.570 -4.347 -1.915 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CA . . . . . . . . . c30226_5ug5 1 . 9 . 2514 . 1 1 17 HIS CB C -8.966 -4.368 -2.559 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CB . . . . . . . . . c30226_5ug5 1 . 9 . 2515 . 1 1 17 HIS CD2 C -9.547 -6.333 -4.165 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CD2 . . . . . . . . . c30226_5ug5 1 . 9 . 2516 . 1 1 17 HIS CE1 C -10.210 -7.784 -2.667 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CE1 . . . . . . . . . c30226_5ug5 1 . 9 . 2517 . 1 1 17 HIS CG C -9.439 -5.741 -2.950 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CG . . . . . . . . . c30226_5ug5 1 . 9 . 2518 . 1 1 17 HIS H H -6.793 -2.381 -1.819 . . . 1.0 . . . . . . . . . . . . A . 17 HIS H . . . . . . . . . c30226_5ug5 1 . 9 . 2519 . 1 1 17 HIS HA H -7.527 -5.091 -1.133 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HA . . . . . . . . . c30226_5ug5 1 . 9 . 2520 . 1 1 17 HIS HB2 H -9.682 -3.959 -1.860 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HB2 . . . . . . . . . c30226_5ug5 1 . 9 . 2521 . 1 1 17 HIS HB3 H -8.952 -3.756 -3.449 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HB3 . . . . . . . . . c30226_5ug5 1 . 9 . 2522 . 1 1 17 HIS HD1 H -9.913 -6.550 -1.062 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HD1 . . . . . . . . . c30226_5ug5 1 . 9 . 2523 . 1 1 17 HIS HD2 H -9.301 -5.888 -5.119 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HD2 . . . . . . . . . c30226_5ug5 1 . 9 . 2524 . 1 1 17 HIS HE1 H -10.583 -8.685 -2.204 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HE1 . . . . . . . . . c30226_5ug5 1 . 9 . 2525 . 1 1 17 HIS HE2 H -10.376 -8.196 -4.664 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HE2 . . . . . . . . . c30226_5ug5 1 . 9 . 2526 . 1 1 17 HIS N N -7.294 -3.050 -1.312 . . . 1.0 . . . . . . . . . . . . A . 17 HIS N . . . . . . . . . c30226_5ug5 1 . 9 . 2527 . 1 1 17 HIS ND1 N -9.864 -6.678 -2.034 . . . 1.0 . . . . . . . . . . . . A . 17 HIS ND1 . . . . . . . . . c30226_5ug5 1 . 9 . 2528 . 1 1 17 HIS NE2 N -10.028 -7.602 -3.961 . . . 1.0 . . . . . . . . . . . . A . 17 HIS NE2 . . . . . . . . . c30226_5ug5 1 . 9 . 2529 . 1 1 17 HIS O O -6.749 -5.217 -4.012 . . . 1.0 . . . . . . . . . . . . A . 17 HIS O . . . . . . . . . c30226_5ug5 1 . 9 . 2530 . 1 1 18 VAL C C -3.251 -5.591 -2.998 . . . 1.0 . . . . . . . . . . . . A . 18 VAL C . . . . . . . . . c30226_5ug5 1 . 9 . 2531 . 1 1 18 VAL CA C -4.138 -4.466 -3.520 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CA . . . . . . . . . c30226_5ug5 1 . 9 . 2532 . 1 1 18 VAL CB C -3.356 -3.141 -3.692 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CB . . . . . . . . . c30226_5ug5 1 . 9 . 2533 . 1 1 18 VAL CG1 C -1.853 -3.341 -3.686 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CG1 . . . . . . . . . c30226_5ug5 1 . 9 . 2534 . 1 1 18 VAL CG2 C -3.790 -2.434 -4.965 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CG2 . . . . . . . . . c30226_5ug5 1 . 9 . 2535 . 1 1 18 VAL H H -5.102 -3.833 -1.766 . . . 1.0 . . . . . . . . . . . . A . 18 VAL H . . . . . . . . . c30226_5ug5 1 . 9 . 2536 . 1 1 18 VAL HA H -4.528 -4.755 -4.473 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HA . . . . . . . . . c30226_5ug5 1 . 9 . 2537 . 1 1 18 VAL HB H -3.607 -2.501 -2.861 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HB . . . . . . . . . c30226_5ug5 1 . 9 . 2538 . 1 1 18 VAL HG11 H -1.591 -3.997 -2.869 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG11 . . . . . . . . . c30226_5ug5 1 . 9 . 2539 . 1 1 18 VAL HG12 H -1.370 -2.381 -3.541 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG12 . . . . . . . . . c30226_5ug5 1 . 9 . 2540 . 1 1 18 VAL HG13 H -1.536 -3.775 -4.621 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG13 . . . . . . . . . c30226_5ug5 1 . 9 . 2541 . 1 1 18 VAL HG21 H -3.260 -1.498 -5.054 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG21 . . . . . . . . . c30226_5ug5 1 . 9 . 2542 . 1 1 18 VAL HG22 H -4.850 -2.242 -4.924 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG22 . . . . . . . . . c30226_5ug5 1 . 9 . 2543 . 1 1 18 VAL HG23 H -3.570 -3.056 -5.818 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG23 . . . . . . . . . c30226_5ug5 1 . 9 . 2544 . 1 1 18 VAL N N -5.261 -4.263 -2.631 . . . 1.0 . . . . . . . . . . . . A . 18 VAL N . . . . . . . . . c30226_5ug5 1 . 9 . 2545 . 1 1 18 VAL O O -2.588 -6.292 -3.765 . . . 1.0 . . . . . . . . . . . . A . 18 VAL O . . . . . . . . . c30226_5ug5 1 . 9 . 2546 . 1 1 19 CYS C C -3.516 -7.868 -0.465 . . . 1.0 . . . . . . . . . . . . A . 19 CYS C . . . . . . . . . c30226_5ug5 1 . 9 . 2547 . 1 1 19 CYS CA C -2.543 -6.854 -1.056 . . . 1.0 . . . . . . . . . . . . A . 19 CYS CA . . . . . . . . . c30226_5ug5 1 . 9 . 2548 . 1 1 19 CYS CB C -1.616 -6.308 0.032 . . . 1.0 . . . . . . . . . . . . A . 19 CYS CB . . . . . . . . . c30226_5ug5 1 . 9 . 2549 . 1 1 19 CYS H H -3.824 -5.176 -1.143 . . . 1.0 . . . . . . . . . . . . A . 19 CYS H . . . . . . . . . c30226_5ug5 1 . 9 . 2550 . 1 1 19 CYS HA H -1.950 -7.343 -1.814 . . . 1.0 . . . . . . . . . . . . A . 19 CYS HA . . . . . . . . . c30226_5ug5 1 . 9 . 2551 . 1 1 19 CYS HB2 H -0.932 -5.600 -0.410 . . . 1.0 . . . . . . . . . . . . A . 19 CYS HB2 . . . . . . . . . c30226_5ug5 1 . 9 . 2552 . 1 1 19 CYS HB3 H -2.210 -5.807 0.783 . . . 1.0 . . . . . . . . . . . . A . 19 CYS HB3 . . . . . . . . . c30226_5ug5 1 . 9 . 2553 . 1 1 19 CYS N N -3.280 -5.777 -1.695 . . . 1.0 . . . . . . . . . . . . A . 19 CYS N . . . . . . . . . c30226_5ug5 1 . 9 . 2554 . 1 1 19 CYS O O -3.795 -8.886 -1.136 . . . 1.0 . . . . . . . . . . . . A . 19 CYS O . . . . . . . . . c30226_5ug5 1 . 9 . 2555 . 1 1 19 CYS OXT O -4.028 -7.632 0.650 . . . 1.0 . . . . . . . . . . . . A . 19 CYS OXT . . . . . . . . . c30226_5ug5 1 . 9 . 2556 . 1 1 19 CYS SG S -0.622 -7.588 0.873 . . . 1.0 . . . . . . . . . . . . A . 19 CYS SG . . . . . . . . . c30226_5ug5 1 . 10 . 2557 . 1 1 1 ILE C C 6.132 1.993 -4.237 . . . 1.0 . . . . . . . . . . . . A . 1 ILE C . . . . . . . . . c30226_5ug5 1 . 10 . 2558 . 1 1 1 ILE CA C 5.231 2.666 -5.262 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CA . . . . . . . . . c30226_5ug5 1 . 10 . 2559 . 1 1 1 ILE CB C 4.783 1.625 -6.313 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CB . . . . . . . . . c30226_5ug5 1 . 10 . 2560 . 1 1 1 ILE CD1 C 5.634 -0.083 -7.995 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CD1 . . . . . . . . . c30226_5ug5 1 . 10 . 2561 . 1 1 1 ILE CG1 C 5.991 1.041 -7.047 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CG1 . . . . . . . . . c30226_5ug5 1 . 10 . 2562 . 1 1 1 ILE CG2 C 3.810 2.258 -7.299 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CG2 . . . . . . . . . c30226_5ug5 1 . 10 . 2563 . 1 1 1 ILE H1 H 6.797 3.477 -6.361 . . . 1.0 . . . . . . . . . . . . A . 1 ILE H1 . . . . . . . . . c30226_5ug5 1 . 10 . 2564 . 1 1 1 ILE H2 H 6.198 4.500 -5.160 . . . 1.0 . . . . . . . . . . . . A . 1 ILE H2 . . . . . . . . . c30226_5ug5 1 . 10 . 2565 . 1 1 1 ILE H3 H 5.321 4.270 -6.586 . . . 1.0 . . . . . . . . . . . . A . 1 ILE H3 . . . . . . . . . c30226_5ug5 1 . 10 . 2566 . 1 1 1 ILE HA H 4.353 3.044 -4.760 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HA . . . . . . . . . c30226_5ug5 1 . 10 . 2567 . 1 1 1 ILE HB H 4.266 0.829 -5.798 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HB . . . . . . . . . c30226_5ug5 1 . 10 . 2568 . 1 1 1 ILE HD11 H 4.920 0.274 -8.722 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HD11 . . . . . . . . . c30226_5ug5 1 . 10 . 2569 . 1 1 1 ILE HD12 H 5.202 -0.900 -7.437 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HD12 . . . . . . . . . c30226_5ug5 1 . 10 . 2570 . 1 1 1 ILE HD13 H 6.524 -0.424 -8.502 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HD13 . . . . . . . . . c30226_5ug5 1 . 10 . 2571 . 1 1 1 ILE HG12 H 6.467 1.821 -7.623 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG12 . . . . . . . . . c30226_5ug5 1 . 10 . 2572 . 1 1 1 ILE HG13 H 6.694 0.655 -6.323 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG13 . . . . . . . . . c30226_5ug5 1 . 10 . 2573 . 1 1 1 ILE HG21 H 3.476 1.511 -8.004 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG21 . . . . . . . . . c30226_5ug5 1 . 10 . 2574 . 1 1 1 ILE HG22 H 4.305 3.057 -7.830 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG22 . . . . . . . . . c30226_5ug5 1 . 10 . 2575 . 1 1 1 ILE HG23 H 2.961 2.654 -6.763 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG23 . . . . . . . . . c30226_5ug5 1 . 10 . 2576 . 1 1 1 ILE N N 5.934 3.806 -5.888 . . . 1.0 . . . . . . . . . . . . A . 1 ILE N . . . . . . . . . c30226_5ug5 1 . 10 . 2577 . 1 1 1 ILE O O 7.300 2.357 -4.098 . . . 1.0 . . . . . . . . . . . . A . 1 ILE O . . . . . . . . . c30226_5ug5 1 . 10 . 2578 . 1 1 2 ARG C C 6.238 -1.181 -2.666 . . . 1.0 . . . . . . . . . . . . A . 2 ARG C . . . . . . . . . c30226_5ug5 1 . 10 . 2579 . 1 1 2 ARG CA C 6.334 0.326 -2.477 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CA . . . . . . . . . c30226_5ug5 1 . 10 . 2580 . 1 1 2 ARG CB C 5.792 0.692 -1.089 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CB . . . . . . . . . c30226_5ug5 1 . 10 . 2581 . 1 1 2 ARG CD C 7.191 2.757 -0.779 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CD . . . . . . . . . c30226_5ug5 1 . 10 . 2582 . 1 1 2 ARG CG C 5.787 2.183 -0.797 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CG . . . . . . . . . c30226_5ug5 1 . 10 . 2583 . 1 1 2 ARG CZ C 8.278 4.962 -0.667 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CZ . . . . . . . . . c30226_5ug5 1 . 10 . 2584 . 1 1 2 ARG H H 4.662 0.758 -3.688 . . . 1.0 . . . . . . . . . . . . A . 2 ARG H . . . . . . . . . c30226_5ug5 1 . 10 . 2585 . 1 1 2 ARG HA H 7.363 0.627 -2.549 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HA . . . . . . . . . c30226_5ug5 1 . 10 . 2586 . 1 1 2 ARG HB2 H 4.780 0.327 -1.004 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB2 . . . . . . . . . c30226_5ug5 1 . 10 . 2587 . 1 1 2 ARG HB3 H 6.402 0.205 -0.341 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB3 . . . . . . . . . c30226_5ug5 1 . 10 . 2588 . 1 1 2 ARG HD2 H 7.741 2.306 0.034 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD2 . . . . . . . . . c30226_5ug5 1 . 10 . 2589 . 1 1 2 ARG HD3 H 7.674 2.521 -1.715 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD3 . . . . . . . . . c30226_5ug5 1 . 10 . 2590 . 1 1 2 ARG HE H 6.316 4.637 -0.437 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HE . . . . . . . . . c30226_5ug5 1 . 10 . 2591 . 1 1 2 ARG HG2 H 5.214 2.687 -1.562 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG2 . . . . . . . . . c30226_5ug5 1 . 10 . 2592 . 1 1 2 ARG HG3 H 5.327 2.349 0.167 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG3 . . . . . . . . . c30226_5ug5 1 . 10 . 2593 . 1 1 2 ARG HH11 H 9.539 3.406 -0.977 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH11 . . . . . . . . . c30226_5ug5 1 . 10 . 2594 . 1 1 2 ARG HH12 H 10.287 4.971 -0.931 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH12 . . . . . . . . . c30226_5ug5 1 . 10 . 2595 . 1 1 2 ARG HH21 H 7.293 6.710 -0.377 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH21 . . . . . . . . . c30226_5ug5 1 . 10 . 2596 . 1 1 2 ARG HH22 H 9.008 6.849 -0.585 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH22 . . . . . . . . . c30226_5ug5 1 . 10 . 2597 . 1 1 2 ARG N N 5.587 1.021 -3.514 . . . 1.0 . . . . . . . . . . . . A . 2 ARG N . . . . . . . . . c30226_5ug5 1 . 10 . 2598 . 1 1 2 ARG NE N 7.185 4.206 -0.601 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NE . . . . . . . . . c30226_5ug5 1 . 10 . 2599 . 1 1 2 ARG NH1 N 9.463 4.402 -0.872 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH1 . . . . . . . . . c30226_5ug5 1 . 10 . 2600 . 1 1 2 ARG NH2 N 8.186 6.278 -0.532 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH2 . . . . . . . . . c30226_5ug5 1 . 10 . 2601 . 1 1 2 ARG O O 5.255 -1.685 -3.206 . . . 1.0 . . . . . . . . . . . . A . 2 ARG O . . . . . . . . . c30226_5ug5 1 . 10 . 2602 . 1 1 3 ASP C C 6.768 -3.846 -0.869 . . . 1.0 . . . . . . . . . . . . A . 3 ASP C . . . . . . . . . c30226_5ug5 1 . 10 . 2603 . 1 1 3 ASP CA C 7.245 -3.353 -2.217 . . . 1.0 . . . . . . . . . . . . A . 3 ASP CA . . . . . . . . . c30226_5ug5 1 . 10 . 2604 . 1 1 3 ASP CB C 8.635 -3.912 -2.548 . . . 1.0 . . . . . . . . . . . . A . 3 ASP CB . . . . . . . . . c30226_5ug5 1 . 10 . 2605 . 1 1 3 ASP CG C 8.700 -5.429 -2.493 . . . 1.0 . . . . . . . . . . . . A . 3 ASP CG . . . . . . . . . c30226_5ug5 1 . 10 . 2606 . 1 1 3 ASP H H 8.048 -1.422 -1.863 . . . 1.0 . . . . . . . . . . . . A . 3 ASP H . . . . . . . . . c30226_5ug5 1 . 10 . 2607 . 1 1 3 ASP HA H 6.542 -3.659 -2.952 . . . 1.0 . . . . . . . . . . . . A . 3 ASP HA . . . . . . . . . c30226_5ug5 1 . 10 . 2608 . 1 1 3 ASP HB2 H 8.912 -3.598 -3.542 . . . 1.0 . . . . . . . . . . . . A . 3 ASP HB2 . . . . . . . . . c30226_5ug5 1 . 10 . 2609 . 1 1 3 ASP HB3 H 9.349 -3.515 -1.841 . . . 1.0 . . . . . . . . . . . . A . 3 ASP HB3 . . . . . . . . . c30226_5ug5 1 . 10 . 2610 . 1 1 3 ASP N N 7.261 -1.891 -2.214 . . . 1.0 . . . . . . . . . . . . A . 3 ASP N . . . . . . . . . c30226_5ug5 1 . 10 . 2611 . 1 1 3 ASP O O 6.477 -5.021 -0.658 . . . 1.0 . . . . . . . . . . . . A . 3 ASP O . . . . . . . . . c30226_5ug5 1 . 10 . 2612 . 1 1 3 ASP OD1 O 8.268 -6.088 -3.467 . . . 1.0 . . . . . . . . . . . . A . 3 ASP OD1 . . . . . . . . . c30226_5ug5 1 . 10 . 2613 . 1 1 3 ASP OD2 O 9.171 -5.975 -1.472 . . . 1.0 . . . . . . . . . . . . A . 3 ASP OD2 . . . . . . . . . c30226_5ug5 1 . 10 . 2614 . 1 1 4 GLU C C 4.769 -2.637 1.549 . . . 1.0 . . . . . . . . . . . . A . 4 GLU C . . . . . . . . . c30226_5ug5 1 . 10 . 2615 . 1 1 4 GLU CA C 6.205 -3.101 1.375 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CA . . . . . . . . . c30226_5ug5 1 . 10 . 2616 . 1 1 4 GLU CB C 7.097 -2.322 2.326 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CB . . . . . . . . . c30226_5ug5 1 . 10 . 2617 . 1 1 4 GLU CD C 8.330 -4.254 3.356 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CD . . . . . . . . . c30226_5ug5 1 . 10 . 2618 . 1 1 4 GLU CG C 8.447 -2.966 2.578 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CG . . . . . . . . . c30226_5ug5 1 . 10 . 2619 . 1 1 4 GLU H H 6.844 -1.986 -0.297 . . . 1.0 . . . . . . . . . . . . A . 4 GLU H . . . . . . . . . c30226_5ug5 1 . 10 . 2620 . 1 1 4 GLU HA H 6.273 -4.155 1.598 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HA . . . . . . . . . c30226_5ug5 1 . 10 . 2621 . 1 1 4 GLU HB2 H 7.262 -1.337 1.917 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HB2 . . . . . . . . . c30226_5ug5 1 . 10 . 2622 . 1 1 4 GLU HB3 H 6.579 -2.228 3.261 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HB3 . . . . . . . . . c30226_5ug5 1 . 10 . 2623 . 1 1 4 GLU HG2 H 8.915 -3.179 1.628 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HG2 . . . . . . . . . c30226_5ug5 1 . 10 . 2624 . 1 1 4 GLU HG3 H 9.064 -2.278 3.138 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HG3 . . . . . . . . . c30226_5ug5 1 . 10 . 2625 . 1 1 4 GLU N N 6.641 -2.889 0.005 . . . 1.0 . . . . . . . . . . . . A . 4 GLU N . . . . . . . . . c30226_5ug5 1 . 10 . 2626 . 1 1 4 GLU O O 4.344 -2.288 2.644 . . . 1.0 . . . . . . . . . . . . A . 4 GLU O . . . . . . . . . c30226_5ug5 1 . 10 . 2627 . 1 1 4 GLU OE1 O 8.415 -4.209 4.599 . . . 1.0 . . . . . . . . . . . . A . 4 GLU OE1 . . . . . . . . . c30226_5ug5 1 . 10 . 2628 . 1 1 4 GLU OE2 O 8.142 -5.318 2.736 . . . 1.0 . . . . . . . . . . . . A . 4 GLU OE2 . . . . . . . . . c30226_5ug5 1 . 10 . 2629 . 1 1 5 CYS C C 1.727 -2.586 1.396 . . . 1.0 . . . . . . . . . . . . A . 5 CYS C . . . . . . . . . c30226_5ug5 1 . 10 . 2630 . 1 1 5 CYS CA C 2.729 -2.050 0.372 . . . 1.0 . . . . . . . . . . . . A . 5 CYS CA . . . . . . . . . c30226_5ug5 1 . 10 . 2631 . 1 1 5 CYS CB C 2.216 -2.246 -1.041 . . . 1.0 . . . . . . . . . . . . A . 5 CYS CB . . . . . . . . . c30226_5ug5 1 . 10 . 2632 . 1 1 5 CYS H H 4.386 -3.098 -0.328 . . . 1.0 . . . . . . . . . . . . A . 5 CYS H . . . . . . . . . c30226_5ug5 1 . 10 . 2633 . 1 1 5 CYS HA H 2.850 -0.992 0.541 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HA . . . . . . . . . c30226_5ug5 1 . 10 . 2634 . 1 1 5 CYS HB2 H 2.733 -3.081 -1.490 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HB2 . . . . . . . . . c30226_5ug5 1 . 10 . 2635 . 1 1 5 CYS HB3 H 1.175 -2.459 -1.006 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HB3 . . . . . . . . . c30226_5ug5 1 . 10 . 2636 . 1 1 5 CYS N N 4.038 -2.651 0.459 . . . 1.0 . . . . . . . . . . . . A . 5 CYS N . . . . . . . . . c30226_5ug5 1 . 10 . 2637 . 1 1 5 CYS O O 0.860 -1.842 1.852 . . . 1.0 . . . . . . . . . . . . A . 5 CYS O . . . . . . . . . c30226_5ug5 1 . 10 . 2638 . 1 1 5 CYS SG S 2.471 -0.799 -2.114 . . . 1.0 . . . . . . . . . . . . A . 5 CYS SG . . . . . . . . . c30226_5ug5 1 . 10 . 2639 . 1 1 6 CYS C C 1.136 -3.862 4.120 . . . 1.0 . . . . . . . . . . . . A . 6 CYS C . . . . . . . . . c30226_5ug5 1 . 10 . 2640 . 1 1 6 CYS CA C 0.912 -4.439 2.727 . . . 1.0 . . . . . . . . . . . . A . 6 CYS CA . . . . . . . . . c30226_5ug5 1 . 10 . 2641 . 1 1 6 CYS CB C 1.050 -5.961 2.753 . . . 1.0 . . . . . . . . . . . . A . 6 CYS CB . . . . . . . . . c30226_5ug5 1 . 10 . 2642 . 1 1 6 CYS H H 2.572 -4.402 1.406 . . . 1.0 . . . . . . . . . . . . A . 6 CYS H . . . . . . . . . c30226_5ug5 1 . 10 . 2643 . 1 1 6 CYS HA H -0.088 -4.185 2.407 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HA . . . . . . . . . c30226_5ug5 1 . 10 . 2644 . 1 1 6 CYS HB2 H 0.949 -6.341 1.749 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HB2 . . . . . . . . . c30226_5ug5 1 . 10 . 2645 . 1 1 6 CYS HB3 H 2.028 -6.221 3.133 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HB3 . . . . . . . . . c30226_5ug5 1 . 10 . 2646 . 1 1 6 CYS N N 1.845 -3.850 1.775 . . . 1.0 . . . . . . . . . . . . A . 6 CYS N . . . . . . . . . c30226_5ug5 1 . 10 . 2647 . 1 1 6 CYS O O 0.203 -3.739 4.919 . . . 1.0 . . . . . . . . . . . . A . 6 CYS O . . . . . . . . . c30226_5ug5 1 . 10 . 2648 . 1 1 6 CYS SG S -0.190 -6.801 3.791 . . . 1.0 . . . . . . . . . . . . A . 6 CYS SG . . . . . . . . . c30226_5ug5 1 . 10 . 2649 . 1 1 7 SER C C 2.566 -1.351 5.530 . . . 1.0 . . . . . . . . . . . . A . 7 SER C . . . . . . . . . c30226_5ug5 1 . 10 . 2650 . 1 1 7 SER CA C 2.717 -2.856 5.653 . . . 1.0 . . . . . . . . . . . . A . 7 SER CA . . . . . . . . . c30226_5ug5 1 . 10 . 2651 . 1 1 7 SER CB C 4.163 -3.161 5.987 . . . 1.0 . . . . . . . . . . . . A . 7 SER CB . . . . . . . . . c30226_5ug5 1 . 10 . 2652 . 1 1 7 SER H H 3.092 -3.686 3.764 . . . 1.0 . . . . . . . . . . . . A . 7 SER H . . . . . . . . . c30226_5ug5 1 . 10 . 2653 . 1 1 7 SER HA H 2.076 -3.230 6.432 . . . 1.0 . . . . . . . . . . . . A . 7 SER HA . . . . . . . . . c30226_5ug5 1 . 10 . 2654 . 1 1 7 SER HB2 H 4.791 -2.418 5.513 . . . 1.0 . . . . . . . . . . . . A . 7 SER HB2 . . . . . . . . . c30226_5ug5 1 . 10 . 2655 . 1 1 7 SER HB3 H 4.295 -3.118 7.050 . . . 1.0 . . . . . . . . . . . . A . 7 SER HB3 . . . . . . . . . c30226_5ug5 1 . 10 . 2656 . 1 1 7 SER HG H 5.490 -4.560 5.591 . . . 1.0 . . . . . . . . . . . . A . 7 SER HG . . . . . . . . . c30226_5ug5 1 . 10 . 2657 . 1 1 7 SER N N 2.374 -3.498 4.405 . . . 1.0 . . . . . . . . . . . . A . 7 SER N . . . . . . . . . c30226_5ug5 1 . 10 . 2658 . 1 1 7 SER O O 2.270 -0.658 6.500 . . . 1.0 . . . . . . . . . . . . A . 7 SER O . . . . . . . . . c30226_5ug5 1 . 10 . 2659 . 1 1 7 SER OG O 4.531 -4.457 5.530 . . . 1.0 . . . . . . . . . . . . A . 7 SER OG . . . . . . . . . c30226_5ug5 1 . 10 . 2660 . 1 1 8 ASN C C 1.630 1.286 4.034 . . . 1.0 . . . . . . . . . . . . A . 8 ASN C . . . . . . . . . c30226_5ug5 1 . 10 . 2661 . 1 1 8 ASN CA C 2.960 0.548 4.081 . . . 1.0 . . . . . . . . . . . . A . 8 ASN CA . . . . . . . . . c30226_5ug5 1 . 10 . 2662 . 1 1 8 ASN CB C 3.716 0.746 2.765 . . . 1.0 . . . . . . . . . . . . A . 8 ASN CB . . . . . . . . . c30226_5ug5 1 . 10 . 2663 . 1 1 8 ASN CG C 4.219 2.165 2.571 . . . 1.0 . . . . . . . . . . . . A . 8 ASN CG . . . . . . . . . c30226_5ug5 1 . 10 . 2664 . 1 1 8 ASN H H 2.721 -1.472 3.542 . . . 1.0 . . . . . . . . . . . . A . 8 ASN H . . . . . . . . . c30226_5ug5 1 . 10 . 2665 . 1 1 8 ASN HA H 3.560 0.917 4.894 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HA . . . . . . . . . c30226_5ug5 1 . 10 . 2666 . 1 1 8 ASN HB2 H 4.564 0.079 2.741 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HB2 . . . . . . . . . c30226_5ug5 1 . 10 . 2667 . 1 1 8 ASN HB3 H 3.052 0.506 1.946 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HB3 . . . . . . . . . c30226_5ug5 1 . 10 . 2668 . 1 1 8 ASN HD21 H 2.650 2.620 1.449 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HD21 . . . . . . . . . c30226_5ug5 1 . 10 . 2669 . 1 1 8 ASN HD22 H 3.793 3.891 1.690 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HD22 . . . . . . . . . c30226_5ug5 1 . 10 . 2670 . 1 1 8 ASN N N 2.750 -0.863 4.312 . . . 1.0 . . . . . . . . . . . . A . 8 ASN N . . . . . . . . . c30226_5ug5 1 . 10 . 2671 . 1 1 8 ASN ND2 N 3.476 2.971 1.830 . . . 1.0 . . . . . . . . . . . . A . 8 ASN ND2 . . . . . . . . . c30226_5ug5 1 . 10 . 2672 . 1 1 8 ASN O O 0.867 1.149 3.073 . . . 1.0 . . . . . . . . . . . . A . 8 ASN O . . . . . . . . . c30226_5ug5 1 . 10 . 2673 . 1 1 8 ASN OD1 O 5.289 2.523 3.058 . . . 1.0 . . . . . . . . . . . . A . 8 ASN OD1 . . . . . . . . . c30226_5ug5 1 . 10 . 2674 . 1 1 9 PRO C C -0.252 3.682 4.037 . . . 1.0 . . . . . . . . . . . . A . 9 PRO C . . . . . . . . . c30226_5ug5 1 . 10 . 2675 . 1 1 9 PRO CA C 0.076 2.804 5.225 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CA . . . . . . . . . c30226_5ug5 1 . 10 . 2676 . 1 1 9 PRO CB C 0.316 3.668 6.463 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CB . . . . . . . . . c30226_5ug5 1 . 10 . 2677 . 1 1 9 PRO CD C 2.283 2.460 6.151 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CD . . . . . . . . . c30226_5ug5 1 . 10 . 2678 . 1 1 9 PRO CG C 1.778 3.797 6.565 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CG . . . . . . . . . c30226_5ug5 1 . 10 . 2679 . 1 1 9 PRO HA H -0.737 2.117 5.408 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HA . . . . . . . . . c30226_5ug5 1 . 10 . 2680 . 1 1 9 PRO HB2 H -0.165 4.625 6.355 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HB2 . . . . . . . . . c30226_5ug5 1 . 10 . 2681 . 1 1 9 PRO HB3 H -0.056 3.162 7.306 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HB3 . . . . . . . . . c30226_5ug5 1 . 10 . 2682 . 1 1 9 PRO HD2 H 3.281 2.542 5.801 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HD2 . . . . . . . . . c30226_5ug5 1 . 10 . 2683 . 1 1 9 PRO HD3 H 2.215 1.754 6.965 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HD3 . . . . . . . . . c30226_5ug5 1 . 10 . 2684 . 1 1 9 PRO HG2 H 2.134 4.570 5.899 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HG2 . . . . . . . . . c30226_5ug5 1 . 10 . 2685 . 1 1 9 PRO HG3 H 2.058 4.007 7.584 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HG3 . . . . . . . . . c30226_5ug5 1 . 10 . 2686 . 1 1 9 PRO N N 1.355 2.105 5.063 . . . 1.0 . . . . . . . . . . . . A . 9 PRO N . . . . . . . . . c30226_5ug5 1 . 10 . 2687 . 1 1 9 PRO O O -1.375 3.704 3.546 . . . 1.0 . . . . . . . . . . . . A . 9 PRO O . . . . . . . . . c30226_5ug5 1 . 10 . 2688 . 1 1 10 ALA C C 0.303 4.570 1.149 . . . 1.0 . . . . . . . . . . . . A . 10 ALA C . . . . . . . . . c30226_5ug5 1 . 10 . 2689 . 1 1 10 ALA CA C 0.627 5.299 2.455 . . . 1.0 . . . . . . . . . . . . A . 10 ALA CA . . . . . . . . . c30226_5ug5 1 . 10 . 2690 . 1 1 10 ALA CB C 1.895 6.119 2.292 . . . 1.0 . . . . . . . . . . . . A . 10 ALA CB . . . . . . . . . c30226_5ug5 1 . 10 . 2691 . 1 1 10 ALA H H 1.615 4.326 4.063 . . . 1.0 . . . . . . . . . . . . A . 10 ALA H . . . . . . . . . c30226_5ug5 1 . 10 . 2692 . 1 1 10 ALA HA H -0.180 5.981 2.675 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HA . . . . . . . . . c30226_5ug5 1 . 10 . 2693 . 1 1 10 ALA HB1 H 2.711 5.466 2.021 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HB1 . . . . . . . . . c30226_5ug5 1 . 10 . 2694 . 1 1 10 ALA HB2 H 2.124 6.616 3.222 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HB2 . . . . . . . . . c30226_5ug5 1 . 10 . 2695 . 1 1 10 ALA HB3 H 1.749 6.855 1.516 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HB3 . . . . . . . . . c30226_5ug5 1 . 10 . 2696 . 1 1 10 ALA N N 0.756 4.392 3.586 . . . 1.0 . . . . . . . . . . . . A . 10 ALA N . . . . . . . . . c30226_5ug5 1 . 10 . 2697 . 1 1 10 ALA O O -0.161 5.192 0.197 . . . 1.0 . . . . . . . . . . . . A . 10 ALA O . . . . . . . . . c30226_5ug5 1 . 10 . 2698 . 1 1 11 CYS C C -1.105 2.067 -0.040 . . . 1.0 . . . . . . . . . . . . A . 11 CYS C . . . . . . . . . c30226_5ug5 1 . 10 . 2699 . 1 1 11 CYS CA C 0.294 2.543 -0.144 . . . 1.0 . . . . . . . . . . . . A . 11 CYS CA . . . . . . . . . c30226_5ug5 1 . 10 . 2700 . 1 1 11 CYS CB C 1.241 1.355 -0.334 . . . 1.0 . . . . . . . . . . . . A . 11 CYS CB . . . . . . . . . c30226_5ug5 1 . 10 . 2701 . 1 1 11 CYS H H 0.665 2.740 1.917 . . . 1.0 . . . . . . . . . . . . A . 11 CYS H . . . . . . . . . c30226_5ug5 1 . 10 . 2702 . 1 1 11 CYS HA H 0.384 3.232 -0.971 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HA . . . . . . . . . c30226_5ug5 1 . 10 . 2703 . 1 1 11 CYS HB2 H 2.249 1.719 -0.466 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HB2 . . . . . . . . . c30226_5ug5 1 . 10 . 2704 . 1 1 11 CYS HB3 H 1.198 0.723 0.543 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HB3 . . . . . . . . . c30226_5ug5 1 . 10 . 2705 . 1 1 11 CYS N N 0.537 3.259 1.089 . . . 1.0 . . . . . . . . . . . . A . 11 CYS N . . . . . . . . . c30226_5ug5 1 . 10 . 2706 . 1 1 11 CYS O O -1.957 2.305 -0.891 . . . 1.0 . . . . . . . . . . . . A . 11 CYS O . . . . . . . . . c30226_5ug5 1 . 10 . 2707 . 1 1 11 CYS SG S 0.820 0.329 -1.784 . . . 1.0 . . . . . . . . . . . . A . 11 CYS SG . . . . . . . . . c30226_5ug5 1 . 10 . 2708 . 1 1 12 ARG C C -3.675 1.978 1.380 . . . 1.0 . . . . . . . . . . . . A . 12 ARG C . . . . . . . . . c30226_5ug5 1 . 10 . 2709 . 1 1 12 ARG CA C -2.568 0.940 1.527 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CA . . . . . . . . . c30226_5ug5 1 . 10 . 2710 . 1 1 12 ARG CB C -2.403 0.540 2.969 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CB . . . . . . . . . c30226_5ug5 1 . 10 . 2711 . 1 1 12 ARG CD C -1.184 -1.119 4.379 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CD . . . . . . . . . c30226_5ug5 1 . 10 . 2712 . 1 1 12 ARG CG C -2.043 -0.917 3.149 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CG . . . . . . . . . c30226_5ug5 1 . 10 . 2713 . 1 1 12 ARG CZ C -1.511 -0.976 6.818 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CZ . . . . . . . . . c30226_5ug5 1 . 10 . 2714 . 1 1 12 ARG H H -0.526 1.242 1.673 . . . 1.0 . . . . . . . . . . . . A . 12 ARG H . . . . . . . . . c30226_5ug5 1 . 10 . 2715 . 1 1 12 ARG HA H -2.793 0.079 0.952 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HA . . . . . . . . . c30226_5ug5 1 . 10 . 2716 . 1 1 12 ARG HB2 H -1.612 1.137 3.402 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HB2 . . . . . . . . . c30226_5ug5 1 . 10 . 2717 . 1 1 12 ARG HB3 H -3.307 0.745 3.484 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HB3 . . . . . . . . . c30226_5ug5 1 . 10 . 2718 . 1 1 12 ARG HD2 H -1.022 -2.178 4.518 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HD2 . . . . . . . . . c30226_5ug5 1 . 10 . 2719 . 1 1 12 ARG HD3 H -0.231 -0.628 4.213 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HD3 . . . . . . . . . c30226_5ug5 1 . 10 . 2720 . 1 1 12 ARG HE H -2.462 0.149 5.464 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HE . . . . . . . . . c30226_5ug5 1 . 10 . 2721 . 1 1 12 ARG HG2 H -2.947 -1.490 3.253 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HG2 . . . . . . . . . c30226_5ug5 1 . 10 . 2722 . 1 1 12 ARG HG3 H -1.497 -1.254 2.280 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HG3 . . . . . . . . . c30226_5ug5 1 . 10 . 2723 . 1 1 12 ARG HH11 H -0.233 -2.440 6.231 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH11 . . . . . . . . . c30226_5ug5 1 . 10 . 2724 . 1 1 12 ARG HH12 H -0.432 -2.272 7.946 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH12 . . . . . . . . . c30226_5ug5 1 . 10 . 2725 . 1 1 12 ARG HH21 H -2.742 0.360 7.713 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH21 . . . . . . . . . c30226_5ug5 1 . 10 . 2726 . 1 1 12 ARG HH22 H -1.876 -0.691 8.791 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH22 . . . . . . . . . c30226_5ug5 1 . 10 . 2727 . 1 1 12 ARG N N -1.304 1.421 1.091 . . . 1.0 . . . . . . . . . . . . A . 12 ARG N . . . . . . . . . c30226_5ug5 1 . 10 . 2728 . 1 1 12 ARG NE N -1.801 -0.572 5.584 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NE . . . . . . . . . c30226_5ug5 1 . 10 . 2729 . 1 1 12 ARG NH1 N -0.660 -1.978 7.013 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NH1 . . . . . . . . . c30226_5ug5 1 . 10 . 2730 . 1 1 12 ARG NH2 N -2.089 -0.390 7.856 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NH2 . . . . . . . . . c30226_5ug5 1 . 10 . 2731 . 1 1 12 ARG O O -4.795 1.651 0.998 . . . 1.0 . . . . . . . . . . . . A . 12 ARG O . . . . . . . . . c30226_5ug5 1 . 10 . 2732 . 1 1 13 TYR C C -4.966 4.409 0.243 . . . 1.0 . . . . . . . . . . . . A . 13 TYR C . . . . . . . . . c30226_5ug5 1 . 10 . 2733 . 1 1 13 TYR CA C -4.249 4.348 1.595 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CA . . . . . . . . . c30226_5ug5 1 . 10 . 2734 . 1 1 13 TYR CB C -3.460 5.629 1.831 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CB . . . . . . . . . c30226_5ug5 1 . 10 . 2735 . 1 1 13 TYR CD1 C -5.010 6.908 3.331 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CD1 . . . . . . . . . c30226_5ug5 1 . 10 . 2736 . 1 1 13 TYR CD2 C -4.339 7.896 1.284 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CD2 . . . . . . . . . c30226_5ug5 1 . 10 . 2737 . 1 1 13 TYR CE1 C -5.756 8.030 3.633 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CE1 . . . . . . . . . c30226_5ug5 1 . 10 . 2738 . 1 1 13 TYR CE2 C -5.079 9.015 1.569 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CE2 . . . . . . . . . c30226_5ug5 1 . 10 . 2739 . 1 1 13 TYR CG C -4.295 6.830 2.154 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CG . . . . . . . . . c30226_5ug5 1 . 10 . 2740 . 1 1 13 TYR CZ C -5.789 9.083 2.746 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CZ . . . . . . . . . c30226_5ug5 1 . 10 . 2741 . 1 1 13 TYR H H -2.419 3.399 1.985 . . . 1.0 . . . . . . . . . . . . A . 13 TYR H . . . . . . . . . c30226_5ug5 1 . 10 . 2742 . 1 1 13 TYR HA H -4.979 4.242 2.375 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HA . . . . . . . . . c30226_5ug5 1 . 10 . 2743 . 1 1 13 TYR HB2 H -2.772 5.476 2.647 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HB2 . . . . . . . . . c30226_5ug5 1 . 10 . 2744 . 1 1 13 TYR HB3 H -2.905 5.860 0.942 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HB3 . . . . . . . . . c30226_5ug5 1 . 10 . 2745 . 1 1 13 TYR HD1 H -4.979 6.076 4.015 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HD1 . . . . . . . . . c30226_5ug5 1 . 10 . 2746 . 1 1 13 TYR HD2 H -3.784 7.838 0.364 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HD2 . . . . . . . . . c30226_5ug5 1 . 10 . 2747 . 1 1 13 TYR HE1 H -6.309 8.078 4.553 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HE1 . . . . . . . . . c30226_5ug5 1 . 10 . 2748 . 1 1 13 TYR HE2 H -5.096 9.829 0.874 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HE2 . . . . . . . . . c30226_5ug5 1 . 10 . 2749 . 1 1 13 TYR HH H -6.979 10.514 2.245 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HH . . . . . . . . . c30226_5ug5 1 . 10 . 2750 . 1 1 13 TYR N N -3.332 3.224 1.675 . . . 1.0 . . . . . . . . . . . . A . 13 TYR N . . . . . . . . . c30226_5ug5 1 . 10 . 2751 . 1 1 13 TYR O O -6.124 4.818 0.167 . . . 1.0 . . . . . . . . . . . . A . 13 TYR O . . . . . . . . . c30226_5ug5 1 . 10 . 2752 . 1 1 13 TYR OH O -6.523 10.212 3.042 . . . 1.0 . . . . . . . . . . . . A . 13 TYR OH . . . . . . . . . c30226_5ug5 1 . 10 . 2753 . 1 1 14 ASN C C -5.072 2.633 -2.665 . . . 1.0 . . . . . . . . . . . . A . 14 ASN C . . . . . . . . . c30226_5ug5 1 . 10 . 2754 . 1 1 14 ASN CA C -4.864 4.049 -2.156 . . . 1.0 . . . . . . . . . . . . A . 14 ASN CA . . . . . . . . . c30226_5ug5 1 . 10 . 2755 . 1 1 14 ASN CB C -3.937 4.828 -3.097 . . . 1.0 . . . . . . . . . . . . A . 14 ASN CB . . . . . . . . . c30226_5ug5 1 . 10 . 2756 . 1 1 14 ASN CG C -4.535 5.073 -4.474 . . . 1.0 . . . . . . . . . . . . A . 14 ASN CG . . . . . . . . . c30226_5ug5 1 . 10 . 2757 . 1 1 14 ASN H H -3.388 3.588 -0.702 . . . 1.0 . . . . . . . . . . . . A . 14 ASN H . . . . . . . . . c30226_5ug5 1 . 10 . 2758 . 1 1 14 ASN HA H -5.819 4.550 -2.091 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HA . . . . . . . . . c30226_5ug5 1 . 10 . 2759 . 1 1 14 ASN HB2 H -3.713 5.786 -2.652 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HB2 . . . . . . . . . c30226_5ug5 1 . 10 . 2760 . 1 1 14 ASN HB3 H -3.018 4.274 -3.218 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HB3 . . . . . . . . . c30226_5ug5 1 . 10 . 2761 . 1 1 14 ASN HD21 H -6.354 5.286 -3.706 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HD21 . . . . . . . . . c30226_5ug5 1 . 10 . 2762 . 1 1 14 ASN HD22 H -6.240 5.444 -5.422 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HD22 . . . . . . . . . c30226_5ug5 1 . 10 . 2763 . 1 1 14 ASN N N -4.286 3.994 -0.819 . . . 1.0 . . . . . . . . . . . . A . 14 ASN N . . . . . . . . . c30226_5ug5 1 . 10 . 2764 . 1 1 14 ASN ND2 N -5.840 5.291 -4.539 . . . 1.0 . . . . . . . . . . . . A . 14 ASN ND2 . . . . . . . . . c30226_5ug5 1 . 10 . 2765 . 1 1 14 ASN O O -5.625 2.402 -3.740 . . . 1.0 . . . . . . . . . . . . A . 14 ASN O . . . . . . . . . c30226_5ug5 1 . 10 . 2766 . 1 1 14 ASN OD1 O -3.816 5.096 -5.473 . . . 1.0 . . . . . . . . . . . . A . 14 ASN OD1 . . . . . . . . . c30226_5ug5 1 . 10 . 2767 . 1 1 15 ASN C C -4.935 -0.679 -1.215 . . . 1.0 . . . . . . . . . . . . A . 15 ASN C . . . . . . . . . c30226_5ug5 1 . 10 . 2768 . 1 1 15 ASN CA C -4.488 0.309 -2.281 . . . 1.0 . . . . . . . . . . . . A . 15 ASN CA . . . . . . . . . c30226_5ug5 1 . 10 . 2769 . 1 1 15 ASN CB C -3.026 0.092 -2.582 . . . 1.0 . . . . . . . . . . . . A . 15 ASN CB . . . . . . . . . c30226_5ug5 1 . 10 . 2770 . 1 1 15 ASN CG C -2.603 0.611 -3.943 . . . 1.0 . . . . . . . . . . . . A . 15 ASN CG . . . . . . . . . c30226_5ug5 1 . 10 . 2771 . 1 1 15 ASN H H -4.441 1.917 -0.917 . . . 1.0 . . . . . . . . . . . . A . 15 ASN H . . . . . . . . . c30226_5ug5 1 . 10 . 2772 . 1 1 15 ASN HA H -5.068 0.165 -3.171 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HA . . . . . . . . . c30226_5ug5 1 . 10 . 2773 . 1 1 15 ASN HB2 H -2.472 0.629 -1.825 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HB2 . . . . . . . . . c30226_5ug5 1 . 10 . 2774 . 1 1 15 ASN HB3 H -2.797 -0.962 -2.518 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HB3 . . . . . . . . . c30226_5ug5 1 . 10 . 2775 . 1 1 15 ASN HD21 H -0.786 1.002 -3.254 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HD21 . . . . . . . . . c30226_5ug5 1 . 10 . 2776 . 1 1 15 ASN HD22 H -1.054 1.377 -4.920 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HD22 . . . . . . . . . c30226_5ug5 1 . 10 . 2777 . 1 1 15 ASN N N -4.651 1.684 -1.848 . . . 1.0 . . . . . . . . . . . . A . 15 ASN N . . . . . . . . . c30226_5ug5 1 . 10 . 2778 . 1 1 15 ASN ND2 N -1.358 1.042 -4.049 . . . 1.0 . . . . . . . . . . . . A . 15 ASN ND2 . . . . . . . . . c30226_5ug5 1 . 10 . 2779 . 1 1 15 ASN O O -4.125 -1.414 -0.649 . . . 1.0 . . . . . . . . . . . . A . 15 ASN O . . . . . . . . . c30226_5ug5 1 . 10 . 2780 . 1 1 15 ASN OD1 O -3.386 0.621 -4.892 . . . 1.0 . . . . . . . . . . . . A . 15 ASN OD1 . . . . . . . . . c30226_5ug5 1 . 10 . 2781 . 1 1 16 HYP C C -7.201 -2.920 -0.369 . . . 1.0 . . . . . . . . . . . . A . 16 HYP C . . . . . . . . . c30226_5ug5 1 . 10 . 2782 . 1 1 16 HYP CA C -6.805 -1.548 0.131 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CA . . . . . . . . . c30226_5ug5 1 . 10 . 2783 . 1 1 16 HYP CB C -8.005 -0.698 0.500 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CB . . . . . . . . . c30226_5ug5 1 . 10 . 2784 . 1 1 16 HYP CD C -7.267 0.112 -1.580 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CD . . . . . . . . . c30226_5ug5 1 . 10 . 2785 . 1 1 16 HYP CG C -8.057 0.527 -0.394 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CG . . . . . . . . . c30226_5ug5 1 . 10 . 2786 . 1 1 16 HYP HA H -6.143 -1.644 0.960 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HA . . . . . . . . . c30226_5ug5 1 . 10 . 2787 . 1 1 16 HYP HB2 H -7.919 -0.378 1.526 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HB2 . . . . . . . . . c30226_5ug5 1 . 10 . 2788 . 1 1 16 HYP HB3 H -8.908 -1.280 0.374 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HB3 . . . . . . . . . c30226_5ug5 1 . 10 . 2789 . 1 1 16 HYP HD1 H -6.400 1.506 -0.018 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HD1 . . . . . . . . . c30226_5ug5 1 . 10 . 2790 . 1 1 16 HYP HD22 H -7.861 -0.465 -2.255 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HD22 . . . . . . . . . c30226_5ug5 1 . 10 . 2791 . 1 1 16 HYP HD23 H -6.832 0.967 -2.075 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HD23 . . . . . . . . . c30226_5ug5 1 . 10 . 2792 . 1 1 16 HYP HG H -9.070 0.794 -0.644 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HG . . . . . . . . . c30226_5ug5 1 . 10 . 2793 . 1 1 16 HYP N N -6.230 -0.710 -0.931 . . . 1.0 . . . . . . . . . . . . A . 16 HYP N . . . . . . . . . c30226_5ug5 1 . 10 . 2794 . 1 1 16 HYP O O -7.579 -3.801 0.397 . . . 1.0 . . . . . . . . . . . . A . 16 HYP O . . . . . . . . . c30226_5ug5 1 . 10 . 2795 . 1 1 16 HYP OD1 O -7.354 1.610 0.198 . . . 1.0 . . . . . . . . . . . . A . 16 HYP OD1 . . . . . . . . . c30226_5ug5 1 . 10 . 2796 . 1 1 17 HIS C C -5.969 -5.011 -2.658 . . . 1.0 . . . . . . . . . . . . A . 17 HIS C . . . . . . . . . c30226_5ug5 1 . 10 . 2797 . 1 1 17 HIS CA C -7.308 -4.377 -2.308 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CA . . . . . . . . . c30226_5ug5 1 . 10 . 2798 . 1 1 17 HIS CB C -8.160 -4.250 -3.579 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CB . . . . . . . . . c30226_5ug5 1 . 10 . 2799 . 1 1 17 HIS CD2 C -10.210 -2.695 -3.229 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CD2 . . . . . . . . . c30226_5ug5 1 . 10 . 2800 . 1 1 17 HIS CE1 C -11.749 -4.239 -3.028 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CE1 . . . . . . . . . c30226_5ug5 1 . 10 . 2801 . 1 1 17 HIS CG C -9.595 -3.898 -3.335 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CG . . . . . . . . . c30226_5ug5 1 . 10 . 2802 . 1 1 17 HIS H H -6.848 -2.302 -2.205 . . . 1.0 . . . . . . . . . . . . A . 17 HIS H . . . . . . . . . c30226_5ug5 1 . 10 . 2803 . 1 1 17 HIS HA H -7.821 -5.014 -1.603 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HA . . . . . . . . . c30226_5ug5 1 . 10 . 2804 . 1 1 17 HIS HB2 H -7.736 -3.485 -4.209 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HB2 . . . . . . . . . c30226_5ug5 1 . 10 . 2805 . 1 1 17 HIS HB3 H -8.135 -5.191 -4.108 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HB3 . . . . . . . . . c30226_5ug5 1 . 10 . 2806 . 1 1 17 HIS HD1 H -10.463 -5.818 -3.245 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HD1 . . . . . . . . . c30226_5ug5 1 . 10 . 2807 . 1 1 17 HIS HD2 H -9.733 -1.727 -3.281 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HD2 . . . . . . . . . c30226_5ug5 1 . 10 . 2808 . 1 1 17 HIS HE1 H -12.701 -4.729 -2.895 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HE1 . . . . . . . . . c30226_5ug5 1 . 10 . 2809 . 1 1 17 HIS HE2 H -12.259 -2.262 -3.140 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HE2 . . . . . . . . . c30226_5ug5 1 . 10 . 2810 . 1 1 17 HIS N N -7.092 -3.083 -1.666 . . . 1.0 . . . . . . . . . . . . A . 17 HIS N . . . . . . . . . c30226_5ug5 1 . 10 . 2811 . 1 1 17 HIS ND1 N -10.589 -4.843 -3.203 . . . 1.0 . . . . . . . . . . . . A . 17 HIS ND1 . . . . . . . . . c30226_5ug5 1 . 10 . 2812 . 1 1 17 HIS NE2 N -11.548 -2.934 -3.040 . . . 1.0 . . . . . . . . . . . . A . 17 HIS NE2 . . . . . . . . . c30226_5ug5 1 . 10 . 2813 . 1 1 17 HIS O O -5.910 -6.050 -3.312 . . . 1.0 . . . . . . . . . . . . A . 17 HIS O . . . . . . . . . c30226_5ug5 1 . 10 . 2814 . 1 1 18 VAL C C -3.156 -5.873 -1.419 . . . 1.0 . . . . . . . . . . . . A . 18 VAL C . . . . . . . . . c30226_5ug5 1 . 10 . 2815 . 1 1 18 VAL CA C -3.553 -4.850 -2.474 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CA . . . . . . . . . c30226_5ug5 1 . 10 . 2816 . 1 1 18 VAL CB C -2.572 -3.660 -2.499 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CB . . . . . . . . . c30226_5ug5 1 . 10 . 2817 . 1 1 18 VAL CG1 C -1.177 -4.070 -2.085 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CG1 . . . . . . . . . c30226_5ug5 1 . 10 . 2818 . 1 1 18 VAL CG2 C -2.551 -3.023 -3.880 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CG2 . . . . . . . . . c30226_5ug5 1 . 10 . 2819 . 1 1 18 VAL H H -4.999 -3.538 -1.722 . . . 1.0 . . . . . . . . . . . . A . 18 VAL H . . . . . . . . . c30226_5ug5 1 . 10 . 2820 . 1 1 18 VAL HA H -3.542 -5.319 -3.433 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HA . . . . . . . . . c30226_5ug5 1 . 10 . 2821 . 1 1 18 VAL HB H -2.927 -2.924 -1.798 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HB . . . . . . . . . c30226_5ug5 1 . 10 . 2822 . 1 1 18 VAL HG11 H -0.794 -4.797 -2.778 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG11 . . . . . . . . . c30226_5ug5 1 . 10 . 2823 . 1 1 18 VAL HG12 H -1.219 -4.498 -1.096 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG12 . . . . . . . . . c30226_5ug5 1 . 10 . 2824 . 1 1 18 VAL HG13 H -0.538 -3.201 -2.075 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG13 . . . . . . . . . c30226_5ug5 1 . 10 . 2825 . 1 1 18 VAL HG21 H -1.892 -2.166 -3.870 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG21 . . . . . . . . . c30226_5ug5 1 . 10 . 2826 . 1 1 18 VAL HG22 H -3.548 -2.706 -4.145 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG22 . . . . . . . . . c30226_5ug5 1 . 10 . 2827 . 1 1 18 VAL HG23 H -2.195 -3.741 -4.604 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG23 . . . . . . . . . c30226_5ug5 1 . 10 . 2828 . 1 1 18 VAL N N -4.892 -4.367 -2.228 . . . 1.0 . . . . . . . . . . . . A . 18 VAL N . . . . . . . . . c30226_5ug5 1 . 10 . 2829 . 1 1 18 VAL O O -2.556 -6.909 -1.722 . . . 1.0 . . . . . . . . . . . . A . 18 VAL O . . . . . . . . . c30226_5ug5 1 . 10 . 2830 . 1 1 19 CYS C C -3.956 -5.894 2.181 . . . 1.0 . . . . . . . . . . . . A . 19 CYS C . . . . . . . . . c30226_5ug5 1 . 10 . 2831 . 1 1 19 CYS CA C -3.266 -6.448 0.942 . . . 1.0 . . . . . . . . . . . . A . 19 CYS CA . . . . . . . . . c30226_5ug5 1 . 10 . 2832 . 1 1 19 CYS CB C -1.760 -6.588 1.193 . . . 1.0 . . . . . . . . . . . . A . 19 CYS CB . . . . . . . . . c30226_5ug5 1 . 10 . 2833 . 1 1 19 CYS H H -4.009 -4.741 -0.043 . . . 1.0 . . . . . . . . . . . . A . 19 CYS H . . . . . . . . . c30226_5ug5 1 . 10 . 2834 . 1 1 19 CYS HA H -3.681 -7.420 0.717 . . . 1.0 . . . . . . . . . . . . A . 19 CYS HA . . . . . . . . . c30226_5ug5 1 . 10 . 2835 . 1 1 19 CYS HB2 H -1.277 -6.877 0.272 . . . 1.0 . . . . . . . . . . . . A . 19 CYS HB2 . . . . . . . . . c30226_5ug5 1 . 10 . 2836 . 1 1 19 CYS HB3 H -1.368 -5.635 1.514 . . . 1.0 . . . . . . . . . . . . A . 19 CYS HB3 . . . . . . . . . c30226_5ug5 1 . 10 . 2837 . 1 1 19 CYS N N -3.528 -5.577 -0.192 . . . 1.0 . . . . . . . . . . . . A . 19 CYS N . . . . . . . . . c30226_5ug5 1 . 10 . 2838 . 1 1 19 CYS O O -5.102 -6.305 2.457 . . . 1.0 . . . . . . . . . . . . A . 19 CYS O . . . . . . . . . c30226_5ug5 1 . 10 . 2839 . 1 1 19 CYS OXT O -3.365 -5.028 2.857 . . . 1.0 . . . . . . . . . . . . A . 19 CYS OXT . . . . . . . . . c30226_5ug5 1 . 10 . 2840 . 1 1 19 CYS SG S -1.326 -7.828 2.461 . . . 1.0 . . . . . . . . . . . . A . 19 CYS SG . . . . . . . . . c30226_5ug5 1 . 11 . 2841 . 1 1 1 ILE C C 5.774 1.777 -5.125 . . . 1.0 . . . . . . . . . . . . A . 1 ILE C . . . . . . . . . c30226_5ug5 1 . 11 . 2842 . 1 1 1 ILE CA C 4.850 2.467 -6.124 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CA . . . . . . . . . c30226_5ug5 1 . 11 . 2843 . 1 1 1 ILE CB C 4.270 1.411 -7.092 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CB . . . . . . . . . c30226_5ug5 1 . 11 . 2844 . 1 1 1 ILE CD1 C 2.943 1.134 -9.255 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CD1 . . . . . . . . . c30226_5ug5 1 . 11 . 2845 . 1 1 1 ILE CG1 C 3.494 2.096 -8.223 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CG1 . . . . . . . . . c30226_5ug5 1 . 11 . 2846 . 1 1 1 ILE CG2 C 3.369 0.437 -6.347 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CG2 . . . . . . . . . c30226_5ug5 1 . 11 . 2847 . 1 1 1 ILE H1 H 5.985 4.207 -6.196 . . . 1.0 . . . . . . . . . . . . A . 1 ILE H1 . . . . . . . . . c30226_5ug5 1 . 11 . 2848 . 1 1 1 ILE H2 H 4.976 3.992 -7.533 . . . 1.0 . . . . . . . . . . . . A . 1 ILE H2 . . . . . . . . . c30226_5ug5 1 . 11 . 2849 . 1 1 1 ILE H3 H 6.388 3.074 -7.381 . . . 1.0 . . . . . . . . . . . . A . 1 ILE H3 . . . . . . . . . c30226_5ug5 1 . 11 . 2850 . 1 1 1 ILE HA H 4.038 2.937 -5.592 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HA . . . . . . . . . c30226_5ug5 1 . 11 . 2851 . 1 1 1 ILE HB H 5.091 0.853 -7.514 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HB . . . . . . . . . c30226_5ug5 1 . 11 . 2852 . 1 1 1 ILE HD11 H 2.420 1.688 -10.020 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HD11 . . . . . . . . . c30226_5ug5 1 . 11 . 2853 . 1 1 1 ILE HD12 H 2.260 0.447 -8.779 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HD12 . . . . . . . . . c30226_5ug5 1 . 11 . 2854 . 1 1 1 ILE HD13 H 3.756 0.581 -9.702 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HD13 . . . . . . . . . c30226_5ug5 1 . 11 . 2855 . 1 1 1 ILE HG12 H 2.661 2.639 -7.802 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG12 . . . . . . . . . c30226_5ug5 1 . 11 . 2856 . 1 1 1 ILE HG13 H 4.149 2.788 -8.731 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG13 . . . . . . . . . c30226_5ug5 1 . 11 . 2857 . 1 1 1 ILE HG21 H 2.553 0.978 -5.891 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG21 . . . . . . . . . c30226_5ug5 1 . 11 . 2858 . 1 1 1 ILE HG22 H 3.939 -0.066 -5.581 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG22 . . . . . . . . . c30226_5ug5 1 . 11 . 2859 . 1 1 1 ILE HG23 H 2.975 -0.293 -7.039 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG23 . . . . . . . . . c30226_5ug5 1 . 11 . 2860 . 1 1 1 ILE N N 5.599 3.506 -6.860 . . . 1.0 . . . . . . . . . . . . A . 1 ILE N . . . . . . . . . c30226_5ug5 1 . 11 . 2861 . 1 1 1 ILE O O 6.960 1.597 -5.394 . . . 1.0 . . . . . . . . . . . . A . 1 ILE O . . . . . . . . . c30226_5ug5 1 . 11 . 2862 . 1 1 2 ARG C C 5.865 -0.804 -3.171 . . . 1.0 . . . . . . . . . . . . A . 2 ARG C . . . . . . . . . c30226_5ug5 1 . 11 . 2863 . 1 1 2 ARG CA C 6.011 0.696 -2.963 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CA . . . . . . . . . c30226_5ug5 1 . 11 . 2864 . 1 1 2 ARG CB C 5.563 1.036 -1.536 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CB . . . . . . . . . c30226_5ug5 1 . 11 . 2865 . 1 1 2 ARG CD C 4.784 3.439 -1.627 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CD . . . . . . . . . c30226_5ug5 1 . 11 . 2866 . 1 1 2 ARG CG C 5.825 2.470 -1.093 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CG . . . . . . . . . c30226_5ug5 1 . 11 . 2867 . 1 1 2 ARG CZ C 4.048 5.758 -1.199 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CZ . . . . . . . . . c30226_5ug5 1 . 11 . 2868 . 1 1 2 ARG H H 4.297 1.620 -3.788 . . . 1.0 . . . . . . . . . . . . A . 2 ARG H . . . . . . . . . c30226_5ug5 1 . 11 . 2869 . 1 1 2 ARG HA H 7.045 0.969 -3.087 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HA . . . . . . . . . c30226_5ug5 1 . 11 . 2870 . 1 1 2 ARG HB2 H 4.505 0.850 -1.456 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB2 . . . . . . . . . c30226_5ug5 1 . 11 . 2871 . 1 1 2 ARG HB3 H 6.079 0.377 -0.852 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB3 . . . . . . . . . c30226_5ug5 1 . 11 . 2872 . 1 1 2 ARG HD2 H 4.939 3.567 -2.687 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD2 . . . . . . . . . c30226_5ug5 1 . 11 . 2873 . 1 1 2 ARG HD3 H 3.801 3.029 -1.453 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD3 . . . . . . . . . c30226_5ug5 1 . 11 . 2874 . 1 1 2 ARG HE H 5.603 4.864 -0.314 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HE . . . . . . . . . c30226_5ug5 1 . 11 . 2875 . 1 1 2 ARG HG2 H 5.810 2.508 -0.015 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG2 . . . . . . . . . c30226_5ug5 1 . 11 . 2876 . 1 1 2 ARG HG3 H 6.799 2.772 -1.449 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG3 . . . . . . . . . c30226_5ug5 1 . 11 . 2877 . 1 1 2 ARG HH11 H 2.926 4.776 -2.574 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH11 . . . . . . . . . c30226_5ug5 1 . 11 . 2878 . 1 1 2 ARG HH12 H 2.436 6.408 -2.240 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH12 . . . . . . . . . c30226_5ug5 1 . 11 . 2879 . 1 1 2 ARG HH21 H 4.957 6.998 0.118 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH21 . . . . . . . . . c30226_5ug5 1 . 11 . 2880 . 1 1 2 ARG HH22 H 3.589 7.671 -0.713 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH22 . . . . . . . . . c30226_5ug5 1 . 11 . 2881 . 1 1 2 ARG N N 5.237 1.414 -3.966 . . . 1.0 . . . . . . . . . . . . A . 2 ARG N . . . . . . . . . c30226_5ug5 1 . 11 . 2882 . 1 1 2 ARG NE N 4.877 4.743 -0.972 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NE . . . . . . . . . c30226_5ug5 1 . 11 . 2883 . 1 1 2 ARG NH1 N 3.056 5.635 -2.075 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH1 . . . . . . . . . c30226_5ug5 1 . 11 . 2884 . 1 1 2 ARG NH2 N 4.209 6.898 -0.546 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH2 . . . . . . . . . c30226_5ug5 1 . 11 . 2885 . 1 1 2 ARG O O 4.844 -1.269 -3.677 . . . 1.0 . . . . . . . . . . . . A . 2 ARG O . . . . . . . . . c30226_5ug5 1 . 11 . 2886 . 1 1 3 ASP C C 6.587 -3.597 -1.484 . . . 1.0 . . . . . . . . . . . . A . 3 ASP C . . . . . . . . . c30226_5ug5 1 . 11 . 2887 . 1 1 3 ASP CA C 6.834 -3.010 -2.856 . . . 1.0 . . . . . . . . . . . . A . 3 ASP CA . . . . . . . . . c30226_5ug5 1 . 11 . 2888 . 1 1 3 ASP CB C 8.127 -3.562 -3.467 . . . 1.0 . . . . . . . . . . . . A . 3 ASP CB . . . . . . . . . c30226_5ug5 1 . 11 . 2889 . 1 1 3 ASP CG C 8.093 -5.066 -3.648 . . . 1.0 . . . . . . . . . . . . A . 3 ASP CG . . . . . . . . . c30226_5ug5 1 . 11 . 2890 . 1 1 3 ASP H H 7.669 -1.118 -2.383 . . . 1.0 . . . . . . . . . . . . A . 3 ASP H . . . . . . . . . c30226_5ug5 1 . 11 . 2891 . 1 1 3 ASP HA H 6.005 -3.260 -3.476 . . . 1.0 . . . . . . . . . . . . A . 3 ASP HA . . . . . . . . . c30226_5ug5 1 . 11 . 2892 . 1 1 3 ASP HB2 H 8.283 -3.107 -4.432 . . . 1.0 . . . . . . . . . . . . A . 3 ASP HB2 . . . . . . . . . c30226_5ug5 1 . 11 . 2893 . 1 1 3 ASP HB3 H 8.954 -3.315 -2.819 . . . 1.0 . . . . . . . . . . . . A . 3 ASP HB3 . . . . . . . . . c30226_5ug5 1 . 11 . 2894 . 1 1 3 ASP N N 6.877 -1.552 -2.764 . . . 1.0 . . . . . . . . . . . . A . 3 ASP N . . . . . . . . . c30226_5ug5 1 . 11 . 2895 . 1 1 3 ASP O O 6.551 -4.807 -1.273 . . . 1.0 . . . . . . . . . . . . A . 3 ASP O . . . . . . . . . c30226_5ug5 1 . 11 . 2896 . 1 1 3 ASP OD1 O 7.297 -5.551 -4.477 . . . 1.0 . . . . . . . . . . . . A . 3 ASP OD1 . . . . . . . . . c30226_5ug5 1 . 11 . 2897 . 1 1 3 ASP OD2 O 8.867 -5.774 -2.967 . . . 1.0 . . . . . . . . . . . . A . 3 ASP OD2 . . . . . . . . . c30226_5ug5 1 . 11 . 2898 . 1 1 4 GLU C C 4.649 -2.519 1.085 . . . 1.0 . . . . . . . . . . . . A . 4 GLU C . . . . . . . . . c30226_5ug5 1 . 11 . 2899 . 1 1 4 GLU CA C 6.052 -3.012 0.801 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CA . . . . . . . . . c30226_5ug5 1 . 11 . 2900 . 1 1 4 GLU CB C 7.034 -2.359 1.754 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CB . . . . . . . . . c30226_5ug5 1 . 11 . 2901 . 1 1 4 GLU CD C 8.288 -4.460 2.343 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CD . . . . . . . . . c30226_5ug5 1 . 11 . 2902 . 1 1 4 GLU CG C 8.384 -3.049 1.806 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CG . . . . . . . . . c30226_5ug5 1 . 11 . 2903 . 1 1 4 GLU H H 6.473 -1.760 -0.831 . . . 1.0 . . . . . . . . . . . . A . 4 GLU H . . . . . . . . . c30226_5ug5 1 . 11 . 2904 . 1 1 4 GLU HA H 6.088 -4.083 0.922 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HA . . . . . . . . . c30226_5ug5 1 . 11 . 2905 . 1 1 4 GLU HB2 H 7.185 -1.334 1.449 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HB2 . . . . . . . . . c30226_5ug5 1 . 11 . 2906 . 1 1 4 GLU HB3 H 6.602 -2.371 2.732 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HB3 . . . . . . . . . c30226_5ug5 1 . 11 . 2907 . 1 1 4 GLU HG2 H 8.793 -3.088 0.807 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HG2 . . . . . . . . . c30226_5ug5 1 . 11 . 2908 . 1 1 4 GLU HG3 H 9.043 -2.479 2.444 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HG3 . . . . . . . . . c30226_5ug5 1 . 11 . 2909 . 1 1 4 GLU N N 6.394 -2.693 -0.568 . . . 1.0 . . . . . . . . . . . . A . 4 GLU N . . . . . . . . . c30226_5ug5 1 . 11 . 2910 . 1 1 4 GLU O O 4.281 -2.234 2.220 . . . 1.0 . . . . . . . . . . . . A . 4 GLU O . . . . . . . . . c30226_5ug5 1 . 11 . 2911 . 1 1 4 GLU OE1 O 8.485 -4.648 3.560 . . . 1.0 . . . . . . . . . . . . A . 4 GLU OE1 . . . . . . . . . c30226_5ug5 1 . 11 . 2912 . 1 1 4 GLU OE2 O 8.009 -5.389 1.556 . . . 1.0 . . . . . . . . . . . . A . 4 GLU OE2 . . . . . . . . . c30226_5ug5 1 . 11 . 2913 . 1 1 5 CYS C C 1.643 -2.431 1.073 . . . 1.0 . . . . . . . . . . . . A . 5 CYS C . . . . . . . . . c30226_5ug5 1 . 11 . 2914 . 1 1 5 CYS CA C 2.563 -1.817 0.021 . . . 1.0 . . . . . . . . . . . . A . 5 CYS CA . . . . . . . . . c30226_5ug5 1 . 11 . 2915 . 1 1 5 CYS CB C 1.932 -1.949 -1.363 . . . 1.0 . . . . . . . . . . . . A . 5 CYS CB . . . . . . . . . c30226_5ug5 1 . 11 . 2916 . 1 1 5 CYS H H 4.227 -2.804 -0.817 . . . 1.0 . . . . . . . . . . . . A . 5 CYS H . . . . . . . . . c30226_5ug5 1 . 11 . 2917 . 1 1 5 CYS HA H 2.691 -0.769 0.244 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HA . . . . . . . . . c30226_5ug5 1 . 11 . 2918 . 1 1 5 CYS HB2 H 2.689 -1.776 -2.112 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HB2 . . . . . . . . . c30226_5ug5 1 . 11 . 2919 . 1 1 5 CYS HB3 H 1.536 -2.947 -1.478 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HB3 . . . . . . . . . c30226_5ug5 1 . 11 . 2920 . 1 1 5 CYS N N 3.884 -2.432 0.017 . . . 1.0 . . . . . . . . . . . . A . 5 CYS N . . . . . . . . . c30226_5ug5 1 . 11 . 2921 . 1 1 5 CYS O O 0.775 -1.752 1.616 . . . 1.0 . . . . . . . . . . . . A . 5 CYS O . . . . . . . . . c30226_5ug5 1 . 11 . 2922 . 1 1 5 CYS SG S 0.575 -0.776 -1.665 . . . 1.0 . . . . . . . . . . . . A . 5 CYS SG . . . . . . . . . c30226_5ug5 1 . 11 . 2923 . 1 1 6 CYS C C 1.312 -3.872 3.740 . . . 1.0 . . . . . . . . . . . . A . 6 CYS C . . . . . . . . . c30226_5ug5 1 . 11 . 2924 . 1 1 6 CYS CA C 1.026 -4.404 2.345 . . . 1.0 . . . . . . . . . . . . A . 6 CYS CA . . . . . . . . . c30226_5ug5 1 . 11 . 2925 . 1 1 6 CYS CB C 1.284 -5.909 2.287 . . . 1.0 . . . . . . . . . . . . A . 6 CYS CB . . . . . . . . . c30226_5ug5 1 . 11 . 2926 . 1 1 6 CYS H H 2.595 -4.175 0.947 . . . 1.0 . . . . . . . . . . . . A . 6 CYS H . . . . . . . . . c30226_5ug5 1 . 11 . 2927 . 1 1 6 CYS HA H -0.009 -4.211 2.103 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HA . . . . . . . . . c30226_5ug5 1 . 11 . 2928 . 1 1 6 CYS HB2 H 1.152 -6.251 1.271 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HB2 . . . . . . . . . c30226_5ug5 1 . 11 . 2929 . 1 1 6 CYS HB3 H 2.300 -6.106 2.598 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HB3 . . . . . . . . . c30226_5ug5 1 . 11 . 2930 . 1 1 6 CYS N N 1.852 -3.703 1.374 . . . 1.0 . . . . . . . . . . . . A . 6 CYS N . . . . . . . . . c30226_5ug5 1 . 11 . 2931 . 1 1 6 CYS O O 0.425 -3.783 4.587 . . . 1.0 . . . . . . . . . . . . A . 6 CYS O . . . . . . . . . c30226_5ug5 1 . 11 . 2932 . 1 1 6 CYS SG S 0.178 -6.891 3.351 . . . 1.0 . . . . . . . . . . . . A . 6 CYS SG . . . . . . . . . c30226_5ug5 1 . 11 . 2933 . 1 1 7 SER C C 2.564 -1.413 5.215 . . . 1.0 . . . . . . . . . . . . A . 7 SER C . . . . . . . . . c30226_5ug5 1 . 11 . 2934 . 1 1 7 SER CA C 2.959 -2.871 5.196 . . . 1.0 . . . . . . . . . . . . A . 7 SER CA . . . . . . . . . c30226_5ug5 1 . 11 . 2935 . 1 1 7 SER CB C 4.466 -2.951 5.359 . . . 1.0 . . . . . . . . . . . . A . 7 SER CB . . . . . . . . . c30226_5ug5 1 . 11 . 2936 . 1 1 7 SER H H 3.231 -3.641 3.260 . . . 1.0 . . . . . . . . . . . . A . 7 SER H . . . . . . . . . c30226_5ug5 1 . 11 . 2937 . 1 1 7 SER HA H 2.485 -3.385 6.012 . . . 1.0 . . . . . . . . . . . . A . 7 SER HA . . . . . . . . . c30226_5ug5 1 . 11 . 2938 . 1 1 7 SER HB2 H 4.925 -2.833 4.391 . . . 1.0 . . . . . . . . . . . . A . 7 SER HB2 . . . . . . . . . c30226_5ug5 1 . 11 . 2939 . 1 1 7 SER HB3 H 4.791 -2.147 6.009 . . . 1.0 . . . . . . . . . . . . A . 7 SER HB3 . . . . . . . . . c30226_5ug5 1 . 11 . 2940 . 1 1 7 SER HG H 5.041 -4.096 6.841 . . . 1.0 . . . . . . . . . . . . A . 7 SER HG . . . . . . . . . c30226_5ug5 1 . 11 . 2941 . 1 1 7 SER N N 2.557 -3.498 3.959 . . . 1.0 . . . . . . . . . . . . A . 7 SER N . . . . . . . . . c30226_5ug5 1 . 11 . 2942 . 1 1 7 SER O O 2.062 -0.905 6.215 . . . 1.0 . . . . . . . . . . . . A . 7 SER O . . . . . . . . . c30226_5ug5 1 . 11 . 2943 . 1 1 7 SER OG O 4.866 -4.198 5.898 . . . 1.0 . . . . . . . . . . . . A . 7 SER OG . . . . . . . . . c30226_5ug5 1 . 11 . 2944 . 1 1 8 ASN C C 1.354 1.234 4.071 . . . 1.0 . . . . . . . . . . . . A . 8 ASN C . . . . . . . . . c30226_5ug5 1 . 11 . 2945 . 1 1 8 ASN CA C 2.767 0.666 4.017 . . . 1.0 . . . . . . . . . . . . A . 8 ASN CA . . . . . . . . . c30226_5ug5 1 . 11 . 2946 . 1 1 8 ASN CB C 3.426 1.081 2.711 . . . 1.0 . . . . . . . . . . . . A . 8 ASN CB . . . . . . . . . c30226_5ug5 1 . 11 . 2947 . 1 1 8 ASN CG C 4.923 0.829 2.671 . . . 1.0 . . . . . . . . . . . . A . 8 ASN CG . . . . . . . . . c30226_5ug5 1 . 11 . 2948 . 1 1 8 ASN H H 2.918 -1.258 3.253 . . . 1.0 . . . . . . . . . . . . A . 8 ASN H . . . . . . . . . c30226_5ug5 1 . 11 . 2949 . 1 1 8 ASN HA H 3.353 1.030 4.848 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HA . . . . . . . . . c30226_5ug5 1 . 11 . 2950 . 1 1 8 ASN HB2 H 2.972 0.527 1.904 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HB2 . . . . . . . . . c30226_5ug5 1 . 11 . 2951 . 1 1 8 ASN HB3 H 3.250 2.117 2.556 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HB3 . . . . . . . . . c30226_5ug5 1 . 11 . 2952 . 1 1 8 ASN HD21 H 5.093 1.228 4.609 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HD21 . . . . . . . . . c30226_5ug5 1 . 11 . 2953 . 1 1 8 ASN HD22 H 6.556 0.806 3.795 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HD22 . . . . . . . . . c30226_5ug5 1 . 11 . 2954 . 1 1 8 ASN N N 2.770 -0.761 4.084 . . . 1.0 . . . . . . . . . . . . A . 8 ASN N . . . . . . . . . c30226_5ug5 1 . 11 . 2955 . 1 1 8 ASN ND2 N 5.589 0.969 3.805 . . . 1.0 . . . . . . . . . . . . A . 8 ASN ND2 . . . . . . . . . c30226_5ug5 1 . 11 . 2956 . 1 1 8 ASN O O 0.614 1.144 3.090 . . . 1.0 . . . . . . . . . . . . A . 8 ASN O . . . . . . . . . c30226_5ug5 1 . 11 . 2957 . 1 1 8 ASN OD1 O 5.475 0.528 1.616 . . . 1.0 . . . . . . . . . . . . A . 8 ASN OD1 . . . . . . . . . c30226_5ug5 1 . 11 . 2958 . 1 1 9 PRO C C -0.652 3.524 4.342 . . . 1.0 . . . . . . . . . . . . A . 9 PRO C . . . . . . . . . c30226_5ug5 1 . 11 . 2959 . 1 1 9 PRO CA C -0.370 2.437 5.370 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CA . . . . . . . . . c30226_5ug5 1 . 11 . 2960 . 1 1 9 PRO CB C -0.297 3.041 6.773 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CB . . . . . . . . . c30226_5ug5 1 . 11 . 2961 . 1 1 9 PRO CD C 1.777 2.035 6.411 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CD . . . . . . . . . c30226_5ug5 1 . 11 . 2962 . 1 1 9 PRO CG C 0.740 2.259 7.458 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CG . . . . . . . . . c30226_5ug5 1 . 11 . 2963 . 1 1 9 PRO HA H -1.145 1.686 5.333 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HA . . . . . . . . . c30226_5ug5 1 . 11 . 2964 . 1 1 9 PRO HB2 H 0.008 4.062 6.701 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HB2 . . . . . . . . . c30226_5ug5 1 . 11 . 2965 . 1 1 9 PRO HB3 H -1.252 2.963 7.268 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HB3 . . . . . . . . . c30226_5ug5 1 . 11 . 2966 . 1 1 9 PRO HD2 H 2.425 2.895 6.324 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HD2 . . . . . . . . . c30226_5ug5 1 . 11 . 2967 . 1 1 9 PRO HD3 H 2.335 1.162 6.633 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HD3 . . . . . . . . . c30226_5ug5 1 . 11 . 2968 . 1 1 9 PRO HG2 H 1.144 2.833 8.276 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HG2 . . . . . . . . . c30226_5ug5 1 . 11 . 2969 . 1 1 9 PRO HG3 H 0.339 1.320 7.805 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HG3 . . . . . . . . . c30226_5ug5 1 . 11 . 2970 . 1 1 9 PRO N N 0.963 1.851 5.200 . . . 1.0 . . . . . . . . . . . . A . 9 PRO N . . . . . . . . . c30226_5ug5 1 . 11 . 2971 . 1 1 9 PRO O O -1.798 3.758 3.961 . . . 1.0 . . . . . . . . . . . . A . 9 PRO O . . . . . . . . . c30226_5ug5 1 . 11 . 2972 . 1 1 10 ALA C C 0.167 4.664 1.488 . . . 1.0 . . . . . . . . . . . . A . 10 ALA C . . . . . . . . . c30226_5ug5 1 . 11 . 2973 . 1 1 10 ALA CA C 0.285 5.231 2.897 . . . 1.0 . . . . . . . . . . . . A . 10 ALA CA . . . . . . . . . c30226_5ug5 1 . 11 . 2974 . 1 1 10 ALA CB C 1.464 6.185 2.982 . . . 1.0 . . . . . . . . . . . . A . 10 ALA CB . . . . . . . . . c30226_5ug5 1 . 11 . 2975 . 1 1 10 ALA H H 1.300 3.940 4.235 . . . 1.0 . . . . . . . . . . . . A . 10 ALA H . . . . . . . . . c30226_5ug5 1 . 11 . 2976 . 1 1 10 ALA HA H -0.612 5.791 3.123 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HA . . . . . . . . . c30226_5ug5 1 . 11 . 2977 . 1 1 10 ALA HB1 H 2.370 5.663 2.712 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HB1 . . . . . . . . . c30226_5ug5 1 . 11 . 2978 . 1 1 10 ALA HB2 H 1.551 6.559 3.992 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HB2 . . . . . . . . . c30226_5ug5 1 . 11 . 2979 . 1 1 10 ALA HB3 H 1.310 7.012 2.304 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HB3 . . . . . . . . . c30226_5ug5 1 . 11 . 2980 . 1 1 10 ALA N N 0.410 4.174 3.886 . . . 1.0 . . . . . . . . . . . . A . 10 ALA N . . . . . . . . . c30226_5ug5 1 . 11 . 2981 . 1 1 10 ALA O O -0.238 5.366 0.565 . . . 1.0 . . . . . . . . . . . . A . 10 ALA O . . . . . . . . . c30226_5ug5 1 . 11 . 2982 . 1 1 11 CYS C C -0.928 2.199 -0.070 . . . 1.0 . . . . . . . . . . . . A . 11 CYS C . . . . . . . . . c30226_5ug5 1 . 11 . 2983 . 1 1 11 CYS CA C 0.436 2.787 0.005 . . . 1.0 . . . . . . . . . . . . A . 11 CYS CA . . . . . . . . . c30226_5ug5 1 . 11 . 2984 . 1 1 11 CYS CB C 1.501 1.709 -0.182 . . . 1.0 . . . . . . . . . . . . A . 11 CYS CB . . . . . . . . . c30226_5ug5 1 . 11 . 2985 . 1 1 11 CYS H H 0.623 2.804 2.098 . . . 1.0 . . . . . . . . . . . . A . 11 CYS H . . . . . . . . . c30226_5ug5 1 . 11 . 2986 . 1 1 11 CYS HA H 0.544 3.560 -0.745 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HA . . . . . . . . . c30226_5ug5 1 . 11 . 2987 . 1 1 11 CYS HB2 H 2.474 2.132 0.020 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HB2 . . . . . . . . . c30226_5ug5 1 . 11 . 2988 . 1 1 11 CYS HB3 H 1.310 0.904 0.515 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HB3 . . . . . . . . . c30226_5ug5 1 . 11 . 2989 . 1 1 11 CYS N N 0.505 3.392 1.315 . . . 1.0 . . . . . . . . . . . . A . 11 CYS N . . . . . . . . . c30226_5ug5 1 . 11 . 2990 . 1 1 11 CYS O O -1.685 2.371 -1.025 . . . 1.0 . . . . . . . . . . . . A . 11 CYS O . . . . . . . . . c30226_5ug5 1 . 11 . 2991 . 1 1 11 CYS SG S 1.541 0.998 -1.860 . . . 1.0 . . . . . . . . . . . . A . 11 CYS SG . . . . . . . . . c30226_5ug5 1 . 11 . 2992 . 1 1 12 ARG C C -3.601 2.054 1.191 . . . 1.0 . . . . . . . . . . . . A . 12 ARG C . . . . . . . . . c30226_5ug5 1 . 11 . 2993 . 1 1 12 ARG CA C -2.504 1.007 1.334 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CA . . . . . . . . . c30226_5ug5 1 . 11 . 2994 . 1 1 12 ARG CB C -2.442 0.485 2.747 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CB . . . . . . . . . c30226_5ug5 1 . 11 . 2995 . 1 1 12 ARG CD C -1.270 -1.282 4.077 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CD . . . . . . . . . c30226_5ug5 1 . 11 . 2996 . 1 1 12 ARG CG C -2.075 -0.981 2.828 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CG . . . . . . . . . c30226_5ug5 1 . 11 . 2997 . 1 1 12 ARG CZ C -1.713 -1.333 6.506 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CZ . . . . . . . . . c30226_5ug5 1 . 11 . 2998 . 1 1 12 ARG H H -0.500 1.362 1.681 . . . 1.0 . . . . . . . . . . . . A . 12 ARG H . . . . . . . . . c30226_5ug5 1 . 11 . 2999 . 1 1 12 ARG HA H -2.681 0.199 0.669 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HA . . . . . . . . . c30226_5ug5 1 . 11 . 3000 . 1 1 12 ARG HB2 H -1.692 1.049 3.285 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HB2 . . . . . . . . . c30226_5ug5 1 . 11 . 3001 . 1 1 12 ARG HB3 H -3.384 0.639 3.210 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HB3 . . . . . . . . . c30226_5ug5 1 . 11 . 3002 . 1 1 12 ARG HD2 H -1.112 -2.348 4.138 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HD2 . . . . . . . . . c30226_5ug5 1 . 11 . 3003 . 1 1 12 ARG HD3 H -0.313 -0.779 3.994 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HD3 . . . . . . . . . c30226_5ug5 1 . 11 . 3004 . 1 1 12 ARG HE H -2.600 -0.104 5.203 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HE . . . . . . . . . c30226_5ug5 1 . 11 . 3005 . 1 1 12 ARG HG2 H -2.976 -1.566 2.839 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HG2 . . . . . . . . . c30226_5ug5 1 . 11 . 3006 . 1 1 12 ARG HG3 H -1.484 -1.241 1.961 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HG3 . . . . . . . . . c30226_5ug5 1 . 11 . 3007 . 1 1 12 ARG HH11 H -0.410 -2.755 5.866 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH11 . . . . . . . . . c30226_5ug5 1 . 11 . 3008 . 1 1 12 ARG HH12 H -0.699 -2.723 7.577 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH12 . . . . . . . . . c30226_5ug5 1 . 11 . 3009 . 1 1 12 ARG HH21 H -2.985 -0.057 7.445 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH21 . . . . . . . . . c30226_5ug5 1 . 11 . 3010 . 1 1 12 ARG HH22 H -2.174 -1.196 8.477 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH22 . . . . . . . . . c30226_5ug5 1 . 11 . 3011 . 1 1 12 ARG N N -1.220 1.533 1.030 . . . 1.0 . . . . . . . . . . . . A . 12 ARG N . . . . . . . . . c30226_5ug5 1 . 11 . 3012 . 1 1 12 ARG NE N -1.944 -0.833 5.295 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NE . . . . . . . . . c30226_5ug5 1 . 11 . 3013 . 1 1 12 ARG NH1 N -0.875 -2.353 6.664 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NH1 . . . . . . . . . c30226_5ug5 1 . 11 . 3014 . 1 1 12 ARG NH2 N -2.338 -0.822 7.561 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NH2 . . . . . . . . . c30226_5ug5 1 . 11 . 3015 . 1 1 12 ARG O O -4.739 1.730 0.867 . . . 1.0 . . . . . . . . . . . . A . 12 ARG O . . . . . . . . . c30226_5ug5 1 . 11 . 3016 . 1 1 13 TYR C C -4.792 4.430 -0.120 . . . 1.0 . . . . . . . . . . . . A . 13 TYR C . . . . . . . . . c30226_5ug5 1 . 11 . 3017 . 1 1 13 TYR CA C -4.144 4.431 1.264 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CA . . . . . . . . . c30226_5ug5 1 . 11 . 3018 . 1 1 13 TYR CB C -3.369 5.723 1.483 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CB . . . . . . . . . c30226_5ug5 1 . 11 . 3019 . 1 1 13 TYR CD1 C -4.918 7.302 2.618 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CD1 . . . . . . . . . c30226_5ug5 1 . 11 . 3020 . 1 1 13 TYR CD2 C -4.311 7.757 0.374 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CD2 . . . . . . . . . c30226_5ug5 1 . 11 . 3021 . 1 1 13 TYR CE1 C -5.704 8.423 2.645 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CE1 . . . . . . . . . c30226_5ug5 1 . 11 . 3022 . 1 1 13 TYR CE2 C -5.097 8.890 0.386 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CE2 . . . . . . . . . c30226_5ug5 1 . 11 . 3023 . 1 1 13 TYR CG C -4.214 6.955 1.490 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CG . . . . . . . . . c30226_5ug5 1 . 11 . 3024 . 1 1 13 TYR CZ C -5.757 9.246 1.477 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CZ . . . . . . . . . c30226_5ug5 1 . 11 . 3025 . 1 1 13 TYR H H -2.332 3.492 1.733 . . . 1.0 . . . . . . . . . . . . A . 13 TYR H . . . . . . . . . c30226_5ug5 1 . 11 . 3026 . 1 1 13 TYR HA H -4.911 4.353 2.011 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HA . . . . . . . . . c30226_5ug5 1 . 11 . 3027 . 1 1 13 TYR HB2 H -2.850 5.673 2.427 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HB2 . . . . . . . . . c30226_5ug5 1 . 11 . 3028 . 1 1 13 TYR HB3 H -2.655 5.836 0.691 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HB3 . . . . . . . . . c30226_5ug5 1 . 11 . 3029 . 1 1 13 TYR HD1 H -4.840 6.675 3.490 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HD1 . . . . . . . . . c30226_5ug5 1 . 11 . 3030 . 1 1 13 TYR HD2 H -3.760 7.484 -0.511 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HD2 . . . . . . . . . c30226_5ug5 1 . 11 . 3031 . 1 1 13 TYR HE1 H -6.243 8.670 3.537 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HE1 . . . . . . . . . c30226_5ug5 1 . 11 . 3032 . 1 1 13 TYR HE2 H -5.164 9.509 -0.491 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HE2 . . . . . . . . . c30226_5ug5 1 . 11 . 3033 . 1 1 13 TYR HH H -6.349 10.883 2.326 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HH . . . . . . . . . c30226_5ug5 1 . 11 . 3034 . 1 1 13 TYR N N -3.239 3.310 1.424 . . . 1.0 . . . . . . . . . . . . A . 13 TYR N . . . . . . . . . c30226_5ug5 1 . 11 . 3035 . 1 1 13 TYR O O -5.933 4.857 -0.278 . . . 1.0 . . . . . . . . . . . . A . 13 TYR O . . . . . . . . . c30226_5ug5 1 . 11 . 3036 . 1 1 13 TYR OH O -6.585 10.349 1.553 . . . 1.0 . . . . . . . . . . . . A . 13 TYR OH . . . . . . . . . c30226_5ug5 1 . 11 . 3037 . 1 1 14 ASN C C -4.759 2.471 -2.907 . . . 1.0 . . . . . . . . . . . . A . 14 ASN C . . . . . . . . . c30226_5ug5 1 . 11 . 3038 . 1 1 14 ASN CA C -4.580 3.910 -2.482 . . . 1.0 . . . . . . . . . . . . A . 14 ASN CA . . . . . . . . . c30226_5ug5 1 . 11 . 3039 . 1 1 14 ASN CB C -3.625 4.622 -3.445 . . . 1.0 . . . . . . . . . . . . A . 14 ASN CB . . . . . . . . . c30226_5ug5 1 . 11 . 3040 . 1 1 14 ASN CG C -3.499 6.102 -3.153 . . . 1.0 . . . . . . . . . . . . A . 14 ASN CG . . . . . . . . . c30226_5ug5 1 . 11 . 3041 . 1 1 14 ASN H H -3.176 3.545 -0.938 . . . 1.0 . . . . . . . . . . . . A . 14 ASN H . . . . . . . . . c30226_5ug5 1 . 11 . 3042 . 1 1 14 ASN HA H -5.538 4.407 -2.495 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HA . . . . . . . . . c30226_5ug5 1 . 11 . 3043 . 1 1 14 ASN HB2 H -2.645 4.176 -3.365 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HB2 . . . . . . . . . c30226_5ug5 1 . 11 . 3044 . 1 1 14 ASN HB3 H -3.986 4.501 -4.455 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HB3 . . . . . . . . . c30226_5ug5 1 . 11 . 3045 . 1 1 14 ASN HD21 H -5.016 6.489 -4.371 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HD21 . . . . . . . . . c30226_5ug5 1 . 11 . 3046 . 1 1 14 ASN HD22 H -4.297 7.861 -3.603 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HD22 . . . . . . . . . c30226_5ug5 1 . 11 . 3047 . 1 1 14 ASN N N -4.065 3.945 -1.122 . . . 1.0 . . . . . . . . . . . . A . 14 ASN N . . . . . . . . . c30226_5ug5 1 . 11 . 3048 . 1 1 14 ASN ND2 N -4.356 6.896 -3.770 . . . 1.0 . . . . . . . . . . . . A . 14 ASN ND2 . . . . . . . . . c30226_5ug5 1 . 11 . 3049 . 1 1 14 ASN O O -5.159 2.176 -4.031 . . . 1.0 . . . . . . . . . . . . A . 14 ASN O . . . . . . . . . c30226_5ug5 1 . 11 . 3050 . 1 1 14 ASN OD1 O -2.635 6.530 -2.382 . . . 1.0 . . . . . . . . . . . . A . 14 ASN OD1 . . . . . . . . . c30226_5ug5 1 . 11 . 3051 . 1 1 15 ASN C C -4.823 -0.697 -1.130 . . . 1.0 . . . . . . . . . . . . A . 15 ASN C . . . . . . . . . c30226_5ug5 1 . 11 . 3052 . 1 1 15 ASN CA C -4.310 0.167 -2.277 . . . 1.0 . . . . . . . . . . . . A . 15 ASN CA . . . . . . . . . c30226_5ug5 1 . 11 . 3053 . 1 1 15 ASN CB C -2.835 -0.099 -2.483 . . . 1.0 . . . . . . . . . . . . A . 15 ASN CB . . . . . . . . . c30226_5ug5 1 . 11 . 3054 . 1 1 15 ASN CG C -2.317 0.348 -3.838 . . . 1.0 . . . . . . . . . . . . A . 15 ASN CG . . . . . . . . . c30226_5ug5 1 . 11 . 3055 . 1 1 15 ASN H H -4.345 1.881 -1.053 . . . 1.0 . . . . . . . . . . . . A . 15 ASN H . . . . . . . . . c30226_5ug5 1 . 11 . 3056 . 1 1 15 ASN HA H -4.853 -0.058 -3.177 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HA . . . . . . . . . c30226_5ug5 1 . 11 . 3057 . 1 1 15 ASN HB2 H -2.311 0.459 -1.726 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HB2 . . . . . . . . . c30226_5ug5 1 . 11 . 3058 . 1 1 15 ASN HB3 H -2.637 -1.153 -2.360 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HB3 . . . . . . . . . c30226_5ug5 1 . 11 . 3059 . 1 1 15 ASN HD21 H -0.512 0.657 -3.066 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HD21 . . . . . . . . . c30226_5ug5 1 . 11 . 3060 . 1 1 15 ASN HD22 H -0.680 1.005 -4.753 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HD22 . . . . . . . . . c30226_5ug5 1 . 11 . 3061 . 1 1 15 ASN N N -4.465 1.579 -1.978 . . . 1.0 . . . . . . . . . . . . A . 15 ASN N . . . . . . . . . c30226_5ug5 1 . 11 . 3062 . 1 1 15 ASN ND2 N -1.043 0.704 -3.893 . . . 1.0 . . . . . . . . . . . . A . 15 ASN ND2 . . . . . . . . . c30226_5ug5 1 . 11 . 3063 . 1 1 15 ASN O O -4.064 -1.432 -0.500 . . . 1.0 . . . . . . . . . . . . A . 15 ASN O . . . . . . . . . c30226_5ug5 1 . 11 . 3064 . 1 1 15 ASN OD1 O -3.047 0.365 -4.829 . . . 1.0 . . . . . . . . . . . . A . 15 ASN OD1 . . . . . . . . . c30226_5ug5 1 . 11 . 3065 . 1 1 16 HYP C C -7.221 -2.656 0.054 . . . 1.0 . . . . . . . . . . . . A . 16 HYP C . . . . . . . . . c30226_5ug5 1 . 11 . 3066 . 1 1 16 HYP CA C -6.739 -1.248 0.327 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CA . . . . . . . . . c30226_5ug5 1 . 11 . 3067 . 1 1 16 HYP CB C -7.894 -0.292 0.544 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CB . . . . . . . . . c30226_5ug5 1 . 11 . 3068 . 1 1 16 HYP CD C -7.119 0.127 -1.641 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CD . . . . . . . . . c30226_5ug5 1 . 11 . 3069 . 1 1 16 HYP CG C -7.913 0.754 -0.556 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CG . . . . . . . . . c30226_5ug5 1 . 11 . 3070 . 1 1 16 HYP HA H -6.084 -1.244 1.169 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HA . . . . . . . . . c30226_5ug5 1 . 11 . 3071 . 1 1 16 HYP HB2 H -7.780 0.201 1.495 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HB2 . . . . . . . . . c30226_5ug5 1 . 11 . 3072 . 1 1 16 HYP HB3 H -8.824 -0.849 0.532 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HB3 . . . . . . . . . c30226_5ug5 1 . 11 . 3073 . 1 1 16 HYP HD1 H -6.254 1.768 -0.352 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HD1 . . . . . . . . . c30226_5ug5 1 . 11 . 3074 . 1 1 16 HYP HD22 H -7.724 -0.528 -2.230 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HD22 . . . . . . . . . c30226_5ug5 1 . 11 . 3075 . 1 1 16 HYP HD23 H -6.646 0.877 -2.255 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HD23 . . . . . . . . . c30226_5ug5 1 . 11 . 3076 . 1 1 16 HYP HG H -8.918 0.985 -0.863 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HG . . . . . . . . . c30226_5ug5 1 . 11 . 3077 . 1 1 16 HYP N N -6.119 -0.618 -0.852 . . . 1.0 . . . . . . . . . . . . A . 16 HYP N . . . . . . . . . c30226_5ug5 1 . 11 . 3078 . 1 1 16 HYP O O -7.739 -3.345 0.932 . . . 1.0 . . . . . . . . . . . . A . 16 HYP O . . . . . . . . . c30226_5ug5 1 . 11 . 3079 . 1 1 16 HYP OD1 O -7.202 1.920 -0.157 . . . 1.0 . . . . . . . . . . . . A . 16 HYP OD1 . . . . . . . . . c30226_5ug5 1 . 11 . 3080 . 1 1 17 HIS C C -6.234 -4.949 -2.477 . . . 1.0 . . . . . . . . . . . . A . 17 HIS C . . . . . . . . . c30226_5ug5 1 . 11 . 3081 . 1 1 17 HIS CA C -7.365 -4.412 -1.611 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CA . . . . . . . . . c30226_5ug5 1 . 11 . 3082 . 1 1 17 HIS CB C -8.696 -4.460 -2.367 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CB . . . . . . . . . c30226_5ug5 1 . 11 . 3083 . 1 1 17 HIS CD2 C -10.386 -5.107 -0.516 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CD2 . . . . . . . . . c30226_5ug5 1 . 11 . 3084 . 1 1 17 HIS CE1 C -11.680 -3.344 -0.618 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CE1 . . . . . . . . . c30226_5ug5 1 . 11 . 3085 . 1 1 17 HIS CG C -9.890 -4.298 -1.479 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CG . . . . . . . . . c30226_5ug5 1 . 11 . 3086 . 1 1 17 HIS H H -6.728 -2.399 -1.831 . . . 1.0 . . . . . . . . . . . . A . 17 HIS H . . . . . . . . . c30226_5ug5 1 . 11 . 3087 . 1 1 17 HIS HA H -7.442 -5.025 -0.727 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HA . . . . . . . . . c30226_5ug5 1 . 11 . 3088 . 1 1 17 HIS HB2 H -8.716 -3.667 -3.100 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HB2 . . . . . . . . . c30226_5ug5 1 . 11 . 3089 . 1 1 17 HIS HB3 H -8.781 -5.412 -2.871 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HB3 . . . . . . . . . c30226_5ug5 1 . 11 . 3090 . 1 1 17 HIS HD1 H -10.635 -2.427 -2.125 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HD1 . . . . . . . . . c30226_5ug5 1 . 11 . 3091 . 1 1 17 HIS HD2 H -9.981 -6.061 -0.211 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HD2 . . . . . . . . . c30226_5ug5 1 . 11 . 3092 . 1 1 17 HIS HE1 H -12.474 -2.639 -0.422 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HE1 . . . . . . . . . c30226_5ug5 1 . 11 . 3093 . 1 1 17 HIS HE2 H -11.982 -4.785 0.806 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HE2 . . . . . . . . . c30226_5ug5 1 . 11 . 3094 . 1 1 17 HIS N N -7.061 -3.053 -1.181 . . . 1.0 . . . . . . . . . . . . A . 17 HIS N . . . . . . . . . c30226_5ug5 1 . 11 . 3095 . 1 1 17 HIS ND1 N -10.726 -3.200 -1.519 . . . 1.0 . . . . . . . . . . . . A . 17 HIS ND1 . . . . . . . . . c30226_5ug5 1 . 11 . 3096 . 1 1 17 HIS NE2 N -11.497 -4.493 0.002 . . . 1.0 . . . . . . . . . . . . A . 17 HIS NE2 . . . . . . . . . c30226_5ug5 1 . 11 . 3097 . 1 1 17 HIS O O -6.454 -5.714 -3.414 . . . 1.0 . . . . . . . . . . . . A . 17 HIS O . . . . . . . . . c30226_5ug5 1 . 11 . 3098 . 1 1 18 VAL C C -3.191 -6.142 -2.210 . . . 1.0 . . . . . . . . . . . . A . 18 VAL C . . . . . . . . . c30226_5ug5 1 . 11 . 3099 . 1 1 18 VAL CA C -3.839 -4.938 -2.875 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CA . . . . . . . . . c30226_5ug5 1 . 11 . 3100 . 1 1 18 VAL CB C -2.853 -3.754 -2.967 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CB . . . . . . . . . c30226_5ug5 1 . 11 . 3101 . 1 1 18 VAL CG1 C -1.408 -4.210 -2.946 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CG1 . . . . . . . . . c30226_5ug5 1 . 11 . 3102 . 1 1 18 VAL CG2 C -3.130 -2.939 -4.215 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CG2 . . . . . . . . . c30226_5ug5 1 . 11 . 3103 . 1 1 18 VAL H H -4.914 -3.936 -1.377 . . . 1.0 . . . . . . . . . . . . A . 18 VAL H . . . . . . . . . c30226_5ug5 1 . 11 . 3104 . 1 1 18 VAL HA H -4.137 -5.209 -3.864 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HA . . . . . . . . . c30226_5ug5 1 . 11 . 3105 . 1 1 18 VAL HB H -3.017 -3.117 -2.112 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HB . . . . . . . . . c30226_5ug5 1 . 11 . 3106 . 1 1 18 VAL HG11 H -1.211 -4.823 -3.810 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG11 . . . . . . . . . c30226_5ug5 1 . 11 . 3107 . 1 1 18 VAL HG12 H -1.235 -4.781 -2.048 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG12 . . . . . . . . . c30226_5ug5 1 . 11 . 3108 . 1 1 18 VAL HG13 H -0.762 -3.347 -2.956 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG13 . . . . . . . . . c30226_5ug5 1 . 11 . 3109 . 1 1 18 VAL HG21 H -4.174 -2.668 -4.242 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG21 . . . . . . . . . c30226_5ug5 1 . 11 . 3110 . 1 1 18 VAL HG22 H -2.885 -3.522 -5.089 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG22 . . . . . . . . . c30226_5ug5 1 . 11 . 3111 . 1 1 18 VAL HG23 H -2.527 -2.041 -4.197 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG23 . . . . . . . . . c30226_5ug5 1 . 11 . 3112 . 1 1 18 VAL N N -5.020 -4.533 -2.146 . . . 1.0 . . . . . . . . . . . . A . 18 VAL N . . . . . . . . . c30226_5ug5 1 . 11 . 3113 . 1 1 18 VAL O O -2.731 -7.073 -2.872 . . . 1.0 . . . . . . . . . . . . A . 18 VAL O . . . . . . . . . c30226_5ug5 1 . 11 . 3114 . 1 1 19 CYS C C -3.728 -8.089 0.427 . . . 1.0 . . . . . . . . . . . . A . 19 CYS C . . . . . . . . . c30226_5ug5 1 . 11 . 3115 . 1 1 19 CYS CA C -2.619 -7.202 -0.115 . . . 1.0 . . . . . . . . . . . . A . 19 CYS CA . . . . . . . . . c30226_5ug5 1 . 11 . 3116 . 1 1 19 CYS CB C -1.773 -6.649 1.033 . . . 1.0 . . . . . . . . . . . . A . 19 CYS CB . . . . . . . . . c30226_5ug5 1 . 11 . 3117 . 1 1 19 CYS H H -3.606 -5.364 -0.442 . . . 1.0 . . . . . . . . . . . . A . 19 CYS H . . . . . . . . . c30226_5ug5 1 . 11 . 3118 . 1 1 19 CYS HA H -1.990 -7.789 -0.767 . . . 1.0 . . . . . . . . . . . . A . 19 CYS HA . . . . . . . . . c30226_5ug5 1 . 11 . 3119 . 1 1 19 CYS HB2 H -1.003 -6.010 0.628 . . . 1.0 . . . . . . . . . . . . A . 19 CYS HB2 . . . . . . . . . c30226_5ug5 1 . 11 . 3120 . 1 1 19 CYS HB3 H -2.405 -6.071 1.691 . . . 1.0 . . . . . . . . . . . . A . 19 CYS HB3 . . . . . . . . . c30226_5ug5 1 . 11 . 3121 . 1 1 19 CYS N N -3.190 -6.123 -0.899 . . . 1.0 . . . . . . . . . . . . A . 19 CYS N . . . . . . . . . c30226_5ug5 1 . 11 . 3122 . 1 1 19 CYS O O -3.836 -9.246 -0.029 . . . 1.0 . . . . . . . . . . . . A . 19 CYS O . . . . . . . . . c30226_5ug5 1 . 11 . 3123 . 1 1 19 CYS OXT O -4.512 -7.611 1.276 . . . 1.0 . . . . . . . . . . . . A . 19 CYS OXT . . . . . . . . . c30226_5ug5 1 . 11 . 3124 . 1 1 19 CYS SG S -0.956 -7.934 2.035 . . . 1.0 . . . . . . . . . . . . A . 19 CYS SG . . . . . . . . . c30226_5ug5 1 . 12 . 3125 . 1 1 1 ILE C C 5.264 1.462 -4.646 . . . 1.0 . . . . . . . . . . . . A . 1 ILE C . . . . . . . . . c30226_5ug5 1 . 12 . 3126 . 1 1 1 ILE CA C 4.256 1.556 -5.784 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CA . . . . . . . . . c30226_5ug5 1 . 12 . 3127 . 1 1 1 ILE CB C 4.946 1.214 -7.124 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CB . . . . . . . . . c30226_5ug5 1 . 12 . 3128 . 1 1 1 ILE CD1 C 6.609 2.078 -8.864 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CD1 . . . . . . . . . c30226_5ug5 1 . 12 . 3129 . 1 1 1 ILE CG1 C 5.885 2.347 -7.561 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CG1 . . . . . . . . . c30226_5ug5 1 . 12 . 3130 . 1 1 1 ILE CG2 C 3.903 0.932 -8.195 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CG2 . . . . . . . . . c30226_5ug5 1 . 12 . 3131 . 1 1 1 ILE H1 H 3.121 3.075 -4.934 . . . 1.0 . . . . . . . . . . . . A . 1 ILE H1 . . . . . . . . . c30226_5ug5 1 . 12 . 3132 . 1 1 1 ILE H2 H 2.977 2.971 -6.613 . . . 1.0 . . . . . . . . . . . . A . 1 ILE H2 . . . . . . . . . c30226_5ug5 1 . 12 . 3133 . 1 1 1 ILE H3 H 4.374 3.627 -5.924 . . . 1.0 . . . . . . . . . . . . A . 1 ILE H3 . . . . . . . . . c30226_5ug5 1 . 12 . 3134 . 1 1 1 ILE HA H 3.472 0.832 -5.612 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HA . . . . . . . . . c30226_5ug5 1 . 12 . 3135 . 1 1 1 ILE HB H 5.526 0.313 -6.980 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HB . . . . . . . . . c30226_5ug5 1 . 12 . 3136 . 1 1 1 ILE HD11 H 7.214 1.190 -8.764 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HD11 . . . . . . . . . c30226_5ug5 1 . 12 . 3137 . 1 1 1 ILE HD12 H 7.242 2.920 -9.104 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HD12 . . . . . . . . . c30226_5ug5 1 . 12 . 3138 . 1 1 1 ILE HD13 H 5.888 1.934 -9.654 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HD13 . . . . . . . . . c30226_5ug5 1 . 12 . 3139 . 1 1 1 ILE HG12 H 5.312 3.253 -7.683 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG12 . . . . . . . . . c30226_5ug5 1 . 12 . 3140 . 1 1 1 ILE HG13 H 6.631 2.501 -6.793 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG13 . . . . . . . . . c30226_5ug5 1 . 12 . 3141 . 1 1 1 ILE HG21 H 3.303 0.084 -7.898 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG21 . . . . . . . . . c30226_5ug5 1 . 12 . 3142 . 1 1 1 ILE HG22 H 4.397 0.714 -9.129 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG22 . . . . . . . . . c30226_5ug5 1 . 12 . 3143 . 1 1 1 ILE HG23 H 3.269 1.797 -8.315 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG23 . . . . . . . . . c30226_5ug5 1 . 12 . 3144 . 1 1 1 ILE N N 3.640 2.899 -5.818 . . . 1.0 . . . . . . . . . . . . A . 1 ILE N . . . . . . . . . c30226_5ug5 1 . 12 . 3145 . 1 1 1 ILE O O 6.032 2.394 -4.407 . . . 1.0 . . . . . . . . . . . . A . 1 ILE O . . . . . . . . . c30226_5ug5 1 . 12 . 3146 . 1 1 2 ARG C C 6.270 -1.371 -2.553 . . . 1.0 . . . . . . . . . . . . A . 2 ARG C . . . . . . . . . c30226_5ug5 1 . 12 . 3147 . 1 1 2 ARG CA C 6.143 0.125 -2.819 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CA . . . . . . . . . c30226_5ug5 1 . 12 . 3148 . 1 1 2 ARG CB C 5.626 0.845 -1.562 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CB . . . . . . . . . c30226_5ug5 1 . 12 . 3149 . 1 1 2 ARG CD C 7.838 1.795 -0.841 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CD . . . . . . . . . c30226_5ug5 1 . 12 . 3150 . 1 1 2 ARG CG C 6.649 0.939 -0.444 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CG . . . . . . . . . c30226_5ug5 1 . 12 . 3151 . 1 1 2 ARG CZ C 9.760 2.710 0.399 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CZ . . . . . . . . . c30226_5ug5 1 . 12 . 3152 . 1 1 2 ARG H H 4.597 -0.362 -4.169 . . . 1.0 . . . . . . . . . . . . A . 2 ARG H . . . . . . . . . c30226_5ug5 1 . 12 . 3153 . 1 1 2 ARG HA H 7.107 0.519 -3.088 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HA . . . . . . . . . c30226_5ug5 1 . 12 . 3154 . 1 1 2 ARG HB2 H 5.331 1.847 -1.832 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB2 . . . . . . . . . c30226_5ug5 1 . 12 . 3155 . 1 1 2 ARG HB3 H 4.764 0.315 -1.180 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB3 . . . . . . . . . c30226_5ug5 1 . 12 . 3156 . 1 1 2 ARG HD2 H 8.218 1.449 -1.789 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD2 . . . . . . . . . c30226_5ug5 1 . 12 . 3157 . 1 1 2 ARG HD3 H 7.514 2.819 -0.934 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD3 . . . . . . . . . c30226_5ug5 1 . 12 . 3158 . 1 1 2 ARG HE H 8.993 0.869 0.652 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HE . . . . . . . . . c30226_5ug5 1 . 12 . 3159 . 1 1 2 ARG HG2 H 6.179 1.377 0.424 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG2 . . . . . . . . . c30226_5ug5 1 . 12 . 3160 . 1 1 2 ARG HG3 H 6.996 -0.053 -0.204 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG3 . . . . . . . . . c30226_5ug5 1 . 12 . 3161 . 1 1 2 ARG HH11 H 8.940 3.994 -0.941 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH11 . . . . . . . . . c30226_5ug5 1 . 12 . 3162 . 1 1 2 ARG HH12 H 10.305 4.608 -0.069 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH12 . . . . . . . . . c30226_5ug5 1 . 12 . 3163 . 1 1 2 ARG HH21 H 10.799 1.671 1.795 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH21 . . . . . . . . . c30226_5ug5 1 . 12 . 3164 . 1 1 2 ARG HH22 H 11.364 3.282 1.499 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH22 . . . . . . . . . c30226_5ug5 1 . 12 . 3165 . 1 1 2 ARG N N 5.239 0.344 -3.935 . . . 1.0 . . . . . . . . . . . . A . 2 ARG N . . . . . . . . . c30226_5ug5 1 . 12 . 3166 . 1 1 2 ARG NE N 8.904 1.721 0.149 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NE . . . . . . . . . c30226_5ug5 1 . 12 . 3167 . 1 1 2 ARG NH1 N 9.660 3.863 -0.255 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH1 . . . . . . . . . c30226_5ug5 1 . 12 . 3168 . 1 1 2 ARG NH2 N 10.717 2.542 1.301 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH2 . . . . . . . . . c30226_5ug5 1 . 12 . 3169 . 1 1 2 ARG O O 5.310 -2.119 -2.727 . . . 1.0 . . . . . . . . . . . . A . 2 ARG O . . . . . . . . . c30226_5ug5 1 . 12 . 3170 . 1 1 3 ASP C C 7.184 -3.591 -0.493 . . . 1.0 . . . . . . . . . . . . A . 3 ASP C . . . . . . . . . c30226_5ug5 1 . 12 . 3171 . 1 1 3 ASP CA C 7.694 -3.223 -1.871 . . . 1.0 . . . . . . . . . . . . A . 3 ASP CA . . . . . . . . . c30226_5ug5 1 . 12 . 3172 . 1 1 3 ASP CB C 9.185 -3.545 -2.029 . . . 1.0 . . . . . . . . . . . . A . 3 ASP CB . . . . . . . . . c30226_5ug5 1 . 12 . 3173 . 1 1 3 ASP CG C 9.515 -5.002 -1.773 . . . 1.0 . . . . . . . . . . . . A . 3 ASP CG . . . . . . . . . c30226_5ug5 1 . 12 . 3174 . 1 1 3 ASP H H 8.179 -1.160 -1.999 . . . 1.0 . . . . . . . . . . . . A . 3 ASP H . . . . . . . . . c30226_5ug5 1 . 12 . 3175 . 1 1 3 ASP HA H 7.131 -3.772 -2.585 . . . 1.0 . . . . . . . . . . . . A . 3 ASP HA . . . . . . . . . c30226_5ug5 1 . 12 . 3176 . 1 1 3 ASP HB2 H 9.493 -3.303 -3.035 . . . 1.0 . . . . . . . . . . . . A . 3 ASP HB2 . . . . . . . . . c30226_5ug5 1 . 12 . 3177 . 1 1 3 ASP HB3 H 9.748 -2.941 -1.333 . . . 1.0 . . . . . . . . . . . . A . 3 ASP HB3 . . . . . . . . . c30226_5ug5 1 . 12 . 3178 . 1 1 3 ASP N N 7.453 -1.804 -2.135 . . . 1.0 . . . . . . . . . . . . A . 3 ASP N . . . . . . . . . c30226_5ug5 1 . 12 . 3179 . 1 1 3 ASP O O 7.167 -4.747 -0.076 . . . 1.0 . . . . . . . . . . . . A . 3 ASP O . . . . . . . . . c30226_5ug5 1 . 12 . 3180 . 1 1 3 ASP OD1 O 8.957 -5.879 -2.467 . . . 1.0 . . . . . . . . . . . . A . 3 ASP OD1 . . . . . . . . . c30226_5ug5 1 . 12 . 3181 . 1 1 3 ASP OD2 O 10.357 -5.277 -0.892 . . . 1.0 . . . . . . . . . . . . A . 3 ASP OD2 . . . . . . . . . c30226_5ug5 1 . 12 . 3182 . 1 1 4 GLU C C 4.682 -2.249 1.417 . . . 1.0 . . . . . . . . . . . . A . 4 GLU C . . . . . . . . . c30226_5ug5 1 . 12 . 3183 . 1 1 4 GLU CA C 6.140 -2.661 1.486 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CA . . . . . . . . . c30226_5ug5 1 . 12 . 3184 . 1 1 4 GLU CB C 6.838 -1.746 2.472 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CB . . . . . . . . . c30226_5ug5 1 . 12 . 3185 . 1 1 4 GLU CD C 9.283 -1.686 1.828 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CD . . . . . . . . . c30226_5ug5 1 . 12 . 3186 . 1 1 4 GLU CG C 8.252 -2.158 2.830 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CG . . . . . . . . . c30226_5ug5 1 . 12 . 3187 . 1 1 4 GLU H H 6.840 -1.698 -0.234 . . . 1.0 . . . . . . . . . . . . A . 4 GLU H . . . . . . . . . c30226_5ug5 1 . 12 . 3188 . 1 1 4 GLU HA H 6.212 -3.681 1.827 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HA . . . . . . . . . c30226_5ug5 1 . 12 . 3189 . 1 1 4 GLU HB2 H 6.875 -0.751 2.053 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HB2 . . . . . . . . . c30226_5ug5 1 . 12 . 3190 . 1 1 4 GLU HB3 H 6.249 -1.722 3.363 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HB3 . . . . . . . . . c30226_5ug5 1 . 12 . 3191 . 1 1 4 GLU HG2 H 8.498 -1.746 3.796 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HG2 . . . . . . . . . c30226_5ug5 1 . 12 . 3192 . 1 1 4 GLU HG3 H 8.292 -3.236 2.880 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HG3 . . . . . . . . . c30226_5ug5 1 . 12 . 3193 . 1 1 4 GLU N N 6.748 -2.565 0.178 . . . 1.0 . . . . . . . . . . . . A . 4 GLU N . . . . . . . . . c30226_5ug5 1 . 12 . 3194 . 1 1 4 GLU O O 4.112 -1.798 2.397 . . . 1.0 . . . . . . . . . . . . A . 4 GLU O . . . . . . . . . c30226_5ug5 1 . 12 . 3195 . 1 1 4 GLU OE1 O 10.442 -2.132 1.917 . . . 1.0 . . . . . . . . . . . . A . 4 GLU OE1 . . . . . . . . . c30226_5ug5 1 . 12 . 3196 . 1 1 4 GLU OE2 O 8.949 -0.855 0.956 . . . 1.0 . . . . . . . . . . . . A . 4 GLU OE2 . . . . . . . . . c30226_5ug5 1 . 12 . 3197 . 1 1 5 CYS C C 1.691 -2.448 0.889 . . . 1.0 . . . . . . . . . . . . A . 5 CYS C . . . . . . . . . c30226_5ug5 1 . 12 . 3198 . 1 1 5 CYS CA C 2.774 -1.855 -0.014 . . . 1.0 . . . . . . . . . . . . A . 5 CYS CA . . . . . . . . . c30226_5ug5 1 . 12 . 3199 . 1 1 5 CYS CB C 2.442 -2.082 -1.478 . . . 1.0 . . . . . . . . . . . . A . 5 CYS CB . . . . . . . . . c30226_5ug5 1 . 12 . 3200 . 1 1 5 CYS H H 4.549 -2.877 -0.448 . . . 1.0 . . . . . . . . . . . . A . 5 CYS H . . . . . . . . . c30226_5ug5 1 . 12 . 3201 . 1 1 5 CYS HA H 2.816 -0.791 0.162 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HA . . . . . . . . . c30226_5ug5 1 . 12 . 3202 . 1 1 5 CYS HB2 H 3.171 -2.758 -1.899 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HB2 . . . . . . . . . c30226_5ug5 1 . 12 . 3203 . 1 1 5 CYS HB3 H 1.473 -2.525 -1.551 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HB3 . . . . . . . . . c30226_5ug5 1 . 12 . 3204 . 1 1 5 CYS N N 4.092 -2.389 0.255 . . . 1.0 . . . . . . . . . . . . A . 5 CYS N . . . . . . . . . c30226_5ug5 1 . 12 . 3205 . 1 1 5 CYS O O 0.675 -1.802 1.144 . . . 1.0 . . . . . . . . . . . . A . 5 CYS O . . . . . . . . . c30226_5ug5 1 . 12 . 3206 . 1 1 5 CYS SG S 2.460 -0.561 -2.478 . . . 1.0 . . . . . . . . . . . . A . 5 CYS SG . . . . . . . . . c30226_5ug5 1 . 12 . 3207 . 1 1 6 CYS C C 1.178 -3.877 3.709 . . . 1.0 . . . . . . . . . . . . A . 6 CYS C . . . . . . . . . c30226_5ug5 1 . 12 . 3208 . 1 1 6 CYS CA C 0.932 -4.291 2.261 . . . 1.0 . . . . . . . . . . . . A . 6 CYS CA . . . . . . . . . c30226_5ug5 1 . 12 . 3209 . 1 1 6 CYS CB C 0.993 -5.813 2.120 . . . 1.0 . . . . . . . . . . . . A . 6 CYS CB . . . . . . . . . c30226_5ug5 1 . 12 . 3210 . 1 1 6 CYS H H 2.747 -4.121 1.180 . . . 1.0 . . . . . . . . . . . . A . 6 CYS H . . . . . . . . . c30226_5ug5 1 . 12 . 3211 . 1 1 6 CYS HA H -0.048 -3.948 1.963 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HA . . . . . . . . . c30226_5ug5 1 . 12 . 3212 . 1 1 6 CYS HB2 H 1.047 -6.069 1.072 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HB2 . . . . . . . . . c30226_5ug5 1 . 12 . 3213 . 1 1 6 CYS HB3 H 1.876 -6.179 2.622 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HB3 . . . . . . . . . c30226_5ug5 1 . 12 . 3214 . 1 1 6 CYS N N 1.909 -3.654 1.389 . . . 1.0 . . . . . . . . . . . . A . 6 CYS N . . . . . . . . . c30226_5ug5 1 . 12 . 3215 . 1 1 6 CYS O O 0.273 -3.902 4.546 . . . 1.0 . . . . . . . . . . . . A . 6 CYS O . . . . . . . . . c30226_5ug5 1 . 12 . 3216 . 1 1 6 CYS SG S -0.447 -6.677 2.828 . . . 1.0 . . . . . . . . . . . . A . 6 CYS SG . . . . . . . . . c30226_5ug5 1 . 12 . 3217 . 1 1 7 SER C C 2.496 -1.520 5.437 . . . 1.0 . . . . . . . . . . . . A . 7 SER C . . . . . . . . . c30226_5ug5 1 . 12 . 3218 . 1 1 7 SER CA C 2.779 -3.008 5.310 . . . 1.0 . . . . . . . . . . . . A . 7 SER CA . . . . . . . . . c30226_5ug5 1 . 12 . 3219 . 1 1 7 SER CB C 4.267 -3.226 5.510 . . . 1.0 . . . . . . . . . . . . A . 7 SER CB . . . . . . . . . c30226_5ug5 1 . 12 . 3220 . 1 1 7 SER H H 3.101 -3.539 3.305 . . . 1.0 . . . . . . . . . . . . A . 7 SER H . . . . . . . . . c30226_5ug5 1 . 12 . 3221 . 1 1 7 SER HA H 2.227 -3.556 6.054 . . . 1.0 . . . . . . . . . . . . A . 7 SER HA . . . . . . . . . c30226_5ug5 1 . 12 . 3222 . 1 1 7 SER HB2 H 4.779 -2.280 5.373 . . . 1.0 . . . . . . . . . . . . A . 7 SER HB2 . . . . . . . . . c30226_5ug5 1 . 12 . 3223 . 1 1 7 SER HB3 H 4.444 -3.592 6.506 . . . 1.0 . . . . . . . . . . . . A . 7 SER HB3 . . . . . . . . . c30226_5ug5 1 . 12 . 3224 . 1 1 7 SER HG H 5.068 -4.956 5.048 . . . 1.0 . . . . . . . . . . . . A . 7 SER HG . . . . . . . . . c30226_5ug5 1 . 12 . 3225 . 1 1 7 SER N N 2.408 -3.487 3.995 . . . 1.0 . . . . . . . . . . . . A . 7 SER N . . . . . . . . . c30226_5ug5 1 . 12 . 3226 . 1 1 7 SER O O 2.089 -1.034 6.491 . . . 1.0 . . . . . . . . . . . . A . 7 SER O . . . . . . . . . c30226_5ug5 1 . 12 . 3227 . 1 1 7 SER OG O 4.769 -4.171 4.575 . . . 1.0 . . . . . . . . . . . . A . 7 SER OG . . . . . . . . . c30226_5ug5 1 . 12 . 3228 . 1 1 8 ASN C C 1.410 1.271 4.168 . . . 1.0 . . . . . . . . . . . . A . 8 ASN C . . . . . . . . . c30226_5ug5 1 . 12 . 3229 . 1 1 8 ASN CA C 2.777 0.630 4.362 . . . 1.0 . . . . . . . . . . . . A . 8 ASN CA . . . . . . . . . c30226_5ug5 1 . 12 . 3230 . 1 1 8 ASN CB C 3.750 1.119 3.282 . . . 1.0 . . . . . . . . . . . . A . 8 ASN CB . . . . . . . . . c30226_5ug5 1 . 12 . 3231 . 1 1 8 ASN CG C 3.886 2.629 3.248 . . . 1.0 . . . . . . . . . . . . A . 8 ASN CG . . . . . . . . . c30226_5ug5 1 . 12 . 3232 . 1 1 8 ASN H H 2.788 -1.281 3.475 . . . 1.0 . . . . . . . . . . . . A . 8 ASN H . . . . . . . . . c30226_5ug5 1 . 12 . 3233 . 1 1 8 ASN HA H 3.169 0.906 5.328 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HA . . . . . . . . . c30226_5ug5 1 . 12 . 3234 . 1 1 8 ASN HB2 H 4.725 0.696 3.472 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HB2 . . . . . . . . . c30226_5ug5 1 . 12 . 3235 . 1 1 8 ASN HB3 H 3.400 0.784 2.312 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HB3 . . . . . . . . . c30226_5ug5 1 . 12 . 3236 . 1 1 8 ASN HD21 H 4.435 2.561 1.340 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HD21 . . . . . . . . . c30226_5ug5 1 . 12 . 3237 . 1 1 8 ASN HD22 H 4.378 4.134 2.050 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HD22 . . . . . . . . . c30226_5ug5 1 . 12 . 3238 . 1 1 8 ASN N N 2.697 -0.813 4.338 . . . 1.0 . . . . . . . . . . . . A . 8 ASN N . . . . . . . . . c30226_5ug5 1 . 12 . 3239 . 1 1 8 ASN ND2 N 4.267 3.160 2.096 . . . 1.0 . . . . . . . . . . . . A . 8 ASN ND2 . . . . . . . . . c30226_5ug5 1 . 12 . 3240 . 1 1 8 ASN O O 0.803 1.157 3.098 . . . 1.0 . . . . . . . . . . . . A . 8 ASN O . . . . . . . . . c30226_5ug5 1 . 12 . 3241 . 1 1 8 ASN OD1 O 3.665 3.312 4.246 . . . 1.0 . . . . . . . . . . . . A . 8 ASN OD1 . . . . . . . . . c30226_5ug5 1 . 12 . 3242 . 1 1 9 PRO C C -0.449 3.670 4.038 . . . 1.0 . . . . . . . . . . . . A . 9 PRO C . . . . . . . . . c30226_5ug5 1 . 12 . 3243 . 1 1 9 PRO CA C -0.367 2.667 5.177 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CA . . . . . . . . . c30226_5ug5 1 . 12 . 3244 . 1 1 9 PRO CB C -0.380 3.400 6.518 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CB . . . . . . . . . c30226_5ug5 1 . 12 . 3245 . 1 1 9 PRO CD C 1.579 2.126 6.513 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CD . . . . . . . . . c30226_5ug5 1 . 12 . 3246 . 1 1 9 PRO CG C 0.466 2.585 7.393 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CG . . . . . . . . . c30226_5ug5 1 . 12 . 3247 . 1 1 9 PRO HA H -1.200 1.982 5.125 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HA . . . . . . . . . c30226_5ug5 1 . 12 . 3248 . 1 1 9 PRO HB2 H 0.055 4.368 6.393 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HB2 . . . . . . . . . c30226_5ug5 1 . 12 . 3249 . 1 1 9 PRO HB3 H -1.388 3.481 6.892 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HB3 . . . . . . . . . c30226_5ug5 1 . 12 . 3250 . 1 1 9 PRO HD2 H 2.362 2.871 6.466 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HD2 . . . . . . . . . c30226_5ug5 1 . 12 . 3251 . 1 1 9 PRO HD3 H 1.959 1.200 6.863 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HD3 . . . . . . . . . c30226_5ug5 1 . 12 . 3252 . 1 1 9 PRO HG2 H 0.847 3.195 8.194 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HG2 . . . . . . . . . c30226_5ug5 1 . 12 . 3253 . 1 1 9 PRO HG3 H -0.089 1.742 7.777 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HG3 . . . . . . . . . c30226_5ug5 1 . 12 . 3254 . 1 1 9 PRO N N 0.918 1.966 5.207 . . . 1.0 . . . . . . . . . . . . A . 9 PRO N . . . . . . . . . c30226_5ug5 1 . 12 . 3255 . 1 1 9 PRO O O -1.530 3.967 3.538 . . . 1.0 . . . . . . . . . . . . A . 9 PRO O . . . . . . . . . c30226_5ug5 1 . 12 . 3256 . 1 1 10 ALA C C 0.421 4.550 1.209 . . . 1.0 . . . . . . . . . . . . A . 10 ALA C . . . . . . . . . c30226_5ug5 1 . 12 . 3257 . 1 1 10 ALA CA C 0.768 5.168 2.560 . . . 1.0 . . . . . . . . . . . . A . 10 ALA CA . . . . . . . . . c30226_5ug5 1 . 12 . 3258 . 1 1 10 ALA CB C 2.147 5.803 2.503 . . . 1.0 . . . . . . . . . . . . A . 10 ALA CB . . . . . . . . . c30226_5ug5 1 . 12 . 3259 . 1 1 10 ALA H H 1.531 3.922 4.096 . . . 1.0 . . . . . . . . . . . . A . 10 ALA H . . . . . . . . . c30226_5ug5 1 . 12 . 3260 . 1 1 10 ALA HA H 0.051 5.947 2.776 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HA . . . . . . . . . c30226_5ug5 1 . 12 . 3261 . 1 1 10 ALA HB1 H 2.879 5.050 2.255 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HB1 . . . . . . . . . c30226_5ug5 1 . 12 . 3262 . 1 1 10 ALA HB2 H 2.385 6.235 3.463 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HB2 . . . . . . . . . c30226_5ug5 1 . 12 . 3263 . 1 1 10 ALA HB3 H 2.155 6.575 1.748 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HB3 . . . . . . . . . c30226_5ug5 1 . 12 . 3264 . 1 1 10 ALA N N 0.702 4.191 3.639 . . . 1.0 . . . . . . . . . . . . A . 10 ALA N . . . . . . . . . c30226_5ug5 1 . 12 . 3265 . 1 1 10 ALA O O -0.049 5.246 0.311 . . . 1.0 . . . . . . . . . . . . A . 10 ALA O . . . . . . . . . c30226_5ug5 1 . 12 . 3266 . 1 1 11 CYS C C -1.047 2.191 -0.146 . . . 1.0 . . . . . . . . . . . . A . 11 CYS C . . . . . . . . . c30226_5ug5 1 . 12 . 3267 . 1 1 11 CYS CA C 0.371 2.610 -0.214 . . . 1.0 . . . . . . . . . . . . A . 11 CYS CA . . . . . . . . . c30226_5ug5 1 . 12 . 3268 . 1 1 11 CYS CB C 1.258 1.384 -0.441 . . . 1.0 . . . . . . . . . . . . A . 11 CYS CB . . . . . . . . . c30226_5ug5 1 . 12 . 3269 . 1 1 11 CYS H H 0.765 2.670 1.848 . . . 1.0 . . . . . . . . . . . . A . 11 CYS H . . . . . . . . . c30226_5ug5 1 . 12 . 3270 . 1 1 11 CYS HA H 0.508 3.333 -1.005 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HA . . . . . . . . . c30226_5ug5 1 . 12 . 3271 . 1 1 11 CYS HB2 H 2.282 1.700 -0.570 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HB2 . . . . . . . . . c30226_5ug5 1 . 12 . 3272 . 1 1 11 CYS HB3 H 1.187 0.730 0.424 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HB3 . . . . . . . . . c30226_5ug5 1 . 12 . 3273 . 1 1 11 CYS N N 0.628 3.244 1.059 . . . 1.0 . . . . . . . . . . . . A . 11 CYS N . . . . . . . . . c30226_5ug5 1 . 12 . 3274 . 1 1 11 CYS O O -1.888 2.512 -0.986 . . . 1.0 . . . . . . . . . . . . A . 11 CYS O . . . . . . . . . c30226_5ug5 1 . 12 . 3275 . 1 1 11 CYS SG S 0.776 0.416 -1.913 . . . 1.0 . . . . . . . . . . . . A . 11 CYS SG . . . . . . . . . c30226_5ug5 1 . 12 . 3276 . 1 1 12 ARG C C -3.647 2.041 1.280 . . . 1.0 . . . . . . . . . . . . A . 12 ARG C . . . . . . . . . c30226_5ug5 1 . 12 . 3277 . 1 1 12 ARG CA C -2.535 1.001 1.351 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CA . . . . . . . . . c30226_5ug5 1 . 12 . 3278 . 1 1 12 ARG CB C -2.372 0.484 2.754 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CB . . . . . . . . . c30226_5ug5 1 . 12 . 3279 . 1 1 12 ARG CD C -1.284 -1.329 4.071 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CD . . . . . . . . . c30226_5ug5 1 . 12 . 3280 . 1 1 12 ARG CG C -2.028 -0.989 2.803 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CG . . . . . . . . . c30226_5ug5 1 . 12 . 3281 . 1 1 12 ARG CZ C -1.737 -1.468 6.496 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CZ . . . . . . . . . c30226_5ug5 1 . 12 . 3282 . 1 1 12 ARG H H -0.502 1.309 1.541 . . . 1.0 . . . . . . . . . . . . A . 12 ARG H . . . . . . . . . c30226_5ug5 1 . 12 . 3283 . 1 1 12 ARG HA H -2.758 0.187 0.712 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HA . . . . . . . . . c30226_5ug5 1 . 12 . 3284 . 1 1 12 ARG HB2 H -1.570 1.032 3.229 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HB2 . . . . . . . . . c30226_5ug5 1 . 12 . 3285 . 1 1 12 ARG HB3 H -3.270 0.657 3.289 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HB3 . . . . . . . . . c30226_5ug5 1 . 12 . 3286 . 1 1 12 ARG HD2 H -1.021 -2.378 4.050 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HD2 . . . . . . . . . c30226_5ug5 1 . 12 . 3287 . 1 1 12 ARG HD3 H -0.379 -0.731 4.098 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HD3 . . . . . . . . . c30226_5ug5 1 . 12 . 3288 . 1 1 12 ARG HE H -2.912 -0.549 5.155 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HE . . . . . . . . . c30226_5ug5 1 . 12 . 3289 . 1 1 12 ARG HG2 H -2.939 -1.564 2.762 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HG2 . . . . . . . . . c30226_5ug5 1 . 12 . 3290 . 1 1 12 ARG HG3 H -1.406 -1.233 1.954 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HG3 . . . . . . . . . c30226_5ug5 1 . 12 . 3291 . 1 1 12 ARG HH11 H -0.061 -2.438 5.898 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH11 . . . . . . . . . c30226_5ug5 1 . 12 . 3292 . 1 1 12 ARG HH12 H -0.384 -2.494 7.602 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH12 . . . . . . . . . c30226_5ug5 1 . 12 . 3293 . 1 1 12 ARG HH21 H -3.351 -0.650 7.409 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH21 . . . . . . . . . c30226_5ug5 1 . 12 . 3294 . 1 1 12 ARG HH22 H -2.254 -1.496 8.455 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH22 . . . . . . . . . c30226_5ug5 1 . 12 . 3295 . 1 1 12 ARG N N -1.270 1.506 0.954 . . . 1.0 . . . . . . . . . . . . A . 12 ARG N . . . . . . . . . c30226_5ug5 1 . 12 . 3296 . 1 1 12 ARG NE N -2.077 -1.060 5.272 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NE . . . . . . . . . c30226_5ug5 1 . 12 . 3297 . 1 1 12 ARG NH1 N -0.640 -2.191 6.679 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NH1 . . . . . . . . . c30226_5ug5 1 . 12 . 3298 . 1 1 12 ARG NH2 N -2.506 -1.178 7.534 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NH2 . . . . . . . . . c30226_5ug5 1 . 12 . 3299 . 1 1 12 ARG O O -4.793 1.708 0.992 . . . 1.0 . . . . . . . . . . . . A . 12 ARG O . . . . . . . . . c30226_5ug5 1 . 12 . 3300 . 1 1 13 TYR C C -4.970 4.440 0.139 . . . 1.0 . . . . . . . . . . . . A . 13 TYR C . . . . . . . . . c30226_5ug5 1 . 12 . 3301 . 1 1 13 TYR CA C -4.243 4.396 1.481 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CA . . . . . . . . . c30226_5ug5 1 . 12 . 3302 . 1 1 13 TYR CB C -3.502 5.705 1.723 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CB . . . . . . . . . c30226_5ug5 1 . 12 . 3303 . 1 1 13 TYR CD1 C -5.117 6.937 3.177 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CD1 . . . . . . . . . c30226_5ug5 1 . 12 . 3304 . 1 1 13 TYR CD2 C -4.528 7.884 1.087 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CD2 . . . . . . . . . c30226_5ug5 1 . 12 . 3305 . 1 1 13 TYR CE1 C -5.946 8.008 3.436 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CE1 . . . . . . . . . c30226_5ug5 1 . 12 . 3306 . 1 1 13 TYR CE2 C -5.348 8.956 1.330 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CE2 . . . . . . . . . c30226_5ug5 1 . 12 . 3307 . 1 1 13 TYR CG C -4.403 6.864 2.002 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CG . . . . . . . . . c30226_5ug5 1 . 12 . 3308 . 1 1 13 TYR CZ C -6.059 9.017 2.508 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CZ . . . . . . . . . c30226_5ug5 1 . 12 . 3309 . 1 1 13 TYR H H -2.375 3.490 1.796 . . . 1.0 . . . . . . . . . . . . A . 13 TYR H . . . . . . . . . c30226_5ug5 1 . 12 . 3310 . 1 1 13 TYR HA H -4.965 4.257 2.265 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HA . . . . . . . . . c30226_5ug5 1 . 12 . 3311 . 1 1 13 TYR HB2 H -2.837 5.592 2.565 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HB2 . . . . . . . . . c30226_5ug5 1 . 12 . 3312 . 1 1 13 TYR HB3 H -2.929 5.950 0.849 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HB3 . . . . . . . . . c30226_5ug5 1 . 12 . 3313 . 1 1 13 TYR HD1 H -5.019 6.139 3.892 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HD1 . . . . . . . . . c30226_5ug5 1 . 12 . 3314 . 1 1 13 TYR HD2 H -3.970 7.829 0.167 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HD2 . . . . . . . . . c30226_5ug5 1 . 12 . 3315 . 1 1 13 TYR HE1 H -6.496 8.051 4.357 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HE1 . . . . . . . . . c30226_5ug5 1 . 12 . 3316 . 1 1 13 TYR HE2 H -5.428 9.737 0.603 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HE2 . . . . . . . . . c30226_5ug5 1 . 12 . 3317 . 1 1 13 TYR HH H -7.447 10.245 1.983 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HH . . . . . . . . . c30226_5ug5 1 . 12 . 3318 . 1 1 13 TYR N N -3.298 3.295 1.537 . . . 1.0 . . . . . . . . . . . . A . 13 TYR N . . . . . . . . . c30226_5ug5 1 . 12 . 3319 . 1 1 13 TYR O O -6.134 4.824 0.068 . . . 1.0 . . . . . . . . . . . . A . 13 TYR O . . . . . . . . . c30226_5ug5 1 . 12 . 3320 . 1 1 13 TYR OH O -6.887 10.089 2.757 . . . 1.0 . . . . . . . . . . . . A . 13 TYR OH . . . . . . . . . c30226_5ug5 1 . 12 . 3321 . 1 1 14 ASN C C -4.967 2.600 -2.738 . . . 1.0 . . . . . . . . . . . . A . 14 ASN C . . . . . . . . . c30226_5ug5 1 . 12 . 3322 . 1 1 14 ASN CA C -4.879 4.038 -2.253 . . . 1.0 . . . . . . . . . . . . A . 14 ASN CA . . . . . . . . . c30226_5ug5 1 . 12 . 3323 . 1 1 14 ASN CB C -4.047 4.895 -3.214 . . . 1.0 . . . . . . . . . . . . A . 14 ASN CB . . . . . . . . . c30226_5ug5 1 . 12 . 3324 . 1 1 14 ASN CG C -4.720 5.127 -4.557 . . . 1.0 . . . . . . . . . . . . A . 14 ASN CG . . . . . . . . . c30226_5ug5 1 . 12 . 3325 . 1 1 14 ASN H H -3.359 3.701 -0.813 . . . 1.0 . . . . . . . . . . . . A . 14 ASN H . . . . . . . . . c30226_5ug5 1 . 12 . 3326 . 1 1 14 ASN HA H -5.875 4.447 -2.175 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HA . . . . . . . . . c30226_5ug5 1 . 12 . 3327 . 1 1 14 ASN HB2 H -3.865 5.855 -2.758 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HB2 . . . . . . . . . c30226_5ug5 1 . 12 . 3328 . 1 1 14 ASN HB3 H -3.100 4.404 -3.389 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HB3 . . . . . . . . . c30226_5ug5 1 . 12 . 3329 . 1 1 14 ASN HD21 H -6.527 5.056 -3.726 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HD21 . . . . . . . . . c30226_5ug5 1 . 12 . 3330 . 1 1 14 ASN HD22 H -6.496 5.315 -5.434 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HD22 . . . . . . . . . c30226_5ug5 1 . 12 . 3331 . 1 1 14 ASN N N -4.281 4.048 -0.926 . . . 1.0 . . . . . . . . . . . . A . 14 ASN N . . . . . . . . . c30226_5ug5 1 . 12 . 3332 . 1 1 14 ASN ND2 N -6.046 5.171 -4.572 . . . 1.0 . . . . . . . . . . . . A . 14 ASN ND2 . . . . . . . . . c30226_5ug5 1 . 12 . 3333 . 1 1 14 ASN O O -5.340 2.317 -3.877 . . . 1.0 . . . . . . . . . . . . A . 14 ASN O . . . . . . . . . c30226_5ug5 1 . 12 . 3334 . 1 1 14 ASN OD1 O -4.046 5.281 -5.576 . . . 1.0 . . . . . . . . . . . . A . 14 ASN OD1 . . . . . . . . . c30226_5ug5 1 . 12 . 3335 . 1 1 15 ASN C C -4.894 -0.636 -1.089 . . . 1.0 . . . . . . . . . . . . A . 15 ASN C . . . . . . . . . c30226_5ug5 1 . 12 . 3336 . 1 1 15 ASN CA C -4.411 0.298 -2.189 . . . 1.0 . . . . . . . . . . . . A . 15 ASN CA . . . . . . . . . c30226_5ug5 1 . 12 . 3337 . 1 1 15 ASN CB C -2.928 0.087 -2.394 . . . 1.0 . . . . . . . . . . . . A . 15 ASN CB . . . . . . . . . c30226_5ug5 1 . 12 . 3338 . 1 1 15 ASN CG C -2.422 0.563 -3.743 . . . 1.0 . . . . . . . . . . . . A . 15 ASN CG . . . . . . . . . c30226_5ug5 1 . 12 . 3339 . 1 1 15 ASN H H -4.531 1.968 -0.901 . . . 1.0 . . . . . . . . . . . . A . 15 ASN H . . . . . . . . . c30226_5ug5 1 . 12 . 3340 . 1 1 15 ASN HA H -4.940 0.089 -3.097 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HA . . . . . . . . . c30226_5ug5 1 . 12 . 3341 . 1 1 15 ASN HB2 H -2.425 0.658 -1.624 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HB2 . . . . . . . . . c30226_5ug5 1 . 12 . 3342 . 1 1 15 ASN HB3 H -2.693 -0.960 -2.280 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HB3 . . . . . . . . . c30226_5ug5 1 . 12 . 3343 . 1 1 15 ASN HD21 H -1.995 2.341 -2.975 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HD21 . . . . . . . . . c30226_5ug5 1 . 12 . 3344 . 1 1 15 ASN HD22 H -1.650 2.147 -4.660 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HD22 . . . . . . . . . c30226_5ug5 1 . 12 . 3345 . 1 1 15 ASN N N -4.632 1.692 -1.839 . . . 1.0 . . . . . . . . . . . . A . 15 ASN N . . . . . . . . . c30226_5ug5 1 . 12 . 3346 . 1 1 15 ASN ND2 N -1.976 1.806 -3.798 . . . 1.0 . . . . . . . . . . . . A . 15 ASN ND2 . . . . . . . . . c30226_5ug5 1 . 12 . 3347 . 1 1 15 ASN O O -4.101 -1.335 -0.458 . . . 1.0 . . . . . . . . . . . . A . 15 ASN O . . . . . . . . . c30226_5ug5 1 . 12 . 3348 . 1 1 15 ASN OD1 O -2.410 -0.187 -4.720 . . . 1.0 . . . . . . . . . . . . A . 15 ASN OD1 . . . . . . . . . c30226_5ug5 1 . 12 . 3349 . 1 1 16 HYP C C -7.144 -2.847 -0.184 . . . 1.0 . . . . . . . . . . . . A . 16 HYP C . . . . . . . . . c30226_5ug5 1 . 12 . 3350 . 1 1 16 HYP CA C -6.790 -1.441 0.248 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CA . . . . . . . . . c30226_5ug5 1 . 12 . 3351 . 1 1 16 HYP CB C -8.012 -0.592 0.530 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CB . . . . . . . . . c30226_5ug5 1 . 12 . 3352 . 1 1 16 HYP CD C -7.223 0.105 -1.574 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CD . . . . . . . . . c30226_5ug5 1 . 12 . 3353 . 1 1 16 HYP CG C -8.056 0.576 -0.438 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CG . . . . . . . . . c30226_5ug5 1 . 12 . 3354 . 1 1 16 HYP HA H -6.153 -1.476 1.100 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HA . . . . . . . . . c30226_5ug5 1 . 12 . 3355 . 1 1 16 HYP HB2 H -7.961 -0.209 1.537 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HB2 . . . . . . . . . c30226_5ug5 1 . 12 . 3356 . 1 1 16 HYP HB3 H -8.901 -1.195 0.415 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HB3 . . . . . . . . . c30226_5ug5 1 . 12 . 3357 . 1 1 16 HYP HD1 H -6.429 1.605 -0.095 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HD1 . . . . . . . . . c30226_5ug5 1 . 12 . 3358 . 1 1 16 HYP HD22 H -7.787 -0.522 -2.230 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HD22 . . . . . . . . . c30226_5ug5 1 . 12 . 3359 . 1 1 16 HYP HD23 H -6.785 0.936 -2.105 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HD23 . . . . . . . . . c30226_5ug5 1 . 12 . 3360 . 1 1 16 HYP HG H -9.066 0.814 -0.731 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HG . . . . . . . . . c30226_5ug5 1 . 12 . 3361 . 1 1 16 HYP N N -6.194 -0.660 -0.844 . . . 1.0 . . . . . . . . . . . . A . 16 HYP N . . . . . . . . . c30226_5ug5 1 . 12 . 3362 . 1 1 16 HYP O O -7.514 -3.698 0.621 . . . 1.0 . . . . . . . . . . . . A . 16 HYP O . . . . . . . . . c30226_5ug5 1 . 12 . 3363 . 1 1 16 HYP OD1 O -7.383 1.701 0.109 . . . 1.0 . . . . . . . . . . . . A . 16 HYP OD1 . . . . . . . . . c30226_5ug5 1 . 12 . 3364 . 1 1 17 HIS C C -5.784 -4.964 -2.399 . . . 1.0 . . . . . . . . . . . . A . 17 HIS C . . . . . . . . . c30226_5ug5 1 . 12 . 3365 . 1 1 17 HIS CA C -7.154 -4.400 -2.047 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CA . . . . . . . . . c30226_5ug5 1 . 12 . 3366 . 1 1 17 HIS CB C -8.050 -4.373 -3.292 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CB . . . . . . . . . c30226_5ug5 1 . 12 . 3367 . 1 1 17 HIS CD2 C -10.252 -4.403 -1.920 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CD2 . . . . . . . . . c30226_5ug5 1 . 12 . 3368 . 1 1 17 HIS CE1 C -11.548 -3.394 -3.368 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CE1 . . . . . . . . . c30226_5ug5 1 . 12 . 3369 . 1 1 17 HIS CG C -9.495 -4.103 -3.001 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CG . . . . . . . . . c30226_5ug5 1 . 12 . 3370 . 1 1 17 HIS H H -6.763 -2.313 -2.041 . . . 1.0 . . . . . . . . . . . . A . 17 HIS H . . . . . . . . . c30226_5ug5 1 . 12 . 3371 . 1 1 17 HIS HA H -7.607 -5.034 -1.300 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HA . . . . . . . . . c30226_5ug5 1 . 12 . 3372 . 1 1 17 HIS HB2 H -7.701 -3.602 -3.960 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HB2 . . . . . . . . . c30226_5ug5 1 . 12 . 3373 . 1 1 17 HIS HB3 H -7.985 -5.328 -3.792 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HB3 . . . . . . . . . c30226_5ug5 1 . 12 . 3374 . 1 1 17 HIS HD1 H -10.087 -3.132 -4.779 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HD1 . . . . . . . . . c30226_5ug5 1 . 12 . 3375 . 1 1 17 HIS HD2 H -9.918 -4.907 -1.025 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HD2 . . . . . . . . . c30226_5ug5 1 . 12 . 3376 . 1 1 17 HIS HE1 H -12.412 -2.953 -3.840 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HE1 . . . . . . . . . c30226_5ug5 1 . 12 . 3377 . 1 1 17 HIS HE2 H -12.242 -3.879 -1.506 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HE2 . . . . . . . . . c30226_5ug5 1 . 12 . 3378 . 1 1 17 HIS N N -6.998 -3.072 -1.467 . . . 1.0 . . . . . . . . . . . . A . 17 HIS N . . . . . . . . . c30226_5ug5 1 . 12 . 3379 . 1 1 17 HIS ND1 N -10.338 -3.471 -3.890 . . . 1.0 . . . . . . . . . . . . A . 17 HIS ND1 . . . . . . . . . c30226_5ug5 1 . 12 . 3380 . 1 1 17 HIS NE2 N -11.523 -3.951 -2.173 . . . 1.0 . . . . . . . . . . . . A . 17 HIS NE2 . . . . . . . . . c30226_5ug5 1 . 12 . 3381 . 1 1 17 HIS O O -5.661 -5.899 -3.187 . . . 1.0 . . . . . . . . . . . . A . 17 HIS O . . . . . . . . . c30226_5ug5 1 . 12 . 3382 . 1 1 18 VAL C C -3.088 -5.972 -1.052 . . . 1.0 . . . . . . . . . . . . A . 18 VAL C . . . . . . . . . c30226_5ug5 1 . 12 . 3383 . 1 1 18 VAL CA C -3.389 -4.818 -1.995 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CA . . . . . . . . . c30226_5ug5 1 . 12 . 3384 . 1 1 18 VAL CB C -2.402 -3.644 -1.779 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CB . . . . . . . . . c30226_5ug5 1 . 12 . 3385 . 1 1 18 VAL CG1 C -1.249 -4.006 -0.856 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CG1 . . . . . . . . . c30226_5ug5 1 . 12 . 3386 . 1 1 18 VAL CG2 C -1.875 -3.162 -3.113 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CG2 . . . . . . . . . c30226_5ug5 1 . 12 . 3387 . 1 1 18 VAL H H -4.924 -3.598 -1.228 . . . 1.0 . . . . . . . . . . . . A . 18 VAL H . . . . . . . . . c30226_5ug5 1 . 12 . 3388 . 1 1 18 VAL HA H -3.292 -5.165 -3.007 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HA . . . . . . . . . c30226_5ug5 1 . 12 . 3389 . 1 1 18 VAL HB H -2.947 -2.829 -1.326 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HB . . . . . . . . . c30226_5ug5 1 . 12 . 3390 . 1 1 18 VAL HG11 H -0.621 -3.141 -0.711 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG11 . . . . . . . . . c30226_5ug5 1 . 12 . 3391 . 1 1 18 VAL HG12 H -0.672 -4.803 -1.296 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG12 . . . . . . . . . c30226_5ug5 1 . 12 . 3392 . 1 1 18 VAL HG13 H -1.642 -4.329 0.095 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG13 . . . . . . . . . c30226_5ug5 1 . 12 . 3393 . 1 1 18 VAL HG21 H -1.208 -2.327 -2.956 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG21 . . . . . . . . . c30226_5ug5 1 . 12 . 3394 . 1 1 18 VAL HG22 H -2.703 -2.851 -3.731 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG22 . . . . . . . . . c30226_5ug5 1 . 12 . 3395 . 1 1 18 VAL HG23 H -1.343 -3.965 -3.599 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG23 . . . . . . . . . c30226_5ug5 1 . 12 . 3396 . 1 1 18 VAL N N -4.757 -4.369 -1.807 . . . 1.0 . . . . . . . . . . . . A . 18 VAL N . . . . . . . . . c30226_5ug5 1 . 12 . 3397 . 1 1 18 VAL O O -2.271 -6.849 -1.341 . . . 1.0 . . . . . . . . . . . . A . 18 VAL O . . . . . . . . . c30226_5ug5 1 . 12 . 3398 . 1 1 19 CYS C C -4.864 -7.913 1.044 . . . 1.0 . . . . . . . . . . . . A . 19 CYS C . . . . . . . . . c30226_5ug5 1 . 12 . 3399 . 1 1 19 CYS CA C -3.641 -7.007 1.062 . . . 1.0 . . . . . . . . . . . . A . 19 CYS CA . . . . . . . . . c30226_5ug5 1 . 12 . 3400 . 1 1 19 CYS CB C -3.449 -6.394 2.450 . . . 1.0 . . . . . . . . . . . . A . 19 CYS CB . . . . . . . . . c30226_5ug5 1 . 12 . 3401 . 1 1 19 CYS H H -4.409 -5.236 0.211 . . . 1.0 . . . . . . . . . . . . A . 19 CYS H . . . . . . . . . c30226_5ug5 1 . 12 . 3402 . 1 1 19 CYS HA H -2.769 -7.592 0.812 . . . 1.0 . . . . . . . . . . . . A . 19 CYS HA . . . . . . . . . c30226_5ug5 1 . 12 . 3403 . 1 1 19 CYS HB2 H -4.307 -5.784 2.689 . . . 1.0 . . . . . . . . . . . . A . 19 CYS HB2 . . . . . . . . . c30226_5ug5 1 . 12 . 3404 . 1 1 19 CYS HB3 H -3.365 -7.188 3.176 . . . 1.0 . . . . . . . . . . . . A . 19 CYS HB3 . . . . . . . . . c30226_5ug5 1 . 12 . 3405 . 1 1 19 CYS N N -3.778 -5.963 0.062 . . . 1.0 . . . . . . . . . . . . A . 19 CYS N . . . . . . . . . c30226_5ug5 1 . 12 . 3406 . 1 1 19 CYS O O -4.864 -8.897 0.276 . . . 1.0 . . . . . . . . . . . . A . 19 CYS O . . . . . . . . . c30226_5ug5 1 . 12 . 3407 . 1 1 19 CYS OXT O -5.832 -7.629 1.779 . . . 1.0 . . . . . . . . . . . . A . 19 CYS OXT . . . . . . . . . c30226_5ug5 1 . 12 . 3408 . 1 1 19 CYS SG S -1.966 -5.346 2.599 . . . 1.0 . . . . . . . . . . . . A . 19 CYS SG . . . . . . . . . c30226_5ug5 1 . 13 . 3409 . 1 1 1 ILE C C 6.526 1.862 -4.086 . . . 1.0 . . . . . . . . . . . . A . 1 ILE C . . . . . . . . . c30226_5ug5 1 . 13 . 3410 . 1 1 1 ILE CA C 5.670 2.094 -5.323 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CA . . . . . . . . . c30226_5ug5 1 . 13 . 3411 . 1 1 1 ILE CB C 5.871 0.927 -6.320 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CB . . . . . . . . . c30226_5ug5 1 . 13 . 3412 . 1 1 1 ILE CD1 C 3.895 -0.456 -5.496 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CD1 . . . . . . . . . c30226_5ug5 1 . 13 . 3413 . 1 1 1 ILE CG1 C 5.389 -0.401 -5.726 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CG1 . . . . . . . . . c30226_5ug5 1 . 13 . 3414 . 1 1 1 ILE CG2 C 7.328 0.818 -6.745 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CG2 . . . . . . . . . c30226_5ug5 1 . 13 . 3415 . 1 1 1 ILE H1 H 5.800 4.172 -5.286 . . . 1.0 . . . . . . . . . . . . A . 1 ILE H1 . . . . . . . . . c30226_5ug5 1 . 13 . 3416 . 1 1 1 ILE H2 H 5.433 3.534 -6.806 . . . 1.0 . . . . . . . . . . . . A . 1 ILE H2 . . . . . . . . . c30226_5ug5 1 . 13 . 3417 . 1 1 1 ILE H3 H 7.007 3.424 -6.199 . . . 1.0 . . . . . . . . . . . . A . 1 ILE H3 . . . . . . . . . c30226_5ug5 1 . 13 . 3418 . 1 1 1 ILE HA H 4.632 2.115 -5.028 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HA . . . . . . . . . c30226_5ug5 1 . 13 . 3419 . 1 1 1 ILE HB H 5.286 1.144 -7.194 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HB . . . . . . . . . c30226_5ug5 1 . 13 . 3420 . 1 1 1 ILE HD11 H 3.628 -1.423 -5.094 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HD11 . . . . . . . . . c30226_5ug5 1 . 13 . 3421 . 1 1 1 ILE HD12 H 3.380 -0.302 -6.433 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HD12 . . . . . . . . . c30226_5ug5 1 . 13 . 3422 . 1 1 1 ILE HD13 H 3.609 0.316 -4.798 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HD13 . . . . . . . . . c30226_5ug5 1 . 13 . 3423 . 1 1 1 ILE HG12 H 5.650 -1.203 -6.400 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG12 . . . . . . . . . c30226_5ug5 1 . 13 . 3424 . 1 1 1 ILE HG13 H 5.879 -0.561 -4.777 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG13 . . . . . . . . . c30226_5ug5 1 . 13 . 3425 . 1 1 1 ILE HG21 H 7.943 0.623 -5.880 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG21 . . . . . . . . . c30226_5ug5 1 . 13 . 3426 . 1 1 1 ILE HG22 H 7.639 1.744 -7.205 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG22 . . . . . . . . . c30226_5ug5 1 . 13 . 3427 . 1 1 1 ILE HG23 H 7.437 0.010 -7.454 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG23 . . . . . . . . . c30226_5ug5 1 . 13 . 3428 . 1 1 1 ILE N N 6.000 3.394 -5.945 . . . 1.0 . . . . . . . . . . . . A . 1 ILE N . . . . . . . . . c30226_5ug5 1 . 13 . 3429 . 1 1 1 ILE O O 7.670 2.310 -4.014 . . . 1.0 . . . . . . . . . . . . A . 1 ILE O . . . . . . . . . c30226_5ug5 1 . 13 . 3430 . 1 1 2 ARG C C 7.069 -0.635 -1.926 . . . 1.0 . . . . . . . . . . . . A . 2 ARG C . . . . . . . . . c30226_5ug5 1 . 13 . 3431 . 1 1 2 ARG CA C 6.673 0.835 -1.893 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CA . . . . . . . . . c30226_5ug5 1 . 13 . 3432 . 1 1 2 ARG CB C 5.819 1.098 -0.649 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CB . . . . . . . . . c30226_5ug5 1 . 13 . 3433 . 1 1 2 ARG CD C 4.985 3.430 -1.201 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CD . . . . . . . . . c30226_5ug5 1 . 13 . 3434 . 1 1 2 ARG CG C 5.735 2.558 -0.206 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CG . . . . . . . . . c30226_5ug5 1 . 13 . 3435 . 1 1 2 ARG CZ C 5.491 5.309 -2.718 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CZ . . . . . . . . . c30226_5ug5 1 . 13 . 3436 . 1 1 2 ARG H H 5.033 0.881 -3.221 . . . 1.0 . . . . . . . . . . . . A . 2 ARG H . . . . . . . . . c30226_5ug5 1 . 13 . 3437 . 1 1 2 ARG HA H 7.561 1.439 -1.852 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HA . . . . . . . . . c30226_5ug5 1 . 13 . 3438 . 1 1 2 ARG HB2 H 4.820 0.752 -0.844 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB2 . . . . . . . . . c30226_5ug5 1 . 13 . 3439 . 1 1 2 ARG HB3 H 6.226 0.524 0.170 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB3 . . . . . . . . . c30226_5ug5 1 . 13 . 3440 . 1 1 2 ARG HD2 H 4.439 2.789 -1.875 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD2 . . . . . . . . . c30226_5ug5 1 . 13 . 3441 . 1 1 2 ARG HD3 H 4.292 4.059 -0.662 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD3 . . . . . . . . . c30226_5ug5 1 . 13 . 3442 . 1 1 2 ARG HE H 6.852 4.070 -1.935 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HE . . . . . . . . . c30226_5ug5 1 . 13 . 3443 . 1 1 2 ARG HG2 H 5.225 2.602 0.745 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG2 . . . . . . . . . c30226_5ug5 1 . 13 . 3444 . 1 1 2 ARG HG3 H 6.739 2.943 -0.092 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG3 . . . . . . . . . c30226_5ug5 1 . 13 . 3445 . 1 1 2 ARG HH11 H 3.513 5.025 -2.376 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH11 . . . . . . . . . c30226_5ug5 1 . 13 . 3446 . 1 1 2 ARG HH12 H 3.905 6.380 -3.389 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH12 . . . . . . . . . c30226_5ug5 1 . 13 . 3447 . 1 1 2 ARG HH21 H 7.367 5.828 -3.281 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH21 . . . . . . . . . c30226_5ug5 1 . 13 . 3448 . 1 1 2 ARG HH22 H 6.094 6.833 -3.906 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH22 . . . . . . . . . c30226_5ug5 1 . 13 . 3449 . 1 1 2 ARG N N 5.957 1.179 -3.110 . . . 1.0 . . . . . . . . . . . . A . 2 ARG N . . . . . . . . . c30226_5ug5 1 . 13 . 3450 . 1 1 2 ARG NE N 5.888 4.274 -1.981 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NE . . . . . . . . . c30226_5ug5 1 . 13 . 3451 . 1 1 2 ARG NH1 N 4.199 5.591 -2.838 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH1 . . . . . . . . . c30226_5ug5 1 . 13 . 3452 . 1 1 2 ARG NH2 N 6.388 6.048 -3.354 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH2 . . . . . . . . . c30226_5ug5 1 . 13 . 3453 . 1 1 2 ARG O O 6.429 -1.442 -2.598 . . . 1.0 . . . . . . . . . . . . A . 2 ARG O . . . . . . . . . c30226_5ug5 1 . 13 . 3454 . 1 1 3 ASP C C 7.945 -3.128 -0.063 . . . 1.0 . . . . . . . . . . . . A . 3 ASP C . . . . . . . . . c30226_5ug5 1 . 13 . 3455 . 1 1 3 ASP CA C 8.634 -2.342 -1.154 . . . 1.0 . . . . . . . . . . . . A . 3 ASP CA . . . . . . . . . c30226_5ug5 1 . 13 . 3456 . 1 1 3 ASP CB C 10.149 -2.335 -0.927 . . . 1.0 . . . . . . . . . . . . A . 3 ASP CB . . . . . . . . . c30226_5ug5 1 . 13 . 3457 . 1 1 3 ASP CG C 10.789 -3.685 -1.183 . . . 1.0 . . . . . . . . . . . . A . 3 ASP CG . . . . . . . . . c30226_5ug5 1 . 13 . 3458 . 1 1 3 ASP H H 8.543 -0.284 -0.634 . . . 1.0 . . . . . . . . . . . . A . 3 ASP H . . . . . . . . . c30226_5ug5 1 . 13 . 3459 . 1 1 3 ASP HA H 8.410 -2.794 -2.090 . . . 1.0 . . . . . . . . . . . . A . 3 ASP HA . . . . . . . . . c30226_5ug5 1 . 13 . 3460 . 1 1 3 ASP HB2 H 10.602 -1.615 -1.588 . . . 1.0 . . . . . . . . . . . . A . 3 ASP HB2 . . . . . . . . . c30226_5ug5 1 . 13 . 3461 . 1 1 3 ASP HB3 H 10.350 -2.053 0.095 . . . 1.0 . . . . . . . . . . . . A . 3 ASP HB3 . . . . . . . . . c30226_5ug5 1 . 13 . 3462 . 1 1 3 ASP N N 8.114 -0.973 -1.185 . . . 1.0 . . . . . . . . . . . . A . 3 ASP N . . . . . . . . . c30226_5ug5 1 . 13 . 3463 . 1 1 3 ASP O O 7.934 -4.355 -0.045 . . . 1.0 . . . . . . . . . . . . A . 3 ASP O . . . . . . . . . c30226_5ug5 1 . 13 . 3464 . 1 1 3 ASP OD1 O 11.013 -4.023 -2.366 . . . 1.0 . . . . . . . . . . . . A . 3 ASP OD1 . . . . . . . . . c30226_5ug5 1 . 13 . 3465 . 1 1 3 ASP OD2 O 11.100 -4.402 -0.208 . . . 1.0 . . . . . . . . . . . . A . 3 ASP OD2 . . . . . . . . . c30226_5ug5 1 . 13 . 3466 . 1 1 4 GLU C C 5.135 -2.472 1.768 . . . 1.0 . . . . . . . . . . . . A . 4 GLU C . . . . . . . . . c30226_5ug5 1 . 13 . 3467 . 1 1 4 GLU CA C 6.582 -2.894 1.935 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CA . . . . . . . . . c30226_5ug5 1 . 13 . 3468 . 1 1 4 GLU CB C 7.110 -2.378 3.258 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CB . . . . . . . . . c30226_5ug5 1 . 13 . 3469 . 1 1 4 GLU CD C 8.222 -4.554 3.865 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CD . . . . . . . . . c30226_5ug5 1 . 13 . 3470 . 1 1 4 GLU CG C 8.385 -3.056 3.722 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CG . . . . . . . . . c30226_5ug5 1 . 13 . 3471 . 1 1 4 GLU H H 7.472 -1.411 0.743 . . . 1.0 . . . . . . . . . . . . A . 4 GLU H . . . . . . . . . c30226_5ug5 1 . 13 . 3472 . 1 1 4 GLU HA H 6.644 -3.972 1.917 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HA . . . . . . . . . c30226_5ug5 1 . 13 . 3473 . 1 1 4 GLU HB2 H 7.303 -1.319 3.167 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HB2 . . . . . . . . . c30226_5ug5 1 . 13 . 3474 . 1 1 4 GLU HB3 H 6.350 -2.531 3.996 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HB3 . . . . . . . . . c30226_5ug5 1 . 13 . 3475 . 1 1 4 GLU HG2 H 9.164 -2.861 3.001 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HG2 . . . . . . . . . c30226_5ug5 1 . 13 . 3476 . 1 1 4 GLU HG3 H 8.669 -2.646 4.680 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HG3 . . . . . . . . . c30226_5ug5 1 . 13 . 3477 . 1 1 4 GLU N N 7.368 -2.375 0.833 . . . 1.0 . . . . . . . . . . . . A . 4 GLU N . . . . . . . . . c30226_5ug5 1 . 13 . 3478 . 1 1 4 GLU O O 4.398 -2.320 2.737 . . . 1.0 . . . . . . . . . . . . A . 4 GLU O . . . . . . . . . c30226_5ug5 1 . 13 . 3479 . 1 1 4 GLU OE1 O 9.062 -5.304 3.325 . . . 1.0 . . . . . . . . . . . . A . 4 GLU OE1 . . . . . . . . . c30226_5ug5 1 . 13 . 3480 . 1 1 4 GLU OE2 O 7.241 -4.988 4.505 . . . 1.0 . . . . . . . . . . . . A . 4 GLU OE2 . . . . . . . . . c30226_5ug5 1 . 13 . 3481 . 1 1 5 CYS C C 2.295 -2.376 0.805 . . . 1.0 . . . . . . . . . . . . A . 5 CYS C . . . . . . . . . c30226_5ug5 1 . 13 . 3482 . 1 1 5 CYS CA C 3.487 -1.681 0.139 . . . 1.0 . . . . . . . . . . . . A . 5 CYS CA . . . . . . . . . c30226_5ug5 1 . 13 . 3483 . 1 1 5 CYS CB C 3.358 -1.751 -1.380 . . . 1.0 . . . . . . . . . . . . A . 5 CYS CB . . . . . . . . . c30226_5ug5 1 . 13 . 3484 . 1 1 5 CYS H H 5.367 -2.557 -0.186 . . . 1.0 . . . . . . . . . . . . A . 5 CYS H . . . . . . . . . c30226_5ug5 1 . 13 . 3485 . 1 1 5 CYS HA H 3.498 -0.645 0.438 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HA . . . . . . . . . c30226_5ug5 1 . 13 . 3486 . 1 1 5 CYS HB2 H 4.284 -2.124 -1.791 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HB2 . . . . . . . . . c30226_5ug5 1 . 13 . 3487 . 1 1 5 CYS HB3 H 2.566 -2.431 -1.631 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HB3 . . . . . . . . . c30226_5ug5 1 . 13 . 3488 . 1 1 5 CYS N N 4.762 -2.271 0.520 . . . 1.0 . . . . . . . . . . . . A . 5 CYS N . . . . . . . . . c30226_5ug5 1 . 13 . 3489 . 1 1 5 CYS O O 1.276 -1.745 1.081 . . . 1.0 . . . . . . . . . . . . A . 5 CYS O . . . . . . . . . c30226_5ug5 1 . 13 . 3490 . 1 1 5 CYS SG S 3.012 -0.153 -2.182 . . . 1.0 . . . . . . . . . . . . A . 5 CYS SG . . . . . . . . . c30226_5ug5 1 . 13 . 3491 . 1 1 6 CYS C C 1.166 -4.072 3.152 . . . 1.0 . . . . . . . . . . . . A . 6 CYS C . . . . . . . . . c30226_5ug5 1 . 13 . 3492 . 1 1 6 CYS CA C 1.366 -4.440 1.684 . . . 1.0 . . . . . . . . . . . . A . 6 CYS CA . . . . . . . . . c30226_5ug5 1 . 13 . 3493 . 1 1 6 CYS CB C 1.662 -5.935 1.544 . . . 1.0 . . . . . . . . . . . . A . 6 CYS CB . . . . . . . . . c30226_5ug5 1 . 13 . 3494 . 1 1 6 CYS H H 3.306 -4.090 0.913 . . . 1.0 . . . . . . . . . . . . A . 6 CYS H . . . . . . . . . c30226_5ug5 1 . 13 . 3495 . 1 1 6 CYS HA H 0.460 -4.210 1.144 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HA . . . . . . . . . c30226_5ug5 1 . 13 . 3496 . 1 1 6 CYS HB2 H 1.793 -6.172 0.498 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HB2 . . . . . . . . . c30226_5ug5 1 . 13 . 3497 . 1 1 6 CYS HB3 H 2.574 -6.164 2.075 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HB3 . . . . . . . . . c30226_5ug5 1 . 13 . 3498 . 1 1 6 CYS N N 2.444 -3.658 1.093 . . . 1.0 . . . . . . . . . . . . A . 6 CYS N . . . . . . . . . c30226_5ug5 1 . 13 . 3499 . 1 1 6 CYS O O 0.089 -4.274 3.712 . . . 1.0 . . . . . . . . . . . . A . 6 CYS O . . . . . . . . . c30226_5ug5 1 . 13 . 3500 . 1 1 6 CYS SG S 0.351 -7.018 2.196 . . . 1.0 . . . . . . . . . . . . A . 6 CYS SG . . . . . . . . . c30226_5ug5 1 . 13 . 3501 . 1 1 7 SER C C 2.006 -1.584 5.225 . . . 1.0 . . . . . . . . . . . . A . 7 SER C . . . . . . . . . c30226_5ug5 1 . 13 . 3502 . 1 1 7 SER CA C 2.126 -3.093 5.157 . . . 1.0 . . . . . . . . . . . . A . 7 SER CA . . . . . . . . . c30226_5ug5 1 . 13 . 3503 . 1 1 7 SER CB C 3.386 -3.493 5.911 . . . 1.0 . . . . . . . . . . . . A . 7 SER CB . . . . . . . . . c30226_5ug5 1 . 13 . 3504 . 1 1 7 SER H H 3.047 -3.411 3.282 . . . 1.0 . . . . . . . . . . . . A . 7 SER H . . . . . . . . . c30226_5ug5 1 . 13 . 3505 . 1 1 7 SER HA H 1.268 -3.550 5.619 . . . 1.0 . . . . . . . . . . . . A . 7 SER HA . . . . . . . . . c30226_5ug5 1 . 13 . 3506 . 1 1 7 SER HB2 H 3.754 -4.435 5.534 . . . 1.0 . . . . . . . . . . . . A . 7 SER HB2 . . . . . . . . . c30226_5ug5 1 . 13 . 3507 . 1 1 7 SER HB3 H 4.129 -2.719 5.755 . . . 1.0 . . . . . . . . . . . . A . 7 SER HB3 . . . . . . . . . c30226_5ug5 1 . 13 . 3508 . 1 1 7 SER HG H 3.956 -3.885 7.747 . . . 1.0 . . . . . . . . . . . . A . 7 SER HG . . . . . . . . . c30226_5ug5 1 . 13 . 3509 . 1 1 7 SER N N 2.202 -3.525 3.771 . . . 1.0 . . . . . . . . . . . . A . 7 SER N . . . . . . . . . c30226_5ug5 1 . 13 . 3510 . 1 1 7 SER O O 1.459 -1.035 6.181 . . . 1.0 . . . . . . . . . . . . A . 7 SER O . . . . . . . . . c30226_5ug5 1 . 13 . 3511 . 1 1 7 SER OG O 3.143 -3.612 7.304 . . . 1.0 . . . . . . . . . . . . A . 7 SER OG . . . . . . . . . c30226_5ug5 1 . 13 . 3512 . 1 1 8 ASN C C 1.381 1.242 4.175 . . . 1.0 . . . . . . . . . . . . A . 8 ASN C . . . . . . . . . c30226_5ug5 1 . 13 . 3513 . 1 1 8 ASN CA C 2.708 0.499 4.239 . . . 1.0 . . . . . . . . . . . . A . 8 ASN CA . . . . . . . . . c30226_5ug5 1 . 13 . 3514 . 1 1 8 ASN CB C 3.587 0.911 3.071 . . . 1.0 . . . . . . . . . . . . A . 8 ASN CB . . . . . . . . . c30226_5ug5 1 . 13 . 3515 . 1 1 8 ASN CG C 5.077 0.782 3.353 . . . 1.0 . . . . . . . . . . . . A . 8 ASN CG . . . . . . . . . c30226_5ug5 1 . 13 . 3516 . 1 1 8 ASN H H 2.740 -1.393 3.374 . . . 1.0 . . . . . . . . . . . . A . 8 ASN H . . . . . . . . . c30226_5ug5 1 . 13 . 3517 . 1 1 8 ASN HA H 3.213 0.724 5.163 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HA . . . . . . . . . c30226_5ug5 1 . 13 . 3518 . 1 1 8 ASN HB2 H 3.350 0.283 2.227 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HB2 . . . . . . . . . c30226_5ug5 1 . 13 . 3519 . 1 1 8 ASN HB3 H 3.370 1.921 2.818 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HB3 . . . . . . . . . c30226_5ug5 1 . 13 . 3520 . 1 1 8 ASN HD21 H 4.806 1.143 5.290 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HD21 . . . . . . . . . c30226_5ug5 1 . 13 . 3521 . 1 1 8 ASN HD22 H 6.437 0.865 4.796 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HD22 . . . . . . . . . c30226_5ug5 1 . 13 . 3522 . 1 1 8 ASN N N 2.511 -0.920 4.199 . . . 1.0 . . . . . . . . . . . . A . 8 ASN N . . . . . . . . . c30226_5ug5 1 . 13 . 3523 . 1 1 8 ASN ND2 N 5.478 0.946 4.604 . . . 1.0 . . . . . . . . . . . . A . 8 ASN ND2 . . . . . . . . . c30226_5ug5 1 . 13 . 3524 . 1 1 8 ASN O O 0.668 1.168 3.174 . . . 1.0 . . . . . . . . . . . . A . 8 ASN O . . . . . . . . . c30226_5ug5 1 . 13 . 3525 . 1 1 8 ASN OD1 O 5.866 0.540 2.442 . . . 1.0 . . . . . . . . . . . . A . 8 ASN OD1 . . . . . . . . . c30226_5ug5 1 . 13 . 3526 . 1 1 9 PRO C C -0.441 3.678 4.205 . . . 1.0 . . . . . . . . . . . . A . 9 PRO C . . . . . . . . . c30226_5ug5 1 . 13 . 3527 . 1 1 9 PRO CA C -0.215 2.716 5.365 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CA . . . . . . . . . c30226_5ug5 1 . 13 . 3528 . 1 1 9 PRO CB C -0.026 3.487 6.671 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CB . . . . . . . . . c30226_5ug5 1 . 13 . 3529 . 1 1 9 PRO CD C 1.878 2.161 6.454 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CD . . . . . . . . . c30226_5ug5 1 . 13 . 3530 . 1 1 9 PRO CG C 0.895 2.658 7.458 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CG . . . . . . . . . c30226_5ug5 1 . 13 . 3531 . 1 1 9 PRO HA H -1.060 2.051 5.453 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HA . . . . . . . . . c30226_5ug5 1 . 13 . 3532 . 1 1 9 PRO HB2 H 0.429 4.430 6.462 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HB2 . . . . . . . . . c30226_5ug5 1 . 13 . 3533 . 1 1 9 PRO HB3 H -0.971 3.623 7.171 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HB3 . . . . . . . . . c30226_5ug5 1 . 13 . 3534 . 1 1 9 PRO HD2 H 2.653 2.893 6.287 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HD2 . . . . . . . . . c30226_5ug5 1 . 13 . 3535 . 1 1 9 PRO HD3 H 2.292 1.239 6.778 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HD3 . . . . . . . . . c30226_5ug5 1 . 13 . 3536 . 1 1 9 PRO HG2 H 1.384 3.265 8.201 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HG2 . . . . . . . . . c30226_5ug5 1 . 13 . 3537 . 1 1 9 PRO HG3 H 0.366 1.836 7.915 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HG3 . . . . . . . . . c30226_5ug5 1 . 13 . 3538 . 1 1 9 PRO N N 1.047 1.978 5.249 . . . 1.0 . . . . . . . . . . . . A . 9 PRO N . . . . . . . . . c30226_5ug5 1 . 13 . 3539 . 1 1 9 PRO O O -1.565 3.855 3.741 . . . 1.0 . . . . . . . . . . . . A . 9 PRO O . . . . . . . . . c30226_5ug5 1 . 13 . 3540 . 1 1 10 ALA C C 0.383 4.565 1.290 . . . 1.0 . . . . . . . . . . . . A . 10 ALA C . . . . . . . . . c30226_5ug5 1 . 13 . 3541 . 1 1 10 ALA CA C 0.551 5.249 2.642 . . . 1.0 . . . . . . . . . . . . A . 10 ALA CA . . . . . . . . . c30226_5ug5 1 . 13 . 3542 . 1 1 10 ALA CB C 1.777 6.146 2.636 . . . 1.0 . . . . . . . . . . . . A . 10 ALA CB . . . . . . . . . c30226_5ug5 1 . 13 . 3543 . 1 1 10 ALA H H 1.518 4.069 4.112 . . . 1.0 . . . . . . . . . . . . A . 10 ALA H . . . . . . . . . c30226_5ug5 1 . 13 . 3544 . 1 1 10 ALA HA H -0.316 5.868 2.825 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HA . . . . . . . . . c30226_5ug5 1 . 13 . 3545 . 1 1 10 ALA HB1 H 1.878 6.625 3.599 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HB1 . . . . . . . . . c30226_5ug5 1 . 13 . 3546 . 1 1 10 ALA HB2 H 1.669 6.897 1.869 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HB2 . . . . . . . . . c30226_5ug5 1 . 13 . 3547 . 1 1 10 ALA HB3 H 2.655 5.550 2.437 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HB3 . . . . . . . . . c30226_5ug5 1 . 13 . 3548 . 1 1 10 ALA N N 0.639 4.278 3.723 . . . 1.0 . . . . . . . . . . . . A . 10 ALA N . . . . . . . . . c30226_5ug5 1 . 13 . 3549 . 1 1 10 ALA O O 0.036 5.208 0.301 . . . 1.0 . . . . . . . . . . . . A . 10 ALA O . . . . . . . . . c30226_5ug5 1 . 13 . 3550 . 1 1 11 CYS C C -0.936 2.082 -0.015 . . . 1.0 . . . . . . . . . . . . A . 11 CYS C . . . . . . . . . c30226_5ug5 1 . 13 . 3551 . 1 1 11 CYS CA C 0.473 2.542 -0.006 . . . 1.0 . . . . . . . . . . . . A . 11 CYS CA . . . . . . . . . c30226_5ug5 1 . 13 . 3552 . 1 1 11 CYS CB C 1.413 1.342 -0.082 . . . 1.0 . . . . . . . . . . . . A . 11 CYS CB . . . . . . . . . c30226_5ug5 1 . 13 . 3553 . 1 1 11 CYS H H 0.693 2.738 2.075 . . . 1.0 . . . . . . . . . . . . A . 11 CYS H . . . . . . . . . c30226_5ug5 1 . 13 . 3554 . 1 1 11 CYS HA H 0.650 3.219 -0.829 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HA . . . . . . . . . c30226_5ug5 1 . 13 . 3555 . 1 1 11 CYS HB2 H 2.436 1.691 -0.102 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HB2 . . . . . . . . . c30226_5ug5 1 . 13 . 3556 . 1 1 11 CYS HB3 H 1.262 0.719 0.795 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HB3 . . . . . . . . . c30226_5ug5 1 . 13 . 3557 . 1 1 11 CYS N N 0.614 3.258 1.240 . . . 1.0 . . . . . . . . . . . . A . 11 CYS N . . . . . . . . . c30226_5ug5 1 . 13 . 3558 . 1 1 11 CYS O O -1.699 2.247 -0.964 . . . 1.0 . . . . . . . . . . . . A . 11 CYS O . . . . . . . . . c30226_5ug5 1 . 13 . 3559 . 1 1 11 CYS SG S 1.143 0.306 -1.557 . . . 1.0 . . . . . . . . . . . . A . 11 CYS SG . . . . . . . . . c30226_5ug5 1 . 13 . 3560 . 1 1 12 ARG C C -3.622 2.146 1.259 . . . 1.0 . . . . . . . . . . . . A . 12 ARG C . . . . . . . . . c30226_5ug5 1 . 13 . 3561 . 1 1 12 ARG CA C -2.547 1.086 1.484 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CA . . . . . . . . . c30226_5ug5 1 . 13 . 3562 . 1 1 12 ARG CB C -2.496 0.683 2.933 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CB . . . . . . . . . c30226_5ug5 1 . 13 . 3563 . 1 1 12 ARG CD C -1.486 -0.906 4.512 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CD . . . . . . . . . c30226_5ug5 1 . 13 . 3564 . 1 1 12 ARG CG C -2.098 -0.748 3.149 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CG . . . . . . . . . c30226_5ug5 1 . 13 . 3565 . 1 1 12 ARG CZ C -1.426 -2.726 6.169 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CZ . . . . . . . . . c30226_5ug5 1 . 13 . 3566 . 1 1 12 ARG H H -0.533 1.421 1.804 . . . 1.0 . . . . . . . . . . . . A . 12 ARG H . . . . . . . . . c30226_5ug5 1 . 13 . 3567 . 1 1 12 ARG HA H -2.747 0.228 0.896 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HA . . . . . . . . . c30226_5ug5 1 . 13 . 3568 . 1 1 12 ARG HB2 H -1.779 1.309 3.440 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HB2 . . . . . . . . . c30226_5ug5 1 . 13 . 3569 . 1 1 12 ARG HB3 H -3.445 0.836 3.367 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HB3 . . . . . . . . . c30226_5ug5 1 . 13 . 3570 . 1 1 12 ARG HD2 H -0.483 -0.499 4.471 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HD2 . . . . . . . . . c30226_5ug5 1 . 13 . 3571 . 1 1 12 ARG HD3 H -2.073 -0.357 5.230 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HD3 . . . . . . . . . c30226_5ug5 1 . 13 . 3572 . 1 1 12 ARG HE H -1.353 -2.953 4.181 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HE . . . . . . . . . c30226_5ug5 1 . 13 . 3573 . 1 1 12 ARG HG2 H -2.973 -1.375 3.077 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HG2 . . . . . . . . . c30226_5ug5 1 . 13 . 3574 . 1 1 12 ARG HG3 H -1.375 -1.038 2.400 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HG3 . . . . . . . . . c30226_5ug5 1 . 13 . 3575 . 1 1 12 ARG HH11 H -1.733 -0.892 6.975 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH11 . . . . . . . . . c30226_5ug5 1 . 13 . 3576 . 1 1 12 ARG HH12 H -1.606 -2.191 8.120 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH12 . . . . . . . . . c30226_5ug5 1 . 13 . 3577 . 1 1 12 ARG HH21 H -1.168 -4.675 5.675 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH21 . . . . . . . . . c30226_5ug5 1 . 13 . 3578 . 1 1 12 ARG HH22 H -1.289 -4.349 7.375 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH22 . . . . . . . . . c30226_5ug5 1 . 13 . 3579 . 1 1 12 ARG N N -1.250 1.540 1.137 . . . 1.0 . . . . . . . . . . . . A . 12 ARG N . . . . . . . . . c30226_5ug5 1 . 13 . 3580 . 1 1 12 ARG NE N -1.421 -2.297 4.907 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NE . . . . . . . . . c30226_5ug5 1 . 13 . 3581 . 1 1 12 ARG NH1 N -1.602 -1.868 7.168 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NH1 . . . . . . . . . c30226_5ug5 1 . 13 . 3582 . 1 1 12 ARG NH2 N -1.282 -4.019 6.427 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NH2 . . . . . . . . . c30226_5ug5 1 . 13 . 3583 . 1 1 12 ARG O O -4.778 1.815 1.005 . . . 1.0 . . . . . . . . . . . . A . 12 ARG O . . . . . . . . . c30226_5ug5 1 . 13 . 3584 . 1 1 13 TYR C C -5.012 4.421 -0.037 . . . 1.0 . . . . . . . . . . . . A . 13 TYR C . . . . . . . . . c30226_5ug5 1 . 13 . 3585 . 1 1 13 TYR CA C -4.137 4.535 1.210 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CA . . . . . . . . . c30226_5ug5 1 . 13 . 3586 . 1 1 13 TYR CB C -3.344 5.833 1.179 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CB . . . . . . . . . c30226_5ug5 1 . 13 . 3587 . 1 1 13 TYR CD1 C -4.884 7.400 2.348 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CD1 . . . . . . . . . c30226_5ug5 1 . 13 . 3588 . 1 1 13 TYR CD2 C -4.323 7.860 0.094 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CD2 . . . . . . . . . c30226_5ug5 1 . 13 . 3589 . 1 1 13 TYR CE1 C -5.672 8.522 2.393 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CE1 . . . . . . . . . c30226_5ug5 1 . 13 . 3590 . 1 1 13 TYR CE2 C -5.111 8.993 0.121 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CE2 . . . . . . . . . c30226_5ug5 1 . 13 . 3591 . 1 1 13 TYR CG C -4.202 7.056 1.205 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CG . . . . . . . . . c30226_5ug5 1 . 13 . 3592 . 1 1 13 TYR CZ C -5.793 9.316 1.227 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CZ . . . . . . . . . c30226_5ug5 1 . 13 . 3593 . 1 1 13 TYR H H -2.289 3.604 1.543 . . . 1.0 . . . . . . . . . . . . A . 13 TYR H . . . . . . . . . c30226_5ug5 1 . 13 . 3594 . 1 1 13 TYR HA H -4.774 4.547 2.071 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HA . . . . . . . . . c30226_5ug5 1 . 13 . 3595 . 1 1 13 TYR HB2 H -2.683 5.870 2.031 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HB2 . . . . . . . . . c30226_5ug5 1 . 13 . 3596 . 1 1 13 TYR HB3 H -2.764 5.870 0.277 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HB3 . . . . . . . . . c30226_5ug5 1 . 13 . 3597 . 1 1 13 TYR HD1 H -4.790 6.772 3.218 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HD1 . . . . . . . . . c30226_5ug5 1 . 13 . 3598 . 1 1 13 TYR HD2 H -3.787 7.590 -0.802 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HD2 . . . . . . . . . c30226_5ug5 1 . 13 . 3599 . 1 1 13 TYR HE1 H -6.193 8.769 3.295 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HE1 . . . . . . . . . c30226_5ug5 1 . 13 . 3600 . 1 1 13 TYR HE2 H -5.198 9.611 -0.754 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HE2 . . . . . . . . . c30226_5ug5 1 . 13 . 3601 . 1 1 13 TYR HH H -6.462 10.880 2.176 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HH . . . . . . . . . c30226_5ug5 1 . 13 . 3602 . 1 1 13 TYR N N -3.227 3.413 1.353 . . . 1.0 . . . . . . . . . . . . A . 13 TYR N . . . . . . . . . c30226_5ug5 1 . 13 . 3603 . 1 1 13 TYR O O -6.220 4.637 0.032 . . . 1.0 . . . . . . . . . . . . A . 13 TYR O . . . . . . . . . c30226_5ug5 1 . 13 . 3604 . 1 1 13 TYR OH O -6.573 10.448 1.317 . . . 1.0 . . . . . . . . . . . . A . 13 TYR OH . . . . . . . . . c30226_5ug5 1 . 13 . 3605 . 1 1 14 ASN C C -5.200 2.531 -2.853 . . . 1.0 . . . . . . . . . . . . A . 14 ASN C . . . . . . . . . c30226_5ug5 1 . 13 . 3606 . 1 1 14 ASN CA C -5.184 3.979 -2.411 . . . 1.0 . . . . . . . . . . . . A . 14 ASN CA . . . . . . . . . c30226_5ug5 1 . 13 . 3607 . 1 1 14 ASN CB C -4.590 4.876 -3.505 . . . 1.0 . . . . . . . . . . . . A . 14 ASN CB . . . . . . . . . c30226_5ug5 1 . 13 . 3608 . 1 1 14 ASN CG C -5.516 5.024 -4.701 . . . 1.0 . . . . . . . . . . . . A . 14 ASN CG . . . . . . . . . c30226_5ug5 1 . 13 . 3609 . 1 1 14 ASN H H -3.456 3.835 -1.175 . . . 1.0 . . . . . . . . . . . . A . 14 ASN H . . . . . . . . . c30226_5ug5 1 . 13 . 3610 . 1 1 14 ASN HA H -6.197 4.293 -2.203 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HA . . . . . . . . . c30226_5ug5 1 . 13 . 3611 . 1 1 14 ASN HB2 H -4.403 5.856 -3.095 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HB2 . . . . . . . . . c30226_5ug5 1 . 13 . 3612 . 1 1 14 ASN HB3 H -3.657 4.448 -3.844 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HB3 . . . . . . . . . c30226_5ug5 1 . 13 . 3613 . 1 1 14 ASN HD21 H -3.968 5.275 -5.917 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HD21 . . . . . . . . . c30226_5ug5 1 . 13 . 3614 . 1 1 14 ASN HD22 H -5.528 5.326 -6.664 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HD22 . . . . . . . . . c30226_5ug5 1 . 13 . 3615 . 1 1 14 ASN N N -4.417 4.080 -1.173 . . . 1.0 . . . . . . . . . . . . A . 14 ASN N . . . . . . . . . c30226_5ug5 1 . 13 . 3616 . 1 1 14 ASN ND2 N -4.947 5.229 -5.877 . . . 1.0 . . . . . . . . . . . . A . 14 ASN ND2 . . . . . . . . . c30226_5ug5 1 . 13 . 3617 . 1 1 14 ASN O O -5.711 2.173 -3.914 . . . 1.0 . . . . . . . . . . . . A . 14 ASN O . . . . . . . . . c30226_5ug5 1 . 13 . 3618 . 1 1 14 ASN OD1 O -6.740 4.964 -4.566 . . . 1.0 . . . . . . . . . . . . A . 14 ASN OD1 . . . . . . . . . c30226_5ug5 1 . 13 . 3619 . 1 1 15 ASN C C -4.669 -0.577 -1.123 . . . 1.0 . . . . . . . . . . . . A . 15 ASN C . . . . . . . . . c30226_5ug5 1 . 13 . 3620 . 1 1 15 ASN CA C -4.363 0.319 -2.316 . . . 1.0 . . . . . . . . . . . . A . 15 ASN CA . . . . . . . . . c30226_5ug5 1 . 13 . 3621 . 1 1 15 ASN CB C -2.899 0.209 -2.672 . . . 1.0 . . . . . . . . . . . . A . 15 ASN CB . . . . . . . . . c30226_5ug5 1 . 13 . 3622 . 1 1 15 ASN CG C -2.551 0.846 -4.006 . . . 1.0 . . . . . . . . . . . . A . 15 ASN CG . . . . . . . . . c30226_5ug5 1 . 13 . 3623 . 1 1 15 ASN H H -4.394 2.038 -1.106 . . . 1.0 . . . . . . . . . . . . A . 15 ASN H . . . . . . . . . c30226_5ug5 1 . 13 . 3624 . 1 1 15 ASN HA H -4.968 0.031 -3.156 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HA . . . . . . . . . c30226_5ug5 1 . 13 . 3625 . 1 1 15 ASN HB2 H -2.357 0.738 -1.900 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HB2 . . . . . . . . . c30226_5ug5 1 . 13 . 3626 . 1 1 15 ASN HB3 H -2.600 -0.828 -2.684 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HB3 . . . . . . . . . c30226_5ug5 1 . 13 . 3627 . 1 1 15 ASN HD21 H -1.967 2.508 -3.085 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HD21 . . . . . . . . . c30226_5ug5 1 . 13 . 3628 . 1 1 15 ASN HD22 H -1.842 2.520 -4.811 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HD22 . . . . . . . . . c30226_5ug5 1 . 13 . 3629 . 1 1 15 ASN N N -4.639 1.703 -1.996 . . . 1.0 . . . . . . . . . . . . A . 15 ASN N . . . . . . . . . c30226_5ug5 1 . 13 . 3630 . 1 1 15 ASN ND2 N -2.072 2.080 -3.964 . . . 1.0 . . . . . . . . . . . . A . 15 ASN ND2 . . . . . . . . . c30226_5ug5 1 . 13 . 3631 . 1 1 15 ASN O O -3.775 -1.188 -0.537 . . . 1.0 . . . . . . . . . . . . A . 15 ASN O . . . . . . . . . c30226_5ug5 1 . 13 . 3632 . 1 1 15 ASN OD1 O -2.690 0.227 -5.062 . . . 1.0 . . . . . . . . . . . . A . 15 ASN OD1 . . . . . . . . . c30226_5ug5 1 . 13 . 3633 . 1 1 16 HYP C C -6.795 -2.772 0.206 . . . 1.0 . . . . . . . . . . . . A . 16 HYP C . . . . . . . . . c30226_5ug5 1 . 13 . 3634 . 1 1 16 HYP CA C -6.395 -1.339 0.473 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CA . . . . . . . . . c30226_5ug5 1 . 13 . 3635 . 1 1 16 HYP CB C -7.595 -0.480 0.807 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CB . . . . . . . . . c30226_5ug5 1 . 13 . 3636 . 1 1 16 HYP CD C -7.078 -0.037 -1.455 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CD . . . . . . . . . c30226_5ug5 1 . 13 . 3637 . 1 1 16 HYP CG C -7.845 0.519 -0.309 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CG . . . . . . . . . c30226_5ug5 1 . 13 . 3638 . 1 1 16 HYP HA H -5.668 -1.297 1.254 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HA . . . . . . . . . c30226_5ug5 1 . 13 . 3639 . 1 1 16 HYP HB2 H -7.409 0.059 1.721 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HB2 . . . . . . . . . c30226_5ug5 1 . 13 . 3640 . 1 1 16 HYP HB3 H -8.462 -1.115 0.929 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HB3 . . . . . . . . . c30226_5ug5 1 . 13 . 3641 . 1 1 16 HYP HD1 H -6.318 1.737 -0.259 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HD1 . . . . . . . . . c30226_5ug5 1 . 13 . 3642 . 1 1 16 HYP HD22 H -7.653 -0.769 -1.983 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HD22 . . . . . . . . . c30226_5ug5 1 . 13 . 3643 . 1 1 16 HYP HD23 H -6.746 0.748 -2.115 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HD23 . . . . . . . . . c30226_5ug5 1 . 13 . 3644 . 1 1 16 HYP HG H -8.897 0.613 -0.524 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HG . . . . . . . . . c30226_5ug5 1 . 13 . 3645 . 1 1 16 HYP N N -5.941 -0.651 -0.746 . . . 1.0 . . . . . . . . . . . . A . 16 HYP N . . . . . . . . . c30226_5ug5 1 . 13 . 3646 . 1 1 16 HYP O O -7.207 -3.510 1.099 . . . 1.0 . . . . . . . . . . . . A . 16 HYP O . . . . . . . . . c30226_5ug5 1 . 13 . 3647 . 1 1 16 HYP OD1 O -7.259 1.774 0.003 . . . 1.0 . . . . . . . . . . . . A . 16 HYP OD1 . . . . . . . . . c30226_5ug5 1 . 13 . 3648 . 1 1 17 HIS C C -5.759 -4.943 -2.362 . . . 1.0 . . . . . . . . . . . . A . 17 HIS C . . . . . . . . . c30226_5ug5 1 . 13 . 3649 . 1 1 17 HIS CA C -6.938 -4.481 -1.510 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CA . . . . . . . . . c30226_5ug5 1 . 13 . 3650 . 1 1 17 HIS CB C -8.249 -4.507 -2.308 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CB . . . . . . . . . c30226_5ug5 1 . 13 . 3651 . 1 1 17 HIS CD2 C -9.109 -6.915 -1.871 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CD2 . . . . . . . . . c30226_5ug5 1 . 13 . 3652 . 1 1 17 HIS CE1 C -9.325 -7.559 -3.949 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CE1 . . . . . . . . . c30226_5ug5 1 . 13 . 3653 . 1 1 17 HIS CG C -8.731 -5.882 -2.657 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CG . . . . . . . . . c30226_5ug5 1 . 13 . 3654 . 1 1 17 HIS H H -6.393 -2.447 -1.689 . . . 1.0 . . . . . . . . . . . . A . 17 HIS H . . . . . . . . . c30226_5ug5 1 . 13 . 3655 . 1 1 17 HIS HA H -7.026 -5.125 -0.647 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HA . . . . . . . . . c30226_5ug5 1 . 13 . 3656 . 1 1 17 HIS HB2 H -9.021 -4.025 -1.728 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HB2 . . . . . . . . . c30226_5ug5 1 . 13 . 3657 . 1 1 17 HIS HB3 H -8.108 -3.961 -3.230 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HB3 . . . . . . . . . c30226_5ug5 1 . 13 . 3658 . 1 1 17 HIS HD1 H -8.691 -5.793 -4.760 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HD1 . . . . . . . . . c30226_5ug5 1 . 13 . 3659 . 1 1 17 HIS HD2 H -9.118 -6.927 -0.791 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HD2 . . . . . . . . . c30226_5ug5 1 . 13 . 3660 . 1 1 17 HIS HE1 H -9.533 -8.156 -4.821 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HE1 . . . . . . . . . c30226_5ug5 1 . 13 . 3661 . 1 1 17 HIS HE2 H -9.579 -8.883 -2.415 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HE2 . . . . . . . . . c30226_5ug5 1 . 13 . 3662 . 1 1 17 HIS N N -6.673 -3.130 -1.046 . . . 1.0 . . . . . . . . . . . . A . 17 HIS N . . . . . . . . . c30226_5ug5 1 . 13 . 3663 . 1 1 17 HIS ND1 N -8.879 -6.320 -3.953 . . . 1.0 . . . . . . . . . . . . A . 17 HIS ND1 . . . . . . . . . c30226_5ug5 1 . 13 . 3664 . 1 1 17 HIS NE2 N -9.473 -7.946 -2.698 . . . 1.0 . . . . . . . . . . . . A . 17 HIS NE2 . . . . . . . . . c30226_5ug5 1 . 13 . 3665 . 1 1 17 HIS O O -5.882 -5.816 -3.221 . . . 1.0 . . . . . . . . . . . . A . 17 HIS O . . . . . . . . . c30226_5ug5 1 . 13 . 3666 . 1 1 18 VAL C C -2.838 -5.972 -2.565 . . . 1.0 . . . . . . . . . . . . A . 18 VAL C . . . . . . . . . c30226_5ug5 1 . 13 . 3667 . 1 1 18 VAL CA C -3.401 -4.591 -2.865 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CA . . . . . . . . . c30226_5ug5 1 . 13 . 3668 . 1 1 18 VAL CB C -2.357 -3.486 -2.588 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CB . . . . . . . . . c30226_5ug5 1 . 13 . 3669 . 1 1 18 VAL CG1 C -1.159 -3.986 -1.798 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CG1 . . . . . . . . . c30226_5ug5 1 . 13 . 3670 . 1 1 18 VAL CG2 C -1.918 -2.866 -3.890 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CG2 . . . . . . . . . c30226_5ug5 1 . 13 . 3671 . 1 1 18 VAL H H -4.570 -3.679 -1.379 . . . 1.0 . . . . . . . . . . . . A . 18 VAL H . . . . . . . . . c30226_5ug5 1 . 13 . 3672 . 1 1 18 VAL HA H -3.656 -4.553 -3.903 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HA . . . . . . . . . c30226_5ug5 1 . 13 . 3673 . 1 1 18 VAL HB H -2.836 -2.716 -2.003 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HB . . . . . . . . . c30226_5ug5 1 . 13 . 3674 . 1 1 18 VAL HG11 H -0.646 -4.742 -2.368 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG11 . . . . . . . . . c30226_5ug5 1 . 13 . 3675 . 1 1 18 VAL HG12 H -1.495 -4.403 -0.864 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG12 . . . . . . . . . c30226_5ug5 1 . 13 . 3676 . 1 1 18 VAL HG13 H -0.489 -3.161 -1.606 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG13 . . . . . . . . . c30226_5ug5 1 . 13 . 3677 . 1 1 18 VAL HG21 H -2.779 -2.442 -4.381 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG21 . . . . . . . . . c30226_5ug5 1 . 13 . 3678 . 1 1 18 VAL HG22 H -1.480 -3.627 -4.517 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG22 . . . . . . . . . c30226_5ug5 1 . 13 . 3679 . 1 1 18 VAL HG23 H -1.195 -2.090 -3.693 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG23 . . . . . . . . . c30226_5ug5 1 . 13 . 3680 . 1 1 18 VAL N N -4.608 -4.334 -2.104 . . . 1.0 . . . . . . . . . . . . A . 18 VAL N . . . . . . . . . c30226_5ug5 1 . 13 . 3681 . 1 1 18 VAL O O -2.183 -6.591 -3.403 . . . 1.0 . . . . . . . . . . . . A . 18 VAL O . . . . . . . . . c30226_5ug5 1 . 13 . 3682 . 1 1 19 CYS C C -3.721 -8.437 -0.079 . . . 1.0 . . . . . . . . . . . . A . 19 CYS C . . . . . . . . . c30226_5ug5 1 . 13 . 3683 . 1 1 19 CYS CA C -2.672 -7.769 -0.959 . . . 1.0 . . . . . . . . . . . . A . 19 CYS CA . . . . . . . . . c30226_5ug5 1 . 13 . 3684 . 1 1 19 CYS CB C -1.327 -7.675 -0.234 . . . 1.0 . . . . . . . . . . . . A . 19 CYS CB . . . . . . . . . c30226_5ug5 1 . 13 . 3685 . 1 1 19 CYS H H -3.637 -5.898 -0.763 . . . 1.0 . . . . . . . . . . . . A . 19 CYS H . . . . . . . . . c30226_5ug5 1 . 13 . 3686 . 1 1 19 CYS HA H -2.543 -8.367 -1.850 . . . 1.0 . . . . . . . . . . . . A . 19 CYS HA . . . . . . . . . c30226_5ug5 1 . 13 . 3687 . 1 1 19 CYS HB2 H -1.081 -8.642 0.176 . . . 1.0 . . . . . . . . . . . . A . 19 CYS HB2 . . . . . . . . . c30226_5ug5 1 . 13 . 3688 . 1 1 19 CYS HB3 H -0.566 -7.387 -0.942 . . . 1.0 . . . . . . . . . . . . A . 19 CYS HB3 . . . . . . . . . c30226_5ug5 1 . 13 . 3689 . 1 1 19 CYS N N -3.117 -6.451 -1.378 . . . 1.0 . . . . . . . . . . . . A . 19 CYS N . . . . . . . . . c30226_5ug5 1 . 13 . 3690 . 1 1 19 CYS O O -3.822 -8.083 1.113 . . . 1.0 . . . . . . . . . . . . A . 19 CYS O . . . . . . . . . c30226_5ug5 1 . 13 . 3691 . 1 1 19 CYS OXT O -4.449 -9.316 -0.586 . . . 1.0 . . . . . . . . . . . . A . 19 CYS OXT . . . . . . . . . c30226_5ug5 1 . 13 . 3692 . 1 1 19 CYS SG S -1.289 -6.473 1.136 . . . 1.0 . . . . . . . . . . . . A . 19 CYS SG . . . . . . . . . c30226_5ug5 1 . 14 . 3693 . 1 1 1 ILE C C 4.788 1.987 -4.719 . . . 1.0 . . . . . . . . . . . . A . 1 ILE C . . . . . . . . . c30226_5ug5 1 . 14 . 3694 . 1 1 1 ILE CA C 3.595 2.450 -5.550 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CA . . . . . . . . . c30226_5ug5 1 . 14 . 3695 . 1 1 1 ILE CB C 3.610 1.756 -6.938 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CB . . . . . . . . . c30226_5ug5 1 . 14 . 3696 . 1 1 1 ILE CD1 C 2.190 -0.230 -6.197 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CD1 . . . . . . . . . c30226_5ug5 1 . 14 . 3697 . 1 1 1 ILE CG1 C 3.501 0.233 -6.797 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CG1 . . . . . . . . . c30226_5ug5 1 . 14 . 3698 . 1 1 1 ILE CG2 C 4.860 2.128 -7.722 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CG2 . . . . . . . . . c30226_5ug5 1 . 14 . 3699 . 1 1 1 ILE H1 H 3.492 4.365 -4.748 . . . 1.0 . . . . . . . . . . . . A . 1 ILE H1 . . . . . . . . . c30226_5ug5 1 . 14 . 3700 . 1 1 1 ILE H2 H 2.822 4.233 -6.294 . . . 1.0 . . . . . . . . . . . . A . 1 ILE H2 . . . . . . . . . c30226_5ug5 1 . 14 . 3701 . 1 1 1 ILE H3 H 4.499 4.240 -6.097 . . . 1.0 . . . . . . . . . . . . A . 1 ILE H3 . . . . . . . . . c30226_5ug5 1 . 14 . 3702 . 1 1 1 ILE HA H 2.688 2.165 -5.038 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HA . . . . . . . . . c30226_5ug5 1 . 14 . 3703 . 1 1 1 ILE HB H 2.756 2.111 -7.490 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HB . . . . . . . . . c30226_5ug5 1 . 14 . 3704 . 1 1 1 ILE HD11 H 1.373 0.095 -6.825 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HD11 . . . . . . . . . c30226_5ug5 1 . 14 . 3705 . 1 1 1 ILE HD12 H 2.076 0.191 -5.210 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HD12 . . . . . . . . . c30226_5ug5 1 . 14 . 3706 . 1 1 1 ILE HD13 H 2.186 -1.308 -6.132 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HD13 . . . . . . . . . c30226_5ug5 1 . 14 . 3707 . 1 1 1 ILE HG12 H 3.598 -0.219 -7.771 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG12 . . . . . . . . . c30226_5ug5 1 . 14 . 3708 . 1 1 1 ILE HG13 H 4.301 -0.120 -6.161 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG13 . . . . . . . . . c30226_5ug5 1 . 14 . 3709 . 1 1 1 ILE HG21 H 4.838 1.641 -8.686 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG21 . . . . . . . . . c30226_5ug5 1 . 14 . 3710 . 1 1 1 ILE HG22 H 5.735 1.810 -7.177 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG22 . . . . . . . . . c30226_5ug5 1 . 14 . 3711 . 1 1 1 ILE HG23 H 4.892 3.198 -7.860 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG23 . . . . . . . . . c30226_5ug5 1 . 14 . 3712 . 1 1 1 ILE N N 3.602 3.923 -5.683 . . . 1.0 . . . . . . . . . . . . A . 1 ILE N . . . . . . . . . c30226_5ug5 1 . 14 . 3713 . 1 1 1 ILE O O 5.840 2.631 -4.707 . . . 1.0 . . . . . . . . . . . . A . 1 ILE O . . . . . . . . . c30226_5ug5 1 . 14 . 3714 . 1 1 2 ARG C C 5.493 -1.179 -3.083 . . . 1.0 . . . . . . . . . . . . A . 2 ARG C . . . . . . . . . c30226_5ug5 1 . 14 . 3715 . 1 1 2 ARG CA C 5.641 0.338 -3.153 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CA . . . . . . . . . c30226_5ug5 1 . 14 . 3716 . 1 1 2 ARG CB C 5.503 0.942 -1.751 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CB . . . . . . . . . c30226_5ug5 1 . 14 . 3717 . 1 1 2 ARG CD C 7.919 1.456 -1.282 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CD . . . . . . . . . c30226_5ug5 1 . 14 . 3718 . 1 1 2 ARG CG C 6.690 0.682 -0.838 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CG . . . . . . . . . c30226_5ug5 1 . 14 . 3719 . 1 1 2 ARG CZ C 10.230 1.814 -0.508 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CZ . . . . . . . . . c30226_5ug5 1 . 14 . 3720 . 1 1 2 ARG H H 3.764 0.397 -4.101 . . . 1.0 . . . . . . . . . . . . A . 2 ARG H . . . . . . . . . c30226_5ug5 1 . 14 . 3721 . 1 1 2 ARG HA H 6.603 0.588 -3.566 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HA . . . . . . . . . c30226_5ug5 1 . 14 . 3722 . 1 1 2 ARG HB2 H 5.377 2.010 -1.843 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB2 . . . . . . . . . c30226_5ug5 1 . 14 . 3723 . 1 1 2 ARG HB3 H 4.624 0.524 -1.284 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB3 . . . . . . . . . c30226_5ug5 1 . 14 . 3724 . 1 1 2 ARG HD2 H 8.143 1.197 -2.306 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD2 . . . . . . . . . c30226_5ug5 1 . 14 . 3725 . 1 1 2 ARG HD3 H 7.708 2.513 -1.216 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD3 . . . . . . . . . c30226_5ug5 1 . 14 . 3726 . 1 1 2 ARG HE H 9.001 0.395 0.185 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HE . . . . . . . . . c30226_5ug5 1 . 14 . 3727 . 1 1 2 ARG HG2 H 6.433 0.984 0.166 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG2 . . . . . . . . . c30226_5ug5 1 . 14 . 3728 . 1 1 2 ARG HG3 H 6.917 -0.372 -0.851 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG3 . . . . . . . . . c30226_5ug5 1 . 14 . 3729 . 1 1 2 ARG HH11 H 9.595 3.160 -1.888 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH11 . . . . . . . . . c30226_5ug5 1 . 14 . 3730 . 1 1 2 ARG HH12 H 11.230 3.363 -1.353 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH12 . . . . . . . . . c30226_5ug5 1 . 14 . 3731 . 1 1 2 ARG HH21 H 11.140 0.645 0.874 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH21 . . . . . . . . . c30226_5ug5 1 . 14 . 3732 . 1 1 2 ARG HH22 H 12.115 1.927 0.225 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH22 . . . . . . . . . c30226_5ug5 1 . 14 . 3733 . 1 1 2 ARG N N 4.613 0.877 -4.021 . . . 1.0 . . . . . . . . . . . . A . 2 ARG N . . . . . . . . . c30226_5ug5 1 . 14 . 3734 . 1 1 2 ARG NE N 9.080 1.151 -0.452 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NE . . . . . . . . . c30226_5ug5 1 . 14 . 3735 . 1 1 2 ARG NH1 N 10.362 2.861 -1.315 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH1 . . . . . . . . . c30226_5ug5 1 . 14 . 3736 . 1 1 2 ARG NH2 N 11.243 1.433 0.256 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH2 . . . . . . . . . c30226_5ug5 1 . 14 . 3737 . 1 1 2 ARG O O 4.381 -1.695 -3.166 . . . 1.0 . . . . . . . . . . . . A . 2 ARG O . . . . . . . . . c30226_5ug5 1 . 14 . 3738 . 1 1 3 ASP C C 6.316 -3.776 -1.396 . . . 1.0 . . . . . . . . . . . . A . 3 ASP C . . . . . . . . . c30226_5ug5 1 . 14 . 3739 . 1 1 3 ASP CA C 6.572 -3.353 -2.830 . . . 1.0 . . . . . . . . . . . . A . 3 ASP CA . . . . . . . . . c30226_5ug5 1 . 14 . 3740 . 1 1 3 ASP CB C 7.876 -3.962 -3.365 . . . 1.0 . . . . . . . . . . . . A . 3 ASP CB . . . . . . . . . c30226_5ug5 1 . 14 . 3741 . 1 1 3 ASP CG C 7.851 -5.480 -3.395 . . . 1.0 . . . . . . . . . . . . A . 3 ASP CG . . . . . . . . . c30226_5ug5 1 . 14 . 3742 . 1 1 3 ASP H H 7.468 -1.424 -2.869 . . . 1.0 . . . . . . . . . . . . A . 3 ASP H . . . . . . . . . c30226_5ug5 1 . 14 . 3743 . 1 1 3 ASP HA H 5.749 -3.686 -3.423 . . . 1.0 . . . . . . . . . . . . A . 3 ASP HA . . . . . . . . . c30226_5ug5 1 . 14 . 3744 . 1 1 3 ASP HB2 H 8.044 -3.608 -4.369 . . . 1.0 . . . . . . . . . . . . A . 3 ASP HB2 . . . . . . . . . c30226_5ug5 1 . 14 . 3745 . 1 1 3 ASP HB3 H 8.694 -3.646 -2.735 . . . 1.0 . . . . . . . . . . . . A . 3 ASP HB3 . . . . . . . . . c30226_5ug5 1 . 14 . 3746 . 1 1 3 ASP N N 6.605 -1.889 -2.923 . . . 1.0 . . . . . . . . . . . . A . 3 ASP N . . . . . . . . . c30226_5ug5 1 . 14 . 3747 . 1 1 3 ASP O O 6.331 -4.952 -1.034 . . . 1.0 . . . . . . . . . . . . A . 3 ASP O . . . . . . . . . c30226_5ug5 1 . 14 . 3748 . 1 1 3 ASP OD1 O 7.061 -6.054 -4.177 . . . 1.0 . . . . . . . . . . . . A . 3 ASP OD1 . . . . . . . . . c30226_5ug5 1 . 14 . 3749 . 1 1 3 ASP OD2 O 8.628 -6.104 -2.642 . . . 1.0 . . . . . . . . . . . . A . 3 ASP OD2 . . . . . . . . . c30226_5ug5 1 . 14 . 3750 . 1 1 4 GLU C C 4.296 -2.492 1.022 . . . 1.0 . . . . . . . . . . . . A . 4 GLU C . . . . . . . . . c30226_5ug5 1 . 14 . 3751 . 1 1 4 GLU CA C 5.726 -2.931 0.794 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CA . . . . . . . . . c30226_5ug5 1 . 14 . 3752 . 1 1 4 GLU CB C 6.649 -2.075 1.633 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CB . . . . . . . . . c30226_5ug5 1 . 14 . 3753 . 1 1 4 GLU CD C 9.005 -1.507 2.292 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CD . . . . . . . . . c30226_5ug5 1 . 14 . 3754 . 1 1 4 GLU CG C 8.110 -2.474 1.554 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CG . . . . . . . . . c30226_5ug5 1 . 14 . 3755 . 1 1 4 GLU H H 6.058 -1.887 -0.990 . . . 1.0 . . . . . . . . . . . . A . 4 GLU H . . . . . . . . . c30226_5ug5 1 . 14 . 3756 . 1 1 4 GLU HA H 5.840 -3.969 1.065 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HA . . . . . . . . . c30226_5ug5 1 . 14 . 3757 . 1 1 4 GLU HB2 H 6.561 -1.049 1.307 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HB2 . . . . . . . . . c30226_5ug5 1 . 14 . 3758 . 1 1 4 GLU HB3 H 6.326 -2.146 2.645 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HB3 . . . . . . . . . c30226_5ug5 1 . 14 . 3759 . 1 1 4 GLU HG2 H 8.227 -3.456 1.989 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HG2 . . . . . . . . . c30226_5ug5 1 . 14 . 3760 . 1 1 4 GLU HG3 H 8.407 -2.501 0.516 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HG3 . . . . . . . . . c30226_5ug5 1 . 14 . 3761 . 1 1 4 GLU N N 6.053 -2.776 -0.605 . . . 1.0 . . . . . . . . . . . . A . 4 GLU N . . . . . . . . . c30226_5ug5 1 . 14 . 3762 . 1 1 4 GLU O O 3.908 -2.105 2.122 . . . 1.0 . . . . . . . . . . . . A . 4 GLU O . . . . . . . . . c30226_5ug5 1 . 14 . 3763 . 1 1 4 GLU OE1 O 9.407 -1.810 3.434 . . . 1.0 . . . . . . . . . . . . A . 4 GLU OE1 . . . . . . . . . c30226_5ug5 1 . 14 . 3764 . 1 1 4 GLU OE2 O 9.303 -0.429 1.739 . . . 1.0 . . . . . . . . . . . . A . 4 GLU OE2 . . . . . . . . . c30226_5ug5 1 . 14 . 3765 . 1 1 5 CYS C C 1.221 -2.699 0.864 . . . 1.0 . . . . . . . . . . . . A . 5 CYS C . . . . . . . . . c30226_5ug5 1 . 14 . 3766 . 1 1 5 CYS CA C 2.189 -1.983 -0.076 . . . 1.0 . . . . . . . . . . . . A . 5 CYS CA . . . . . . . . . c30226_5ug5 1 . 14 . 3767 . 1 1 5 CYS CB C 1.652 -2.016 -1.507 . . . 1.0 . . . . . . . . . . . . A . 5 CYS CB . . . . . . . . . c30226_5ug5 1 . 14 . 3768 . 1 1 5 CYS H H 3.859 -3.041 -0.818 . . . 1.0 . . . . . . . . . . . . A . 5 CYS H . . . . . . . . . c30226_5ug5 1 . 14 . 3769 . 1 1 5 CYS HA H 2.273 -0.953 0.236 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HA . . . . . . . . . c30226_5ug5 1 . 14 . 3770 . 1 1 5 CYS HB2 H 2.464 -1.827 -2.193 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HB2 . . . . . . . . . c30226_5ug5 1 . 14 . 3771 . 1 1 5 CYS HB3 H 1.238 -2.995 -1.706 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HB3 . . . . . . . . . c30226_5ug5 1 . 14 . 3772 . 1 1 5 CYS N N 3.522 -2.566 -0.036 . . . 1.0 . . . . . . . . . . . . A . 5 CYS N . . . . . . . . . c30226_5ug5 1 . 14 . 3773 . 1 1 5 CYS O O 0.152 -2.182 1.173 . . . 1.0 . . . . . . . . . . . . A . 5 CYS O . . . . . . . . . c30226_5ug5 1 . 14 . 3774 . 1 1 5 CYS SG S 0.351 -0.787 -1.837 . . . 1.0 . . . . . . . . . . . . A . 5 CYS SG . . . . . . . . . c30226_5ug5 1 . 14 . 3775 . 1 1 6 CYS C C 0.934 -4.128 3.666 . . . 1.0 . . . . . . . . . . . . A . 6 CYS C . . . . . . . . . c30226_5ug5 1 . 14 . 3776 . 1 1 6 CYS CA C 0.754 -4.632 2.238 . . . 1.0 . . . . . . . . . . . . A . 6 CYS CA . . . . . . . . . c30226_5ug5 1 . 14 . 3777 . 1 1 6 CYS CB C 1.068 -6.128 2.149 . . . 1.0 . . . . . . . . . . . . A . 6 CYS CB . . . . . . . . . c30226_5ug5 1 . 14 . 3778 . 1 1 6 CYS H H 2.467 -4.248 1.056 . . . 1.0 . . . . . . . . . . . . A . 6 CYS H . . . . . . . . . c30226_5ug5 1 . 14 . 3779 . 1 1 6 CYS HA H -0.271 -4.468 1.942 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HA . . . . . . . . . c30226_5ug5 1 . 14 . 3780 . 1 1 6 CYS HB2 H 0.984 -6.445 1.120 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HB2 . . . . . . . . . c30226_5ug5 1 . 14 . 3781 . 1 1 6 CYS HB3 H 2.077 -6.297 2.490 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HB3 . . . . . . . . . c30226_5ug5 1 . 14 . 3782 . 1 1 6 CYS N N 1.600 -3.876 1.330 . . . 1.0 . . . . . . . . . . . . A . 6 CYS N . . . . . . . . . c30226_5ug5 1 . 14 . 3783 . 1 1 6 CYS O O 0.022 -4.213 4.487 . . . 1.0 . . . . . . . . . . . . A . 6 CYS O . . . . . . . . . c30226_5ug5 1 . 14 . 3784 . 1 1 6 CYS SG S -0.037 -7.184 3.143 . . . 1.0 . . . . . . . . . . . . A . 6 CYS SG . . . . . . . . . c30226_5ug5 1 . 14 . 3785 . 1 1 7 SER C C 2.256 -1.546 5.300 . . . 1.0 . . . . . . . . . . . . A . 7 SER C . . . . . . . . . c30226_5ug5 1 . 14 . 3786 . 1 1 7 SER CA C 2.403 -3.059 5.274 . . . 1.0 . . . . . . . . . . . . A . 7 SER CA . . . . . . . . . c30226_5ug5 1 . 14 . 3787 . 1 1 7 SER CB C 3.831 -3.403 5.675 . . . 1.0 . . . . . . . . . . . . A . 7 SER CB . . . . . . . . . c30226_5ug5 1 . 14 . 3788 . 1 1 7 SER H H 2.802 -3.545 3.254 . . . 1.0 . . . . . . . . . . . . A . 7 SER H . . . . . . . . . c30226_5ug5 1 . 14 . 3789 . 1 1 7 SER HA H 1.717 -3.498 5.979 . . . 1.0 . . . . . . . . . . . . A . 7 SER HA . . . . . . . . . c30226_5ug5 1 . 14 . 3790 . 1 1 7 SER HB2 H 4.181 -4.240 5.089 . . . 1.0 . . . . . . . . . . . . A . 7 SER HB2 . . . . . . . . . c30226_5ug5 1 . 14 . 3791 . 1 1 7 SER HB3 H 4.457 -2.536 5.487 . . . 1.0 . . . . . . . . . . . . A . 7 SER HB3 . . . . . . . . . c30226_5ug5 1 . 14 . 3792 . 1 1 7 SER HG H 3.841 -4.692 7.153 . . . 1.0 . . . . . . . . . . . . A . 7 SER HG . . . . . . . . . c30226_5ug5 1 . 14 . 3793 . 1 1 7 SER N N 2.108 -3.584 3.950 . . . 1.0 . . . . . . . . . . . . A . 7 SER N . . . . . . . . . c30226_5ug5 1 . 14 . 3794 . 1 1 7 SER O O 1.819 -0.969 6.296 . . . 1.0 . . . . . . . . . . . . A . 7 SER O . . . . . . . . . c30226_5ug5 1 . 14 . 3795 . 1 1 7 SER OG O 3.915 -3.733 7.052 . . . 1.0 . . . . . . . . . . . . A . 7 SER OG . . . . . . . . . c30226_5ug5 1 . 14 . 3796 . 1 1 8 ASN C C 1.440 1.252 4.087 . . . 1.0 . . . . . . . . . . . . A . 8 ASN C . . . . . . . . . c30226_5ug5 1 . 14 . 3797 . 1 1 8 ASN CA C 2.781 0.527 4.158 . . . 1.0 . . . . . . . . . . . . A . 8 ASN CA . . . . . . . . . c30226_5ug5 1 . 14 . 3798 . 1 1 8 ASN CB C 3.644 0.918 2.960 . . . 1.0 . . . . . . . . . . . . A . 8 ASN CB . . . . . . . . . c30226_5ug5 1 . 14 . 3799 . 1 1 8 ASN CG C 3.923 2.408 2.898 . . . 1.0 . . . . . . . . . . . . A . 8 ASN CG . . . . . . . . . c30226_5ug5 1 . 14 . 3800 . 1 1 8 ASN H H 2.716 -1.424 3.357 . . . 1.0 . . . . . . . . . . . . A . 8 ASN H . . . . . . . . . c30226_5ug5 1 . 14 . 3801 . 1 1 8 ASN HA H 3.296 0.803 5.066 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HA . . . . . . . . . c30226_5ug5 1 . 14 . 3802 . 1 1 8 ASN HB2 H 4.587 0.396 3.016 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HB2 . . . . . . . . . c30226_5ug5 1 . 14 . 3803 . 1 1 8 ASN HB3 H 3.130 0.630 2.055 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HB3 . . . . . . . . . c30226_5ug5 1 . 14 . 3804 . 1 1 8 ASN HD21 H 5.580 2.173 3.969 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HD21 . . . . . . . . . c30226_5ug5 1 . 14 . 3805 . 1 1 8 ASN HD22 H 5.219 3.795 3.486 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HD22 . . . . . . . . . c30226_5ug5 1 . 14 . 3806 . 1 1 8 ASN N N 2.600 -0.911 4.188 . . . 1.0 . . . . . . . . . . . . A . 8 ASN N . . . . . . . . . c30226_5ug5 1 . 14 . 3807 . 1 1 8 ASN ND2 N 5.015 2.834 3.512 . . . 1.0 . . . . . . . . . . . . A . 8 ASN ND2 . . . . . . . . . c30226_5ug5 1 . 14 . 3808 . 1 1 8 ASN O O 0.744 1.181 3.073 . . . 1.0 . . . . . . . . . . . . A . 8 ASN O . . . . . . . . . c30226_5ug5 1 . 14 . 3809 . 1 1 8 ASN OD1 O 3.166 3.167 2.301 . . . 1.0 . . . . . . . . . . . . A . 8 ASN OD1 . . . . . . . . . c30226_5ug5 1 . 14 . 3810 . 1 1 9 PRO C C -0.447 3.670 4.156 . . . 1.0 . . . . . . . . . . . . A . 9 PRO C . . . . . . . . . c30226_5ug5 1 . 14 . 3811 . 1 1 9 PRO CA C -0.214 2.666 5.276 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CA . . . . . . . . . c30226_5ug5 1 . 14 . 3812 . 1 1 9 PRO CB C -0.082 3.398 6.613 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CB . . . . . . . . . c30226_5ug5 1 . 14 . 3813 . 1 1 9 PRO CD C 1.889 2.178 6.370 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CD . . . . . . . . . c30226_5ug5 1 . 14 . 3814 . 1 1 9 PRO CG C 0.876 2.595 7.379 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CG . . . . . . . . . c30226_5ug5 1 . 14 . 3815 . 1 1 9 PRO HA H -1.039 1.973 5.321 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HA . . . . . . . . . c30226_5ug5 1 . 14 . 3816 . 1 1 9 PRO HB2 H 0.320 4.373 6.441 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HB2 . . . . . . . . . c30226_5ug5 1 . 14 . 3817 . 1 1 9 PRO HB3 H -1.039 3.463 7.104 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HB3 . . . . . . . . . c30226_5ug5 1 . 14 . 3818 . 1 1 9 PRO HD2 H 2.625 2.956 6.219 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HD2 . . . . . . . . . c30226_5ug5 1 . 14 . 3819 . 1 1 9 PRO HD3 H 2.353 1.274 6.674 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HD3 . . . . . . . . . c30226_5ug5 1 . 14 . 3820 . 1 1 9 PRO HG2 H 1.331 3.205 8.143 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HG2 . . . . . . . . . c30226_5ug5 1 . 14 . 3821 . 1 1 9 PRO HG3 H 0.389 1.734 7.809 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HG3 . . . . . . . . . c30226_5ug5 1 . 14 . 3822 . 1 1 9 PRO N N 1.074 1.973 5.161 . . . 1.0 . . . . . . . . . . . . A . 9 PRO N . . . . . . . . . c30226_5ug5 1 . 14 . 3823 . 1 1 9 PRO O O -1.574 3.872 3.714 . . . 1.0 . . . . . . . . . . . . A . 9 PRO O . . . . . . . . . c30226_5ug5 1 . 14 . 3824 . 1 1 10 ALA C C 0.257 4.700 1.289 . . . 1.0 . . . . . . . . . . . . A . 10 ALA C . . . . . . . . . c30226_5ug5 1 . 14 . 3825 . 1 1 10 ALA CA C 0.535 5.306 2.661 . . . 1.0 . . . . . . . . . . . . A . 10 ALA CA . . . . . . . . . c30226_5ug5 1 . 14 . 3826 . 1 1 10 ALA CB C 1.807 6.132 2.623 . . . 1.0 . . . . . . . . . . . . A . 10 ALA CB . . . . . . . . . c30226_5ug5 1 . 14 . 3827 . 1 1 10 ALA H H 1.508 4.049 4.056 . . . 1.0 . . . . . . . . . . . . A . 10 ALA H . . . . . . . . . c30226_5ug5 1 . 14 . 3828 . 1 1 10 ALA HA H -0.281 5.965 2.922 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HA . . . . . . . . . c30226_5ug5 1 . 14 . 3829 . 1 1 10 ALA HB1 H 1.989 6.560 3.598 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HB1 . . . . . . . . . c30226_5ug5 1 . 14 . 3830 . 1 1 10 ALA HB2 H 1.701 6.923 1.896 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HB2 . . . . . . . . . c30226_5ug5 1 . 14 . 3831 . 1 1 10 ALA HB3 H 2.638 5.499 2.346 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HB3 . . . . . . . . . c30226_5ug5 1 . 14 . 3832 . 1 1 10 ALA N N 0.628 4.285 3.692 . . . 1.0 . . . . . . . . . . . . A . 10 ALA N . . . . . . . . . c30226_5ug5 1 . 14 . 3833 . 1 1 10 ALA O O -0.241 5.382 0.395 . . . 1.0 . . . . . . . . . . . . A . 10 ALA O . . . . . . . . . c30226_5ug5 1 . 14 . 3834 . 1 1 11 CYS C C -0.990 2.229 -0.122 . . . 1.0 . . . . . . . . . . . . A . 11 CYS C . . . . . . . . . c30226_5ug5 1 . 14 . 3835 . 1 1 11 CYS CA C 0.390 2.781 -0.161 . . . 1.0 . . . . . . . . . . . . A . 11 CYS CA . . . . . . . . . c30226_5ug5 1 . 14 . 3836 . 1 1 11 CYS CB C 1.413 1.663 -0.375 . . . 1.0 . . . . . . . . . . . . A . 11 CYS CB . . . . . . . . . c30226_5ug5 1 . 14 . 3837 . 1 1 11 CYS H H 0.729 2.850 1.908 . . . 1.0 . . . . . . . . . . . . A . 11 CYS H . . . . . . . . . c30226_5ug5 1 . 14 . 3838 . 1 1 11 CYS HA H 0.468 3.526 -0.940 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HA . . . . . . . . . c30226_5ug5 1 . 14 . 3839 . 1 1 11 CYS HB2 H 2.405 2.054 -0.201 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HB2 . . . . . . . . . c30226_5ug5 1 . 14 . 3840 . 1 1 11 CYS HB3 H 1.213 0.866 0.332 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HB3 . . . . . . . . . c30226_5ug5 1 . 14 . 3841 . 1 1 11 CYS N N 0.561 3.419 1.124 . . . 1.0 . . . . . . . . . . . . A . 11 CYS N . . . . . . . . . c30226_5ug5 1 . 14 . 3842 . 1 1 11 CYS O O -1.816 2.413 -1.016 . . . 1.0 . . . . . . . . . . . . A . 11 CYS O . . . . . . . . . c30226_5ug5 1 . 14 . 3843 . 1 1 11 CYS SG S 1.385 0.945 -2.053 . . . 1.0 . . . . . . . . . . . . A . 11 CYS SG . . . . . . . . . c30226_5ug5 1 . 14 . 3844 . 1 1 12 ARG C C -3.593 2.091 1.291 . . . 1.0 . . . . . . . . . . . . A . 12 ARG C . . . . . . . . . c30226_5ug5 1 . 14 . 3845 . 1 1 12 ARG CA C -2.473 1.066 1.399 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CA . . . . . . . . . c30226_5ug5 1 . 14 . 3846 . 1 1 12 ARG CB C -2.326 0.579 2.820 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CB . . . . . . . . . c30226_5ug5 1 . 14 . 3847 . 1 1 12 ARG CD C -1.134 -1.196 4.121 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CD . . . . . . . . . c30226_5ug5 1 . 14 . 3848 . 1 1 12 ARG CG C -1.985 -0.892 2.906 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CG . . . . . . . . . c30226_5ug5 1 . 14 . 3849 . 1 1 12 ARG CZ C -1.741 -1.538 6.490 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CZ . . . . . . . . . c30226_5ug5 1 . 14 . 3850 . 1 1 12 ARG H H -0.453 1.435 1.618 . . . 1.0 . . . . . . . . . . . . A . 12 ARG H . . . . . . . . . c30226_5ug5 1 . 14 . 3851 . 1 1 12 ARG HA H -2.678 0.237 0.769 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HA . . . . . . . . . c30226_5ug5 1 . 14 . 3852 . 1 1 12 ARG HB2 H -1.531 1.137 3.293 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HB2 . . . . . . . . . c30226_5ug5 1 . 14 . 3853 . 1 1 12 ARG HB3 H -3.232 0.762 3.343 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HB3 . . . . . . . . . c30226_5ug5 1 . 14 . 3854 . 1 1 12 ARG HD2 H -0.932 -2.256 4.143 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HD2 . . . . . . . . . c30226_5ug5 1 . 14 . 3855 . 1 1 12 ARG HD3 H -0.200 -0.652 4.026 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HD3 . . . . . . . . . c30226_5ug5 1 . 14 . 3856 . 1 1 12 ARG HE H -2.284 0.039 5.382 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HE . . . . . . . . . c30226_5ug5 1 . 14 . 3857 . 1 1 12 ARG HG2 H -2.896 -1.457 2.962 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HG2 . . . . . . . . . c30226_5ug5 1 . 14 . 3858 . 1 1 12 ARG HG3 H -1.437 -1.175 2.019 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HG3 . . . . . . . . . c30226_5ug5 1 . 14 . 3859 . 1 1 12 ARG HH11 H -0.664 -3.061 5.683 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH11 . . . . . . . . . c30226_5ug5 1 . 14 . 3860 . 1 1 12 ARG HH12 H -1.078 -3.246 7.358 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH12 . . . . . . . . . c30226_5ug5 1 . 14 . 3861 . 1 1 12 ARG HH21 H -2.832 -0.220 7.575 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH21 . . . . . . . . . c30226_5ug5 1 . 14 . 3862 . 1 1 12 ARG HH22 H -2.314 -1.641 8.432 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH22 . . . . . . . . . c30226_5ug5 1 . 14 . 3863 . 1 1 12 ARG N N -1.212 1.588 1.008 . . . 1.0 . . . . . . . . . . . . A . 12 ARG N . . . . . . . . . c30226_5ug5 1 . 14 . 3864 . 1 1 12 ARG NE N -1.787 -0.814 5.372 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NE . . . . . . . . . c30226_5ug5 1 . 14 . 3865 . 1 1 12 ARG NH1 N -1.111 -2.707 6.511 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NH1 . . . . . . . . . c30226_5ug5 1 . 14 . 3866 . 1 1 12 ARG NH2 N -2.342 -1.098 7.587 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NH2 . . . . . . . . . c30226_5ug5 1 . 14 . 3867 . 1 1 12 ARG O O -4.735 1.738 1.016 . . . 1.0 . . . . . . . . . . . . A . 12 ARG O . . . . . . . . . c30226_5ug5 1 . 14 . 3868 . 1 1 13 TYR C C -4.939 4.448 0.063 . . . 1.0 . . . . . . . . . . . . A . 13 TYR C . . . . . . . . . c30226_5ug5 1 . 14 . 3869 . 1 1 13 TYR CA C -4.199 4.450 1.400 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CA . . . . . . . . . c30226_5ug5 1 . 14 . 3870 . 1 1 13 TYR CB C -3.461 5.769 1.591 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CB . . . . . . . . . c30226_5ug5 1 . 14 . 3871 . 1 1 13 TYR CD1 C -5.211 7.179 2.681 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CD1 . . . . . . . . . c30226_5ug5 1 . 14 . 3872 . 1 1 13 TYR CD2 C -4.361 7.849 0.574 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CD2 . . . . . . . . . c30226_5ug5 1 . 14 . 3873 . 1 1 13 TYR CE1 C -6.046 8.276 2.699 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CE1 . . . . . . . . . c30226_5ug5 1 . 14 . 3874 . 1 1 13 TYR CE2 C -5.185 8.946 0.578 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CE2 . . . . . . . . . c30226_5ug5 1 . 14 . 3875 . 1 1 13 TYR CG C -4.363 6.956 1.619 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CG . . . . . . . . . c30226_5ug5 1 . 14 . 3876 . 1 1 13 TYR CZ C -6.030 9.159 1.643 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CZ . . . . . . . . . c30226_5ug5 1 . 14 . 3877 . 1 1 13 TYR H H -2.330 3.566 1.745 . . . 1.0 . . . . . . . . . . . . A . 13 TYR H . . . . . . . . . c30226_5ug5 1 . 14 . 3878 . 1 1 13 TYR HA H -4.914 4.340 2.194 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HA . . . . . . . . . c30226_5ug5 1 . 14 . 3879 . 1 1 13 TYR HB2 H -2.911 5.743 2.520 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HB2 . . . . . . . . . c30226_5ug5 1 . 14 . 3880 . 1 1 13 TYR HB3 H -2.777 5.906 0.775 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HB3 . . . . . . . . . c30226_5ug5 1 . 14 . 3881 . 1 1 13 TYR HD1 H -5.211 6.479 3.500 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HD1 . . . . . . . . . c30226_5ug5 1 . 14 . 3882 . 1 1 13 TYR HD2 H -3.697 7.674 -0.257 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HD2 . . . . . . . . . c30226_5ug5 1 . 14 . 3883 . 1 1 13 TYR HE1 H -6.703 8.438 3.534 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HE1 . . . . . . . . . c30226_5ug5 1 . 14 . 3884 . 1 1 13 TYR HE2 H -5.163 9.627 -0.247 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HE2 . . . . . . . . . c30226_5ug5 1 . 14 . 3885 . 1 1 13 TYR HH H -7.287 10.338 0.787 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HH . . . . . . . . . c30226_5ug5 1 . 14 . 3886 . 1 1 13 TYR N N -3.251 3.358 1.497 . . . 1.0 . . . . . . . . . . . . A . 13 TYR N . . . . . . . . . c30226_5ug5 1 . 14 . 3887 . 1 1 13 TYR O O -6.107 4.832 -0.008 . . . 1.0 . . . . . . . . . . . . A . 13 TYR O . . . . . . . . . c30226_5ug5 1 . 14 . 3888 . 1 1 13 TYR OH O -6.861 10.256 1.652 . . . 1.0 . . . . . . . . . . . . A . 13 TYR OH . . . . . . . . . c30226_5ug5 1 . 14 . 3889 . 1 1 14 ASN C C -5.106 2.557 -2.738 . . . 1.0 . . . . . . . . . . . . A . 14 ASN C . . . . . . . . . c30226_5ug5 1 . 14 . 3890 . 1 1 14 ASN CA C -4.869 3.994 -2.322 . . . 1.0 . . . . . . . . . . . . A . 14 ASN CA . . . . . . . . . c30226_5ug5 1 . 14 . 3891 . 1 1 14 ASN CB C -3.931 4.691 -3.319 . . . 1.0 . . . . . . . . . . . . A . 14 ASN CB . . . . . . . . . c30226_5ug5 1 . 14 . 3892 . 1 1 14 ASN CG C -4.491 4.768 -4.731 . . . 1.0 . . . . . . . . . . . . A . 14 ASN CG . . . . . . . . . c30226_5ug5 1 . 14 . 3893 . 1 1 14 ASN H H -3.365 3.607 -0.875 . . . 1.0 . . . . . . . . . . . . A . 14 ASN H . . . . . . . . . c30226_5ug5 1 . 14 . 3894 . 1 1 14 ASN HA H -5.812 4.518 -2.278 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HA . . . . . . . . . c30226_5ug5 1 . 14 . 3895 . 1 1 14 ASN HB2 H -3.742 5.698 -2.977 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HB2 . . . . . . . . . c30226_5ug5 1 . 14 . 3896 . 1 1 14 ASN HB3 H -2.995 4.150 -3.354 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HB3 . . . . . . . . . c30226_5ug5 1 . 14 . 3897 . 1 1 14 ASN HD21 H -3.624 3.046 -5.210 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HD21 . . . . . . . . . c30226_5ug5 1 . 14 . 3898 . 1 1 14 ASN HD22 H -4.534 3.806 -6.466 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HD22 . . . . . . . . . c30226_5ug5 1 . 14 . 3899 . 1 1 14 ASN N N -4.272 3.997 -0.993 . . . 1.0 . . . . . . . . . . . . A . 14 ASN N . . . . . . . . . c30226_5ug5 1 . 14 . 3900 . 1 1 14 ASN ND2 N -4.186 3.774 -5.551 . . . 1.0 . . . . . . . . . . . . A . 14 ASN ND2 . . . . . . . . . c30226_5ug5 1 . 14 . 3901 . 1 1 14 ASN O O -5.809 2.261 -3.702 . . . 1.0 . . . . . . . . . . . . A . 14 ASN O . . . . . . . . . c30226_5ug5 1 . 14 . 3902 . 1 1 14 ASN OD1 O -5.182 5.724 -5.087 . . . 1.0 . . . . . . . . . . . . A . 14 ASN OD1 . . . . . . . . . c30226_5ug5 1 . 14 . 3903 . 1 1 15 ASN C C -4.739 -0.655 -1.173 . . . 1.0 . . . . . . . . . . . . A . 15 ASN C . . . . . . . . . c30226_5ug5 1 . 14 . 3904 . 1 1 15 ASN CA C -4.375 0.284 -2.317 . . . 1.0 . . . . . . . . . . . . A . 15 ASN CA . . . . . . . . . c30226_5ug5 1 . 14 . 3905 . 1 1 15 ASN CB C -2.921 0.100 -2.673 . . . 1.0 . . . . . . . . . . . . A . 15 ASN CB . . . . . . . . . c30226_5ug5 1 . 14 . 3906 . 1 1 15 ASN CG C -2.549 0.672 -4.031 . . . 1.0 . . . . . . . . . . . . A . 15 ASN CG . . . . . . . . . c30226_5ug5 1 . 14 . 3907 . 1 1 15 ASN H H -4.236 1.960 -1.057 . . . 1.0 . . . . . . . . . . . . A . 15 ASN H . . . . . . . . . c30226_5ug5 1 . 14 . 3908 . 1 1 15 ASN HA H -4.992 0.079 -3.171 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HA . . . . . . . . . c30226_5ug5 1 . 14 . 3909 . 1 1 15 ASN HB2 H -2.355 0.628 -1.922 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HB2 . . . . . . . . . c30226_5ug5 1 . 14 . 3910 . 1 1 15 ASN HB3 H -2.669 -0.949 -2.649 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HB3 . . . . . . . . . c30226_5ug5 1 . 14 . 3911 . 1 1 15 ASN HD21 H -0.655 0.867 -3.459 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HD21 . . . . . . . . . c30226_5ug5 1 . 14 . 3912 . 1 1 15 ASN HD22 H -1.012 1.371 -5.078 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HD22 . . . . . . . . . c30226_5ug5 1 . 14 . 3913 . 1 1 15 ASN N N -4.548 1.670 -1.940 . . . 1.0 . . . . . . . . . . . . A . 15 ASN N . . . . . . . . . c30226_5ug5 1 . 14 . 3914 . 1 1 15 ASN ND2 N -1.280 1.006 -4.206 . . . 1.0 . . . . . . . . . . . . A . 15 ASN ND2 . . . . . . . . . c30226_5ug5 1 . 14 . 3915 . 1 1 15 ASN O O -3.890 -1.369 -0.641 . . . 1.0 . . . . . . . . . . . . A . 15 ASN O . . . . . . . . . c30226_5ug5 1 . 14 . 3916 . 1 1 15 ASN OD1 O -3.390 0.798 -4.919 . . . 1.0 . . . . . . . . . . . . A . 15 ASN OD1 . . . . . . . . . c30226_5ug5 1 . 14 . 3917 . 1 1 16 HYP C C -6.857 -2.829 0.120 . . . 1.0 . . . . . . . . . . . . A . 16 HYP C . . . . . . . . . c30226_5ug5 1 . 14 . 3918 . 1 1 16 HYP CA C -6.496 -1.388 0.399 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CA . . . . . . . . . c30226_5ug5 1 . 14 . 3919 . 1 1 16 HYP CB C -7.715 -0.553 0.724 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CB . . . . . . . . . c30226_5ug5 1 . 14 . 3920 . 1 1 16 HYP CD C -7.113 0.043 -1.469 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CD . . . . . . . . . c30226_5ug5 1 . 14 . 3921 . 1 1 16 HYP CG C -7.868 0.556 -0.298 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CG . . . . . . . . . c30226_5ug5 1 . 14 . 3922 . 1 1 16 HYP HA H -5.791 -1.345 1.196 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HA . . . . . . . . . c30226_5ug5 1 . 14 . 3923 . 1 1 16 HYP HB2 H -7.600 -0.116 1.701 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HB2 . . . . . . . . . c30226_5ug5 1 . 14 . 3924 . 1 1 16 HYP HB3 H -8.593 -1.185 0.708 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HB3 . . . . . . . . . c30226_5ug5 1 . 14 . 3925 . 1 1 16 HYP HD1 H -6.263 1.663 -0.138 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HD1 . . . . . . . . . c30226_5ug5 1 . 14 . 3926 . 1 1 16 HYP HD22 H -7.713 -0.622 -2.051 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HD22 . . . . . . . . . c30226_5ug5 1 . 14 . 3927 . 1 1 16 HYP HD23 H -6.735 0.855 -2.071 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HD23 . . . . . . . . . c30226_5ug5 1 . 14 . 3928 . 1 1 16 HYP HG H -8.904 0.741 -0.523 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HG . . . . . . . . . c30226_5ug5 1 . 14 . 3929 . 1 1 16 HYP N N -6.012 -0.670 -0.794 . . . 1.0 . . . . . . . . . . . . A . 16 HYP N . . . . . . . . . c30226_5ug5 1 . 14 . 3930 . 1 1 16 HYP O O -7.152 -3.606 1.026 . . . 1.0 . . . . . . . . . . . . A . 16 HYP O . . . . . . . . . c30226_5ug5 1 . 14 . 3931 . 1 1 16 HYP OD1 O -7.202 1.734 0.135 . . . 1.0 . . . . . . . . . . . . A . 16 HYP OD1 . . . . . . . . . c30226_5ug5 1 . 14 . 3932 . 1 1 17 HIS C C -5.930 -4.985 -2.519 . . . 1.0 . . . . . . . . . . . . A . 17 HIS C . . . . . . . . . c30226_5ug5 1 . 14 . 3933 . 1 1 17 HIS CA C -7.035 -4.552 -1.561 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CA . . . . . . . . . c30226_5ug5 1 . 14 . 3934 . 1 1 17 HIS CB C -8.434 -4.763 -2.179 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CB . . . . . . . . . c30226_5ug5 1 . 14 . 3935 . 1 1 17 HIS CD2 C -9.136 -2.769 -3.695 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CD2 . . . . . . . . . c30226_5ug5 1 . 14 . 3936 . 1 1 17 HIS CE1 C -8.915 -3.750 -5.639 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CE1 . . . . . . . . . c30226_5ug5 1 . 14 . 3937 . 1 1 17 HIS CG C -8.702 -4.031 -3.465 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CG . . . . . . . . . c30226_5ug5 1 . 14 . 3938 . 1 1 17 HIS H H -6.644 -2.474 -1.804 . . . 1.0 . . . . . . . . . . . . A . 17 HIS H . . . . . . . . . c30226_5ug5 1 . 14 . 3939 . 1 1 17 HIS HA H -6.960 -5.162 -0.674 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HA . . . . . . . . . c30226_5ug5 1 . 14 . 3940 . 1 1 17 HIS HB2 H -8.569 -5.814 -2.377 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HB2 . . . . . . . . . c30226_5ug5 1 . 14 . 3941 . 1 1 17 HIS HB3 H -9.178 -4.448 -1.462 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HB3 . . . . . . . . . c30226_5ug5 1 . 14 . 3942 . 1 1 17 HIS HD1 H -8.265 -5.536 -4.877 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HD1 . . . . . . . . . c30226_5ug5 1 . 14 . 3943 . 1 1 17 HIS HD2 H -9.339 -2.017 -2.949 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HD2 . . . . . . . . . c30226_5ug5 1 . 14 . 3944 . 1 1 17 HIS HE1 H -8.915 -3.935 -6.703 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HE1 . . . . . . . . . c30226_5ug5 1 . 14 . 3945 . 1 1 17 HIS HE2 H -9.717 -1.872 -5.503 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HE2 . . . . . . . . . c30226_5ug5 1 . 14 . 3946 . 1 1 17 HIS N N -6.825 -3.172 -1.142 . . . 1.0 . . . . . . . . . . . . A . 17 HIS N . . . . . . . . . c30226_5ug5 1 . 14 . 3947 . 1 1 17 HIS ND1 N -8.571 -4.618 -4.705 . . . 1.0 . . . . . . . . . . . . A . 17 HIS ND1 . . . . . . . . . c30226_5ug5 1 . 14 . 3948 . 1 1 17 HIS NE2 N -9.262 -2.621 -5.053 . . . 1.0 . . . . . . . . . . . . A . 17 HIS NE2 . . . . . . . . . c30226_5ug5 1 . 14 . 3949 . 1 1 17 HIS O O -6.137 -5.815 -3.399 . . . 1.0 . . . . . . . . . . . . A . 17 HIS O . . . . . . . . . c30226_5ug5 1 . 14 . 3950 . 1 1 18 VAL C C -2.877 -5.968 -2.594 . . . 1.0 . . . . . . . . . . . . A . 18 VAL C . . . . . . . . . c30226_5ug5 1 . 14 . 3951 . 1 1 18 VAL CA C -3.585 -4.735 -3.133 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CA . . . . . . . . . c30226_5ug5 1 . 14 . 3952 . 1 1 18 VAL CB C -2.621 -3.526 -3.180 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CB . . . . . . . . . c30226_5ug5 1 . 14 . 3953 . 1 1 18 VAL CG1 C -1.166 -3.944 -3.066 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CG1 . . . . . . . . . c30226_5ug5 1 . 14 . 3954 . 1 1 18 VAL CG2 C -2.838 -2.736 -4.451 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CG2 . . . . . . . . . c30226_5ug5 1 . 14 . 3955 . 1 1 18 VAL H H -4.652 -3.750 -1.609 . . . 1.0 . . . . . . . . . . . . A . 18 VAL H . . . . . . . . . c30226_5ug5 1 . 14 . 3956 . 1 1 18 VAL HA H -3.923 -4.938 -4.128 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HA . . . . . . . . . c30226_5ug5 1 . 14 . 3957 . 1 1 18 VAL HB H -2.850 -2.885 -2.345 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HB . . . . . . . . . c30226_5ug5 1 . 14 . 3958 . 1 1 18 VAL HG11 H -0.909 -4.584 -3.895 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG11 . . . . . . . . . c30226_5ug5 1 . 14 . 3959 . 1 1 18 VAL HG12 H -1.023 -4.478 -2.140 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG12 . . . . . . . . . c30226_5ug5 1 . 14 . 3960 . 1 1 18 VAL HG13 H -0.540 -3.066 -3.079 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG13 . . . . . . . . . c30226_5ug5 1 . 14 . 3961 . 1 1 18 VAL HG21 H -3.877 -2.461 -4.526 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG21 . . . . . . . . . c30226_5ug5 1 . 14 . 3962 . 1 1 18 VAL HG22 H -2.559 -3.337 -5.301 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG22 . . . . . . . . . c30226_5ug5 1 . 14 . 3963 . 1 1 18 VAL HG23 H -2.231 -1.841 -4.424 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG23 . . . . . . . . . c30226_5ug5 1 . 14 . 3964 . 1 1 18 VAL N N -4.748 -4.413 -2.322 . . . 1.0 . . . . . . . . . . . . A . 18 VAL N . . . . . . . . . c30226_5ug5 1 . 14 . 3965 . 1 1 18 VAL O O -2.304 -6.760 -3.345 . . . 1.0 . . . . . . . . . . . . A . 18 VAL O . . . . . . . . . c30226_5ug5 1 . 14 . 3966 . 1 1 19 CYS C C -3.162 -8.485 -0.729 . . . 1.0 . . . . . . . . . . . . A . 19 CYS C . . . . . . . . . c30226_5ug5 1 . 14 . 3967 . 1 1 19 CYS CA C -2.298 -7.236 -0.617 . . . 1.0 . . . . . . . . . . . . A . 19 CYS CA . . . . . . . . . c30226_5ug5 1 . 14 . 3968 . 1 1 19 CYS CB C -2.032 -6.901 0.854 . . . 1.0 . . . . . . . . . . . . A . 19 CYS CB . . . . . . . . . c30226_5ug5 1 . 14 . 3969 . 1 1 19 CYS H H -3.450 -5.472 -0.773 . . . 1.0 . . . . . . . . . . . . A . 19 CYS H . . . . . . . . . c30226_5ug5 1 . 14 . 3970 . 1 1 19 CYS HA H -1.357 -7.419 -1.110 . . . 1.0 . . . . . . . . . . . . A . 19 CYS HA . . . . . . . . . c30226_5ug5 1 . 14 . 3971 . 1 1 19 CYS HB2 H -1.447 -5.994 0.910 . . . 1.0 . . . . . . . . . . . . A . 19 CYS HB2 . . . . . . . . . c30226_5ug5 1 . 14 . 3972 . 1 1 19 CYS HB3 H -2.975 -6.746 1.357 . . . 1.0 . . . . . . . . . . . . A . 19 CYS HB3 . . . . . . . . . c30226_5ug5 1 . 14 . 3973 . 1 1 19 CYS N N -2.942 -6.121 -1.291 . . . 1.0 . . . . . . . . . . . . A . 19 CYS N . . . . . . . . . c30226_5ug5 1 . 14 . 3974 . 1 1 19 CYS O O -4.051 -8.681 0.126 . . . 1.0 . . . . . . . . . . . . A . 19 CYS O . . . . . . . . . c30226_5ug5 1 . 14 . 3975 . 1 1 19 CYS OXT O -2.959 -9.263 -1.683 . . . 1.0 . . . . . . . . . . . . A . 19 CYS OXT . . . . . . . . . c30226_5ug5 1 . 14 . 3976 . 1 1 19 CYS SG S -1.125 -8.201 1.763 . . . 1.0 . . . . . . . . . . . . A . 19 CYS SG . . . . . . . . . c30226_5ug5 1 . 15 . 3977 . 1 1 1 ILE C C 6.842 2.248 -4.169 . . . 1.0 . . . . . . . . . . . . A . 1 ILE C . . . . . . . . . c30226_5ug5 1 . 15 . 3978 . 1 1 1 ILE CA C 6.081 3.231 -5.042 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CA . . . . . . . . . c30226_5ug5 1 . 15 . 3979 . 1 1 1 ILE CB C 5.396 2.467 -6.195 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CB . . . . . . . . . c30226_5ug5 1 . 15 . 3980 . 1 1 1 ILE CD1 C 3.694 4.344 -6.525 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CD1 . . . . . . . . . c30226_5ug5 1 . 15 . 3981 . 1 1 1 ILE CG1 C 4.733 3.448 -7.169 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CG1 . . . . . . . . . c30226_5ug5 1 . 15 . 3982 . 1 1 1 ILE CG2 C 4.370 1.482 -5.656 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CG2 . . . . . . . . . c30226_5ug5 1 . 15 . 3983 . 1 1 1 ILE H1 H 7.755 3.824 -6.115 . . . 1.0 . . . . . . . . . . . . A . 1 ILE H1 . . . . . . . . . c30226_5ug5 1 . 15 . 3984 . 1 1 1 ILE H2 H 7.448 4.771 -4.755 . . . 1.0 . . . . . . . . . . . . A . 1 ILE H2 . . . . . . . . . c30226_5ug5 1 . 15 . 3985 . 1 1 1 ILE H3 H 6.497 4.951 -6.139 . . . 1.0 . . . . . . . . . . . . A . 1 ILE H3 . . . . . . . . . c30226_5ug5 1 . 15 . 3986 . 1 1 1 ILE HA H 5.320 3.713 -4.446 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HA . . . . . . . . . c30226_5ug5 1 . 15 . 3987 . 1 1 1 ILE HB H 6.151 1.907 -6.717 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HB . . . . . . . . . c30226_5ug5 1 . 15 . 3988 . 1 1 1 ILE HD11 H 2.897 3.737 -6.119 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HD11 . . . . . . . . . c30226_5ug5 1 . 15 . 3989 . 1 1 1 ILE HD12 H 3.293 5.018 -7.266 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HD12 . . . . . . . . . c30226_5ug5 1 . 15 . 3990 . 1 1 1 ILE HD13 H 4.152 4.914 -5.731 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HD13 . . . . . . . . . c30226_5ug5 1 . 15 . 3991 . 1 1 1 ILE HG12 H 5.493 4.082 -7.601 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG12 . . . . . . . . . c30226_5ug5 1 . 15 . 3992 . 1 1 1 ILE HG13 H 4.249 2.889 -7.955 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG13 . . . . . . . . . c30226_5ug5 1 . 15 . 3993 . 1 1 1 ILE HG21 H 3.592 2.022 -5.138 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG21 . . . . . . . . . c30226_5ug5 1 . 15 . 3994 . 1 1 1 ILE HG22 H 4.852 0.800 -4.974 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG22 . . . . . . . . . c30226_5ug5 1 . 15 . 3995 . 1 1 1 ILE HG23 H 3.940 0.928 -6.477 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG23 . . . . . . . . . c30226_5ug5 1 . 15 . 3996 . 1 1 1 ILE N N 7.006 4.266 -5.549 . . . 1.0 . . . . . . . . . . . . A . 1 ILE N . . . . . . . . . c30226_5ug5 1 . 15 . 3997 . 1 1 1 ILE O O 7.934 1.802 -4.524 . . . 1.0 . . . . . . . . . . . . A . 1 ILE O . . . . . . . . . c30226_5ug5 1 . 15 . 3998 . 1 1 2 ARG C C 6.848 -0.386 -2.425 . . . 1.0 . . . . . . . . . . . . A . 2 ARG C . . . . . . . . . c30226_5ug5 1 . 15 . 3999 . 1 1 2 ARG CA C 6.914 1.083 -2.042 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CA . . . . . . . . . c30226_5ug5 1 . 15 . 4000 . 1 1 2 ARG CB C 6.250 1.279 -0.676 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CB . . . . . . . . . c30226_5ug5 1 . 15 . 4001 . 1 1 2 ARG CD C 7.661 3.168 0.217 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CD . . . . . . . . . c30226_5ug5 1 . 15 . 4002 . 1 1 2 ARG CG C 6.266 2.717 -0.184 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CG . . . . . . . . . c30226_5ug5 1 . 15 . 4003 . 1 1 2 ARG CZ C 7.958 2.535 2.587 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CZ . . . . . . . . . c30226_5ug5 1 . 15 . 4004 . 1 1 2 ARG H H 5.343 2.220 -2.869 . . . 1.0 . . . . . . . . . . . . A . 2 ARG H . . . . . . . . . c30226_5ug5 1 . 15 . 4005 . 1 1 2 ARG HA H 7.945 1.387 -1.981 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HA . . . . . . . . . c30226_5ug5 1 . 15 . 4006 . 1 1 2 ARG HB2 H 5.221 0.952 -0.739 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB2 . . . . . . . . . c30226_5ug5 1 . 15 . 4007 . 1 1 2 ARG HB3 H 6.764 0.667 0.049 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB3 . . . . . . . . . c30226_5ug5 1 . 15 . 4008 . 1 1 2 ARG HD2 H 8.310 3.100 -0.643 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD2 . . . . . . . . . c30226_5ug5 1 . 15 . 4009 . 1 1 2 ARG HD3 H 7.613 4.195 0.550 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD3 . . . . . . . . . c30226_5ug5 1 . 15 . 4010 . 1 1 2 ARG HE H 8.825 1.619 1.033 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HE . . . . . . . . . c30226_5ug5 1 . 15 . 4011 . 1 1 2 ARG HG2 H 5.909 3.359 -0.973 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG2 . . . . . . . . . c30226_5ug5 1 . 15 . 4012 . 1 1 2 ARG HG3 H 5.612 2.799 0.672 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG3 . . . . . . . . . c30226_5ug5 1 . 15 . 4013 . 1 1 2 ARG HH11 H 6.676 4.083 2.295 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH11 . . . . . . . . . c30226_5ug5 1 . 15 . 4014 . 1 1 2 ARG HH12 H 6.929 3.631 3.951 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH12 . . . . . . . . . c30226_5ug5 1 . 15 . 4015 . 1 1 2 ARG HH21 H 9.169 1.022 3.207 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH21 . . . . . . . . . c30226_5ug5 1 . 15 . 4016 . 1 1 2 ARG HH22 H 8.352 1.897 4.472 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH22 . . . . . . . . . c30226_5ug5 1 . 15 . 4017 . 1 1 2 ARG N N 6.257 1.912 -3.036 . . . 1.0 . . . . . . . . . . . . A . 2 ARG N . . . . . . . . . c30226_5ug5 1 . 15 . 4018 . 1 1 2 ARG NE N 8.214 2.346 1.293 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NE . . . . . . . . . c30226_5ug5 1 . 15 . 4019 . 1 1 2 ARG NH1 N 7.121 3.493 2.975 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH1 . . . . . . . . . c30226_5ug5 1 . 15 . 4020 . 1 1 2 ARG NH2 N 8.535 1.757 3.496 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH2 . . . . . . . . . c30226_5ug5 1 . 15 . 4021 . 1 1 2 ARG O O 5.926 -0.820 -3.110 . . . 1.0 . . . . . . . . . . . . A . 2 ARG O . . . . . . . . . c30226_5ug5 1 . 15 . 4022 . 1 1 3 ASP C C 7.343 -3.198 -0.824 . . . 1.0 . . . . . . . . . . . . A . 3 ASP C . . . . . . . . . c30226_5ug5 1 . 15 . 4023 . 1 1 3 ASP CA C 7.823 -2.593 -2.127 . . . 1.0 . . . . . . . . . . . . A . 3 ASP CA . . . . . . . . . c30226_5ug5 1 . 15 . 4024 . 1 1 3 ASP CB C 9.214 -3.117 -2.508 . . . 1.0 . . . . . . . . . . . . A . 3 ASP CB . . . . . . . . . c30226_5ug5 1 . 15 . 4025 . 1 1 3 ASP CG C 9.212 -4.597 -2.850 . . . 1.0 . . . . . . . . . . . . A . 3 ASP CG . . . . . . . . . c30226_5ug5 1 . 15 . 4026 . 1 1 3 ASP H H 8.592 -0.713 -1.519 . . . 1.0 . . . . . . . . . . . . A . 3 ASP H . . . . . . . . . c30226_5ug5 1 . 15 . 4027 . 1 1 3 ASP HA H 7.116 -2.828 -2.892 . . . 1.0 . . . . . . . . . . . . A . 3 ASP HA . . . . . . . . . c30226_5ug5 1 . 15 . 4028 . 1 1 3 ASP HB2 H 9.573 -2.571 -3.368 . . . 1.0 . . . . . . . . . . . . A . 3 ASP HB2 . . . . . . . . . c30226_5ug5 1 . 15 . 4029 . 1 1 3 ASP HB3 H 9.889 -2.959 -1.681 . . . 1.0 . . . . . . . . . . . . A . 3 ASP HB3 . . . . . . . . . c30226_5ug5 1 . 15 . 4030 . 1 1 3 ASP N N 7.836 -1.141 -1.975 . . . 1.0 . . . . . . . . . . . . A . 3 ASP N . . . . . . . . . c30226_5ug5 1 . 15 . 4031 . 1 1 3 ASP O O 7.274 -4.410 -0.627 . . . 1.0 . . . . . . . . . . . . A . 3 ASP O . . . . . . . . . c30226_5ug5 1 . 15 . 4032 . 1 1 3 ASP OD1 O 8.806 -4.956 -3.975 . . . 1.0 . . . . . . . . . . . . A . 3 ASP OD1 . . . . . . . . . c30226_5ug5 1 . 15 . 4033 . 1 1 3 ASP OD2 O 9.613 -5.410 -1.995 . . . 1.0 . . . . . . . . . . . . A . 3 ASP OD2 . . . . . . . . . c30226_5ug5 1 . 15 . 4034 . 1 1 4 GLU C C 5.025 -2.154 1.446 . . . 1.0 . . . . . . . . . . . . A . 4 GLU C . . . . . . . . . c30226_5ug5 1 . 15 . 4035 . 1 1 4 GLU CA C 6.473 -2.591 1.362 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CA . . . . . . . . . c30226_5ug5 1 . 15 . 4036 . 1 1 4 GLU CB C 7.278 -1.842 2.400 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CB . . . . . . . . . c30226_5ug5 1 . 15 . 4037 . 1 1 4 GLU CD C 9.556 -1.340 3.331 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CD . . . . . . . . . c30226_5ug5 1 . 15 . 4038 . 1 1 4 GLU CG C 8.718 -2.303 2.524 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CG . . . . . . . . . c30226_5ug5 1 . 15 . 4039 . 1 1 4 GLU H H 7.063 -1.362 -0.227 . . . 1.0 . . . . . . . . . . . . A . 4 GLU H . . . . . . . . . c30226_5ug5 1 . 15 . 4040 . 1 1 4 GLU HA H 6.547 -3.653 1.534 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HA . . . . . . . . . c30226_5ug5 1 . 15 . 4041 . 1 1 4 GLU HB2 H 7.281 -0.793 2.145 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HB2 . . . . . . . . . c30226_5ug5 1 . 15 . 4042 . 1 1 4 GLU HB3 H 6.792 -1.967 3.343 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HB3 . . . . . . . . . c30226_5ug5 1 . 15 . 4043 . 1 1 4 GLU HG2 H 8.735 -3.267 3.010 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HG2 . . . . . . . . . c30226_5ug5 1 . 15 . 4044 . 1 1 4 GLU HG3 H 9.144 -2.390 1.536 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HG3 . . . . . . . . . c30226_5ug5 1 . 15 . 4045 . 1 1 4 GLU N N 6.987 -2.292 0.045 . . . 1.0 . . . . . . . . . . . . A . 4 GLU N . . . . . . . . . c30226_5ug5 1 . 15 . 4046 . 1 1 4 GLU O O 4.509 -1.847 2.514 . . . 1.0 . . . . . . . . . . . . A . 4 GLU O . . . . . . . . . c30226_5ug5 1 . 15 . 4047 . 1 1 4 GLU OE1 O 9.714 -1.556 4.548 . . . 1.0 . . . . . . . . . . . . A . 4 GLU OE1 . . . . . . . . . c30226_5ug5 1 . 15 . 4048 . 1 1 4 GLU OE2 O 10.052 -0.350 2.751 . . . 1.0 . . . . . . . . . . . . A . 4 GLU OE2 . . . . . . . . . c30226_5ug5 1 . 15 . 4049 . 1 1 5 CYS C C 2.024 -2.241 1.009 . . . 1.0 . . . . . . . . . . . . A . 5 CYS C . . . . . . . . . c30226_5ug5 1 . 15 . 4050 . 1 1 5 CYS CA C 3.072 -1.565 0.131 . . . 1.0 . . . . . . . . . . . . A . 5 CYS CA . . . . . . . . . c30226_5ug5 1 . 15 . 4051 . 1 1 5 CYS CB C 2.690 -1.675 -1.332 . . . 1.0 . . . . . . . . . . . . A . 5 CYS CB . . . . . . . . . c30226_5ug5 1 . 15 . 4052 . 1 1 5 CYS H H 4.823 -2.506 -0.482 . . . 1.0 . . . . . . . . . . . . A . 5 CYS H . . . . . . . . . c30226_5ug5 1 . 15 . 4053 . 1 1 5 CYS HA H 3.121 -0.520 0.394 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HA . . . . . . . . . c30226_5ug5 1 . 15 . 4054 . 1 1 5 CYS HB2 H 3.272 -2.466 -1.786 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HB2 . . . . . . . . . c30226_5ug5 1 . 15 . 4055 . 1 1 5 CYS HB3 H 1.658 -1.920 -1.403 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HB3 . . . . . . . . . c30226_5ug5 1 . 15 . 4056 . 1 1 5 CYS N N 4.391 -2.121 0.297 . . . 1.0 . . . . . . . . . . . . A . 5 CYS N . . . . . . . . . c30226_5ug5 1 . 15 . 4057 . 1 1 5 CYS O O 1.059 -1.602 1.423 . . . 1.0 . . . . . . . . . . . . A . 5 CYS O . . . . . . . . . c30226_5ug5 1 . 15 . 4058 . 1 1 5 CYS SG S 2.990 -0.155 -2.288 . . . 1.0 . . . . . . . . . . . . A . 5 CYS SG . . . . . . . . . c30226_5ug5 1 . 15 . 4059 . 1 1 6 CYS C C 1.410 -3.879 3.594 . . . 1.0 . . . . . . . . . . . . A . 6 CYS C . . . . . . . . . c30226_5ug5 1 . 15 . 4060 . 1 1 6 CYS CA C 1.253 -4.245 2.120 . . . 1.0 . . . . . . . . . . . . A . 6 CYS CA . . . . . . . . . c30226_5ug5 1 . 15 . 4061 . 1 1 6 CYS CB C 1.402 -5.756 1.922 . . . 1.0 . . . . . . . . . . . . A . 6 CYS CB . . . . . . . . . c30226_5ug5 1 . 15 . 4062 . 1 1 6 CYS H H 3.027 -3.971 0.989 . . . 1.0 . . . . . . . . . . . . A . 6 CYS H . . . . . . . . . c30226_5ug5 1 . 15 . 4063 . 1 1 6 CYS HA H 0.267 -3.945 1.796 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HA . . . . . . . . . c30226_5ug5 1 . 15 . 4064 . 1 1 6 CYS HB2 H 1.666 -5.955 0.896 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HB2 . . . . . . . . . c30226_5ug5 1 . 15 . 4065 . 1 1 6 CYS HB3 H 2.181 -6.124 2.572 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HB3 . . . . . . . . . c30226_5ug5 1 . 15 . 4066 . 1 1 6 CYS N N 2.219 -3.515 1.312 . . . 1.0 . . . . . . . . . . . . A . 6 CYS N . . . . . . . . . c30226_5ug5 1 . 15 . 4067 . 1 1 6 CYS O O 0.462 -3.958 4.376 . . . 1.0 . . . . . . . . . . . . A . 6 CYS O . . . . . . . . . c30226_5ug5 1 . 15 . 4068 . 1 1 6 CYS SG S -0.122 -6.677 2.298 . . . 1.0 . . . . . . . . . . . . A . 6 CYS SG . . . . . . . . . c30226_5ug5 1 . 15 . 4069 . 1 1 7 SER C C 2.561 -1.494 5.397 . . . 1.0 . . . . . . . . . . . . A . 7 SER C . . . . . . . . . c30226_5ug5 1 . 15 . 4070 . 1 1 7 SER CA C 2.876 -2.967 5.298 . . . 1.0 . . . . . . . . . . . . A . 7 SER CA . . . . . . . . . c30226_5ug5 1 . 15 . 4071 . 1 1 7 SER CB C 4.343 -3.141 5.655 . . . 1.0 . . . . . . . . . . . . A . 7 SER CB . . . . . . . . . c30226_5ug5 1 . 15 . 4072 . 1 1 7 SER H H 3.348 -3.508 3.314 . . . 1.0 . . . . . . . . . . . . A . 7 SER H . . . . . . . . . c30226_5ug5 1 . 15 . 4073 . 1 1 7 SER HA H 2.272 -3.515 6.000 . . . 1.0 . . . . . . . . . . . . A . 7 SER HA . . . . . . . . . c30226_5ug5 1 . 15 . 4074 . 1 1 7 SER HB2 H 4.929 -3.100 4.749 . . . 1.0 . . . . . . . . . . . . A . 7 SER HB2 . . . . . . . . . c30226_5ug5 1 . 15 . 4075 . 1 1 7 SER HB3 H 4.637 -2.326 6.309 . . . 1.0 . . . . . . . . . . . . A . 7 SER HB3 . . . . . . . . . c30226_5ug5 1 . 15 . 4076 . 1 1 7 SER HG H 4.367 -4.303 7.231 . . . 1.0 . . . . . . . . . . . . A . 7 SER HG . . . . . . . . . c30226_5ug5 1 . 15 . 4077 . 1 1 7 SER N N 2.610 -3.466 3.962 . . . 1.0 . . . . . . . . . . . . A . 7 SER N . . . . . . . . . c30226_5ug5 1 . 15 . 4078 . 1 1 7 SER O O 2.163 -0.998 6.449 . . . 1.0 . . . . . . . . . . . . A . 7 SER O . . . . . . . . . c30226_5ug5 1 . 15 . 4079 . 1 1 7 SER OG O 4.582 -4.383 6.293 . . . 1.0 . . . . . . . . . . . . A . 7 SER OG . . . . . . . . . c30226_5ug5 1 . 15 . 4080 . 1 1 8 ASN C C 1.396 1.245 4.180 . . . 1.0 . . . . . . . . . . . . A . 8 ASN C . . . . . . . . . c30226_5ug5 1 . 15 . 4081 . 1 1 8 ASN CA C 2.788 0.640 4.310 . . . 1.0 . . . . . . . . . . . . A . 8 ASN CA . . . . . . . . . c30226_5ug5 1 . 15 . 4082 . 1 1 8 ASN CB C 3.674 1.143 3.172 . . . 1.0 . . . . . . . . . . . . A . 8 ASN CB . . . . . . . . . c30226_5ug5 1 . 15 . 4083 . 1 1 8 ASN CG C 3.718 2.656 3.086 . . . 1.0 . . . . . . . . . . . . A . 8 ASN CG . . . . . . . . . c30226_5ug5 1 . 15 . 4084 . 1 1 8 ASN H H 2.828 -1.273 3.434 . . . 1.0 . . . . . . . . . . . . A . 8 ASN H . . . . . . . . . c30226_5ug5 1 . 15 . 4085 . 1 1 8 ASN HA H 3.229 0.924 5.255 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HA . . . . . . . . . c30226_5ug5 1 . 15 . 4086 . 1 1 8 ASN HB2 H 4.683 0.780 3.318 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HB2 . . . . . . . . . c30226_5ug5 1 . 15 . 4087 . 1 1 8 ASN HB3 H 3.291 0.760 2.238 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HB3 . . . . . . . . . c30226_5ug5 1 . 15 . 4088 . 1 1 8 ASN HD21 H 3.909 2.560 1.116 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HD21 . . . . . . . . . c30226_5ug5 1 . 15 . 4089 . 1 1 8 ASN HD22 H 3.894 4.151 1.788 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HD22 . . . . . . . . . c30226_5ug5 1 . 15 . 4090 . 1 1 8 ASN N N 2.740 -0.802 4.290 . . . 1.0 . . . . . . . . . . . . A . 8 ASN N . . . . . . . . . c30226_5ug5 1 . 15 . 4091 . 1 1 8 ASN ND2 N 3.850 3.171 1.877 . . . 1.0 . . . . . . . . . . . . A . 8 ASN ND2 . . . . . . . . . c30226_5ug5 1 . 15 . 4092 . 1 1 8 ASN O O 0.783 1.180 3.108 . . . 1.0 . . . . . . . . . . . . A . 8 ASN O . . . . . . . . . c30226_5ug5 1 . 15 . 4093 . 1 1 8 ASN OD1 O 3.620 3.355 4.091 . . . 1.0 . . . . . . . . . . . . A . 8 ASN OD1 . . . . . . . . . c30226_5ug5 1 . 15 . 4094 . 1 1 9 PRO C C -0.570 3.558 4.190 . . . 1.0 . . . . . . . . . . . . A . 9 PRO C . . . . . . . . . c30226_5ug5 1 . 15 . 4095 . 1 1 9 PRO CA C -0.425 2.507 5.283 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CA . . . . . . . . . c30226_5ug5 1 . 15 . 4096 . 1 1 9 PRO CB C -0.446 3.169 6.660 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CB . . . . . . . . . c30226_5ug5 1 . 15 . 4097 . 1 1 9 PRO CD C 1.559 1.978 6.568 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CD . . . . . . . . . c30226_5ug5 1 . 15 . 4098 . 1 1 9 PRO CG C 0.438 2.337 7.483 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CG . . . . . . . . . c30226_5ug5 1 . 15 . 4099 . 1 1 9 PRO HA H -1.227 1.788 5.209 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HA . . . . . . . . . c30226_5ug5 1 . 15 . 4100 . 1 1 9 PRO HB2 H -0.043 4.156 6.581 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HB2 . . . . . . . . . c30226_5ug5 1 . 15 . 4101 . 1 1 9 PRO HB3 H -1.451 3.198 7.049 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HB3 . . . . . . . . . c30226_5ug5 1 . 15 . 4102 . 1 1 9 PRO HD2 H 2.306 2.754 6.556 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HD2 . . . . . . . . . c30226_5ug5 1 . 15 . 4103 . 1 1 9 PRO HD3 H 1.985 1.051 6.861 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HD3 . . . . . . . . . c30226_5ug5 1 . 15 . 4104 . 1 1 9 PRO HG2 H 0.803 2.912 8.318 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HG2 . . . . . . . . . c30226_5ug5 1 . 15 . 4105 . 1 1 9 PRO HG3 H -0.079 1.452 7.818 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HG3 . . . . . . . . . c30226_5ug5 1 . 15 . 4106 . 1 1 9 PRO N N 0.890 1.861 5.260 . . . 1.0 . . . . . . . . . . . . A . 9 PRO N . . . . . . . . . c30226_5ug5 1 . 15 . 4107 . 1 1 9 PRO O O -1.666 3.799 3.688 . . . 1.0 . . . . . . . . . . . . A . 9 PRO O . . . . . . . . . c30226_5ug5 1 . 15 . 4108 . 1 1 10 ALA C C 0.284 4.657 1.412 . . . 1.0 . . . . . . . . . . . . A . 10 ALA C . . . . . . . . . c30226_5ug5 1 . 15 . 4109 . 1 1 10 ALA CA C 0.553 5.218 2.809 . . . 1.0 . . . . . . . . . . . . A . 10 ALA CA . . . . . . . . . c30226_5ug5 1 . 15 . 4110 . 1 1 10 ALA CB C 1.876 5.967 2.825 . . . 1.0 . . . . . . . . . . . . A . 10 ALA CB . . . . . . . . . c30226_5ug5 1 . 15 . 4111 . 1 1 10 ALA H H 1.389 3.937 4.275 . . . 1.0 . . . . . . . . . . . . A . 10 ALA H . . . . . . . . . c30226_5ug5 1 . 15 . 4112 . 1 1 10 ALA HA H -0.229 5.922 3.053 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HA . . . . . . . . . c30226_5ug5 1 . 15 . 4113 . 1 1 10 ALA HB1 H 2.035 6.394 3.804 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HB1 . . . . . . . . . c30226_5ug5 1 . 15 . 4114 . 1 1 10 ALA HB2 H 1.853 6.755 2.088 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HB2 . . . . . . . . . c30226_5ug5 1 . 15 . 4115 . 1 1 10 ALA HB3 H 2.679 5.283 2.597 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HB3 . . . . . . . . . c30226_5ug5 1 . 15 . 4116 . 1 1 10 ALA N N 0.546 4.177 3.828 . . . 1.0 . . . . . . . . . . . . A . 10 ALA N . . . . . . . . . c30226_5ug5 1 . 15 . 4117 . 1 1 10 ALA O O -0.237 5.364 0.553 . . . 1.0 . . . . . . . . . . . . A . 10 ALA O . . . . . . . . . c30226_5ug5 1 . 15 . 4118 . 1 1 11 CYS C C -0.918 2.257 -0.161 . . . 1.0 . . . . . . . . . . . . A . 11 CYS C . . . . . . . . . c30226_5ug5 1 . 15 . 4119 . 1 1 11 CYS CA C 0.455 2.819 -0.142 . . . 1.0 . . . . . . . . . . . . A . 11 CYS CA . . . . . . . . . c30226_5ug5 1 . 15 . 4120 . 1 1 11 CYS CB C 1.484 1.720 -0.415 . . . 1.0 . . . . . . . . . . . . A . 11 CYS CB . . . . . . . . . c30226_5ug5 1 . 15 . 4121 . 1 1 11 CYS H H 0.772 2.778 1.939 . . . 1.0 . . . . . . . . . . . . A . 11 CYS H . . . . . . . . . c30226_5ug5 1 . 15 . 4122 . 1 1 11 CYS HA H 0.541 3.610 -0.875 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HA . . . . . . . . . c30226_5ug5 1 . 15 . 4123 . 1 1 11 CYS HB2 H 2.477 2.143 -0.373 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HB2 . . . . . . . . . c30226_5ug5 1 . 15 . 4124 . 1 1 11 CYS HB3 H 1.389 0.954 0.347 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HB3 . . . . . . . . . c30226_5ug5 1 . 15 . 4125 . 1 1 11 CYS N N 0.609 3.386 1.184 . . . 1.0 . . . . . . . . . . . . A . 11 CYS N . . . . . . . . . c30226_5ug5 1 . 15 . 4126 . 1 1 11 CYS O O -1.725 2.477 -1.065 . . . 1.0 . . . . . . . . . . . . A . 11 CYS O . . . . . . . . . c30226_5ug5 1 . 15 . 4127 . 1 1 11 CYS SG S 1.286 0.920 -2.043 . . . 1.0 . . . . . . . . . . . . A . 11 CYS SG . . . . . . . . . c30226_5ug5 1 . 15 . 4128 . 1 1 12 ARG C C -3.546 2.038 1.192 . . . 1.0 . . . . . . . . . . . . A . 12 ARG C . . . . . . . . . c30226_5ug5 1 . 15 . 4129 . 1 1 12 ARG CA C -2.421 1.008 1.271 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CA . . . . . . . . . c30226_5ug5 1 . 15 . 4130 . 1 1 12 ARG CB C -2.297 0.464 2.669 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CB . . . . . . . . . c30226_5ug5 1 . 15 . 4131 . 1 1 12 ARG CD C -1.107 -1.341 3.925 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CD . . . . . . . . . c30226_5ug5 1 . 15 . 4132 . 1 1 12 ARG CG C -1.948 -1.008 2.710 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CG . . . . . . . . . c30226_5ug5 1 . 15 . 4133 . 1 1 12 ARG CZ C -1.453 -1.392 6.365 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CZ . . . . . . . . . c30226_5ug5 1 . 15 . 4134 . 1 1 12 ARG H H -0.397 1.359 1.530 . . . 1.0 . . . . . . . . . . . . A . 12 ARG H . . . . . . . . . c30226_5ug5 1 . 15 . 4135 . 1 1 12 ARG HA H -2.614 0.207 0.603 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HA . . . . . . . . . c30226_5ug5 1 . 15 . 4136 . 1 1 12 ARG HB2 H -1.515 1.009 3.180 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HB2 . . . . . . . . . c30226_5ug5 1 . 15 . 4137 . 1 1 12 ARG HB3 H -3.216 0.622 3.180 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HB3 . . . . . . . . . c30226_5ug5 1 . 15 . 4138 . 1 1 12 ARG HD2 H -0.982 -2.412 3.978 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HD2 . . . . . . . . . c30226_5ug5 1 . 15 . 4139 . 1 1 12 ARG HD3 H -0.136 -0.869 3.807 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HD3 . . . . . . . . . c30226_5ug5 1 . 15 . 4140 . 1 1 12 ARG HE H -2.340 -0.115 5.109 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HE . . . . . . . . . c30226_5ug5 1 . 15 . 4141 . 1 1 12 ARG HG2 H -2.857 -1.580 2.742 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HG2 . . . . . . . . . c30226_5ug5 1 . 15 . 4142 . 1 1 12 ARG HG3 H -1.392 -1.262 1.819 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HG3 . . . . . . . . . c30226_5ug5 1 . 15 . 4143 . 1 1 12 ARG HH11 H -0.257 -2.872 5.659 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH11 . . . . . . . . . c30226_5ug5 1 . 15 . 4144 . 1 1 12 ARG HH12 H -0.465 -2.837 7.382 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH12 . . . . . . . . . c30226_5ug5 1 . 15 . 4145 . 1 1 12 ARG HH21 H -2.618 -0.073 7.372 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH21 . . . . . . . . . c30226_5ug5 1 . 15 . 4146 . 1 1 12 ARG HH22 H -1.803 -1.250 8.357 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH22 . . . . . . . . . c30226_5ug5 1 . 15 . 4147 . 1 1 12 ARG N N -1.153 1.551 0.924 . . . 1.0 . . . . . . . . . . . . A . 12 ARG N . . . . . . . . . c30226_5ug5 1 . 15 . 4148 . 1 1 12 ARG NE N -1.715 -0.873 5.168 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NE . . . . . . . . . c30226_5ug5 1 . 15 . 4149 . 1 1 12 ARG NH1 N -0.662 -2.452 6.477 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NH1 . . . . . . . . . c30226_5ug5 1 . 15 . 4150 . 1 1 12 ARG NH2 N -2.003 -0.864 7.451 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NH2 . . . . . . . . . c30226_5ug5 1 . 15 . 4151 . 1 1 12 ARG O O -4.699 1.687 0.947 . . . 1.0 . . . . . . . . . . . . A . 12 ARG O . . . . . . . . . c30226_5ug5 1 . 15 . 4152 . 1 1 13 TYR C C -4.932 4.343 -0.002 . . . 1.0 . . . . . . . . . . . . A . 13 TYR C . . . . . . . . . c30226_5ug5 1 . 15 . 4153 . 1 1 13 TYR CA C -4.141 4.401 1.302 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CA . . . . . . . . . c30226_5ug5 1 . 15 . 4154 . 1 1 13 TYR CB C -3.381 5.717 1.405 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CB . . . . . . . . . c30226_5ug5 1 . 15 . 4155 . 1 1 13 TYR CD1 C -5.025 7.229 2.497 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CD1 . . . . . . . . . c30226_5ug5 1 . 15 . 4156 . 1 1 13 TYR CD2 C -4.303 7.765 0.305 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CD2 . . . . . . . . . c30226_5ug5 1 . 15 . 4157 . 1 1 13 TYR CE1 C -5.834 8.335 2.515 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CE1 . . . . . . . . . c30226_5ug5 1 . 15 . 4158 . 1 1 13 TYR CE2 C -5.113 8.883 0.306 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CE2 . . . . . . . . . c30226_5ug5 1 . 15 . 4159 . 1 1 13 TYR CG C -4.254 6.929 1.399 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CG . . . . . . . . . c30226_5ug5 1 . 15 . 4160 . 1 1 13 TYR CZ C -5.861 9.177 1.357 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CZ . . . . . . . . . c30226_5ug5 1 . 15 . 4161 . 1 1 13 TYR H H -2.277 3.510 1.648 . . . 1.0 . . . . . . . . . . . . A . 13 TYR H . . . . . . . . . c30226_5ug5 1 . 15 . 4162 . 1 1 13 TYR HA H -4.824 4.330 2.128 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HA . . . . . . . . . c30226_5ug5 1 . 15 . 4163 . 1 1 13 TYR HB2 H -2.805 5.728 2.316 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HB2 . . . . . . . . . c30226_5ug5 1 . 15 . 4164 . 1 1 13 TYR HB3 H -2.717 5.801 0.565 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HB3 . . . . . . . . . c30226_5ug5 1 . 15 . 4165 . 1 1 13 TYR HD1 H -4.983 6.575 3.352 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HD1 . . . . . . . . . c30226_5ug5 1 . 15 . 4166 . 1 1 13 TYR HD2 H -3.698 7.529 -0.555 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HD2 . . . . . . . . . c30226_5ug5 1 . 15 . 4167 . 1 1 13 TYR HE1 H -6.424 8.546 3.383 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HE1 . . . . . . . . . c30226_5ug5 1 . 15 . 4168 . 1 1 13 TYR HE2 H -5.142 9.527 -0.554 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HE2 . . . . . . . . . c30226_5ug5 1 . 15 . 4169 . 1 1 13 TYR HH H -7.155 10.342 0.592 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HH . . . . . . . . . c30226_5ug5 1 . 15 . 4170 . 1 1 13 TYR N N -3.200 3.304 1.401 . . . 1.0 . . . . . . . . . . . . A . 13 TYR N . . . . . . . . . c30226_5ug5 1 . 15 . 4171 . 1 1 13 TYR O O -6.137 4.588 -0.020 . . . 1.0 . . . . . . . . . . . . A . 13 TYR O . . . . . . . . . c30226_5ug5 1 . 15 . 4172 . 1 1 13 TYR OH O -6.684 10.280 1.432 . . . 1.0 . . . . . . . . . . . . A . 13 TYR OH . . . . . . . . . c30226_5ug5 1 . 15 . 4173 . 1 1 14 ASN C C -4.868 2.485 -2.854 . . . 1.0 . . . . . . . . . . . . A . 14 ASN C . . . . . . . . . c30226_5ug5 1 . 15 . 4174 . 1 1 14 ASN CA C -4.918 3.926 -2.381 . . . 1.0 . . . . . . . . . . . . A . 14 ASN CA . . . . . . . . . c30226_5ug5 1 . 15 . 4175 . 1 1 14 ASN CB C -4.287 4.891 -3.393 . . . 1.0 . . . . . . . . . . . . A . 14 ASN CB . . . . . . . . . c30226_5ug5 1 . 15 . 4176 . 1 1 14 ASN CG C -2.837 4.582 -3.706 . . . 1.0 . . . . . . . . . . . . A . 14 ASN CG . . . . . . . . . c30226_5ug5 1 . 15 . 4177 . 1 1 14 ASN H H -3.301 3.768 -1.024 . . . 1.0 . . . . . . . . . . . . A . 14 ASN H . . . . . . . . . c30226_5ug5 1 . 15 . 4178 . 1 1 14 ASN HA H -5.952 4.201 -2.235 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HA . . . . . . . . . c30226_5ug5 1 . 15 . 4179 . 1 1 14 ASN HB2 H -4.844 4.846 -4.312 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HB2 . . . . . . . . . c30226_5ug5 1 . 15 . 4180 . 1 1 14 ASN HB3 H -4.342 5.896 -2.998 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HB3 . . . . . . . . . c30226_5ug5 1 . 15 . 4181 . 1 1 14 ASN HD21 H -3.374 3.667 -5.382 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HD21 . . . . . . . . . c30226_5ug5 1 . 15 . 4182 . 1 1 14 ASN HD22 H -1.677 3.710 -5.056 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HD22 . . . . . . . . . c30226_5ug5 1 . 15 . 4183 . 1 1 14 ASN N N -4.257 4.018 -1.092 . . . 1.0 . . . . . . . . . . . . A . 14 ASN N . . . . . . . . . c30226_5ug5 1 . 15 . 4184 . 1 1 14 ASN ND2 N -2.606 3.919 -4.825 . . . 1.0 . . . . . . . . . . . . A . 14 ASN ND2 . . . . . . . . . c30226_5ug5 1 . 15 . 4185 . 1 1 14 ASN O O -5.143 2.170 -4.009 . . . 1.0 . . . . . . . . . . . . A . 14 ASN O . . . . . . . . . c30226_5ug5 1 . 15 . 4186 . 1 1 14 ASN OD1 O -1.933 4.970 -2.967 . . . 1.0 . . . . . . . . . . . . A . 14 ASN OD1 . . . . . . . . . c30226_5ug5 1 . 15 . 4187 . 1 1 15 ASN C C -4.872 -0.670 -1.079 . . . 1.0 . . . . . . . . . . . . A . 15 ASN C . . . . . . . . . c30226_5ug5 1 . 15 . 4188 . 1 1 15 ASN CA C -4.312 0.202 -2.196 . . . 1.0 . . . . . . . . . . . . A . 15 ASN CA . . . . . . . . . c30226_5ug5 1 . 15 . 4189 . 1 1 15 ASN CB C -2.825 -0.054 -2.318 . . . 1.0 . . . . . . . . . . . . A . 15 ASN CB . . . . . . . . . c30226_5ug5 1 . 15 . 4190 . 1 1 15 ASN CG C -2.284 0.158 -3.716 . . . 1.0 . . . . . . . . . . . . A . 15 ASN CG . . . . . . . . . c30226_5ug5 1 . 15 . 4191 . 1 1 15 ASN H H -4.392 1.937 -1.000 . . . 1.0 . . . . . . . . . . . . A . 15 ASN H . . . . . . . . . c30226_5ug5 1 . 15 . 4192 . 1 1 15 ASN HA H -4.802 -0.036 -3.121 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HA . . . . . . . . . c30226_5ug5 1 . 15 . 4193 . 1 1 15 ASN HB2 H -2.332 0.644 -1.655 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HB2 . . . . . . . . . c30226_5ug5 1 . 15 . 4194 . 1 1 15 ASN HB3 H -2.607 -1.063 -2.004 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HB3 . . . . . . . . . c30226_5ug5 1 . 15 . 4195 . 1 1 15 ASN HD21 H -1.591 1.944 -3.200 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HD21 . . . . . . . . . c30226_5ug5 1 . 15 . 4196 . 1 1 15 ASN HD22 H -1.300 1.464 -4.835 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HD22 . . . . . . . . . c30226_5ug5 1 . 15 . 4197 . 1 1 15 ASN N N -4.522 1.614 -1.919 . . . 1.0 . . . . . . . . . . . . A . 15 ASN N . . . . . . . . . c30226_5ug5 1 . 15 . 4198 . 1 1 15 ASN ND2 N -1.665 1.303 -3.941 . . . 1.0 . . . . . . . . . . . . A . 15 ASN ND2 . . . . . . . . . c30226_5ug5 1 . 15 . 4199 . 1 1 15 ASN O O -4.132 -1.374 -0.398 . . . 1.0 . . . . . . . . . . . . A . 15 ASN O . . . . . . . . . c30226_5ug5 1 . 15 . 4200 . 1 1 15 ASN OD1 O -2.389 -0.715 -4.575 . . . 1.0 . . . . . . . . . . . . A . 15 ASN OD1 . . . . . . . . . c30226_5ug5 1 . 15 . 4201 . 1 1 16 HYP C C -7.266 -2.735 -0.113 . . . 1.0 . . . . . . . . . . . . A . 16 HYP C . . . . . . . . . c30226_5ug5 1 . 15 . 4202 . 1 1 16 HYP CA C -6.846 -1.324 0.243 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CA . . . . . . . . . c30226_5ug5 1 . 15 . 4203 . 1 1 16 HYP CB C -8.037 -0.406 0.438 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CB . . . . . . . . . c30226_5ug5 1 . 15 . 4204 . 1 1 16 HYP CD C -7.156 0.133 -1.675 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CD . . . . . . . . . c30226_5ug5 1 . 15 . 4205 . 1 1 16 HYP CG C -7.990 0.708 -0.589 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CG . . . . . . . . . c30226_5ug5 1 . 15 . 4206 . 1 1 16 HYP HA H -6.237 -1.340 1.116 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HA . . . . . . . . . c30226_5ug5 1 . 15 . 4207 . 1 1 16 HYP HB2 H -8.000 0.027 1.424 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HB2 . . . . . . . . . c30226_5ug5 1 . 15 . 4208 . 1 1 16 HYP HB3 H -8.951 -0.974 0.322 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HB3 . . . . . . . . . c30226_5ug5 1 . 15 . 4209 . 1 1 16 HYP HD1 H -6.317 1.662 -0.249 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HD1 . . . . . . . . . c30226_5ug5 1 . 15 . 4210 . 1 1 16 HYP HD22 H -7.733 -0.506 -2.308 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HD22 . . . . . . . . . c30226_5ug5 1 . 15 . 4211 . 1 1 16 HYP HD23 H -6.667 0.909 -2.243 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HD23 . . . . . . . . . c30226_5ug5 1 . 15 . 4212 . 1 1 16 HYP HG H -8.977 0.986 -0.923 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HG . . . . . . . . . c30226_5ug5 1 . 15 . 4213 . 1 1 16 HYP N N -6.182 -0.631 -0.874 . . . 1.0 . . . . . . . . . . . . A . 16 HYP N . . . . . . . . . c30226_5ug5 1 . 15 . 4214 . 1 1 16 HYP O O -7.705 -3.513 0.733 . . . 1.0 . . . . . . . . . . . . A . 16 HYP O . . . . . . . . . c30226_5ug5 1 . 15 . 4215 . 1 1 16 HYP OD1 O -7.268 1.820 -0.077 . . . 1.0 . . . . . . . . . . . . A . 16 HYP OD1 . . . . . . . . . c30226_5ug5 1 . 15 . 4216 . 1 1 17 HIS C C -6.062 -5.078 -2.184 . . . 1.0 . . . . . . . . . . . . A . 17 HIS C . . . . . . . . . c30226_5ug5 1 . 15 . 4217 . 1 1 17 HIS CA C -7.384 -4.374 -1.892 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CA . . . . . . . . . c30226_5ug5 1 . 15 . 4218 . 1 1 17 HIS CB C -8.254 -4.286 -3.156 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CB . . . . . . . . . c30226_5ug5 1 . 15 . 4219 . 1 1 17 HIS CD2 C -8.268 -6.348 -4.735 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CD2 . . . . . . . . . c30226_5ug5 1 . 15 . 4220 . 1 1 17 HIS CE1 C -9.928 -7.443 -3.819 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CE1 . . . . . . . . . c30226_5ug5 1 . 15 . 4221 . 1 1 17 HIS CG C -8.711 -5.611 -3.688 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CG . . . . . . . . . c30226_5ug5 1 . 15 . 4222 . 1 1 17 HIS H H -6.809 -2.336 -1.981 . . . 1.0 . . . . . . . . . . . . A . 17 HIS H . . . . . . . . . c30226_5ug5 1 . 15 . 4223 . 1 1 17 HIS HA H -7.915 -4.927 -1.132 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HA . . . . . . . . . c30226_5ug5 1 . 15 . 4224 . 1 1 17 HIS HB2 H -9.134 -3.702 -2.936 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HB2 . . . . . . . . . c30226_5ug5 1 . 15 . 4225 . 1 1 17 HIS HB3 H -7.691 -3.793 -3.935 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HB3 . . . . . . . . . c30226_5ug5 1 . 15 . 4226 . 1 1 17 HIS HD1 H -10.278 -6.063 -2.349 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HD1 . . . . . . . . . c30226_5ug5 1 . 15 . 4227 . 1 1 17 HIS HD2 H -7.456 -6.093 -5.400 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HD2 . . . . . . . . . c30226_5ug5 1 . 15 . 4228 . 1 1 17 HIS HE1 H -10.673 -8.196 -3.614 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HE1 . . . . . . . . . c30226_5ug5 1 . 15 . 4229 . 1 1 17 HIS HE2 H -9.002 -8.161 -5.498 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HE2 . . . . . . . . . c30226_5ug5 1 . 15 . 4230 . 1 1 17 HIS N N -7.115 -3.041 -1.374 . . . 1.0 . . . . . . . . . . . . A . 17 HIS N . . . . . . . . . c30226_5ug5 1 . 15 . 4231 . 1 1 17 HIS ND1 N -9.752 -6.327 -3.137 . . . 1.0 . . . . . . . . . . . . A . 17 HIS ND1 . . . . . . . . . c30226_5ug5 1 . 15 . 4232 . 1 1 17 HIS NE2 N -9.041 -7.479 -4.793 . . . 1.0 . . . . . . . . . . . . A . 17 HIS NE2 . . . . . . . . . c30226_5ug5 1 . 15 . 4233 . 1 1 17 HIS O O -6.029 -6.254 -2.540 . . . 1.0 . . . . . . . . . . . . A . 17 HIS O . . . . . . . . . c30226_5ug5 1 . 15 . 4234 . 1 1 18 VAL C C -3.225 -5.881 -1.224 . . . 1.0 . . . . . . . . . . . . A . 18 VAL C . . . . . . . . . c30226_5ug5 1 . 15 . 4235 . 1 1 18 VAL CA C -3.639 -4.847 -2.271 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CA . . . . . . . . . c30226_5ug5 1 . 15 . 4236 . 1 1 18 VAL CB C -2.638 -3.676 -2.333 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CB . . . . . . . . . c30226_5ug5 1 . 15 . 4237 . 1 1 18 VAL CG1 C -1.887 -3.491 -1.028 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CG1 . . . . . . . . . c30226_5ug5 1 . 15 . 4238 . 1 1 18 VAL CG2 C -1.687 -3.849 -3.492 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CG2 . . . . . . . . . c30226_5ug5 1 . 15 . 4239 . 1 1 18 VAL H H -5.064 -3.411 -1.726 . . . 1.0 . . . . . . . . . . . . A . 18 VAL H . . . . . . . . . c30226_5ug5 1 . 15 . 4240 . 1 1 18 VAL HA H -3.650 -5.323 -3.227 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HA . . . . . . . . . c30226_5ug5 1 . 15 . 4241 . 1 1 18 VAL HB H -3.206 -2.777 -2.511 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HB . . . . . . . . . c30226_5ug5 1 . 15 . 4242 . 1 1 18 VAL HG11 H -1.298 -4.372 -0.830 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG11 . . . . . . . . . c30226_5ug5 1 . 15 . 4243 . 1 1 18 VAL HG12 H -2.595 -3.341 -0.228 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG12 . . . . . . . . . c30226_5ug5 1 . 15 . 4244 . 1 1 18 VAL HG13 H -1.239 -2.629 -1.105 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG13 . . . . . . . . . c30226_5ug5 1 . 15 . 4245 . 1 1 18 VAL HG21 H -0.998 -3.019 -3.515 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG21 . . . . . . . . . c30226_5ug5 1 . 15 . 4246 . 1 1 18 VAL HG22 H -2.253 -3.874 -4.409 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG22 . . . . . . . . . c30226_5ug5 1 . 15 . 4247 . 1 1 18 VAL HG23 H -1.142 -4.770 -3.377 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG23 . . . . . . . . . c30226_5ug5 1 . 15 . 4248 . 1 1 18 VAL N N -4.970 -4.339 -2.013 . . . 1.0 . . . . . . . . . . . . A . 18 VAL N . . . . . . . . . c30226_5ug5 1 . 15 . 4249 . 1 1 18 VAL O O -2.295 -6.662 -1.433 . . . 1.0 . . . . . . . . . . . . A . 18 VAL O . . . . . . . . . c30226_5ug5 1 . 15 . 4250 . 1 1 19 CYS C C -4.999 -7.576 1.291 . . . 1.0 . . . . . . . . . . . . A . 19 CYS C . . . . . . . . . c30226_5ug5 1 . 15 . 4251 . 1 1 19 CYS CA C -3.701 -6.863 0.946 . . . 1.0 . . . . . . . . . . . . A . 19 CYS CA . . . . . . . . . c30226_5ug5 1 . 15 . 4252 . 1 1 19 CYS CB C -3.128 -6.192 2.197 . . . 1.0 . . . . . . . . . . . . A . 19 CYS CB . . . . . . . . . c30226_5ug5 1 . 15 . 4253 . 1 1 19 CYS H H -4.648 -5.233 -0.002 . . . 1.0 . . . . . . . . . . . . A . 19 CYS H . . . . . . . . . c30226_5ug5 1 . 15 . 4254 . 1 1 19 CYS HA H -2.991 -7.589 0.578 . . . 1.0 . . . . . . . . . . . . A . 19 CYS HA . . . . . . . . . c30226_5ug5 1 . 15 . 4255 . 1 1 19 CYS HB2 H -3.846 -5.481 2.574 . . . 1.0 . . . . . . . . . . . . A . 19 CYS HB2 . . . . . . . . . c30226_5ug5 1 . 15 . 4256 . 1 1 19 CYS HB3 H -2.947 -6.947 2.948 . . . 1.0 . . . . . . . . . . . . A . 19 CYS HB3 . . . . . . . . . c30226_5ug5 1 . 15 . 4257 . 1 1 19 CYS N N -3.936 -5.891 -0.111 . . . 1.0 . . . . . . . . . . . . A . 19 CYS N . . . . . . . . . c30226_5ug5 1 . 15 . 4258 . 1 1 19 CYS O O -5.841 -6.975 1.992 . . . 1.0 . . . . . . . . . . . . A . 19 CYS O . . . . . . . . . c30226_5ug5 1 . 15 . 4259 . 1 1 19 CYS OXT O -5.176 -8.735 0.859 . . . 1.0 . . . . . . . . . . . . A . 19 CYS OXT . . . . . . . . . c30226_5ug5 1 . 15 . 4260 . 1 1 19 CYS SG S -1.568 -5.302 1.918 . . . 1.0 . . . . . . . . . . . . A . 19 CYS SG . . . . . . . . . c30226_5ug5 1 . 16 . 4261 . 1 1 1 ILE C C 4.671 1.592 -5.092 . . . 1.0 . . . . . . . . . . . . A . 1 ILE C . . . . . . . . . c30226_5ug5 1 . 16 . 4262 . 1 1 1 ILE CA C 3.469 2.129 -5.853 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CA . . . . . . . . . c30226_5ug5 1 . 16 . 4263 . 1 1 1 ILE CB C 3.253 1.285 -7.129 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CB . . . . . . . . . c30226_5ug5 1 . 16 . 4264 . 1 1 1 ILE CD1 C 4.344 0.565 -9.319 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CD1 . . . . . . . . . c30226_5ug5 1 . 16 . 4265 . 1 1 1 ILE CG1 C 4.434 1.447 -8.092 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CG1 . . . . . . . . . c30226_5ug5 1 . 16 . 4266 . 1 1 1 ILE CG2 C 1.947 1.679 -7.808 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CG2 . . . . . . . . . c30226_5ug5 1 . 16 . 4267 . 1 1 1 ILE H1 H 3.782 4.102 -5.286 . . . 1.0 . . . . . . . . . . . . A . 1 ILE H1 . . . . . . . . . c30226_5ug5 1 . 16 . 4268 . 1 1 1 ILE H2 H 2.845 3.932 -6.684 . . . 1.0 . . . . . . . . . . . . A . 1 ILE H2 . . . . . . . . . c30226_5ug5 1 . 16 . 4269 . 1 1 1 ILE H3 H 4.513 3.684 -6.749 . . . 1.0 . . . . . . . . . . . . A . 1 ILE H3 . . . . . . . . . c30226_5ug5 1 . 16 . 4270 . 1 1 1 ILE HA H 2.592 2.035 -5.227 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HA . . . . . . . . . c30226_5ug5 1 . 16 . 4271 . 1 1 1 ILE HB H 3.177 0.248 -6.838 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HB . . . . . . . . . c30226_5ug5 1 . 16 . 4272 . 1 1 1 ILE HD11 H 4.314 -0.471 -9.016 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HD11 . . . . . . . . . c30226_5ug5 1 . 16 . 4273 . 1 1 1 ILE HD12 H 5.209 0.732 -9.946 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HD12 . . . . . . . . . c30226_5ug5 1 . 16 . 4274 . 1 1 1 ILE HD13 H 3.447 0.804 -9.870 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HD13 . . . . . . . . . c30226_5ug5 1 . 16 . 4275 . 1 1 1 ILE HG12 H 4.479 2.473 -8.426 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG12 . . . . . . . . . c30226_5ug5 1 . 16 . 4276 . 1 1 1 ILE HG13 H 5.349 1.203 -7.573 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG13 . . . . . . . . . c30226_5ug5 1 . 16 . 4277 . 1 1 1 ILE HG21 H 1.125 1.519 -7.127 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG21 . . . . . . . . . c30226_5ug5 1 . 16 . 4278 . 1 1 1 ILE HG22 H 1.805 1.077 -8.692 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG22 . . . . . . . . . c30226_5ug5 1 . 16 . 4279 . 1 1 1 ILE HG23 H 1.988 2.722 -8.086 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG23 . . . . . . . . . c30226_5ug5 1 . 16 . 4280 . 1 1 1 ILE N N 3.663 3.560 -6.167 . . . 1.0 . . . . . . . . . . . . A . 1 ILE N . . . . . . . . . c30226_5ug5 1 . 16 . 4281 . 1 1 1 ILE O O 5.801 2.026 -5.317 . . . 1.0 . . . . . . . . . . . . A . 1 ILE O . . . . . . . . . c30226_5ug5 1 . 16 . 4282 . 1 1 2 ARG C C 5.346 -1.416 -3.295 . . . 1.0 . . . . . . . . . . . . A . 2 ARG C . . . . . . . . . c30226_5ug5 1 . 16 . 4283 . 1 1 2 ARG CA C 5.486 0.094 -3.365 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CA . . . . . . . . . c30226_5ug5 1 . 16 . 4284 . 1 1 2 ARG CB C 5.443 0.681 -1.948 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CB . . . . . . . . . c30226_5ug5 1 . 16 . 4285 . 1 1 2 ARG CD C 7.093 2.543 -2.344 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CD . . . . . . . . . c30226_5ug5 1 . 16 . 4286 . 1 1 2 ARG CG C 5.686 2.182 -1.888 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CG . . . . . . . . . c30226_5ug5 1 . 16 . 4287 . 1 1 2 ARG CZ C 9.386 2.320 -1.454 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CZ . . . . . . . . . c30226_5ug5 1 . 16 . 4288 . 1 1 2 ARG H H 3.515 0.324 -4.075 . . . 1.0 . . . . . . . . . . . . A . 2 ARG H . . . . . . . . . c30226_5ug5 1 . 16 . 4289 . 1 1 2 ARG HA H 6.427 0.340 -3.824 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HA . . . . . . . . . c30226_5ug5 1 . 16 . 4290 . 1 1 2 ARG HB2 H 4.472 0.479 -1.517 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB2 . . . . . . . . . c30226_5ug5 1 . 16 . 4291 . 1 1 2 ARG HB3 H 6.197 0.193 -1.348 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB3 . . . . . . . . . c30226_5ug5 1 . 16 . 4292 . 1 1 2 ARG HD2 H 7.224 2.209 -3.362 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD2 . . . . . . . . . c30226_5ug5 1 . 16 . 4293 . 1 1 2 ARG HD3 H 7.209 3.614 -2.299 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD3 . . . . . . . . . c30226_5ug5 1 . 16 . 4294 . 1 1 2 ARG HE H 7.837 1.162 -0.945 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HE . . . . . . . . . c30226_5ug5 1 . 16 . 4295 . 1 1 2 ARG HG2 H 4.973 2.678 -2.531 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG2 . . . . . . . . . c30226_5ug5 1 . 16 . 4296 . 1 1 2 ARG HG3 H 5.549 2.519 -0.871 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG3 . . . . . . . . . c30226_5ug5 1 . 16 . 4297 . 1 1 2 ARG HH11 H 9.147 3.823 -2.797 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH11 . . . . . . . . . c30226_5ug5 1 . 16 . 4298 . 1 1 2 ARG HH12 H 10.751 3.646 -2.159 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH12 . . . . . . . . . c30226_5ug5 1 . 16 . 4299 . 1 1 2 ARG HH21 H 9.944 0.912 -0.094 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH21 . . . . . . . . . c30226_5ug5 1 . 16 . 4300 . 1 1 2 ARG HH22 H 11.202 1.998 -0.609 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH22 . . . . . . . . . c30226_5ug5 1 . 16 . 4301 . 1 1 2 ARG N N 4.429 0.658 -4.186 . . . 1.0 . . . . . . . . . . . . A . 2 ARG N . . . . . . . . . c30226_5ug5 1 . 16 . 4302 . 1 1 2 ARG NE N 8.117 1.921 -1.505 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NE . . . . . . . . . c30226_5ug5 1 . 16 . 4303 . 1 1 2 ARG NH1 N 9.794 3.345 -2.196 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH1 . . . . . . . . . c30226_5ug5 1 . 16 . 4304 . 1 1 2 ARG NH2 N 10.247 1.693 -0.658 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH2 . . . . . . . . . c30226_5ug5 1 . 16 . 4305 . 1 1 2 ARG O O 4.251 -1.953 -3.448 . . . 1.0 . . . . . . . . . . . . A . 2 ARG O . . . . . . . . . c30226_5ug5 1 . 16 . 4306 . 1 1 3 ASP C C 6.343 -3.940 -1.477 . . . 1.0 . . . . . . . . . . . . A . 3 ASP C . . . . . . . . . c30226_5ug5 1 . 16 . 4307 . 1 1 3 ASP CA C 6.459 -3.551 -2.938 . . . 1.0 . . . . . . . . . . . . A . 3 ASP CA . . . . . . . . . c30226_5ug5 1 . 16 . 4308 . 1 1 3 ASP CB C 7.724 -4.138 -3.572 . . . 1.0 . . . . . . . . . . . . A . 3 ASP CB . . . . . . . . . c30226_5ug5 1 . 16 . 4309 . 1 1 3 ASP CG C 7.712 -5.651 -3.623 . . . 1.0 . . . . . . . . . . . . A . 3 ASP CG . . . . . . . . . c30226_5ug5 1 . 16 . 4310 . 1 1 3 ASP H H 7.302 -1.605 -2.944 . . . 1.0 . . . . . . . . . . . . A . 3 ASP H . . . . . . . . . c30226_5ug5 1 . 16 . 4311 . 1 1 3 ASP HA H 5.594 -3.910 -3.449 . . . 1.0 . . . . . . . . . . . . A . 3 ASP HA . . . . . . . . . c30226_5ug5 1 . 16 . 4312 . 1 1 3 ASP HB2 H 7.818 -3.765 -4.580 . . . 1.0 . . . . . . . . . . . . A . 3 ASP HB2 . . . . . . . . . c30226_5ug5 1 . 16 . 4313 . 1 1 3 ASP HB3 H 8.582 -3.823 -2.997 . . . 1.0 . . . . . . . . . . . . A . 3 ASP HB3 . . . . . . . . . c30226_5ug5 1 . 16 . 4314 . 1 1 3 ASP N N 6.458 -2.095 -3.054 . . . 1.0 . . . . . . . . . . . . A . 3 ASP N . . . . . . . . . c30226_5ug5 1 . 16 . 4315 . 1 1 3 ASP O O 6.392 -5.108 -1.089 . . . 1.0 . . . . . . . . . . . . A . 3 ASP O . . . . . . . . . c30226_5ug5 1 . 16 . 4316 . 1 1 3 ASP OD1 O 6.866 -6.217 -4.344 . . . 1.0 . . . . . . . . . . . . A . 3 ASP OD1 . . . . . . . . . c30226_5ug5 1 . 16 . 4317 . 1 1 3 ASP OD2 O 8.564 -6.282 -2.959 . . . 1.0 . . . . . . . . . . . . A . 3 ASP OD2 . . . . . . . . . c30226_5ug5 1 . 16 . 4318 . 1 1 4 GLU C C 4.542 -2.570 1.059 . . . 1.0 . . . . . . . . . . . . A . 4 GLU C . . . . . . . . . c30226_5ug5 1 . 16 . 4319 . 1 1 4 GLU CA C 5.948 -3.030 0.738 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CA . . . . . . . . . c30226_5ug5 1 . 16 . 4320 . 1 1 4 GLU CB C 6.930 -2.143 1.470 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CB . . . . . . . . . c30226_5ug5 1 . 16 . 4321 . 1 1 4 GLU CD C 9.326 -1.438 1.740 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CD . . . . . . . . . c30226_5ug5 1 . 16 . 4322 . 1 1 4 GLU CG C 8.385 -2.542 1.310 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CG . . . . . . . . . c30226_5ug5 1 . 16 . 4323 . 1 1 4 GLU H H 6.154 -2.035 -1.100 . . . 1.0 . . . . . . . . . . . . A . 4 GLU H . . . . . . . . . c30226_5ug5 1 . 16 . 4324 . 1 1 4 GLU HA H 6.082 -4.059 1.036 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HA . . . . . . . . . c30226_5ug5 1 . 16 . 4325 . 1 1 4 GLU HB2 H 6.816 -1.135 1.106 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HB2 . . . . . . . . . c30226_5ug5 1 . 16 . 4326 . 1 1 4 GLU HB3 H 6.678 -2.165 2.507 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HB3 . . . . . . . . . c30226_5ug5 1 . 16 . 4327 . 1 1 4 GLU HG2 H 8.577 -3.416 1.916 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HG2 . . . . . . . . . c30226_5ug5 1 . 16 . 4328 . 1 1 4 GLU HG3 H 8.573 -2.774 0.273 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HG3 . . . . . . . . . c30226_5ug5 1 . 16 . 4329 . 1 1 4 GLU N N 6.161 -2.918 -0.691 . . . 1.0 . . . . . . . . . . . . A . 4 GLU N . . . . . . . . . c30226_5ug5 1 . 16 . 4330 . 1 1 4 GLU O O 4.221 -2.215 2.191 . . . 1.0 . . . . . . . . . . . . A . 4 GLU O . . . . . . . . . c30226_5ug5 1 . 16 . 4331 . 1 1 4 GLU OE1 O 9.935 -1.553 2.823 . . . 1.0 . . . . . . . . . . . . A . 4 GLU OE1 . . . . . . . . . c30226_5ug5 1 . 16 . 4332 . 1 1 4 GLU OE2 O 9.447 -0.435 0.999 . . . 1.0 . . . . . . . . . . . . A . 4 GLU OE2 . . . . . . . . . c30226_5ug5 1 . 16 . 4333 . 1 1 5 CYS C C 1.504 -2.588 1.140 . . . 1.0 . . . . . . . . . . . . A . 5 CYS C . . . . . . . . . c30226_5ug5 1 . 16 . 4334 . 1 1 5 CYS CA C 2.404 -1.960 0.080 . . . 1.0 . . . . . . . . . . . . A . 5 CYS CA . . . . . . . . . c30226_5ug5 1 . 16 . 4335 . 1 1 5 CYS CB C 1.744 -2.046 -1.295 . . . 1.0 . . . . . . . . . . . . A . 5 CYS CB . . . . . . . . . c30226_5ug5 1 . 16 . 4336 . 1 1 5 CYS H H 4.006 -3.033 -0.779 . . . 1.0 . . . . . . . . . . . . A . 5 CYS H . . . . . . . . . c30226_5ug5 1 . 16 . 4337 . 1 1 5 CYS HA H 2.547 -0.920 0.326 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HA . . . . . . . . . c30226_5ug5 1 . 16 . 4338 . 1 1 5 CYS HB2 H 2.491 -1.887 -2.058 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HB2 . . . . . . . . . c30226_5ug5 1 . 16 . 4339 . 1 1 5 CYS HB3 H 1.313 -3.027 -1.419 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HB3 . . . . . . . . . c30226_5ug5 1 . 16 . 4340 . 1 1 5 CYS N N 3.718 -2.584 0.038 . . . 1.0 . . . . . . . . . . . . A . 5 CYS N . . . . . . . . . c30226_5ug5 1 . 16 . 4341 . 1 1 5 CYS O O 0.621 -1.924 1.676 . . . 1.0 . . . . . . . . . . . . A . 5 CYS O . . . . . . . . . c30226_5ug5 1 . 16 . 4342 . 1 1 5 CYS SG S 0.421 -0.823 -1.552 . . . 1.0 . . . . . . . . . . . . A . 5 CYS SG . . . . . . . . . c30226_5ug5 1 . 16 . 4343 . 1 1 6 CYS C C 1.220 -3.972 3.846 . . . 1.0 . . . . . . . . . . . . A . 6 CYS C . . . . . . . . . c30226_5ug5 1 . 16 . 4344 . 1 1 6 CYS CA C 0.936 -4.539 2.462 . . . 1.0 . . . . . . . . . . . . A . 6 CYS CA . . . . . . . . . c30226_5ug5 1 . 16 . 4345 . 1 1 6 CYS CB C 1.210 -6.045 2.443 . . . 1.0 . . . . . . . . . . . . A . 6 CYS CB . . . . . . . . . c30226_5ug5 1 . 16 . 4346 . 1 1 6 CYS H H 2.491 -4.324 1.038 . . . 1.0 . . . . . . . . . . . . A . 6 CYS H . . . . . . . . . c30226_5ug5 1 . 16 . 4347 . 1 1 6 CYS HA H -0.103 -4.367 2.222 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HA . . . . . . . . . c30226_5ug5 1 . 16 . 4348 . 1 1 6 CYS HB2 H 1.007 -6.428 1.454 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HB2 . . . . . . . . . c30226_5ug5 1 . 16 . 4349 . 1 1 6 CYS HB3 H 2.249 -6.218 2.684 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HB3 . . . . . . . . . c30226_5ug5 1 . 16 . 4350 . 1 1 6 CYS N N 1.745 -3.851 1.465 . . . 1.0 . . . . . . . . . . . . A . 6 CYS N . . . . . . . . . c30226_5ug5 1 . 16 . 4351 . 1 1 6 CYS O O 0.321 -3.852 4.683 . . . 1.0 . . . . . . . . . . . . A . 6 CYS O . . . . . . . . . c30226_5ug5 1 . 16 . 4352 . 1 1 6 CYS SG S 0.197 -6.997 3.623 . . . 1.0 . . . . . . . . . . . . A . 6 CYS SG . . . . . . . . . c30226_5ug5 1 . 16 . 4353 . 1 1 7 SER C C 2.613 -1.532 5.335 . . . 1.0 . . . . . . . . . . . . A . 7 SER C . . . . . . . . . c30226_5ug5 1 . 16 . 4354 . 1 1 7 SER CA C 2.891 -3.023 5.326 . . . 1.0 . . . . . . . . . . . . A . 7 SER CA . . . . . . . . . c30226_5ug5 1 . 16 . 4355 . 1 1 7 SER CB C 4.387 -3.220 5.493 . . . 1.0 . . . . . . . . . . . . A . 7 SER CB . . . . . . . . . c30226_5ug5 1 . 16 . 4356 . 1 1 7 SER H H 3.150 -3.751 3.381 . . . 1.0 . . . . . . . . . . . . A . 7 SER H . . . . . . . . . c30226_5ug5 1 . 16 . 4357 . 1 1 7 SER HA H 2.368 -3.502 6.136 . . . 1.0 . . . . . . . . . . . . A . 7 SER HA . . . . . . . . . c30226_5ug5 1 . 16 . 4358 . 1 1 7 SER HB2 H 4.897 -2.361 5.076 . . . 1.0 . . . . . . . . . . . . A . 7 SER HB2 . . . . . . . . . c30226_5ug5 1 . 16 . 4359 . 1 1 7 SER HB3 H 4.619 -3.304 6.538 . . . 1.0 . . . . . . . . . . . . A . 7 SER HB3 . . . . . . . . . c30226_5ug5 1 . 16 . 4360 . 1 1 7 SER HG H 4.386 -5.164 5.223 . . . 1.0 . . . . . . . . . . . . A . 7 SER HG . . . . . . . . . c30226_5ug5 1 . 16 . 4361 . 1 1 7 SER N N 2.474 -3.609 4.074 . . . 1.0 . . . . . . . . . . . . A . 7 SER N . . . . . . . . . c30226_5ug5 1 . 16 . 4362 . 1 1 7 SER O O 2.278 -0.953 6.368 . . . 1.0 . . . . . . . . . . . . A . 7 SER O . . . . . . . . . c30226_5ug5 1 . 16 . 4363 . 1 1 7 SER OG O 4.822 -4.397 4.829 . . . 1.0 . . . . . . . . . . . . A . 7 SER OG . . . . . . . . . c30226_5ug5 1 . 16 . 4364 . 1 1 8 ASN C C 1.437 1.151 4.036 . . . 1.0 . . . . . . . . . . . . A . 8 ASN C . . . . . . . . . c30226_5ug5 1 . 16 . 4365 . 1 1 8 ASN CA C 2.822 0.518 4.071 . . . 1.0 . . . . . . . . . . . . A . 8 ASN CA . . . . . . . . . c30226_5ug5 1 . 16 . 4366 . 1 1 8 ASN CB C 3.628 0.913 2.829 . . . 1.0 . . . . . . . . . . . . A . 8 ASN CB . . . . . . . . . c30226_5ug5 1 . 16 . 4367 . 1 1 8 ASN CG C 3.754 2.416 2.656 . . . 1.0 . . . . . . . . . . . . A . 8 ASN CG . . . . . . . . . c30226_5ug5 1 . 16 . 4368 . 1 1 8 ASN H H 2.744 -1.457 3.339 . . . 1.0 . . . . . . . . . . . . A . 8 ASN H . . . . . . . . . c30226_5ug5 1 . 16 . 4369 . 1 1 8 ASN HA H 3.351 0.854 4.948 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HA . . . . . . . . . c30226_5ug5 1 . 16 . 4370 . 1 1 8 ASN HB2 H 4.622 0.496 2.906 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HB2 . . . . . . . . . c30226_5ug5 1 . 16 . 4371 . 1 1 8 ASN HB3 H 3.141 0.509 1.954 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HB3 . . . . . . . . . c30226_5ug5 1 . 16 . 4372 . 1 1 8 ASN HD21 H 4.170 2.181 0.731 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HD21 . . . . . . . . . c30226_5ug5 1 . 16 . 4373 . 1 1 8 ASN HD22 H 4.152 3.813 1.305 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HD22 . . . . . . . . . c30226_5ug5 1 . 16 . 4374 . 1 1 8 ASN N N 2.735 -0.922 4.165 . . . 1.0 . . . . . . . . . . . . A . 8 ASN N . . . . . . . . . c30226_5ug5 1 . 16 . 4375 . 1 1 8 ASN ND2 N 4.049 2.845 1.442 . . . 1.0 . . . . . . . . . . . . A . 8 ASN ND2 . . . . . . . . . c30226_5ug5 1 . 16 . 4376 . 1 1 8 ASN O O 0.715 1.031 3.043 . . . 1.0 . . . . . . . . . . . . A . 8 ASN O . . . . . . . . . c30226_5ug5 1 . 16 . 4377 . 1 1 8 ASN OD1 O 3.618 3.183 3.608 . . . 1.0 . . . . . . . . . . . . A . 8 ASN OD1 . . . . . . . . . c30226_5ug5 1 . 16 . 4378 . 1 1 9 PRO C C -0.513 3.502 4.164 . . . 1.0 . . . . . . . . . . . . A . 9 PRO C . . . . . . . . . c30226_5ug5 1 . 16 . 4379 . 1 1 9 PRO CA C -0.253 2.487 5.257 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CA . . . . . . . . . c30226_5ug5 1 . 16 . 4380 . 1 1 9 PRO CB C -0.146 3.193 6.608 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CB . . . . . . . . . c30226_5ug5 1 . 16 . 4381 . 1 1 9 PRO CD C 1.902 2.132 6.295 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CD . . . . . . . . . c30226_5ug5 1 . 16 . 4382 . 1 1 9 PRO CG C 1.296 3.383 6.825 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CG . . . . . . . . . c30226_5ug5 1 . 16 . 4383 . 1 1 9 PRO HA H -1.049 1.760 5.281 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HA . . . . . . . . . c30226_5ug5 1 . 16 . 4384 . 1 1 9 PRO HB2 H -0.679 4.128 6.589 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HB2 . . . . . . . . . c30226_5ug5 1 . 16 . 4385 . 1 1 9 PRO HB3 H -0.540 2.560 7.352 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HB3 . . . . . . . . . c30226_5ug5 1 . 16 . 4386 . 1 1 9 PRO HD2 H 2.912 2.307 6.021 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HD2 . . . . . . . . . c30226_5ug5 1 . 16 . 4387 . 1 1 9 PRO HD3 H 1.829 1.334 7.018 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HD3 . . . . . . . . . c30226_5ug5 1 . 16 . 4388 . 1 1 9 PRO HG2 H 1.651 4.246 6.279 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HG2 . . . . . . . . . c30226_5ug5 1 . 16 . 4389 . 1 1 9 PRO HG3 H 1.498 3.482 7.879 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HG3 . . . . . . . . . c30226_5ug5 1 . 16 . 4390 . 1 1 9 PRO N N 1.062 1.857 5.117 . . . 1.0 . . . . . . . . . . . . A . 9 PRO N . . . . . . . . . c30226_5ug5 1 . 16 . 4391 . 1 1 9 PRO O O -1.591 3.558 3.580 . . . 1.0 . . . . . . . . . . . . A . 9 PRO O . . . . . . . . . c30226_5ug5 1 . 16 . 4392 . 1 1 10 ALA C C 0.252 4.722 1.473 . . . 1.0 . . . . . . . . . . . . A . 10 ALA C . . . . . . . . . c30226_5ug5 1 . 16 . 4393 . 1 1 10 ALA CA C 0.446 5.319 2.870 . . . 1.0 . . . . . . . . . . . . A . 10 ALA CA . . . . . . . . . c30226_5ug5 1 . 16 . 4394 . 1 1 10 ALA CB C 1.709 6.166 2.909 . . . 1.0 . . . . . . . . . . . . A . 10 ALA CB . . . . . . . . . c30226_5ug5 1 . 16 . 4395 . 1 1 10 ALA H H 1.307 4.206 4.458 . . . 1.0 . . . . . . . . . . . . A . 10 ALA H . . . . . . . . . c30226_5ug5 1 . 16 . 4396 . 1 1 10 ALA HA H -0.392 5.965 3.089 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HA . . . . . . . . . c30226_5ug5 1 . 16 . 4397 . 1 1 10 ALA HB1 H 1.843 6.567 3.903 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HB1 . . . . . . . . . c30226_5ug5 1 . 16 . 4398 . 1 1 10 ALA HB2 H 1.619 6.978 2.203 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HB2 . . . . . . . . . c30226_5ug5 1 . 16 . 4399 . 1 1 10 ALA HB3 H 2.560 5.555 2.649 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HB3 . . . . . . . . . c30226_5ug5 1 . 16 . 4400 . 1 1 10 ALA N N 0.499 4.295 3.905 . . . 1.0 . . . . . . . . . . . . A . 10 ALA N . . . . . . . . . c30226_5ug5 1 . 16 . 4401 . 1 1 10 ALA O O -0.166 5.422 0.552 . . . 1.0 . . . . . . . . . . . . A . 10 ALA O . . . . . . . . . c30226_5ug5 1 . 16 . 4402 . 1 1 11 CYS C C -0.957 2.285 -0.061 . . . 1.0 . . . . . . . . . . . . A . 11 CYS C . . . . . . . . . c30226_5ug5 1 . 16 . 4403 . 1 1 11 CYS CA C 0.432 2.812 0.007 . . . 1.0 . . . . . . . . . . . . A . 11 CYS CA . . . . . . . . . c30226_5ug5 1 . 16 . 4404 . 1 1 11 CYS CB C 1.440 1.675 -0.151 . . . 1.0 . . . . . . . . . . . . A . 11 CYS CB . . . . . . . . . c30226_5ug5 1 . 16 . 4405 . 1 1 11 CYS H H 0.630 2.846 2.097 . . . 1.0 . . . . . . . . . . . . A . 11 CYS H . . . . . . . . . c30226_5ug5 1 . 16 . 4406 . 1 1 11 CYS HA H 0.582 3.563 -0.755 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HA . . . . . . . . . c30226_5ug5 1 . 16 . 4407 . 1 1 11 CYS HB2 H 2.433 2.053 0.035 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HB2 . . . . . . . . . c30226_5ug5 1 . 16 . 4408 . 1 1 11 CYS HB3 H 1.209 0.899 0.572 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HB3 . . . . . . . . . c30226_5ug5 1 . 16 . 4409 . 1 1 11 CYS N N 0.534 3.431 1.311 . . . 1.0 . . . . . . . . . . . . A . 11 CYS N . . . . . . . . . c30226_5ug5 1 . 16 . 4410 . 1 1 11 CYS O O -1.728 2.521 -0.995 . . . 1.0 . . . . . . . . . . . . A . 11 CYS O . . . . . . . . . c30226_5ug5 1 . 16 . 4411 . 1 1 11 CYS SG S 1.435 0.916 -1.808 . . . 1.0 . . . . . . . . . . . . A . 11 CYS SG . . . . . . . . . c30226_5ug5 1 . 16 . 4412 . 1 1 12 ARG C C -3.642 2.115 1.185 . . . 1.0 . . . . . . . . . . . . A . 12 ARG C . . . . . . . . . c30226_5ug5 1 . 16 . 4413 . 1 1 12 ARG CA C -2.535 1.071 1.318 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CA . . . . . . . . . c30226_5ug5 1 . 16 . 4414 . 1 1 12 ARG CB C -2.469 0.525 2.722 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CB . . . . . . . . . c30226_5ug5 1 . 16 . 4415 . 1 1 12 ARG CD C -1.403 -1.293 4.060 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CD . . . . . . . . . c30226_5ug5 1 . 16 . 4416 . 1 1 12 ARG CG C -2.113 -0.943 2.771 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CG . . . . . . . . . c30226_5ug5 1 . 16 . 4417 . 1 1 12 ARG CZ C -1.928 -1.445 6.473 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CZ . . . . . . . . . c30226_5ug5 1 . 16 . 4418 . 1 1 12 ARG H H -0.520 1.389 1.655 . . . 1.0 . . . . . . . . . . . . A . 12 ARG H . . . . . . . . . c30226_5ug5 1 . 16 . 4419 . 1 1 12 ARG HA H -2.710 0.270 0.646 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HA . . . . . . . . . c30226_5ug5 1 . 16 . 4420 . 1 1 12 ARG HB2 H -1.712 1.072 3.266 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HB2 . . . . . . . . . c30226_5ug5 1 . 16 . 4421 . 1 1 12 ARG HB3 H -3.406 0.678 3.195 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HB3 . . . . . . . . . c30226_5ug5 1 . 16 . 4422 . 1 1 12 ARG HD2 H -1.130 -2.338 4.034 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HD2 . . . . . . . . . c30226_5ug5 1 . 16 . 4423 . 1 1 12 ARG HD3 H -0.507 -0.686 4.124 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HD3 . . . . . . . . . c30226_5ug5 1 . 16 . 4424 . 1 1 12 ARG HE H -3.085 -0.566 5.095 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HE . . . . . . . . . c30226_5ug5 1 . 16 . 4425 . 1 1 12 ARG HG2 H -3.016 -1.523 2.696 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HG2 . . . . . . . . . c30226_5ug5 1 . 16 . 4426 . 1 1 12 ARG HG3 H -1.464 -1.173 1.939 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HG3 . . . . . . . . . c30226_5ug5 1 . 16 . 4427 . 1 1 12 ARG HH11 H -0.190 -2.342 5.941 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH11 . . . . . . . . . c30226_5ug5 1 . 16 . 4428 . 1 1 12 ARG HH12 H -0.573 -2.415 7.631 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH12 . . . . . . . . . c30226_5ug5 1 . 16 . 4429 . 1 1 12 ARG HH21 H -3.615 -0.687 7.310 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH21 . . . . . . . . . c30226_5ug5 1 . 16 . 4430 . 1 1 12 ARG HH22 H -2.530 -1.475 8.412 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH22 . . . . . . . . . c30226_5ug5 1 . 16 . 4431 . 1 1 12 ARG N N -1.248 1.591 1.019 . . . 1.0 . . . . . . . . . . . . A . 12 ARG N . . . . . . . . . c30226_5ug5 1 . 16 . 4432 . 1 1 12 ARG NE N -2.238 -1.049 5.238 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NE . . . . . . . . . c30226_5ug5 1 . 16 . 4433 . 1 1 12 ARG NH1 N -0.808 -2.122 6.698 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NH1 . . . . . . . . . c30226_5ug5 1 . 16 . 4434 . 1 1 12 ARG NH2 N -2.757 -1.182 7.479 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NH2 . . . . . . . . . c30226_5ug5 1 . 16 . 4435 . 1 1 12 ARG O O -4.788 1.778 0.903 . . . 1.0 . . . . . . . . . . . . A . 12 ARG O . . . . . . . . . c30226_5ug5 1 . 16 . 4436 . 1 1 13 TYR C C -4.942 4.449 -0.093 . . . 1.0 . . . . . . . . . . . . A . 13 TYR C . . . . . . . . . c30226_5ug5 1 . 16 . 4437 . 1 1 13 TYR CA C -4.199 4.496 1.243 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CA . . . . . . . . . c30226_5ug5 1 . 16 . 4438 . 1 1 13 TYR CB C -3.413 5.795 1.362 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CB . . . . . . . . . c30226_5ug5 1 . 16 . 4439 . 1 1 13 TYR CD1 C -4.999 7.284 2.565 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CD1 . . . . . . . . . c30226_5ug5 1 . 16 . 4440 . 1 1 13 TYR CD2 C -4.330 7.904 0.378 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CD2 . . . . . . . . . c30226_5ug5 1 . 16 . 4441 . 1 1 13 TYR CE1 C -5.790 8.401 2.650 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CE1 . . . . . . . . . c30226_5ug5 1 . 16 . 4442 . 1 1 13 TYR CE2 C -5.120 9.032 0.448 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CE2 . . . . . . . . . c30226_5ug5 1 . 16 . 4443 . 1 1 13 TYR CG C -4.262 7.021 1.434 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CG . . . . . . . . . c30226_5ug5 1 . 16 . 4444 . 1 1 13 TYR CZ C -5.818 9.301 1.544 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CZ . . . . . . . . . c30226_5ug5 1 . 16 . 4445 . 1 1 13 TYR H H -2.364 3.570 1.663 . . . 1.0 . . . . . . . . . . . . A . 13 TYR H . . . . . . . . . c30226_5ug5 1 . 16 . 4446 . 1 1 13 TYR HA H -4.912 4.447 2.043 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HA . . . . . . . . . c30226_5ug5 1 . 16 . 4447 . 1 1 13 TYR HB2 H -2.802 5.763 2.249 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HB2 . . . . . . . . . c30226_5ug5 1 . 16 . 4448 . 1 1 13 TYR HB3 H -2.781 5.898 0.500 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HB3 . . . . . . . . . c30226_5ug5 1 . 16 . 4449 . 1 1 13 TYR HD1 H -4.947 6.596 3.391 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HD1 . . . . . . . . . c30226_5ug5 1 . 16 . 4450 . 1 1 13 TYR HD2 H -3.753 7.697 -0.509 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HD2 . . . . . . . . . c30226_5ug5 1 . 16 . 4451 . 1 1 13 TYR HE1 H -6.356 8.584 3.541 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HE1 . . . . . . . . . c30226_5ug5 1 . 16 . 4452 . 1 1 13 TYR HE2 H -5.166 9.712 -0.381 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HE2 . . . . . . . . . c30226_5ug5 1 . 16 . 4453 . 1 1 13 TYR HH H -7.141 10.498 0.850 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HH . . . . . . . . . c30226_5ug5 1 . 16 . 4454 . 1 1 13 TYR N N -3.282 3.379 1.385 . . . 1.0 . . . . . . . . . . . . A . 13 TYR N . . . . . . . . . c30226_5ug5 1 . 16 . 4455 . 1 1 13 TYR O O -6.128 4.776 -0.166 . . . 1.0 . . . . . . . . . . . . A . 13 TYR O . . . . . . . . . c30226_5ug5 1 . 16 . 4456 . 1 1 13 TYR OH O -6.641 10.400 1.672 . . . 1.0 . . . . . . . . . . . . A . 13 TYR OH . . . . . . . . . c30226_5ug5 1 . 16 . 4457 . 1 1 14 ASN C C -4.976 2.523 -2.895 . . . 1.0 . . . . . . . . . . . . A . 14 ASN C . . . . . . . . . c30226_5ug5 1 . 16 . 4458 . 1 1 14 ASN CA C -4.850 3.976 -2.472 . . . 1.0 . . . . . . . . . . . . A . 14 ASN CA . . . . . . . . . c30226_5ug5 1 . 16 . 4459 . 1 1 14 ASN CB C -3.993 4.761 -3.472 . . . 1.0 . . . . . . . . . . . . A . 14 ASN CB . . . . . . . . . c30226_5ug5 1 . 16 . 4460 . 1 1 14 ASN CG C -4.653 4.910 -4.832 . . . 1.0 . . . . . . . . . . . . A . 14 ASN CG . . . . . . . . . c30226_5ug5 1 . 16 . 4461 . 1 1 14 ASN H H -3.329 3.682 -1.020 . . . 1.0 . . . . . . . . . . . . A . 14 ASN H . . . . . . . . . c30226_5ug5 1 . 16 . 4462 . 1 1 14 ASN HA H -5.834 4.416 -2.415 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HA . . . . . . . . . c30226_5ug5 1 . 16 . 4463 . 1 1 14 ASN HB2 H -3.805 5.746 -3.075 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HB2 . . . . . . . . . c30226_5ug5 1 . 16 . 4464 . 1 1 14 ASN HB3 H -3.051 4.247 -3.605 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HB3 . . . . . . . . . c30226_5ug5 1 . 16 . 4465 . 1 1 14 ASN HD21 H -2.878 4.965 -5.718 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HD21 . . . . . . . . . c30226_5ug5 1 . 16 . 4466 . 1 1 14 ASN HD22 H -4.247 5.098 -6.766 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HD22 . . . . . . . . . c30226_5ug5 1 . 16 . 4467 . 1 1 14 ASN N N -4.252 4.024 -1.144 . . . 1.0 . . . . . . . . . . . . A . 14 ASN N . . . . . . . . . c30226_5ug5 1 . 16 . 4468 . 1 1 14 ASN ND2 N -3.846 5.000 -5.875 . . . 1.0 . . . . . . . . . . . . A . 14 ASN ND2 . . . . . . . . . c30226_5ug5 1 . 16 . 4469 . 1 1 14 ASN O O -5.450 2.198 -3.986 . . . 1.0 . . . . . . . . . . . . A . 14 ASN O . . . . . . . . . c30226_5ug5 1 . 16 . 4470 . 1 1 14 ASN OD1 O -5.877 4.951 -4.941 . . . 1.0 . . . . . . . . . . . . A . 14 ASN OD1 . . . . . . . . . c30226_5ug5 1 . 16 . 4471 . 1 1 15 ASN C C -4.839 -0.648 -1.153 . . . 1.0 . . . . . . . . . . . . A . 15 ASN C . . . . . . . . . c30226_5ug5 1 . 16 . 4472 . 1 1 15 ASN CA C -4.368 0.251 -2.291 . . . 1.0 . . . . . . . . . . . . A . 15 ASN CA . . . . . . . . . c30226_5ug5 1 . 16 . 4473 . 1 1 15 ASN CB C -2.888 0.041 -2.508 . . . 1.0 . . . . . . . . . . . . A . 15 ASN CB . . . . . . . . . c30226_5ug5 1 . 16 . 4474 . 1 1 15 ASN CG C -2.398 0.513 -3.864 . . . 1.0 . . . . . . . . . . . . A . 15 ASN CG . . . . . . . . . c30226_5ug5 1 . 16 . 4475 . 1 1 15 ASN H H -4.394 1.971 -1.073 . . . 1.0 . . . . . . . . . . . . A . 15 ASN H . . . . . . . . . c30226_5ug5 1 . 16 . 4476 . 1 1 15 ASN HA H -4.907 0.014 -3.187 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HA . . . . . . . . . c30226_5ug5 1 . 16 . 4477 . 1 1 15 ASN HB2 H -2.378 0.615 -1.750 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HB2 . . . . . . . . . c30226_5ug5 1 . 16 . 4478 . 1 1 15 ASN HB3 H -2.651 -1.005 -2.392 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HB3 . . . . . . . . . c30226_5ug5 1 . 16 . 4479 . 1 1 15 ASN HD21 H -0.595 0.852 -3.110 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HD21 . . . . . . . . . c30226_5ug5 1 . 16 . 4480 . 1 1 15 ASN HD22 H -0.783 1.193 -4.795 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HD22 . . . . . . . . . c30226_5ug5 1 . 16 . 4481 . 1 1 15 ASN N N -4.571 1.655 -1.986 . . . 1.0 . . . . . . . . . . . . A . 15 ASN N . . . . . . . . . c30226_5ug5 1 . 16 . 4482 . 1 1 15 ASN ND2 N -1.134 0.894 -3.930 . . . 1.0 . . . . . . . . . . . . A . 15 ASN ND2 . . . . . . . . . c30226_5ug5 1 . 16 . 4483 . 1 1 15 ASN O O -4.047 -1.359 -0.538 . . . 1.0 . . . . . . . . . . . . A . 15 ASN O . . . . . . . . . c30226_5ug5 1 . 16 . 4484 . 1 1 15 ASN OD1 O -3.145 0.532 -4.842 . . . 1.0 . . . . . . . . . . . . A . 15 ASN OD1 . . . . . . . . . c30226_5ug5 1 . 16 . 4485 . 1 1 16 HYP C C -7.092 -2.773 -0.028 . . . 1.0 . . . . . . . . . . . . A . 16 HYP C . . . . . . . . . c30226_5ug5 1 . 16 . 4486 . 1 1 16 HYP CA C -6.711 -1.342 0.290 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CA . . . . . . . . . c30226_5ug5 1 . 16 . 4487 . 1 1 16 HYP CB C -7.923 -0.466 0.545 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CB . . . . . . . . . c30226_5ug5 1 . 16 . 4488 . 1 1 16 HYP CD C -7.174 0.102 -1.614 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CD . . . . . . . . . c30226_5ug5 1 . 16 . 4489 . 1 1 16 HYP CG C -7.983 0.643 -0.490 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CG . . . . . . . . . c30226_5ug5 1 . 16 . 4490 . 1 1 16 HYP HA H -6.053 -1.326 1.128 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HA . . . . . . . . . c30226_5ug5 1 . 16 . 4491 . 1 1 16 HYP HB2 H -7.847 -0.025 1.526 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HB2 . . . . . . . . . c30226_5ug5 1 . 16 . 4492 . 1 1 16 HYP HB3 H -8.819 -1.069 0.485 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HB3 . . . . . . . . . c30226_5ug5 1 . 16 . 4493 . 1 1 16 HYP HD1 H -6.363 1.719 -0.292 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HD1 . . . . . . . . . c30226_5ug5 1 . 16 . 4494 . 1 1 16 HYP HD22 H -7.758 -0.553 -2.225 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HD22 . . . . . . . . . c30226_5ug5 1 . 16 . 4495 . 1 1 16 HYP HD23 H -6.741 0.898 -2.198 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HD23 . . . . . . . . . c30226_5ug5 1 . 16 . 4496 . 1 1 16 HYP HG H -8.998 0.864 -0.777 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HG . . . . . . . . . c30226_5ug5 1 . 16 . 4497 . 1 1 16 HYP N N -6.136 -0.636 -0.868 . . . 1.0 . . . . . . . . . . . . A . 16 HYP N . . . . . . . . . c30226_5ug5 1 . 16 . 4498 . 1 1 16 HYP O O -7.405 -3.573 0.850 . . . 1.0 . . . . . . . . . . . . A . 16 HYP O . . . . . . . . . c30226_5ug5 1 . 16 . 4499 . 1 1 16 HYP OD1 O -7.301 1.803 -0.029 . . . 1.0 . . . . . . . . . . . . A . 16 HYP OD1 . . . . . . . . . c30226_5ug5 1 . 16 . 4500 . 1 1 17 HIS C C -6.010 -5.044 -2.337 . . . 1.0 . . . . . . . . . . . . A . 17 HIS C . . . . . . . . . c30226_5ug5 1 . 16 . 4501 . 1 1 17 HIS CA C -7.290 -4.434 -1.780 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CA . . . . . . . . . c30226_5ug5 1 . 16 . 4502 . 1 1 17 HIS CB C -8.406 -4.452 -2.841 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CB . . . . . . . . . c30226_5ug5 1 . 16 . 4503 . 1 1 17 HIS CD2 C -8.332 -2.428 -4.471 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CD2 . . . . . . . . . c30226_5ug5 1 . 16 . 4504 . 1 1 17 HIS CE1 C -7.366 -3.413 -6.168 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CE1 . . . . . . . . . c30226_5ug5 1 . 16 . 4505 . 1 1 17 HIS CG C -8.092 -3.711 -4.111 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CG . . . . . . . . . c30226_5ug5 1 . 16 . 4506 . 1 1 17 HIS H H -6.792 -2.375 -1.927 . . . 1.0 . . . . . . . . . . . . A . 17 HIS H . . . . . . . . . c30226_5ug5 1 . 16 . 4507 . 1 1 17 HIS HA H -7.606 -5.024 -0.932 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HA . . . . . . . . . c30226_5ug5 1 . 16 . 4508 . 1 1 17 HIS HB2 H -8.615 -5.477 -3.106 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HB2 . . . . . . . . . c30226_5ug5 1 . 16 . 4509 . 1 1 17 HIS HB3 H -9.296 -4.013 -2.414 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HB3 . . . . . . . . . c30226_5ug5 1 . 16 . 4510 . 1 1 17 HIS HD1 H -7.178 -5.234 -5.252 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HD1 . . . . . . . . . c30226_5ug5 1 . 16 . 4511 . 1 1 17 HIS HD2 H -8.802 -1.670 -3.861 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HD2 . . . . . . . . . c30226_5ug5 1 . 16 . 4512 . 1 1 17 HIS HE1 H -6.932 -3.596 -7.139 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HE1 . . . . . . . . . c30226_5ug5 1 . 16 . 4513 . 1 1 17 HIS HE2 H -7.720 -1.401 -6.192 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HE2 . . . . . . . . . c30226_5ug5 1 . 16 . 4514 . 1 1 17 HIS N N -7.031 -3.082 -1.299 . . . 1.0 . . . . . . . . . . . . A . 17 HIS N . . . . . . . . . c30226_5ug5 1 . 16 . 4515 . 1 1 17 HIS ND1 N -7.486 -4.299 -5.198 . . . 1.0 . . . . . . . . . . . . A . 17 HIS ND1 . . . . . . . . . c30226_5ug5 1 . 16 . 4516 . 1 1 17 HIS NE2 N -7.872 -2.269 -5.753 . . . 1.0 . . . . . . . . . . . . A . 17 HIS NE2 . . . . . . . . . c30226_5ug5 1 . 16 . 4517 . 1 1 17 HIS O O -6.043 -6.003 -3.103 . . . 1.0 . . . . . . . . . . . . A . 17 HIS O . . . . . . . . . c30226_5ug5 1 . 16 . 4518 . 1 1 18 VAL C C -3.072 -6.071 -1.550 . . . 1.0 . . . . . . . . . . . . A . 18 VAL C . . . . . . . . . c30226_5ug5 1 . 16 . 4519 . 1 1 18 VAL CA C -3.585 -4.919 -2.400 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CA . . . . . . . . . c30226_5ug5 1 . 16 . 4520 . 1 1 18 VAL CB C -2.601 -3.730 -2.392 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CB . . . . . . . . . c30226_5ug5 1 . 16 . 4521 . 1 1 18 VAL CG1 C -1.202 -4.139 -1.984 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CG1 . . . . . . . . . c30226_5ug5 1 . 16 . 4522 . 1 1 18 VAL CG2 C -2.579 -3.074 -3.754 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CG2 . . . . . . . . . c30226_5ug5 1 . 16 . 4523 . 1 1 18 VAL H H -4.921 -3.732 -1.298 . . . 1.0 . . . . . . . . . . . . A . 18 VAL H . . . . . . . . . c30226_5ug5 1 . 16 . 4524 . 1 1 18 VAL HA H -3.696 -5.258 -3.410 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HA . . . . . . . . . c30226_5ug5 1 . 16 . 4525 . 1 1 18 VAL HB H -2.960 -3.005 -1.680 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HB . . . . . . . . . c30226_5ug5 1 . 16 . 4526 . 1 1 18 VAL HG11 H -0.567 -3.270 -1.979 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG11 . . . . . . . . . c30226_5ug5 1 . 16 . 4527 . 1 1 18 VAL HG12 H -0.819 -4.866 -2.682 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG12 . . . . . . . . . c30226_5ug5 1 . 16 . 4528 . 1 1 18 VAL HG13 H -1.234 -4.568 -0.995 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG13 . . . . . . . . . c30226_5ug5 1 . 16 . 4529 . 1 1 18 VAL HG21 H -2.247 -3.787 -4.491 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG21 . . . . . . . . . c30226_5ug5 1 . 16 . 4530 . 1 1 18 VAL HG22 H -1.906 -2.230 -3.737 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG22 . . . . . . . . . c30226_5ug5 1 . 16 . 4531 . 1 1 18 VAL HG23 H -3.574 -2.736 -4.001 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG23 . . . . . . . . . c30226_5ug5 1 . 16 . 4532 . 1 1 18 VAL N N -4.882 -4.475 -1.935 . . . 1.0 . . . . . . . . . . . . A . 18 VAL N . . . . . . . . . c30226_5ug5 1 . 16 . 4533 . 1 1 18 VAL O O -2.329 -6.936 -2.016 . . . 1.0 . . . . . . . . . . . . A . 18 VAL O . . . . . . . . . c30226_5ug5 1 . 16 . 4534 . 1 1 19 CYS C C -4.270 -7.473 1.537 . . . 1.0 . . . . . . . . . . . . A . 19 CYS C . . . . . . . . . c30226_5ug5 1 . 16 . 4535 . 1 1 19 CYS CA C -3.105 -7.122 0.620 . . . 1.0 . . . . . . . . . . . . A . 19 CYS CA . . . . . . . . . c30226_5ug5 1 . 16 . 4536 . 1 1 19 CYS CB C -1.894 -6.666 1.436 . . . 1.0 . . . . . . . . . . . . A . 19 CYS CB . . . . . . . . . c30226_5ug5 1 . 16 . 4537 . 1 1 19 CYS H H -4.106 -5.378 -0.018 . . . 1.0 . . . . . . . . . . . . A . 19 CYS H . . . . . . . . . c30226_5ug5 1 . 16 . 4538 . 1 1 19 CYS HA H -2.835 -7.997 0.047 . . . 1.0 . . . . . . . . . . . . A . 19 CYS HA . . . . . . . . . c30226_5ug5 1 . 16 . 4539 . 1 1 19 CYS HB2 H -1.136 -6.290 0.764 . . . 1.0 . . . . . . . . . . . . A . 19 CYS HB2 . . . . . . . . . c30226_5ug5 1 . 16 . 4540 . 1 1 19 CYS HB3 H -2.197 -5.873 2.103 . . . 1.0 . . . . . . . . . . . . A . 19 CYS HB3 . . . . . . . . . c30226_5ug5 1 . 16 . 4541 . 1 1 19 CYS N N -3.500 -6.085 -0.312 . . . 1.0 . . . . . . . . . . . . A . 19 CYS N . . . . . . . . . c30226_5ug5 1 . 16 . 4542 . 1 1 19 CYS O O -4.838 -8.578 1.388 . . . 1.0 . . . . . . . . . . . . A . 19 CYS O . . . . . . . . . c30226_5ug5 1 . 16 . 4543 . 1 1 19 CYS OXT O -4.636 -6.630 2.381 . . . 1.0 . . . . . . . . . . . . A . 19 CYS OXT . . . . . . . . . c30226_5ug5 1 . 16 . 4544 . 1 1 19 CYS SG S -1.136 -7.980 2.447 . . . 1.0 . . . . . . . . . . . . A . 19 CYS SG . . . . . . . . . c30226_5ug5 1 . 17 . 4545 . 1 1 1 ILE C C 5.581 3.468 -3.184 . . . 1.0 . . . . . . . . . . . . A . 1 ILE C . . . . . . . . . c30226_5ug5 1 . 17 . 4546 . 1 1 1 ILE CA C 4.410 3.903 -4.055 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CA . . . . . . . . . c30226_5ug5 1 . 17 . 4547 . 1 1 1 ILE CB C 4.094 2.796 -5.096 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CB . . . . . . . . . c30226_5ug5 1 . 17 . 4548 . 1 1 1 ILE CD1 C 6.434 2.289 -6.017 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CD1 . . . . . . . . . c30226_5ug5 1 . 17 . 4549 . 1 1 1 ILE CG1 C 5.054 2.849 -6.296 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CG1 . . . . . . . . . c30226_5ug5 1 . 17 . 4550 . 1 1 1 ILE CG2 C 2.651 2.902 -5.565 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CG2 . . . . . . . . . c30226_5ug5 1 . 17 . 4551 . 1 1 1 ILE H1 H 5.520 5.132 -5.311 . . . 1.0 . . . . . . . . . . . . A . 1 ILE H1 . . . . . . . . . c30226_5ug5 1 . 17 . 4552 . 1 1 1 ILE H2 H 4.868 5.928 -3.973 . . . 1.0 . . . . . . . . . . . . A . 1 ILE H2 . . . . . . . . . c30226_5ug5 1 . 17 . 4553 . 1 1 1 ILE H3 H 3.871 5.503 -5.270 . . . 1.0 . . . . . . . . . . . . A . 1 ILE H3 . . . . . . . . . c30226_5ug5 1 . 17 . 4554 . 1 1 1 ILE HA H 3.542 4.023 -3.422 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HA . . . . . . . . . c30226_5ug5 1 . 17 . 4555 . 1 1 1 ILE HB H 4.207 1.842 -4.605 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HB . . . . . . . . . c30226_5ug5 1 . 17 . 4556 . 1 1 1 ILE HD11 H 6.881 2.826 -5.193 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HD11 . . . . . . . . . c30226_5ug5 1 . 17 . 4557 . 1 1 1 ILE HD12 H 7.051 2.401 -6.896 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HD12 . . . . . . . . . c30226_5ug5 1 . 17 . 4558 . 1 1 1 ILE HD13 H 6.354 1.243 -5.764 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HD13 . . . . . . . . . c30226_5ug5 1 . 17 . 4559 . 1 1 1 ILE HG12 H 4.628 2.281 -7.109 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG12 . . . . . . . . . c30226_5ug5 1 . 17 . 4560 . 1 1 1 ILE HG13 H 5.170 3.878 -6.608 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG13 . . . . . . . . . c30226_5ug5 1 . 17 . 4561 . 1 1 1 ILE HG21 H 1.989 2.802 -4.718 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG21 . . . . . . . . . c30226_5ug5 1 . 17 . 4562 . 1 1 1 ILE HG22 H 2.446 2.116 -6.277 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG22 . . . . . . . . . c30226_5ug5 1 . 17 . 4563 . 1 1 1 ILE HG23 H 2.493 3.861 -6.033 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG23 . . . . . . . . . c30226_5ug5 1 . 17 . 4564 . 1 1 1 ILE N N 4.685 5.206 -4.699 . . . 1.0 . . . . . . . . . . . . A . 1 ILE N . . . . . . . . . c30226_5ug5 1 . 17 . 4565 . 1 1 1 ILE O O 6.558 4.202 -3.023 . . . 1.0 . . . . . . . . . . . . A . 1 ILE O . . . . . . . . . c30226_5ug5 1 . 17 . 4566 . 1 1 2 ARG C C 6.581 0.225 -2.022 . . . 1.0 . . . . . . . . . . . . A . 2 ARG C . . . . . . . . . c30226_5ug5 1 . 17 . 4567 . 1 1 2 ARG CA C 6.505 1.722 -1.776 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CA . . . . . . . . . c30226_5ug5 1 . 17 . 4568 . 1 1 2 ARG CB C 6.167 2.002 -0.306 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CB . . . . . . . . . c30226_5ug5 1 . 17 . 4569 . 1 1 2 ARG CD C 8.446 2.746 0.440 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CD . . . . . . . . . c30226_5ug5 1 . 17 . 4570 . 1 1 2 ARG CG C 7.312 1.760 0.662 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CG . . . . . . . . . c30226_5ug5 1 . 17 . 4571 . 1 1 2 ARG CZ C 10.378 3.581 1.722 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CZ . . . . . . . . . c30226_5ug5 1 . 17 . 4572 . 1 1 2 ARG H H 4.671 1.742 -2.793 . . . 1.0 . . . . . . . . . . . . A . 2 ARG H . . . . . . . . . c30226_5ug5 1 . 17 . 4573 . 1 1 2 ARG HA H 7.443 2.182 -2.030 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HA . . . . . . . . . c30226_5ug5 1 . 17 . 4574 . 1 1 2 ARG HB2 H 5.863 3.033 -0.214 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB2 . . . . . . . . . c30226_5ug5 1 . 17 . 4575 . 1 1 2 ARG HB3 H 5.339 1.368 -0.016 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB3 . . . . . . . . . c30226_5ug5 1 . 17 . 4576 . 1 1 2 ARG HD2 H 8.889 2.557 -0.526 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD2 . . . . . . . . . c30226_5ug5 1 . 17 . 4577 . 1 1 2 ARG HD3 H 8.043 3.748 0.460 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD3 . . . . . . . . . c30226_5ug5 1 . 17 . 4578 . 1 1 2 ARG HE H 9.495 1.797 2.002 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HE . . . . . . . . . c30226_5ug5 1 . 17 . 4579 . 1 1 2 ARG HG2 H 6.947 1.869 1.672 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG2 . . . . . . . . . c30226_5ug5 1 . 17 . 4580 . 1 1 2 ARG HG3 H 7.686 0.757 0.518 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG3 . . . . . . . . . c30226_5ug5 1 . 17 . 4581 . 1 1 2 ARG HH11 H 9.736 4.824 0.253 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH11 . . . . . . . . . c30226_5ug5 1 . 17 . 4582 . 1 1 2 ARG HH12 H 11.068 5.412 1.196 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH12 . . . . . . . . . c30226_5ug5 1 . 17 . 4583 . 1 1 2 ARG HH21 H 11.256 2.577 3.249 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH21 . . . . . . . . . c30226_5ug5 1 . 17 . 4584 . 1 1 2 ARG HH22 H 11.932 4.134 2.897 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH22 . . . . . . . . . c30226_5ug5 1 . 17 . 4585 . 1 1 2 ARG N N 5.473 2.276 -2.625 . . . 1.0 . . . . . . . . . . . . A . 2 ARG N . . . . . . . . . c30226_5ug5 1 . 17 . 4586 . 1 1 2 ARG NE N 9.479 2.630 1.464 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NE . . . . . . . . . c30226_5ug5 1 . 17 . 4587 . 1 1 2 ARG NH1 N 10.396 4.694 0.997 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH1 . . . . . . . . . c30226_5ug5 1 . 17 . 4588 . 1 1 2 ARG NH2 N 11.260 3.417 2.699 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH2 . . . . . . . . . c30226_5ug5 1 . 17 . 4589 . 1 1 2 ARG O O 5.565 -0.399 -2.321 . . . 1.0 . . . . . . . . . . . . A . 2 ARG O . . . . . . . . . c30226_5ug5 1 . 17 . 4590 . 1 1 3 ASP C C 7.580 -2.532 -0.818 . . . 1.0 . . . . . . . . . . . . A . 3 ASP C . . . . . . . . . c30226_5ug5 1 . 17 . 4591 . 1 1 3 ASP CA C 7.922 -1.799 -2.102 . . . 1.0 . . . . . . . . . . . . A . 3 ASP CA . . . . . . . . . c30226_5ug5 1 . 17 . 4592 . 1 1 3 ASP CB C 9.335 -2.142 -2.579 . . . 1.0 . . . . . . . . . . . . A . 3 ASP CB . . . . . . . . . c30226_5ug5 1 . 17 . 4593 . 1 1 3 ASP CG C 9.456 -3.575 -3.053 . . . 1.0 . . . . . . . . . . . . A . 3 ASP CG . . . . . . . . . c30226_5ug5 1 . 17 . 4594 . 1 1 3 ASP H H 8.555 0.188 -1.676 . . . 1.0 . . . . . . . . . . . . A . 3 ASP H . . . . . . . . . c30226_5ug5 1 . 17 . 4595 . 1 1 3 ASP HA H 7.210 -2.088 -2.846 . . . 1.0 . . . . . . . . . . . . A . 3 ASP HA . . . . . . . . . c30226_5ug5 1 . 17 . 4596 . 1 1 3 ASP HB2 H 9.598 -1.490 -3.398 . . . 1.0 . . . . . . . . . . . . A . 3 ASP HB2 . . . . . . . . . c30226_5ug5 1 . 17 . 4597 . 1 1 3 ASP HB3 H 10.029 -1.991 -1.767 . . . 1.0 . . . . . . . . . . . . A . 3 ASP HB3 . . . . . . . . . c30226_5ug5 1 . 17 . 4598 . 1 1 3 ASP N N 7.768 -0.358 -1.900 . . . 1.0 . . . . . . . . . . . . A . 3 ASP N . . . . . . . . . c30226_5ug5 1 . 17 . 4599 . 1 1 3 ASP O O 7.774 -3.734 -0.664 . . . 1.0 . . . . . . . . . . . . A . 3 ASP O . . . . . . . . . c30226_5ug5 1 . 17 . 4600 . 1 1 3 ASP OD1 O 8.839 -3.918 -4.087 . . . 1.0 . . . . . . . . . . . . A . 3 ASP OD1 . . . . . . . . . c30226_5ug5 1 . 17 . 4601 . 1 1 3 ASP OD2 O 10.173 -4.364 -2.400 . . . 1.0 . . . . . . . . . . . . A . 3 ASP OD2 . . . . . . . . . c30226_5ug5 1 . 17 . 4602 . 1 1 4 GLU C C 5.025 -1.947 1.352 . . . 1.0 . . . . . . . . . . . . A . 4 GLU C . . . . . . . . . c30226_5ug5 1 . 17 . 4603 . 1 1 4 GLU CA C 6.519 -2.211 1.347 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CA . . . . . . . . . c30226_5ug5 1 . 17 . 4604 . 1 1 4 GLU CB C 7.166 -1.448 2.481 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CB . . . . . . . . . c30226_5ug5 1 . 17 . 4605 . 1 1 4 GLU CD C 9.317 -0.658 3.513 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CD . . . . . . . . . c30226_5ug5 1 . 17 . 4606 . 1 1 4 GLU CG C 8.661 -1.674 2.605 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CG . . . . . . . . . c30226_5ug5 1 . 17 . 4607 . 1 1 4 GLU H H 7.007 -0.805 -0.121 . . . 1.0 . . . . . . . . . . . . A . 4 GLU H . . . . . . . . . c30226_5ug5 1 . 17 . 4608 . 1 1 4 GLU HA H 6.711 -3.267 1.450 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HA . . . . . . . . . c30226_5ug5 1 . 17 . 4609 . 1 1 4 GLU HB2 H 6.995 -0.392 2.332 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HB2 . . . . . . . . . c30226_5ug5 1 . 17 . 4610 . 1 1 4 GLU HB3 H 6.694 -1.751 3.387 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HB3 . . . . . . . . . c30226_5ug5 1 . 17 . 4611 . 1 1 4 GLU HG2 H 8.833 -2.661 3.007 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HG2 . . . . . . . . . c30226_5ug5 1 . 17 . 4612 . 1 1 4 GLU HG3 H 9.108 -1.601 1.624 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HG3 . . . . . . . . . c30226_5ug5 1 . 17 . 4613 . 1 1 4 GLU N N 7.054 -1.752 0.086 . . . 1.0 . . . . . . . . . . . . A . 4 GLU N . . . . . . . . . c30226_5ug5 1 . 17 . 4614 . 1 1 4 GLU O O 4.404 -1.764 2.394 . . . 1.0 . . . . . . . . . . . . A . 4 GLU O . . . . . . . . . c30226_5ug5 1 . 17 . 4615 . 1 1 4 GLU OE1 O 9.424 -0.927 4.730 . . . 1.0 . . . . . . . . . . . . A . 4 GLU OE1 . . . . . . . . . c30226_5ug5 1 . 17 . 4616 . 1 1 4 GLU OE2 O 9.737 0.406 3.023 . . . 1.0 . . . . . . . . . . . . A . 4 GLU OE2 . . . . . . . . . c30226_5ug5 1 . 17 . 4617 . 1 1 5 CYS C C 2.067 -2.007 0.751 . . . 1.0 . . . . . . . . . . . . A . 5 CYS C . . . . . . . . . c30226_5ug5 1 . 17 . 4618 . 1 1 5 CYS CA C 3.154 -1.386 -0.124 . . . 1.0 . . . . . . . . . . . . A . 5 CYS CA . . . . . . . . . c30226_5ug5 1 . 17 . 4619 . 1 1 5 CYS CB C 2.813 -1.598 -1.600 . . . 1.0 . . . . . . . . . . . . A . 5 CYS CB . . . . . . . . . c30226_5ug5 1 . 17 . 4620 . 1 1 5 CYS H H 5.016 -2.262 -0.586 . . . 1.0 . . . . . . . . . . . . A . 5 CYS H . . . . . . . . . c30226_5ug5 1 . 17 . 4621 . 1 1 5 CYS HA H 3.179 -0.324 0.069 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HA . . . . . . . . . c30226_5ug5 1 . 17 . 4622 . 1 1 5 CYS HB2 H 3.659 -1.302 -2.203 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HB2 . . . . . . . . . c30226_5ug5 1 . 17 . 4623 . 1 1 5 CYS HB3 H 2.608 -2.644 -1.766 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HB3 . . . . . . . . . c30226_5ug5 1 . 17 . 4624 . 1 1 5 CYS N N 4.487 -1.910 0.154 . . . 1.0 . . . . . . . . . . . . A . 5 CYS N . . . . . . . . . c30226_5ug5 1 . 17 . 4625 . 1 1 5 CYS O O 1.168 -1.305 1.213 . . . 1.0 . . . . . . . . . . . . A . 5 CYS O . . . . . . . . . c30226_5ug5 1 . 17 . 4626 . 1 1 5 CYS SG S 1.368 -0.651 -2.173 . . . 1.0 . . . . . . . . . . . . A . 5 CYS SG . . . . . . . . . c30226_5ug5 1 . 17 . 4627 . 1 1 6 CYS C C 1.206 -3.752 3.209 . . . 1.0 . . . . . . . . . . . . A . 6 CYS C . . . . . . . . . c30226_5ug5 1 . 17 . 4628 . 1 1 6 CYS CA C 1.095 -4.003 1.709 . . . 1.0 . . . . . . . . . . . . A . 6 CYS CA . . . . . . . . . c30226_5ug5 1 . 17 . 4629 . 1 1 6 CYS CB C 1.137 -5.500 1.403 . . . 1.0 . . . . . . . . . . . . A . 6 CYS CB . . . . . . . . . c30226_5ug5 1 . 17 . 4630 . 1 1 6 CYS H H 2.968 -3.790 0.740 . . . 1.0 . . . . . . . . . . . . A . 6 CYS H . . . . . . . . . c30226_5ug5 1 . 17 . 4631 . 1 1 6 CYS HA H 0.155 -3.601 1.362 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HA . . . . . . . . . c30226_5ug5 1 . 17 . 4632 . 1 1 6 CYS HB2 H 1.455 -5.645 0.382 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HB2 . . . . . . . . . c30226_5ug5 1 . 17 . 4633 . 1 1 6 CYS HB3 H 1.841 -5.978 2.068 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HB3 . . . . . . . . . c30226_5ug5 1 . 17 . 4634 . 1 1 6 CYS N N 2.160 -3.302 1.004 . . . 1.0 . . . . . . . . . . . . A . 6 CYS N . . . . . . . . . c30226_5ug5 1 . 17 . 4635 . 1 1 6 CYS O O 0.232 -3.878 3.952 . . . 1.0 . . . . . . . . . . . . A . 6 CYS O . . . . . . . . . c30226_5ug5 1 . 17 . 4636 . 1 1 6 CYS SG S -0.472 -6.332 1.606 . . . 1.0 . . . . . . . . . . . . A . 6 CYS SG . . . . . . . . . c30226_5ug5 1 . 17 . 4637 . 1 1 7 SER C C 2.316 -1.485 5.179 . . . 1.0 . . . . . . . . . . . . A . 7 SER C . . . . . . . . . c30226_5ug5 1 . 17 . 4638 . 1 1 7 SER CA C 2.616 -2.957 5.014 . . . 1.0 . . . . . . . . . . . . A . 7 SER CA . . . . . . . . . c30226_5ug5 1 . 17 . 4639 . 1 1 7 SER CB C 4.061 -3.185 5.423 . . . 1.0 . . . . . . . . . . . . A . 7 SER CB . . . . . . . . . c30226_5ug5 1 . 17 . 4640 . 1 1 7 SER H H 3.161 -3.399 3.025 . . . 1.0 . . . . . . . . . . . . A . 7 SER H . . . . . . . . . c30226_5ug5 1 . 17 . 4641 . 1 1 7 SER HA H 1.970 -3.530 5.656 . . . 1.0 . . . . . . . . . . . . A . 7 SER HA . . . . . . . . . c30226_5ug5 1 . 17 . 4642 . 1 1 7 SER HB2 H 4.692 -3.046 4.558 . . . 1.0 . . . . . . . . . . . . A . 7 SER HB2 . . . . . . . . . c30226_5ug5 1 . 17 . 4643 . 1 1 7 SER HB3 H 4.326 -2.455 6.179 . . . 1.0 . . . . . . . . . . . . A . 7 SER HB3 . . . . . . . . . c30226_5ug5 1 . 17 . 4644 . 1 1 7 SER HG H 4.038 -5.142 5.240 . . . 1.0 . . . . . . . . . . . . A . 7 SER HG . . . . . . . . . c30226_5ug5 1 . 17 . 4645 . 1 1 7 SER N N 2.398 -3.379 3.644 . . . 1.0 . . . . . . . . . . . . A . 7 SER N . . . . . . . . . c30226_5ug5 1 . 17 . 4646 . 1 1 7 SER O O 1.730 -1.062 6.172 . . . 1.0 . . . . . . . . . . . . A . 7 SER O . . . . . . . . . c30226_5ug5 1 . 17 . 4647 . 1 1 7 SER OG O 4.264 -4.497 5.926 . . . 1.0 . . . . . . . . . . . . A . 7 SER OG . . . . . . . . . c30226_5ug5 1 . 17 . 4648 . 1 1 8 ASN C C 1.378 1.350 4.198 . . . 1.0 . . . . . . . . . . . . A . 8 ASN C . . . . . . . . . c30226_5ug5 1 . 17 . 4649 . 1 1 8 ASN CA C 2.764 0.726 4.327 . . . 1.0 . . . . . . . . . . . . A . 8 ASN CA . . . . . . . . . c30226_5ug5 1 . 17 . 4650 . 1 1 8 ASN CB C 3.701 1.323 3.277 . . . 1.0 . . . . . . . . . . . . A . 8 ASN CB . . . . . . . . . c30226_5ug5 1 . 17 . 4651 . 1 1 8 ASN CG C 3.783 2.837 3.350 . . . 1.0 . . . . . . . . . . . . A . 8 ASN CG . . . . . . . . . c30226_5ug5 1 . 17 . 4652 . 1 1 8 ASN H H 2.965 -1.125 3.326 . . . 1.0 . . . . . . . . . . . . A . 8 ASN H . . . . . . . . . c30226_5ug5 1 . 17 . 4653 . 1 1 8 ASN HA H 3.164 0.924 5.312 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HA . . . . . . . . . c30226_5ug5 1 . 17 . 4654 . 1 1 8 ASN HB2 H 4.692 0.921 3.419 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HB2 . . . . . . . . . c30226_5ug5 1 . 17 . 4655 . 1 1 8 ASN HB3 H 3.344 1.046 2.296 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HB3 . . . . . . . . . c30226_5ug5 1 . 17 . 4656 . 1 1 8 ASN HD21 H 4.187 2.939 1.409 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HD21 . . . . . . . . . c30226_5ug5 1 . 17 . 4657 . 1 1 8 ASN HD22 H 4.133 4.450 2.243 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HD22 . . . . . . . . . c30226_5ug5 1 . 17 . 4658 . 1 1 8 ASN N N 2.711 -0.713 4.186 . . . 1.0 . . . . . . . . . . . . A . 8 ASN N . . . . . . . . . c30226_5ug5 1 . 17 . 4659 . 1 1 8 ASN ND2 N 4.057 3.471 2.221 . . . 1.0 . . . . . . . . . . . . A . 8 ASN ND2 . . . . . . . . . c30226_5ug5 1 . 17 . 4660 . 1 1 8 ASN O O 0.760 1.285 3.135 . . . 1.0 . . . . . . . . . . . . A . 8 ASN O . . . . . . . . . c30226_5ug5 1 . 17 . 4661 . 1 1 8 ASN OD1 O 3.598 3.433 4.408 . . . 1.0 . . . . . . . . . . . . A . 8 ASN OD1 . . . . . . . . . c30226_5ug5 1 . 17 . 4662 . 1 1 9 PRO C C -0.591 3.673 4.223 . . . 1.0 . . . . . . . . . . . . A . 9 PRO C . . . . . . . . . c30226_5ug5 1 . 17 . 4663 . 1 1 9 PRO CA C -0.428 2.628 5.318 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CA . . . . . . . . . c30226_5ug5 1 . 17 . 4664 . 1 1 9 PRO CB C -0.423 3.302 6.688 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CB . . . . . . . . . c30226_5ug5 1 . 17 . 4665 . 1 1 9 PRO CD C 1.563 2.080 6.584 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CD . . . . . . . . . c30226_5ug5 1 . 17 . 4666 . 1 1 9 PRO CG C 0.457 2.464 7.508 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CG . . . . . . . . . c30226_5ug5 1 . 17 . 4667 . 1 1 9 PRO HA H -1.237 1.915 5.266 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HA . . . . . . . . . c30226_5ug5 1 . 17 . 4668 . 1 1 9 PRO HB2 H -0.007 4.281 6.595 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HB2 . . . . . . . . . c30226_5ug5 1 . 17 . 4669 . 1 1 9 PRO HB3 H -1.423 3.351 7.088 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HB3 . . . . . . . . . c30226_5ug5 1 . 17 . 4670 . 1 1 9 PRO HD2 H 2.328 2.843 6.562 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HD2 . . . . . . . . . c30226_5ug5 1 . 17 . 4671 . 1 1 9 PRO HD3 H 1.971 1.147 6.878 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HD3 . . . . . . . . . c30226_5ug5 1 . 17 . 4672 . 1 1 9 PRO HG2 H 0.836 3.040 8.333 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HG2 . . . . . . . . . c30226_5ug5 1 . 17 . 4673 . 1 1 9 PRO HG3 H -0.072 1.588 7.856 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HG3 . . . . . . . . . c30226_5ug5 1 . 17 . 4674 . 1 1 9 PRO N N 0.883 1.971 5.282 . . . 1.0 . . . . . . . . . . . . A . 9 PRO N . . . . . . . . . c30226_5ug5 1 . 17 . 4675 . 1 1 9 PRO O O -1.694 3.918 3.743 . . . 1.0 . . . . . . . . . . . . A . 9 PRO O . . . . . . . . . c30226_5ug5 1 . 17 . 4676 . 1 1 10 ALA C C 0.286 4.681 1.407 . . . 1.0 . . . . . . . . . . . . A . 10 ALA C . . . . . . . . . c30226_5ug5 1 . 17 . 4677 . 1 1 10 ALA CA C 0.502 5.301 2.788 . . . 1.0 . . . . . . . . . . . . A . 10 ALA CA . . . . . . . . . c30226_5ug5 1 . 17 . 4678 . 1 1 10 ALA CB C 1.795 6.101 2.811 . . . 1.0 . . . . . . . . . . . . A . 10 ALA CB . . . . . . . . . c30226_5ug5 1 . 17 . 4679 . 1 1 10 ALA H H 1.367 4.054 4.271 . . . 1.0 . . . . . . . . . . . . A . 10 ALA H . . . . . . . . . c30226_5ug5 1 . 17 . 4680 . 1 1 10 ALA HA H -0.314 5.977 2.996 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HA . . . . . . . . . c30226_5ug5 1 . 17 . 4681 . 1 1 10 ALA HB1 H 2.623 5.453 2.571 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HB1 . . . . . . . . . c30226_5ug5 1 . 17 . 4682 . 1 1 10 ALA HB2 H 1.940 6.522 3.794 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HB2 . . . . . . . . . c30226_5ug5 1 . 17 . 4683 . 1 1 10 ALA HB3 H 1.738 6.898 2.084 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HB3 . . . . . . . . . c30226_5ug5 1 . 17 . 4684 . 1 1 10 ALA N N 0.517 4.283 3.832 . . . 1.0 . . . . . . . . . . . . A . 10 ALA N . . . . . . . . . c30226_5ug5 1 . 17 . 4685 . 1 1 10 ALA O O -0.170 5.354 0.481 . . . 1.0 . . . . . . . . . . . . A . 10 ALA O . . . . . . . . . c30226_5ug5 1 . 17 . 4686 . 1 1 11 CYS C C -0.897 2.170 -0.012 . . . 1.0 . . . . . . . . . . . . A . 11 CYS C . . . . . . . . . c30226_5ug5 1 . 17 . 4687 . 1 1 11 CYS CA C 0.477 2.735 -0.009 . . . 1.0 . . . . . . . . . . . . A . 11 CYS CA . . . . . . . . . c30226_5ug5 1 . 17 . 4688 . 1 1 11 CYS CB C 1.534 1.645 -0.178 . . . 1.0 . . . . . . . . . . . . A . 11 CYS CB . . . . . . . . . c30226_5ug5 1 . 17 . 4689 . 1 1 11 CYS H H 0.725 2.838 2.074 . . . 1.0 . . . . . . . . . . . . A . 11 CYS H . . . . . . . . . c30226_5ug5 1 . 17 . 4690 . 1 1 11 CYS HA H 0.563 3.461 -0.795 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HA . . . . . . . . . c30226_5ug5 1 . 17 . 4691 . 1 1 11 CYS HB2 H 2.446 1.958 0.311 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HB2 . . . . . . . . . c30226_5ug5 1 . 17 . 4692 . 1 1 11 CYS HB3 H 1.178 0.731 0.283 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HB3 . . . . . . . . . c30226_5ug5 1 . 17 . 4693 . 1 1 11 CYS N N 0.595 3.396 1.272 . . . 1.0 . . . . . . . . . . . . A . 11 CYS N . . . . . . . . . c30226_5ug5 1 . 17 . 4694 . 1 1 11 CYS O O -1.673 2.290 -0.955 . . . 1.0 . . . . . . . . . . . . A . 11 CYS O . . . . . . . . . c30226_5ug5 1 . 17 . 4695 . 1 1 11 CYS SG S 1.936 1.278 -1.919 . . . 1.0 . . . . . . . . . . . . A . 11 CYS SG . . . . . . . . . c30226_5ug5 1 . 17 . 4696 . 1 1 12 ARG C C -3.562 2.160 1.333 . . . 1.0 . . . . . . . . . . . . A . 12 ARG C . . . . . . . . . c30226_5ug5 1 . 17 . 4697 . 1 1 12 ARG CA C -2.462 1.107 1.486 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CA . . . . . . . . . c30226_5ug5 1 . 17 . 4698 . 1 1 12 ARG CB C -2.366 0.594 2.902 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CB . . . . . . . . . c30226_5ug5 1 . 17 . 4699 . 1 1 12 ARG CD C -1.087 -1.181 4.136 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CD . . . . . . . . . c30226_5ug5 1 . 17 . 4700 . 1 1 12 ARG CG C -1.991 -0.873 2.961 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CG . . . . . . . . . c30226_5ug5 1 . 17 . 4701 . 1 1 12 ARG CZ C -1.541 -1.648 6.517 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CZ . . . . . . . . . c30226_5ug5 1 . 17 . 4702 . 1 1 12 ARG H H -0.448 1.479 1.789 . . . 1.0 . . . . . . . . . . . . A . 12 ARG H . . . . . . . . . c30226_5ug5 1 . 17 . 4703 . 1 1 12 ARG HA H -2.663 0.290 0.838 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HA . . . . . . . . . c30226_5ug5 1 . 17 . 4704 . 1 1 12 ARG HB2 H -1.605 1.158 3.422 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HB2 . . . . . . . . . c30226_5ug5 1 . 17 . 4705 . 1 1 12 ARG HB3 H -3.297 0.740 3.386 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HB3 . . . . . . . . . c30226_5ug5 1 . 17 . 4706 . 1 1 12 ARG HD2 H -0.821 -2.227 4.099 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HD2 . . . . . . . . . c30226_5ug5 1 . 17 . 4707 . 1 1 12 ARG HD3 H -0.188 -0.579 4.042 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HD3 . . . . . . . . . c30226_5ug5 1 . 17 . 4708 . 1 1 12 ARG HE H -2.292 -0.105 5.482 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HE . . . . . . . . . c30226_5ug5 1 . 17 . 4709 . 1 1 12 ARG HG2 H -2.887 -1.455 3.049 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HG2 . . . . . . . . . c30226_5ug5 1 . 17 . 4710 . 1 1 12 ARG HG3 H -1.477 -1.138 2.048 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HG3 . . . . . . . . . c30226_5ug5 1 . 17 . 4711 . 1 1 12 ARG HH11 H -0.399 -3.050 5.591 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH11 . . . . . . . . . c30226_5ug5 1 . 17 . 4712 . 1 1 12 ARG HH12 H -0.673 -3.315 7.284 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH12 . . . . . . . . . c30226_5ug5 1 . 17 . 4713 . 1 1 12 ARG HH21 H -2.676 -0.462 7.708 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH21 . . . . . . . . . c30226_5ug5 1 . 17 . 4714 . 1 1 12 ARG HH22 H -1.983 -1.849 8.487 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH22 . . . . . . . . . c30226_5ug5 1 . 17 . 4715 . 1 1 12 ARG N N -1.177 1.601 1.136 . . . 1.0 . . . . . . . . . . . . A . 12 ARG N . . . . . . . . . c30226_5ug5 1 . 17 . 4716 . 1 1 12 ARG NE N -1.717 -0.901 5.424 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NE . . . . . . . . . c30226_5ug5 1 . 17 . 4717 . 1 1 12 ARG NH1 N -0.815 -2.761 6.460 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NH1 . . . . . . . . . c30226_5ug5 1 . 17 . 4718 . 1 1 12 ARG NH2 N -2.111 -1.291 7.662 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NH2 . . . . . . . . . c30226_5ug5 1 . 17 . 4719 . 1 1 12 ARG O O -4.737 1.824 1.175 . . . 1.0 . . . . . . . . . . . . A . 12 ARG O . . . . . . . . . c30226_5ug5 1 . 17 . 4720 . 1 1 13 TYR C C -4.757 4.366 -0.266 . . . 1.0 . . . . . . . . . . . . A . 13 TYR C . . . . . . . . . c30226_5ug5 1 . 17 . 4721 . 1 1 13 TYR CA C -4.089 4.523 1.103 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CA . . . . . . . . . c30226_5ug5 1 . 17 . 4722 . 1 1 13 TYR CB C -3.322 5.839 1.194 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CB . . . . . . . . . c30226_5ug5 1 . 17 . 4723 . 1 1 13 TYR CD1 C -5.069 7.636 1.371 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CD1 . . . . . . . . . c30226_5ug5 1 . 17 . 4724 . 1 1 13 TYR CD2 C -3.719 7.532 -0.572 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CD2 . . . . . . . . . c30226_5ug5 1 . 17 . 4725 . 1 1 13 TYR CE1 C -5.730 8.734 0.861 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CE1 . . . . . . . . . c30226_5ug5 1 . 17 . 4726 . 1 1 13 TYR CE2 C -4.366 8.623 -1.094 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CE2 . . . . . . . . . c30226_5ug5 1 . 17 . 4727 . 1 1 13 TYR CG C -4.058 7.024 0.658 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CG . . . . . . . . . c30226_5ug5 1 . 17 . 4728 . 1 1 13 TYR CZ C -5.373 9.225 -0.376 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CZ . . . . . . . . . c30226_5ug5 1 . 17 . 4729 . 1 1 13 TYR H H -2.237 3.639 1.544 . . . 1.0 . . . . . . . . . . . . A . 13 TYR H . . . . . . . . . c30226_5ug5 1 . 17 . 4730 . 1 1 13 TYR HA H -4.846 4.505 1.867 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HA . . . . . . . . . c30226_5ug5 1 . 17 . 4731 . 1 1 13 TYR HB2 H -3.078 6.039 2.224 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HB2 . . . . . . . . . c30226_5ug5 1 . 17 . 4732 . 1 1 13 TYR HB3 H -2.415 5.747 0.627 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HB3 . . . . . . . . . c30226_5ug5 1 . 17 . 4733 . 1 1 13 TYR HD1 H -5.338 7.239 2.336 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HD1 . . . . . . . . . c30226_5ug5 1 . 17 . 4734 . 1 1 13 TYR HD2 H -2.931 7.051 -1.128 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HD2 . . . . . . . . . c30226_5ug5 1 . 17 . 4735 . 1 1 13 TYR HE1 H -6.515 9.203 1.426 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HE1 . . . . . . . . . c30226_5ug5 1 . 17 . 4736 . 1 1 13 TYR HE2 H -4.082 8.997 -2.056 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HE2 . . . . . . . . . c30226_5ug5 1 . 17 . 4737 . 1 1 13 TYR HH H -6.241 10.154 -1.827 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HH . . . . . . . . . c30226_5ug5 1 . 17 . 4738 . 1 1 13 TYR N N -3.172 3.430 1.353 . . . 1.0 . . . . . . . . . . . . A . 13 TYR N . . . . . . . . . c30226_5ug5 1 . 17 . 4739 . 1 1 13 TYR O O -5.929 4.697 -0.440 . . . 1.0 . . . . . . . . . . . . A . 13 TYR O . . . . . . . . . c30226_5ug5 1 . 17 . 4740 . 1 1 13 TYR OH O -6.026 10.322 -0.896 . . . 1.0 . . . . . . . . . . . . A . 13 TYR OH . . . . . . . . . c30226_5ug5 1 . 17 . 4741 . 1 1 14 ASN C C -4.572 2.089 -2.792 . . . 1.0 . . . . . . . . . . . . A . 14 ASN C . . . . . . . . . c30226_5ug5 1 . 17 . 4742 . 1 1 14 ASN CA C -4.536 3.589 -2.563 . . . 1.0 . . . . . . . . . . . . A . 14 ASN CA . . . . . . . . . c30226_5ug5 1 . 17 . 4743 . 1 1 14 ASN CB C -3.687 4.279 -3.641 . . . 1.0 . . . . . . . . . . . . A . 14 ASN CB . . . . . . . . . c30226_5ug5 1 . 17 . 4744 . 1 1 14 ASN CG C -2.234 3.832 -3.637 . . . 1.0 . . . . . . . . . . . . A . 14 ASN CG . . . . . . . . . c30226_5ug5 1 . 17 . 4745 . 1 1 14 ASN H H -3.076 3.577 -1.030 . . . 1.0 . . . . . . . . . . . . A . 14 ASN H . . . . . . . . . c30226_5ug5 1 . 17 . 4746 . 1 1 14 ASN HA H -5.544 3.973 -2.601 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HA . . . . . . . . . c30226_5ug5 1 . 17 . 4747 . 1 1 14 ASN HB2 H -4.105 4.057 -4.610 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HB2 . . . . . . . . . c30226_5ug5 1 . 17 . 4748 . 1 1 14 ASN HB3 H -3.715 5.347 -3.480 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HB3 . . . . . . . . . c30226_5ug5 1 . 17 . 4749 . 1 1 14 ASN HD21 H -1.736 5.366 -2.480 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HD21 . . . . . . . . . c30226_5ug5 1 . 17 . 4750 . 1 1 14 ASN HD22 H -0.442 4.308 -2.919 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HD22 . . . . . . . . . c30226_5ug5 1 . 17 . 4751 . 1 1 14 ASN N N -4.006 3.845 -1.230 . . . 1.0 . . . . . . . . . . . . A . 14 ASN N . . . . . . . . . c30226_5ug5 1 . 17 . 4752 . 1 1 14 ASN ND2 N -1.387 4.576 -2.943 . . . 1.0 . . . . . . . . . . . . A . 14 ASN ND2 . . . . . . . . . c30226_5ug5 1 . 17 . 4753 . 1 1 14 ASN O O -4.735 1.609 -3.915 . . . 1.0 . . . . . . . . . . . . A . 14 ASN O . . . . . . . . . c30226_5ug5 1 . 17 . 4754 . 1 1 14 ASN OD1 O -1.870 2.846 -4.278 . . . 1.0 . . . . . . . . . . . . A . 14 ASN OD1 . . . . . . . . . c30226_5ug5 1 . 17 . 4755 . 1 1 15 ASN C C -4.883 -0.730 -0.499 . . . 1.0 . . . . . . . . . . . . A . 15 ASN C . . . . . . . . . c30226_5ug5 1 . 17 . 4756 . 1 1 15 ASN CA C -4.246 -0.076 -1.730 . . . 1.0 . . . . . . . . . . . . A . 15 ASN CA . . . . . . . . . c30226_5ug5 1 . 17 . 4757 . 1 1 15 ASN CB C -2.747 -0.324 -1.832 . . . 1.0 . . . . . . . . . . . . A . 15 ASN CB . . . . . . . . . c30226_5ug5 1 . 17 . 4758 . 1 1 15 ASN CG C -2.241 -1.629 -1.236 . . . 1.0 . . . . . . . . . . . . A . 15 ASN CG . . . . . . . . . c30226_5ug5 1 . 17 . 4759 . 1 1 15 ASN H H -4.417 1.818 -0.827 . . . 1.0 . . . . . . . . . . . . A . 15 ASN H . . . . . . . . . c30226_5ug5 1 . 17 . 4760 . 1 1 15 ASN HA H -4.732 -0.450 -2.615 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HA . . . . . . . . . c30226_5ug5 1 . 17 . 4761 . 1 1 15 ASN HB2 H -2.466 -0.307 -2.874 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HB2 . . . . . . . . . c30226_5ug5 1 . 17 . 4762 . 1 1 15 ASN HB3 H -2.265 0.495 -1.335 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HB3 . . . . . . . . . c30226_5ug5 1 . 17 . 4763 . 1 1 15 ASN HD21 H -0.586 -0.695 -0.650 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HD21 . . . . . . . . . c30226_5ug5 1 . 17 . 4764 . 1 1 15 ASN HD22 H -0.696 -2.383 -0.256 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HD22 . . . . . . . . . c30226_5ug5 1 . 17 . 4765 . 1 1 15 ASN N N -4.427 1.363 -1.697 . . . 1.0 . . . . . . . . . . . . A . 15 ASN N . . . . . . . . . c30226_5ug5 1 . 17 . 4766 . 1 1 15 ASN ND2 N -1.058 -1.567 -0.656 . . . 1.0 . . . . . . . . . . . . A . 15 ASN ND2 . . . . . . . . . c30226_5ug5 1 . 17 . 4767 . 1 1 15 ASN O O -4.227 -1.100 0.474 . . . 1.0 . . . . . . . . . . . . A . 15 ASN O . . . . . . . . . c30226_5ug5 1 . 17 . 4768 . 1 1 15 ASN OD1 O -2.903 -2.671 -1.285 . . . 1.0 . . . . . . . . . . . . A . 15 ASN OD1 . . . . . . . . . c30226_5ug5 1 . 17 . 4769 . 1 1 16 HYP C C -7.332 -2.892 0.140 . . . 1.0 . . . . . . . . . . . . A . 16 HYP C . . . . . . . . . c30226_5ug5 1 . 17 . 4770 . 1 1 16 HYP CA C -6.983 -1.471 0.543 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CA . . . . . . . . . c30226_5ug5 1 . 17 . 4771 . 1 1 16 HYP CB C -8.191 -0.549 0.563 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CB . . . . . . . . . c30226_5ug5 1 . 17 . 4772 . 1 1 16 HYP CD C -7.091 -0.123 -1.464 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CD . . . . . . . . . c30226_5ug5 1 . 17 . 4773 . 1 1 16 HYP CG C -8.037 0.514 -0.516 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CG . . . . . . . . . c30226_5ug5 1 . 17 . 4774 . 1 1 16 HYP HA H -6.482 -1.466 1.486 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HA . . . . . . . . . c30226_5ug5 1 . 17 . 4775 . 1 1 16 HYP HB2 H -8.261 -0.064 1.524 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HB2 . . . . . . . . . c30226_5ug5 1 . 17 . 4776 . 1 1 16 HYP HB3 H -9.087 -1.129 0.380 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HB3 . . . . . . . . . c30226_5ug5 1 . 17 . 4777 . 1 1 16 HYP HD1 H -6.405 1.517 -0.078 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HD1 . . . . . . . . . c30226_5ug5 1 . 17 . 4778 . 1 1 16 HYP HD22 H -7.591 -0.823 -2.099 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HD22 . . . . . . . . . c30226_5ug5 1 . 17 . 4779 . 1 1 16 HYP HD23 H -6.555 0.616 -2.038 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HD23 . . . . . . . . . c30226_5ug5 1 . 17 . 4780 . 1 1 16 HYP HG H -8.982 0.762 -0.970 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HG . . . . . . . . . c30226_5ug5 1 . 17 . 4781 . 1 1 16 HYP N N -6.203 -0.798 -0.503 . . . 1.0 . . . . . . . . . . . . A . 16 HYP N . . . . . . . . . c30226_5ug5 1 . 17 . 4782 . 1 1 16 HYP O O -7.892 -3.674 0.911 . . . 1.0 . . . . . . . . . . . . A . 16 HYP O . . . . . . . . . c30226_5ug5 1 . 17 . 4783 . 1 1 16 HYP OD1 O -7.373 1.668 -0.003 . . . 1.0 . . . . . . . . . . . . A . 16 HYP OD1 . . . . . . . . . c30226_5ug5 1 . 17 . 4784 . 1 1 17 HIS C C -6.297 -4.585 -2.960 . . . 1.0 . . . . . . . . . . . . A . 17 HIS C . . . . . . . . . c30226_5ug5 1 . 17 . 4785 . 1 1 17 HIS CA C -7.123 -4.516 -1.674 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CA . . . . . . . . . c30226_5ug5 1 . 17 . 4786 . 1 1 17 HIS CB C -8.602 -4.825 -1.948 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CB . . . . . . . . . c30226_5ug5 1 . 17 . 4787 . 1 1 17 HIS CD2 C -8.586 -7.415 -1.751 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CD2 . . . . . . . . . c30226_5ug5 1 . 17 . 4788 . 1 1 17 HIS CE1 C -9.557 -7.885 -3.656 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CE1 . . . . . . . . . c30226_5ug5 1 . 17 . 4789 . 1 1 17 HIS CG C -8.858 -6.242 -2.370 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CG . . . . . . . . . c30226_5ug5 1 . 17 . 4790 . 1 1 17 HIS H H -6.586 -2.472 -1.626 . . . 1.0 . . . . . . . . . . . . A . 17 HIS H . . . . . . . . . c30226_5ug5 1 . 17 . 4791 . 1 1 17 HIS HA H -6.734 -5.236 -0.972 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HA . . . . . . . . . c30226_5ug5 1 . 17 . 4792 . 1 1 17 HIS HB2 H -9.170 -4.640 -1.050 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HB2 . . . . . . . . . c30226_5ug5 1 . 17 . 4793 . 1 1 17 HIS HB3 H -8.957 -4.175 -2.733 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HB3 . . . . . . . . . c30226_5ug5 1 . 17 . 4794 . 1 1 17 HIS HD1 H -9.794 -5.938 -4.233 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HD1 . . . . . . . . . c30226_5ug5 1 . 17 . 4795 . 1 1 17 HIS HD2 H -8.108 -7.536 -0.790 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HD2 . . . . . . . . . c30226_5ug5 1 . 17 . 4796 . 1 1 17 HIS HE1 H -9.988 -8.431 -4.483 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HE1 . . . . . . . . . c30226_5ug5 1 . 17 . 4797 . 1 1 17 HIS HE2 H -8.845 -9.378 -2.450 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HE2 . . . . . . . . . c30226_5ug5 1 . 17 . 4798 . 1 1 17 HIS N N -6.972 -3.190 -1.088 . . . 1.0 . . . . . . . . . . . . A . 17 HIS N . . . . . . . . . c30226_5ug5 1 . 17 . 4799 . 1 1 17 HIS ND1 N -9.467 -6.573 -3.560 . . . 1.0 . . . . . . . . . . . . A . 17 HIS ND1 . . . . . . . . . c30226_5ug5 1 . 17 . 4800 . 1 1 17 HIS NE2 N -9.029 -8.420 -2.573 . . . 1.0 . . . . . . . . . . . . A . 17 HIS NE2 . . . . . . . . . c30226_5ug5 1 . 17 . 4801 . 1 1 17 HIS O O -6.730 -5.119 -3.980 . . . 1.0 . . . . . . . . . . . . A . 17 HIS O . . . . . . . . . c30226_5ug5 1 . 17 . 4802 . 1 1 18 VAL C C -3.142 -5.037 -3.949 . . . 1.0 . . . . . . . . . . . . A . 18 VAL C . . . . . . . . . c30226_5ug5 1 . 17 . 4803 . 1 1 18 VAL CA C -4.213 -3.956 -4.044 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CA . . . . . . . . . c30226_5ug5 1 . 17 . 4804 . 1 1 18 VAL CB C -3.596 -2.539 -4.135 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CB . . . . . . . . . c30226_5ug5 1 . 17 . 4805 . 1 1 18 VAL CG1 C -2.112 -2.562 -4.458 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CG1 . . . . . . . . . c30226_5ug5 1 . 17 . 4806 . 1 1 18 VAL CG2 C -4.345 -1.692 -5.147 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CG2 . . . . . . . . . c30226_5ug5 1 . 17 . 4807 . 1 1 18 VAL H H -4.785 -3.653 -2.045 . . . 1.0 . . . . . . . . . . . . A . 18 VAL H . . . . . . . . . c30226_5ug5 1 . 17 . 4808 . 1 1 18 VAL HA H -4.802 -4.130 -4.923 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HA . . . . . . . . . c30226_5ug5 1 . 17 . 4809 . 1 1 18 VAL HB H -3.712 -2.073 -3.171 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HB . . . . . . . . . c30226_5ug5 1 . 17 . 4810 . 1 1 18 VAL HG11 H -1.966 -2.834 -5.491 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG11 . . . . . . . . . c30226_5ug5 1 . 17 . 4811 . 1 1 18 VAL HG12 H -1.625 -3.284 -3.819 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG12 . . . . . . . . . c30226_5ug5 1 . 17 . 4812 . 1 1 18 VAL HG13 H -1.696 -1.580 -4.271 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG13 . . . . . . . . . c30226_5ug5 1 . 17 . 4813 . 1 1 18 VAL HG21 H -4.198 -2.097 -6.134 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG21 . . . . . . . . . c30226_5ug5 1 . 17 . 4814 . 1 1 18 VAL HG22 H -3.970 -0.680 -5.112 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG22 . . . . . . . . . c30226_5ug5 1 . 17 . 4815 . 1 1 18 VAL HG23 H -5.396 -1.695 -4.910 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG23 . . . . . . . . . c30226_5ug5 1 . 17 . 4816 . 1 1 18 VAL N N -5.097 -4.024 -2.896 . . . 1.0 . . . . . . . . . . . . A . 18 VAL N . . . . . . . . . c30226_5ug5 1 . 17 . 4817 . 1 1 18 VAL O O -2.600 -5.496 -4.958 . . . 1.0 . . . . . . . . . . . . A . 18 VAL O . . . . . . . . . c30226_5ug5 1 . 17 . 4818 . 1 1 19 CYS C C -2.673 -7.792 -2.064 . . . 1.0 . . . . . . . . . . . . A . 19 CYS C . . . . . . . . . c30226_5ug5 1 . 17 . 4819 . 1 1 19 CYS CA C -1.925 -6.527 -2.473 . . . 1.0 . . . . . . . . . . . . A . 19 CYS CA . . . . . . . . . c30226_5ug5 1 . 17 . 4820 . 1 1 19 CYS CB C -0.904 -6.116 -1.402 . . . 1.0 . . . . . . . . . . . . A . 19 CYS CB . . . . . . . . . c30226_5ug5 1 . 17 . 4821 . 1 1 19 CYS H H -3.328 -5.034 -1.973 . . . 1.0 . . . . . . . . . . . . A . 19 CYS H . . . . . . . . . c30226_5ug5 1 . 17 . 4822 . 1 1 19 CYS HA H -1.402 -6.724 -3.398 . . . 1.0 . . . . . . . . . . . . A . 19 CYS HA . . . . . . . . . c30226_5ug5 1 . 17 . 4823 . 1 1 19 CYS HB2 H -0.294 -6.970 -1.157 . . . 1.0 . . . . . . . . . . . . A . 19 CYS HB2 . . . . . . . . . c30226_5ug5 1 . 17 . 4824 . 1 1 19 CYS HB3 H -0.274 -5.336 -1.803 . . . 1.0 . . . . . . . . . . . . A . 19 CYS HB3 . . . . . . . . . c30226_5ug5 1 . 17 . 4825 . 1 1 19 CYS N N -2.870 -5.454 -2.726 . . . 1.0 . . . . . . . . . . . . A . 19 CYS N . . . . . . . . . c30226_5ug5 1 . 17 . 4826 . 1 1 19 CYS O O -3.035 -8.581 -2.960 . . . 1.0 . . . . . . . . . . . . A . 19 CYS O . . . . . . . . . c30226_5ug5 1 . 17 . 4827 . 1 1 19 CYS OXT O -2.929 -7.983 -0.856 . . . 1.0 . . . . . . . . . . . . A . 19 CYS OXT . . . . . . . . . c30226_5ug5 1 . 17 . 4828 . 1 1 19 CYS SG S -1.628 -5.496 0.157 . . . 1.0 . . . . . . . . . . . . A . 19 CYS SG . . . . . . . . . c30226_5ug5 1 . 18 . 4829 . 1 1 1 ILE C C 2.591 -9.940 6.177 . . . 1.0 . . . . . . . . . . . . A . 1 ILE C . . . . . . . . . c30226_5ug5 1 . 18 . 4830 . 1 1 1 ILE CA C 3.233 -9.812 7.550 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CA . . . . . . . . . c30226_5ug5 1 . 18 . 4831 . 1 1 1 ILE CB C 4.769 -9.763 7.391 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CB . . . . . . . . . c30226_5ug5 1 . 18 . 4832 . 1 1 1 ILE CD1 C 6.781 -11.036 6.480 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CD1 . . . . . . . . . c30226_5ug5 1 . 18 . 4833 . 1 1 1 ILE CG1 C 5.294 -11.060 6.765 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CG1 . . . . . . . . . c30226_5ug5 1 . 18 . 4834 . 1 1 1 ILE CG2 C 5.431 -9.507 8.738 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CG2 . . . . . . . . . c30226_5ug5 1 . 18 . 4835 . 1 1 1 ILE H1 H 1.768 -10.898 8.548 . . . 1.0 . . . . . . . . . . . . A . 1 ILE H1 . . . . . . . . . c30226_5ug5 1 . 18 . 4836 . 1 1 1 ILE H2 H 3.253 -10.859 9.353 . . . 1.0 . . . . . . . . . . . . A . 1 ILE H2 . . . . . . . . . c30226_5ug5 1 . 18 . 4837 . 1 1 1 ILE H3 H 3.057 -11.838 7.993 . . . 1.0 . . . . . . . . . . . . A . 1 ILE H3 . . . . . . . . . c30226_5ug5 1 . 18 . 4838 . 1 1 1 ILE HA H 2.908 -8.884 7.999 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HA . . . . . . . . . c30226_5ug5 1 . 18 . 4839 . 1 1 1 ILE HB H 5.011 -8.936 6.740 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HB . . . . . . . . . c30226_5ug5 1 . 18 . 4840 . 1 1 1 ILE HD11 H 7.321 -10.879 7.401 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HD11 . . . . . . . . . c30226_5ug5 1 . 18 . 4841 . 1 1 1 ILE HD12 H 7.004 -10.237 5.790 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HD12 . . . . . . . . . c30226_5ug5 1 . 18 . 4842 . 1 1 1 ILE HD13 H 7.079 -11.979 6.045 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HD13 . . . . . . . . . c30226_5ug5 1 . 18 . 4843 . 1 1 1 ILE HG12 H 5.101 -11.881 7.438 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG12 . . . . . . . . . c30226_5ug5 1 . 18 . 4844 . 1 1 1 ILE HG13 H 4.780 -11.236 5.832 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG13 . . . . . . . . . c30226_5ug5 1 . 18 . 4845 . 1 1 1 ILE HG21 H 6.503 -9.471 8.611 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG21 . . . . . . . . . c30226_5ug5 1 . 18 . 4846 . 1 1 1 ILE HG22 H 5.178 -10.304 9.422 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG22 . . . . . . . . . c30226_5ug5 1 . 18 . 4847 . 1 1 1 ILE HG23 H 5.083 -8.567 9.137 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG23 . . . . . . . . . c30226_5ug5 1 . 18 . 4848 . 1 1 1 ILE N N 2.800 -10.928 8.422 . . . 1.0 . . . . . . . . . . . . A . 1 ILE N . . . . . . . . . c30226_5ug5 1 . 18 . 4849 . 1 1 1 ILE O O 2.133 -11.018 5.797 . . . 1.0 . . . . . . . . . . . . A . 1 ILE O . . . . . . . . . c30226_5ug5 1 . 18 . 4850 . 1 1 2 ARG C C 2.851 -8.236 3.075 . . . 1.0 . . . . . . . . . . . . A . 2 ARG C . . . . . . . . . c30226_5ug5 1 . 18 . 4851 . 1 1 2 ARG CA C 1.933 -8.837 4.127 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CA . . . . . . . . . c30226_5ug5 1 . 18 . 4852 . 1 1 2 ARG CB C 0.608 -8.067 4.140 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CB . . . . . . . . . c30226_5ug5 1 . 18 . 4853 . 1 1 2 ARG CD C -0.794 -10.148 4.282 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CD . . . . . . . . . c30226_5ug5 1 . 18 . 4854 . 1 1 2 ARG CG C -0.515 -8.775 4.881 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CG . . . . . . . . . c30226_5ug5 1 . 18 . 4855 . 1 1 2 ARG CZ C -1.855 -10.700 2.115 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CZ . . . . . . . . . c30226_5ug5 1 . 18 . 4856 . 1 1 2 ARG H H 2.948 -8.016 5.778 . . . 1.0 . . . . . . . . . . . . A . 2 ARG H . . . . . . . . . c30226_5ug5 1 . 18 . 4857 . 1 1 2 ARG HA H 1.734 -9.859 3.865 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HA . . . . . . . . . c30226_5ug5 1 . 18 . 4858 . 1 1 2 ARG HB2 H 0.767 -7.100 4.602 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB2 . . . . . . . . . c30226_5ug5 1 . 18 . 4859 . 1 1 2 ARG HB3 H 0.292 -7.913 3.119 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB3 . . . . . . . . . c30226_5ug5 1 . 18 . 4860 . 1 1 2 ARG HD2 H 0.013 -10.812 4.551 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD2 . . . . . . . . . c30226_5ug5 1 . 18 . 4861 . 1 1 2 ARG HD3 H -1.718 -10.522 4.691 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD3 . . . . . . . . . c30226_5ug5 1 . 18 . 4862 . 1 1 2 ARG HE H -0.204 -9.604 2.337 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HE . . . . . . . . . c30226_5ug5 1 . 18 . 4863 . 1 1 2 ARG HG2 H -0.233 -8.895 5.915 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG2 . . . . . . . . . c30226_5ug5 1 . 18 . 4864 . 1 1 2 ARG HG3 H -1.411 -8.175 4.815 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG3 . . . . . . . . . c30226_5ug5 1 . 18 . 4865 . 1 1 2 ARG HH11 H -2.867 -11.425 3.716 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH11 . . . . . . . . . c30226_5ug5 1 . 18 . 4866 . 1 1 2 ARG HH12 H -3.545 -11.815 2.169 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH12 . . . . . . . . . c30226_5ug5 1 . 18 . 4867 . 1 1 2 ARG HH21 H -1.096 -10.094 0.333 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH21 . . . . . . . . . c30226_5ug5 1 . 18 . 4868 . 1 1 2 ARG HH22 H -2.543 -11.065 0.241 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH22 . . . . . . . . . c30226_5ug5 1 . 18 . 4869 . 1 1 2 ARG N N 2.549 -8.842 5.438 . . . 1.0 . . . . . . . . . . . . A . 2 ARG N . . . . . . . . . c30226_5ug5 1 . 18 . 4870 . 1 1 2 ARG NE N -0.901 -10.100 2.822 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NE . . . . . . . . . c30226_5ug5 1 . 18 . 4871 . 1 1 2 ARG NH1 N -2.833 -11.366 2.715 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH1 . . . . . . . . . c30226_5ug5 1 . 18 . 4872 . 1 1 2 ARG NH2 N -1.832 -10.614 0.792 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH2 . . . . . . . . . c30226_5ug5 1 . 18 . 4873 . 1 1 2 ARG O O 4.032 -7.976 3.330 . . . 1.0 . . . . . . . . . . . . A . 2 ARG O . . . . . . . . . c30226_5ug5 1 . 18 . 4874 . 1 1 3 ASP C C 3.508 -6.082 1.161 . . . 1.0 . . . . . . . . . . . . A . 3 ASP C . . . . . . . . . c30226_5ug5 1 . 18 . 4875 . 1 1 3 ASP CA C 2.945 -7.431 0.778 . . . 1.0 . . . . . . . . . . . . A . 3 ASP CA . . . . . . . . . c30226_5ug5 1 . 18 . 4876 . 1 1 3 ASP CB C 1.935 -7.269 -0.356 . . . 1.0 . . . . . . . . . . . . A . 3 ASP CB . . . . . . . . . c30226_5ug5 1 . 18 . 4877 . 1 1 3 ASP CG C 1.137 -8.532 -0.616 . . . 1.0 . . . . . . . . . . . . A . 3 ASP CG . . . . . . . . . c30226_5ug5 1 . 18 . 4878 . 1 1 3 ASP H H 1.377 -8.332 1.752 . . . 1.0 . . . . . . . . . . . . A . 3 ASP H . . . . . . . . . c30226_5ug5 1 . 18 . 4879 . 1 1 3 ASP HA H 3.744 -8.075 0.454 . . . 1.0 . . . . . . . . . . . . A . 3 ASP HA . . . . . . . . . c30226_5ug5 1 . 18 . 4880 . 1 1 3 ASP HB2 H 1.245 -6.476 -0.107 . . . 1.0 . . . . . . . . . . . . A . 3 ASP HB2 . . . . . . . . . c30226_5ug5 1 . 18 . 4881 . 1 1 3 ASP HB3 H 2.461 -7.010 -1.256 . . . 1.0 . . . . . . . . . . . . A . 3 ASP HB3 . . . . . . . . . c30226_5ug5 1 . 18 . 4882 . 1 1 3 ASP N N 2.285 -8.039 1.893 . . . 1.0 . . . . . . . . . . . . A . 3 ASP N . . . . . . . . . c30226_5ug5 1 . 18 . 4883 . 1 1 3 ASP O O 3.035 -5.414 2.080 . . . 1.0 . . . . . . . . . . . . A . 3 ASP O . . . . . . . . . c30226_5ug5 1 . 18 . 4884 . 1 1 3 ASP OD1 O 1.435 -9.237 -1.607 . . . 1.0 . . . . . . . . . . . . A . 3 ASP OD1 . . . . . . . . . c30226_5ug5 1 . 18 . 4885 . 1 1 3 ASP OD2 O 0.219 -8.835 0.174 . . . 1.0 . . . . . . . . . . . . A . 3 ASP OD2 . . . . . . . . . c30226_5ug5 1 . 18 . 4886 . 1 1 4 GLU C C 4.414 -3.265 0.675 . . . 1.0 . . . . . . . . . . . . A . 4 GLU C . . . . . . . . . c30226_5ug5 1 . 18 . 4887 . 1 1 4 GLU CA C 5.301 -4.503 0.640 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CA . . . . . . . . . c30226_5ug5 1 . 18 . 4888 . 1 1 4 GLU CB C 6.358 -4.340 -0.461 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CB . . . . . . . . . c30226_5ug5 1 . 18 . 4889 . 1 1 4 GLU CD C 6.383 -6.489 -1.811 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CD . . . . . . . . . c30226_5ug5 1 . 18 . 4890 . 1 1 4 GLU CG C 7.117 -5.618 -0.804 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CG . . . . . . . . . c30226_5ug5 1 . 18 . 4891 . 1 1 4 GLU H H 4.756 -6.305 -0.332 . . . 1.0 . . . . . . . . . . . . A . 4 GLU H . . . . . . . . . c30226_5ug5 1 . 18 . 4892 . 1 1 4 GLU HA H 5.799 -4.601 1.591 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HA . . . . . . . . . c30226_5ug5 1 . 18 . 4893 . 1 1 4 GLU HB2 H 5.871 -3.990 -1.359 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HB2 . . . . . . . . . c30226_5ug5 1 . 18 . 4894 . 1 1 4 GLU HB3 H 7.074 -3.600 -0.144 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HB3 . . . . . . . . . c30226_5ug5 1 . 18 . 4895 . 1 1 4 GLU HG2 H 8.078 -5.351 -1.217 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HG2 . . . . . . . . . c30226_5ug5 1 . 18 . 4896 . 1 1 4 GLU HG3 H 7.262 -6.187 0.102 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HG3 . . . . . . . . . c30226_5ug5 1 . 18 . 4897 . 1 1 4 GLU N N 4.517 -5.714 0.416 . . . 1.0 . . . . . . . . . . . . A . 4 GLU N . . . . . . . . . c30226_5ug5 1 . 18 . 4898 . 1 1 4 GLU O O 4.692 -2.307 1.398 . . . 1.0 . . . . . . . . . . . . A . 4 GLU O . . . . . . . . . c30226_5ug5 1 . 18 . 4899 . 1 1 4 GLU OE1 O 5.572 -7.339 -1.385 . . . 1.0 . . . . . . . . . . . . A . 4 GLU OE1 . . . . . . . . . c30226_5ug5 1 . 18 . 4900 . 1 1 4 GLU OE2 O 6.615 -6.331 -3.028 . . . 1.0 . . . . . . . . . . . . A . 4 GLU OE2 . . . . . . . . . c30226_5ug5 1 . 18 . 4901 . 1 1 5 CYS C C 1.383 -2.281 0.945 . . . 1.0 . . . . . . . . . . . . A . 5 CYS C . . . . . . . . . c30226_5ug5 1 . 18 . 4902 . 1 1 5 CYS CA C 2.408 -2.189 -0.181 . . . 1.0 . . . . . . . . . . . . A . 5 CYS CA . . . . . . . . . c30226_5ug5 1 . 18 . 4903 . 1 1 5 CYS CB C 1.708 -2.186 -1.545 . . . 1.0 . . . . . . . . . . . . A . 5 CYS CB . . . . . . . . . c30226_5ug5 1 . 18 . 4904 . 1 1 5 CYS H H 3.197 -4.092 -0.666 . . . 1.0 . . . . . . . . . . . . A . 5 CYS H . . . . . . . . . c30226_5ug5 1 . 18 . 4905 . 1 1 5 CYS HA H 2.967 -1.272 -0.069 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HA . . . . . . . . . c30226_5ug5 1 . 18 . 4906 . 1 1 5 CYS HB2 H 2.448 -2.044 -2.318 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HB2 . . . . . . . . . c30226_5ug5 1 . 18 . 4907 . 1 1 5 CYS HB3 H 1.223 -3.140 -1.691 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HB3 . . . . . . . . . c30226_5ug5 1 . 18 . 4908 . 1 1 5 CYS N N 3.349 -3.299 -0.109 . . . 1.0 . . . . . . . . . . . . A . 5 CYS N . . . . . . . . . c30226_5ug5 1 . 18 . 4909 . 1 1 5 CYS O O 0.761 -1.290 1.323 . . . 1.0 . . . . . . . . . . . . A . 5 CYS O . . . . . . . . . c30226_5ug5 1 . 18 . 4910 . 1 1 5 CYS SG S 0.442 -0.889 -1.752 . . . 1.0 . . . . . . . . . . . . A . 5 CYS SG . . . . . . . . . c30226_5ug5 1 . 18 . 4911 . 1 1 6 CYS C C 0.848 -3.486 3.924 . . . 1.0 . . . . . . . . . . . . A . 6 CYS C . . . . . . . . . c30226_5ug5 1 . 18 . 4912 . 1 1 6 CYS CA C 0.244 -3.711 2.541 . . . 1.0 . . . . . . . . . . . . A . 6 CYS CA . . . . . . . . . c30226_5ug5 1 . 18 . 4913 . 1 1 6 CYS CB C -0.317 -5.124 2.422 . . . 1.0 . . . . . . . . . . . . A . 6 CYS CB . . . . . . . . . c30226_5ug5 1 . 18 . 4914 . 1 1 6 CYS H H 1.825 -4.209 1.227 . . . 1.0 . . . . . . . . . . . . A . 6 CYS H . . . . . . . . . c30226_5ug5 1 . 18 . 4915 . 1 1 6 CYS HA H -0.557 -3.003 2.395 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HA . . . . . . . . . c30226_5ug5 1 . 18 . 4916 . 1 1 6 CYS HB2 H -0.545 -5.322 1.387 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HB2 . . . . . . . . . c30226_5ug5 1 . 18 . 4917 . 1 1 6 CYS HB3 H 0.428 -5.827 2.761 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HB3 . . . . . . . . . c30226_5ug5 1 . 18 . 4918 . 1 1 6 CYS N N 1.237 -3.474 1.505 . . . 1.0 . . . . . . . . . . . . A . 6 CYS N . . . . . . . . . c30226_5ug5 1 . 18 . 4919 . 1 1 6 CYS O O 0.131 -3.321 4.909 . . . 1.0 . . . . . . . . . . . . A . 6 CYS O . . . . . . . . . c30226_5ug5 1 . 18 . 4920 . 1 1 6 CYS SG S -1.834 -5.411 3.390 . . . 1.0 . . . . . . . . . . . . A . 6 CYS SG . . . . . . . . . c30226_5ug5 1 . 18 . 4921 . 1 1 7 SER C C 2.753 -1.585 5.364 . . . 1.0 . . . . . . . . . . . . A . 7 SER C . . . . . . . . . c30226_5ug5 1 . 18 . 4922 . 1 1 7 SER CA C 2.854 -3.083 5.212 . . . 1.0 . . . . . . . . . . . . A . 7 SER CA . . . . . . . . . c30226_5ug5 1 . 18 . 4923 . 1 1 7 SER CB C 4.322 -3.426 5.119 . . . 1.0 . . . . . . . . . . . . A . 7 SER CB . . . . . . . . . c30226_5ug5 1 . 18 . 4924 . 1 1 7 SER H H 2.704 -3.798 3.238 . . . 1.0 . . . . . . . . . . . . A . 7 SER H . . . . . . . . . c30226_5ug5 1 . 18 . 4925 . 1 1 7 SER HA H 2.409 -3.574 6.059 . . . 1.0 . . . . . . . . . . . . A . 7 SER HA . . . . . . . . . c30226_5ug5 1 . 18 . 4926 . 1 1 7 SER HB2 H 4.833 -2.604 4.630 . . . 1.0 . . . . . . . . . . . . A . 7 SER HB2 . . . . . . . . . c30226_5ug5 1 . 18 . 4927 . 1 1 7 SER HB3 H 4.718 -3.557 6.110 . . . 1.0 . . . . . . . . . . . . A . 7 SER HB3 . . . . . . . . . c30226_5ug5 1 . 18 . 4928 . 1 1 7 SER HG H 3.873 -5.284 4.673 . . . 1.0 . . . . . . . . . . . . A . 7 SER HG . . . . . . . . . c30226_5ug5 1 . 18 . 4929 . 1 1 7 SER N N 2.171 -3.489 4.001 . . . 1.0 . . . . . . . . . . . . A . 7 SER N . . . . . . . . . c30226_5ug5 1 . 18 . 4930 . 1 1 7 SER O O 2.714 -1.047 6.470 . . . 1.0 . . . . . . . . . . . . A . 7 SER O . . . . . . . . . c30226_5ug5 1 . 18 . 4931 . 1 1 7 SER OG O 4.520 -4.624 4.384 . . . 1.0 . . . . . . . . . . . . A . 7 SER OG . . . . . . . . . c30226_5ug5 1 . 18 . 4932 . 1 1 8 ASN C C 1.479 1.173 4.123 . . . 1.0 . . . . . . . . . . . . A . 8 ASN C . . . . . . . . . c30226_5ug5 1 . 18 . 4933 . 1 1 8 ASN CA C 2.851 0.507 4.173 . . . 1.0 . . . . . . . . . . . . A . 8 ASN CA . . . . . . . . . c30226_5ug5 1 . 18 . 4934 . 1 1 8 ASN CB C 3.672 0.905 2.949 . . . 1.0 . . . . . . . . . . . . A . 8 ASN CB . . . . . . . . . c30226_5ug5 1 . 18 . 4935 . 1 1 8 ASN CG C 3.796 2.411 2.786 . . . 1.0 . . . . . . . . . . . . A . 8 ASN CG . . . . . . . . . c30226_5ug5 1 . 18 . 4936 . 1 1 8 ASN H H 2.580 -1.417 3.386 . . . 1.0 . . . . . . . . . . . . A . 8 ASN H . . . . . . . . . c30226_5ug5 1 . 18 . 4937 . 1 1 8 ASN HA H 3.380 0.803 5.062 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HA . . . . . . . . . c30226_5ug5 1 . 18 . 4938 . 1 1 8 ASN HB2 H 4.664 0.489 3.037 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HB2 . . . . . . . . . c30226_5ug5 1 . 18 . 4939 . 1 1 8 ASN HB3 H 3.193 0.503 2.068 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HB3 . . . . . . . . . c30226_5ug5 1 . 18 . 4940 . 1 1 8 ASN HD21 H 4.068 2.200 0.830 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HD21 . . . . . . . . . c30226_5ug5 1 . 18 . 4941 . 1 1 8 ASN HD22 H 4.096 3.825 1.425 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HD22 . . . . . . . . . c30226_5ug5 1 . 18 . 4942 . 1 1 8 ASN N N 2.718 -0.922 4.222 . . . 1.0 . . . . . . . . . . . . A . 8 ASN N . . . . . . . . . c30226_5ug5 1 . 18 . 4943 . 1 1 8 ASN ND2 N 4.003 2.856 1.557 . . . 1.0 . . . . . . . . . . . . A . 8 ASN ND2 . . . . . . . . . c30226_5ug5 1 . 18 . 4944 . 1 1 8 ASN O O 0.795 1.117 3.098 . . . 1.0 . . . . . . . . . . . . A . 8 ASN O . . . . . . . . . c30226_5ug5 1 . 18 . 4945 . 1 1 8 ASN OD1 O 3.721 3.165 3.756 . . . 1.0 . . . . . . . . . . . . A . 8 ASN OD1 . . . . . . . . . c30226_5ug5 1 . 18 . 4946 . 1 1 9 PRO C C -0.426 3.535 4.221 . . . 1.0 . . . . . . . . . . . . A . 9 PRO C . . . . . . . . . c30226_5ug5 1 . 18 . 4947 . 1 1 9 PRO CA C -0.236 2.495 5.320 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CA . . . . . . . . . c30226_5ug5 1 . 18 . 4948 . 1 1 9 PRO CB C -0.156 3.171 6.689 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CB . . . . . . . . . c30226_5ug5 1 . 18 . 4949 . 1 1 9 PRO CD C 1.819 1.947 6.483 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CD . . . . . . . . . c30226_5ug5 1 . 18 . 4950 . 1 1 9 PRO CG C 0.760 2.325 7.463 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CG . . . . . . . . . c30226_5ug5 1 . 18 . 4951 . 1 1 9 PRO HA H -1.056 1.793 5.305 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HA . . . . . . . . . c30226_5ug5 1 . 18 . 4952 . 1 1 9 PRO HB2 H 0.263 4.147 6.576 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HB2 . . . . . . . . . c30226_5ug5 1 . 18 . 4953 . 1 1 9 PRO HB3 H -1.135 3.226 7.140 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HB3 . . . . . . . . . c30226_5ug5 1 . 18 . 4954 . 1 1 9 PRO HD2 H 2.566 2.725 6.410 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HD2 . . . . . . . . . c30226_5ug5 1 . 18 . 4955 . 1 1 9 PRO HD3 H 2.261 1.024 6.760 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HD3 . . . . . . . . . c30226_5ug5 1 . 18 . 4956 . 1 1 9 PRO HG2 H 1.180 2.895 8.275 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HG2 . . . . . . . . . c30226_5ug5 1 . 18 . 4957 . 1 1 9 PRO HG3 H 0.248 1.447 7.828 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HG3 . . . . . . . . . c30226_5ug5 1 . 18 . 4958 . 1 1 9 PRO N N 1.063 1.818 5.225 . . . 1.0 . . . . . . . . . . . . A . 9 PRO N . . . . . . . . . c30226_5ug5 1 . 18 . 4959 . 1 1 9 PRO O O -1.535 3.742 3.729 . . . 1.0 . . . . . . . . . . . . A . 9 PRO O . . . . . . . . . c30226_5ug5 1 . 18 . 4960 . 1 1 10 ALA C C 0.386 4.618 1.416 . . . 1.0 . . . . . . . . . . . . A . 10 ALA C . . . . . . . . . c30226_5ug5 1 . 18 . 4961 . 1 1 10 ALA CA C 0.626 5.205 2.806 . . . 1.0 . . . . . . . . . . . . A . 10 ALA CA . . . . . . . . . c30226_5ug5 1 . 18 . 4962 . 1 1 10 ALA CB C 1.915 6.013 2.825 . . . 1.0 . . . . . . . . . . . . A . 10 ALA CB . . . . . . . . . c30226_5ug5 1 . 18 . 4963 . 1 1 10 ALA H H 1.530 3.932 4.236 . . . 1.0 . . . . . . . . . . . . A . 10 ALA H . . . . . . . . . c30226_5ug5 1 . 18 . 4964 . 1 1 10 ALA HA H -0.190 5.871 3.047 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HA . . . . . . . . . c30226_5ug5 1 . 18 . 4965 . 1 1 10 ALA HB1 H 2.745 5.374 2.560 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HB1 . . . . . . . . . c30226_5ug5 1 . 18 . 4966 . 1 1 10 ALA HB2 H 2.075 6.416 3.815 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HB2 . . . . . . . . . c30226_5ug5 1 . 18 . 4967 . 1 1 10 ALA HB3 H 1.843 6.822 2.114 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HB3 . . . . . . . . . c30226_5ug5 1 . 18 . 4968 . 1 1 10 ALA N N 0.668 4.168 3.826 . . . 1.0 . . . . . . . . . . . . A . 10 ALA N . . . . . . . . . c30226_5ug5 1 . 18 . 4969 . 1 1 10 ALA O O -0.016 5.327 0.497 . . . 1.0 . . . . . . . . . . . . A . 10 ALA O . . . . . . . . . c30226_5ug5 1 . 18 . 4970 . 1 1 11 CYS C C -0.945 2.223 -0.075 . . . 1.0 . . . . . . . . . . . . A . 11 CYS C . . . . . . . . . c30226_5ug5 1 . 18 . 4971 . 1 1 11 CYS CA C 0.469 2.694 -0.036 . . . 1.0 . . . . . . . . . . . . A . 11 CYS CA . . . . . . . . . c30226_5ug5 1 . 18 . 4972 . 1 1 11 CYS CB C 1.442 1.524 -0.197 . . . 1.0 . . . . . . . . . . . . A . 11 CYS CB . . . . . . . . . c30226_5ug5 1 . 18 . 4973 . 1 1 11 CYS H H 0.711 2.737 2.051 . . . 1.0 . . . . . . . . . . . . A . 11 CYS H . . . . . . . . . c30226_5ug5 1 . 18 . 4974 . 1 1 11 CYS HA H 0.634 3.435 -0.806 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HA . . . . . . . . . c30226_5ug5 1 . 18 . 4975 . 1 1 11 CYS HB2 H 2.437 1.857 0.059 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HB2 . . . . . . . . . c30226_5ug5 1 . 18 . 4976 . 1 1 11 CYS HB3 H 1.147 0.727 0.478 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HB3 . . . . . . . . . c30226_5ug5 1 . 18 . 4977 . 1 1 11 CYS N N 0.615 3.318 1.261 . . . 1.0 . . . . . . . . . . . . A . 11 CYS N . . . . . . . . . c30226_5ug5 1 . 18 . 4978 . 1 1 11 CYS O O -1.708 2.447 -1.017 . . . 1.0 . . . . . . . . . . . . A . 11 CYS O . . . . . . . . . c30226_5ug5 1 . 18 . 4979 . 1 1 11 CYS SG S 1.508 0.832 -1.883 . . . 1.0 . . . . . . . . . . . . A . 11 CYS SG . . . . . . . . . c30226_5ug5 1 . 18 . 4980 . 1 1 12 ARG C C -3.645 2.216 1.199 . . . 1.0 . . . . . . . . . . . . A . 12 ARG C . . . . . . . . . c30226_5ug5 1 . 18 . 4981 . 1 1 12 ARG CA C -2.571 1.152 1.380 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CA . . . . . . . . . c30226_5ug5 1 . 18 . 4982 . 1 1 12 ARG CB C -2.520 0.715 2.819 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CB . . . . . . . . . c30226_5ug5 1 . 18 . 4983 . 1 1 12 ARG CD C -1.463 -0.992 4.278 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CD . . . . . . . . . c30226_5ug5 1 . 18 . 4984 . 1 1 12 ARG CG C -2.220 -0.753 2.993 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CG . . . . . . . . . c30226_5ug5 1 . 18 . 4985 . 1 1 12 ARG CZ C -2.048 -0.919 6.678 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CZ . . . . . . . . . c30226_5ug5 1 . 18 . 4986 . 1 1 12 ARG H H -0.547 1.410 1.687 . . . 1.0 . . . . . . . . . . . . A . 12 ARG H . . . . . . . . . c30226_5ug5 1 . 18 . 4987 . 1 1 12 ARG HA H -2.782 0.310 0.770 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HA . . . . . . . . . c30226_5ug5 1 . 18 . 4988 . 1 1 12 ARG HB2 H -1.744 1.276 3.318 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HB2 . . . . . . . . . c30226_5ug5 1 . 18 . 4989 . 1 1 12 ARG HB3 H -3.450 0.939 3.279 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HB3 . . . . . . . . . c30226_5ug5 1 . 18 . 4990 . 1 1 12 ARG HD2 H -1.345 -2.056 4.418 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HD2 . . . . . . . . . c30226_5ug5 1 . 18 . 4991 . 1 1 12 ARG HD3 H -0.486 -0.527 4.187 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HD3 . . . . . . . . . c30226_5ug5 1 . 18 . 4992 . 1 1 12 ARG HE H -2.727 0.352 5.287 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HE . . . . . . . . . c30226_5ug5 1 . 18 . 4993 . 1 1 12 ARG HG2 H -3.145 -1.300 3.020 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HG2 . . . . . . . . . c30226_5ug5 1 . 18 . 4994 . 1 1 12 ARG HG3 H -1.619 -1.092 2.162 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HG3 . . . . . . . . . c30226_5ug5 1 . 18 . 4995 . 1 1 12 ARG HH11 H -0.813 -2.451 6.172 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH11 . . . . . . . . . c30226_5ug5 1 . 18 . 4996 . 1 1 12 ARG HH12 H -1.225 -2.351 7.856 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH12 . . . . . . . . . c30226_5ug5 1 . 18 . 4997 . 1 1 12 ARG HH21 H -3.268 0.479 7.492 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH21 . . . . . . . . . c30226_5ug5 1 . 18 . 4998 . 1 1 12 ARG HH22 H -2.628 -0.689 8.604 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH22 . . . . . . . . . c30226_5ug5 1 . 18 . 4999 . 1 1 12 ARG N N -1.264 1.603 1.042 . . . 1.0 . . . . . . . . . . . . A . 12 ARG N . . . . . . . . . c30226_5ug5 1 . 18 . 5000 . 1 1 12 ARG NE N -2.153 -0.435 5.440 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NE . . . . . . . . . c30226_5ug5 1 . 18 . 5001 . 1 1 12 ARG NH1 N -1.304 -1.993 6.921 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NH1 . . . . . . . . . c30226_5ug5 1 . 18 . 5002 . 1 1 12 ARG NH2 N -2.700 -0.329 7.671 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NH2 . . . . . . . . . c30226_5ug5 1 . 18 . 5003 . 1 1 12 ARG O O -4.814 1.891 0.994 . . . 1.0 . . . . . . . . . . . . A . 12 ARG O . . . . . . . . . c30226_5ug5 1 . 18 . 5004 . 1 1 13 TYR C C -5.016 4.481 -0.079 . . . 1.0 . . . . . . . . . . . . A . 13 TYR C . . . . . . . . . c30226_5ug5 1 . 18 . 5005 . 1 1 13 TYR CA C -4.146 4.606 1.164 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CA . . . . . . . . . c30226_5ug5 1 . 18 . 5006 . 1 1 13 TYR CB C -3.322 5.885 1.090 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CB . . . . . . . . . c30226_5ug5 1 . 18 . 5007 . 1 1 13 TYR CD1 C -4.121 7.608 2.742 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CD1 . . . . . . . . . c30226_5ug5 1 . 18 . 5008 . 1 1 13 TYR CD2 C -4.757 7.820 0.467 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CD2 . . . . . . . . . c30226_5ug5 1 . 18 . 5009 . 1 1 13 TYR CE1 C -4.833 8.749 3.051 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CE1 . . . . . . . . . c30226_5ug5 1 . 18 . 5010 . 1 1 13 TYR CE2 C -5.467 8.957 0.763 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CE2 . . . . . . . . . c30226_5ug5 1 . 18 . 5011 . 1 1 13 TYR CG C -4.076 7.131 1.446 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CG . . . . . . . . . c30226_5ug5 1 . 18 . 5012 . 1 1 13 TYR CZ C -5.432 9.440 2.149 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CZ . . . . . . . . . c30226_5ug5 1 . 18 . 5013 . 1 1 13 TYR H H -2.290 3.660 1.436 . . . 1.0 . . . . . . . . . . . . A . 13 TYR H . . . . . . . . . c30226_5ug5 1 . 18 . 5014 . 1 1 13 TYR HA H -4.774 4.634 2.039 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HA . . . . . . . . . c30226_5ug5 1 . 18 . 5015 . 1 1 13 TYR HB2 H -2.502 5.810 1.775 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HB2 . . . . . . . . . c30226_5ug5 1 . 18 . 5016 . 1 1 13 TYR HB3 H -2.939 5.997 0.089 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HB3 . . . . . . . . . c30226_5ug5 1 . 18 . 5017 . 1 1 13 TYR HD1 H -3.591 7.077 3.515 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HD1 . . . . . . . . . c30226_5ug5 1 . 18 . 5018 . 1 1 13 TYR HD2 H -4.725 7.451 -0.544 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HD2 . . . . . . . . . c30226_5ug5 1 . 18 . 5019 . 1 1 13 TYR HE1 H -4.859 9.107 4.063 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HE1 . . . . . . . . . c30226_5ug5 1 . 18 . 5020 . 1 1 13 TYR HE2 H -5.987 9.472 -0.018 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HE2 . . . . . . . . . c30226_5ug5 1 . 18 . 5021 . 1 1 13 TYR HH H -5.717 11.090 2.998 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HH . . . . . . . . . c30226_5ug5 1 . 18 . 5022 . 1 1 13 TYR N N -3.240 3.477 1.283 . . . 1.0 . . . . . . . . . . . . A . 13 TYR N . . . . . . . . . c30226_5ug5 1 . 18 . 5023 . 1 1 13 TYR O O -6.219 4.728 -0.039 . . . 1.0 . . . . . . . . . . . . A . 13 TYR O . . . . . . . . . c30226_5ug5 1 . 18 . 5024 . 1 1 13 TYR OH O -6.217 10.562 2.360 . . . 1.0 . . . . . . . . . . . . A . 13 TYR OH . . . . . . . . . c30226_5ug5 1 . 18 . 5025 . 1 1 14 ASN C C -5.160 2.487 -2.826 . . . 1.0 . . . . . . . . . . . . A . 14 ASN C . . . . . . . . . c30226_5ug5 1 . 18 . 5026 . 1 1 14 ASN CA C -5.116 3.948 -2.440 . . . 1.0 . . . . . . . . . . . . A . 14 ASN CA . . . . . . . . . c30226_5ug5 1 . 18 . 5027 . 1 1 14 ASN CB C -4.441 4.764 -3.547 . . . 1.0 . . . . . . . . . . . . A . 14 ASN CB . . . . . . . . . c30226_5ug5 1 . 18 . 5028 . 1 1 14 ASN CG C -4.331 6.238 -3.209 . . . 1.0 . . . . . . . . . . . . A . 14 ASN CG . . . . . . . . . c30226_5ug5 1 . 18 . 5029 . 1 1 14 ASN H H -3.438 3.849 -1.138 . . . 1.0 . . . . . . . . . . . . A . 14 ASN H . . . . . . . . . c30226_5ug5 1 . 18 . 5030 . 1 1 14 ASN HA H -6.125 4.305 -2.295 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HA . . . . . . . . . c30226_5ug5 1 . 18 . 5031 . 1 1 14 ASN HB2 H -3.445 4.378 -3.710 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HB2 . . . . . . . . . c30226_5ug5 1 . 18 . 5032 . 1 1 14 ASN HB3 H -5.014 4.664 -4.456 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HB3 . . . . . . . . . c30226_5ug5 1 . 18 . 5033 . 1 1 14 ASN HD21 H -6.140 6.574 -3.954 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HD21 . . . . . . . . . c30226_5ug5 1 . 18 . 5034 . 1 1 14 ASN HD22 H -5.318 7.957 -3.320 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HD22 . . . . . . . . . c30226_5ug5 1 . 18 . 5035 . 1 1 14 ASN N N -4.398 4.089 -1.180 . . . 1.0 . . . . . . . . . . . . A . 14 ASN N . . . . . . . . . c30226_5ug5 1 . 18 . 5036 . 1 1 14 ASN ND2 N -5.365 6.999 -3.526 . . . 1.0 . . . . . . . . . . . . A . 14 ASN ND2 . . . . . . . . . c30226_5ug5 1 . 18 . 5037 . 1 1 14 ASN O O -5.648 2.114 -3.889 . . . 1.0 . . . . . . . . . . . . A . 14 ASN O . . . . . . . . . c30226_5ug5 1 . 18 . 5038 . 1 1 14 ASN OD1 O -3.324 6.688 -2.660 . . . 1.0 . . . . . . . . . . . . A . 14 ASN OD1 . . . . . . . . . c30226_5ug5 1 . 18 . 5039 . 1 1 15 ASN C C -4.827 -0.625 -1.052 . . . 1.0 . . . . . . . . . . . . A . 15 ASN C . . . . . . . . . c30226_5ug5 1 . 18 . 5040 . 1 1 15 ASN CA C -4.403 0.264 -2.213 . . . 1.0 . . . . . . . . . . . . A . 15 ASN CA . . . . . . . . . c30226_5ug5 1 . 18 . 5041 . 1 1 15 ASN CB C -2.922 0.105 -2.460 . . . 1.0 . . . . . . . . . . . . A . 15 ASN CB . . . . . . . . . c30226_5ug5 1 . 18 . 5042 . 1 1 15 ASN CG C -2.501 0.477 -3.870 . . . 1.0 . . . . . . . . . . . . A . 15 ASN CG . . . . . . . . . c30226_5ug5 1 . 18 . 5043 . 1 1 15 ASN H H -4.421 2.015 -1.040 . . . 1.0 . . . . . . . . . . . . A . 15 ASN H . . . . . . . . . c30226_5ug5 1 . 18 . 5044 . 1 1 15 ASN HA H -4.950 -0.007 -3.098 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HA . . . . . . . . . c30226_5ug5 1 . 18 . 5045 . 1 1 15 ASN HB2 H -2.423 0.771 -1.770 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HB2 . . . . . . . . . c30226_5ug5 1 . 18 . 5046 . 1 1 15 ASN HB3 H -2.626 -0.913 -2.259 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HB3 . . . . . . . . . c30226_5ug5 1 . 18 . 5047 . 1 1 15 ASN HD21 H -0.731 1.080 -3.205 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HD21 . . . . . . . . . c30226_5ug5 1 . 18 . 5048 . 1 1 15 ASN HD22 H -0.988 1.231 -4.909 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HD22 . . . . . . . . . c30226_5ug5 1 . 18 . 5049 . 1 1 15 ASN N N -4.650 1.664 -1.928 . . . 1.0 . . . . . . . . . . . . A . 15 ASN N . . . . . . . . . c30226_5ug5 1 . 18 . 5050 . 1 1 15 ASN ND2 N -1.285 0.979 -4.010 . . . 1.0 . . . . . . . . . . . . A . 15 ASN ND2 . . . . . . . . . c30226_5ug5 1 . 18 . 5051 . 1 1 15 ASN O O -3.996 -1.225 -0.375 . . . 1.0 . . . . . . . . . . . . A . 15 ASN O . . . . . . . . . c30226_5ug5 1 . 18 . 5052 . 1 1 15 ASN OD1 O -3.263 0.318 -4.825 . . . 1.0 . . . . . . . . . . . . A . 15 ASN OD1 . . . . . . . . . c30226_5ug5 1 . 18 . 5053 . 1 1 16 HYP C C -7.046 -2.884 -0.031 . . . 1.0 . . . . . . . . . . . . A . 16 HYP C . . . . . . . . . c30226_5ug5 1 . 18 . 5054 . 1 1 16 HYP CA C -6.686 -1.459 0.337 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CA . . . . . . . . . c30226_5ug5 1 . 18 . 5055 . 1 1 16 HYP CB C -7.916 -0.614 0.610 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CB . . . . . . . . . c30226_5ug5 1 . 18 . 5056 . 1 1 16 HYP CD C -7.194 -0.026 -1.556 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CD . . . . . . . . . c30226_5ug5 1 . 18 . 5057 . 1 1 16 HYP CG C -8.028 0.482 -0.436 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CG . . . . . . . . . c30226_5ug5 1 . 18 . 5058 . 1 1 16 HYP HA H -6.031 -1.456 1.180 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HA . . . . . . . . . c30226_5ug5 1 . 18 . 5059 . 1 1 16 HYP HB2 H -7.832 -0.160 1.585 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HB2 . . . . . . . . . c30226_5ug5 1 . 18 . 5060 . 1 1 16 HYP HB3 H -8.797 -1.242 0.576 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HB3 . . . . . . . . . c30226_5ug5 1 . 18 . 5061 . 1 1 16 HYP HD1 H -6.465 1.641 -0.252 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HD1 . . . . . . . . . c30226_5ug5 1 . 18 . 5062 . 1 1 16 HYP HD22 H -7.743 -0.710 -2.167 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HD22 . . . . . . . . . c30226_5ug5 1 . 18 . 5063 . 1 1 16 HYP HD23 H -6.795 0.788 -2.141 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HD23 . . . . . . . . . c30226_5ug5 1 . 18 . 5064 . 1 1 16 HYP HG H -9.053 0.650 -0.726 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HG . . . . . . . . . c30226_5ug5 1 . 18 . 5065 . 1 1 16 HYP N N -6.128 -0.708 -0.799 . . . 1.0 . . . . . . . . . . . . A . 16 HYP N . . . . . . . . . c30226_5ug5 1 . 18 . 5066 . 1 1 16 HYP O O -7.419 -3.698 0.810 . . . 1.0 . . . . . . . . . . . . A . 16 HYP O . . . . . . . . . c30226_5ug5 1 . 18 . 5067 . 1 1 16 HYP OD1 O -7.404 1.676 0.018 . . . 1.0 . . . . . . . . . . . . A . 16 HYP OD1 . . . . . . . . . c30226_5ug5 1 . 18 . 5068 . 1 1 17 HIS C C -5.882 -5.081 -2.406 . . . 1.0 . . . . . . . . . . . . A . 17 HIS C . . . . . . . . . c30226_5ug5 1 . 18 . 5069 . 1 1 17 HIS CA C -7.176 -4.491 -1.848 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CA . . . . . . . . . c30226_5ug5 1 . 18 . 5070 . 1 1 17 HIS CB C -8.250 -4.403 -2.944 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CB . . . . . . . . . c30226_5ug5 1 . 18 . 5071 . 1 1 17 HIS CD2 C -8.470 -6.537 -4.419 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CD2 . . . . . . . . . c30226_5ug5 1 . 18 . 5072 . 1 1 17 HIS CE1 C -10.106 -7.506 -3.336 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CE1 . . . . . . . . . c30226_5ug5 1 . 18 . 5073 . 1 1 17 HIS CG C -8.804 -5.730 -3.381 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CG . . . . . . . . . c30226_5ug5 1 . 18 . 5074 . 1 1 17 HIS H H -6.628 -2.441 -1.901 . . . 1.0 . . . . . . . . . . . . A . 17 HIS H . . . . . . . . . c30226_5ug5 1 . 18 . 5075 . 1 1 17 HIS HA H -7.534 -5.118 -1.047 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HA . . . . . . . . . c30226_5ug5 1 . 18 . 5076 . 1 1 17 HIS HB2 H -9.073 -3.808 -2.580 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HB2 . . . . . . . . . c30226_5ug5 1 . 18 . 5077 . 1 1 17 HIS HB3 H -7.825 -3.920 -3.811 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HB3 . . . . . . . . . c30226_5ug5 1 . 18 . 5078 . 1 1 17 HIS HD1 H -10.304 -6.029 -1.930 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HD1 . . . . . . . . . c30226_5ug5 1 . 18 . 5079 . 1 1 17 HIS HD2 H -7.698 -6.350 -5.153 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HD2 . . . . . . . . . c30226_5ug5 1 . 18 . 5080 . 1 1 17 HIS HE1 H -10.865 -8.214 -3.041 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HE1 . . . . . . . . . c30226_5ug5 1 . 18 . 5081 . 1 1 17 HIS HE2 H -9.182 -8.453 -4.900 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HE2 . . . . . . . . . c30226_5ug5 1 . 18 . 5082 . 1 1 17 HIS N N -6.913 -3.164 -1.304 . . . 1.0 . . . . . . . . . . . . A . 17 HIS N . . . . . . . . . c30226_5ug5 1 . 18 . 5083 . 1 1 17 HIS ND1 N -9.834 -6.367 -2.726 . . . 1.0 . . . . . . . . . . . . A . 17 HIS ND1 . . . . . . . . . c30226_5ug5 1 . 18 . 5084 . 1 1 17 HIS NE2 N -9.292 -7.633 -4.366 . . . 1.0 . . . . . . . . . . . . A . 17 HIS NE2 . . . . . . . . . c30226_5ug5 1 . 18 . 5085 . 1 1 17 HIS O O -5.868 -6.174 -2.963 . . . 1.0 . . . . . . . . . . . . A . 17 HIS O . . . . . . . . . c30226_5ug5 1 . 18 . 5086 . 1 1 18 VAL C C -2.918 -5.955 -2.049 . . . 1.0 . . . . . . . . . . . . A . 18 VAL C . . . . . . . . . c30226_5ug5 1 . 18 . 5087 . 1 1 18 VAL CA C -3.494 -4.722 -2.758 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CA . . . . . . . . . c30226_5ug5 1 . 18 . 5088 . 1 1 18 VAL CB C -2.538 -3.528 -2.639 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CB . . . . . . . . . c30226_5ug5 1 . 18 . 5089 . 1 1 18 VAL CG1 C -1.969 -3.418 -1.240 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CG1 . . . . . . . . . c30226_5ug5 1 . 18 . 5090 . 1 1 18 VAL CG2 C -1.447 -3.608 -3.677 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CG2 . . . . . . . . . c30226_5ug5 1 . 18 . 5091 . 1 1 18 VAL H H -4.855 -3.503 -1.742 . . . 1.0 . . . . . . . . . . . . A . 18 VAL H . . . . . . . . . c30226_5ug5 1 . 18 . 5092 . 1 1 18 VAL HA H -3.614 -4.949 -3.797 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HA . . . . . . . . . c30226_5ug5 1 . 18 . 5093 . 1 1 18 VAL HB H -3.110 -2.633 -2.831 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HB . . . . . . . . . c30226_5ug5 1 . 18 . 5094 . 1 1 18 VAL HG11 H -1.381 -2.515 -1.160 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG11 . . . . . . . . . c30226_5ug5 1 . 18 . 5095 . 1 1 18 VAL HG12 H -1.348 -4.278 -1.042 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG12 . . . . . . . . . c30226_5ug5 1 . 18 . 5096 . 1 1 18 VAL HG13 H -2.779 -3.388 -0.531 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG13 . . . . . . . . . c30226_5ug5 1 . 18 . 5097 . 1 1 18 VAL HG21 H -0.804 -2.748 -3.585 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG21 . . . . . . . . . c30226_5ug5 1 . 18 . 5098 . 1 1 18 VAL HG22 H -1.896 -3.622 -4.655 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG22 . . . . . . . . . c30226_5ug5 1 . 18 . 5099 . 1 1 18 VAL HG23 H -0.876 -4.507 -3.527 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG23 . . . . . . . . . c30226_5ug5 1 . 18 . 5100 . 1 1 18 VAL N N -4.789 -4.345 -2.228 . . . 1.0 . . . . . . . . . . . . A . 18 VAL N . . . . . . . . . c30226_5ug5 1 . 18 . 5101 . 1 1 18 VAL O O -1.892 -6.508 -2.456 . . . 1.0 . . . . . . . . . . . . A . 18 VAL O . . . . . . . . . c30226_5ug5 1 . 18 . 5102 . 1 1 19 CYS C C -4.419 -8.430 0.039 . . . 1.0 . . . . . . . . . . . . A . 19 CYS C . . . . . . . . . c30226_5ug5 1 . 18 . 5103 . 1 1 19 CYS CA C -3.200 -7.569 -0.260 . . . 1.0 . . . . . . . . . . . . A . 19 CYS CA . . . . . . . . . c30226_5ug5 1 . 18 . 5104 . 1 1 19 CYS CB C -2.464 -7.195 1.029 . . . 1.0 . . . . . . . . . . . . A . 19 CYS CB . . . . . . . . . c30226_5ug5 1 . 18 . 5105 . 1 1 19 CYS H H -4.377 -5.881 -0.701 . . . 1.0 . . . . . . . . . . . . A . 19 CYS H . . . . . . . . . c30226_5ug5 1 . 18 . 5106 . 1 1 19 CYS HA H -2.530 -8.134 -0.890 . . . 1.0 . . . . . . . . . . . . A . 19 CYS HA . . . . . . . . . c30226_5ug5 1 . 18 . 5107 . 1 1 19 CYS HB2 H -2.428 -8.060 1.674 . . . 1.0 . . . . . . . . . . . . A . 19 CYS HB2 . . . . . . . . . c30226_5ug5 1 . 18 . 5108 . 1 1 19 CYS HB3 H -1.457 -6.898 0.781 . . . 1.0 . . . . . . . . . . . . A . 19 CYS HB3 . . . . . . . . . c30226_5ug5 1 . 18 . 5109 . 1 1 19 CYS N N -3.589 -6.379 -0.993 . . . 1.0 . . . . . . . . . . . . A . 19 CYS N . . . . . . . . . c30226_5ug5 1 . 18 . 5110 . 1 1 19 CYS O O -5.177 -8.101 0.971 . . . 1.0 . . . . . . . . . . . . A . 19 CYS O . . . . . . . . . c30226_5ug5 1 . 18 . 5111 . 1 1 19 CYS OXT O -4.630 -9.427 -0.682 . . . 1.0 . . . . . . . . . . . . A . 19 CYS OXT . . . . . . . . . c30226_5ug5 1 . 18 . 5112 . 1 1 19 CYS SG S -3.228 -5.836 1.979 . . . 1.0 . . . . . . . . . . . . A . 19 CYS SG . . . . . . . . . c30226_5ug5 1 . 19 . 5113 . 1 1 1 ILE C C 6.330 2.988 -3.109 . . . 1.0 . . . . . . . . . . . . A . 1 ILE C . . . . . . . . . c30226_5ug5 1 . 19 . 5114 . 1 1 1 ILE CA C 5.273 3.777 -3.863 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CA . . . . . . . . . c30226_5ug5 1 . 19 . 5115 . 1 1 1 ILE CB C 4.244 2.790 -4.464 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CB . . . . . . . . . c30226_5ug5 1 . 19 . 5116 . 1 1 1 ILE CD1 C 3.995 0.799 -6.038 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CD1 . . . . . . . . . c30226_5ug5 1 . 19 . 5117 . 1 1 1 ILE CG1 C 4.907 1.881 -5.503 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CG1 . . . . . . . . . c30226_5ug5 1 . 19 . 5118 . 1 1 1 ILE CG2 C 3.076 3.552 -5.078 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CG2 . . . . . . . . . c30226_5ug5 1 . 19 . 5119 . 1 1 1 ILE H1 H 6.573 5.281 -4.461 . . . 1.0 . . . . . . . . . . . . A . 1 ILE H1 . . . . . . . . . c30226_5ug5 1 . 19 . 5120 . 1 1 1 ILE H2 H 5.189 5.149 -5.423 . . . 1.0 . . . . . . . . . . . . A . 1 ILE H2 . . . . . . . . . c30226_5ug5 1 . 19 . 5121 . 1 1 1 ILE H3 H 6.433 4.016 -5.572 . . . 1.0 . . . . . . . . . . . . A . 1 ILE H3 . . . . . . . . . c30226_5ug5 1 . 19 . 5122 . 1 1 1 ILE HA H 4.760 4.427 -3.170 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HA . . . . . . . . . c30226_5ug5 1 . 19 . 5123 . 1 1 1 ILE HB H 3.857 2.180 -3.660 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HB . . . . . . . . . c30226_5ug5 1 . 19 . 5124 . 1 1 1 ILE HD11 H 4.524 0.214 -6.776 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HD11 . . . . . . . . . c30226_5ug5 1 . 19 . 5125 . 1 1 1 ILE HD12 H 3.125 1.251 -6.491 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HD12 . . . . . . . . . c30226_5ug5 1 . 19 . 5126 . 1 1 1 ILE HD13 H 3.686 0.157 -5.226 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HD13 . . . . . . . . . c30226_5ug5 1 . 19 . 5127 . 1 1 1 ILE HG12 H 5.233 2.481 -6.340 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG12 . . . . . . . . . c30226_5ug5 1 . 19 . 5128 . 1 1 1 ILE HG13 H 5.765 1.402 -5.056 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG13 . . . . . . . . . c30226_5ug5 1 . 19 . 5129 . 1 1 1 ILE HG21 H 2.585 4.136 -4.312 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG21 . . . . . . . . . c30226_5ug5 1 . 19 . 5130 . 1 1 1 ILE HG22 H 2.372 2.851 -5.500 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG22 . . . . . . . . . c30226_5ug5 1 . 19 . 5131 . 1 1 1 ILE HG23 H 3.441 4.207 -5.853 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG23 . . . . . . . . . c30226_5ug5 1 . 19 . 5132 . 1 1 1 ILE N N 5.909 4.613 -4.902 . . . 1.0 . . . . . . . . . . . . A . 1 ILE N . . . . . . . . . c30226_5ug5 1 . 19 . 5133 . 1 1 1 ILE O O 7.447 2.812 -3.593 . . . 1.0 . . . . . . . . . . . . A . 1 ILE O . . . . . . . . . c30226_5ug5 1 . 19 . 5134 . 1 1 2 ARG C C 6.862 0.281 -1.568 . . . 1.0 . . . . . . . . . . . . A . 2 ARG C . . . . . . . . . c30226_5ug5 1 . 19 . 5135 . 1 1 2 ARG CA C 6.891 1.729 -1.125 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CA . . . . . . . . . c30226_5ug5 1 . 19 . 5136 . 1 1 2 ARG CB C 6.528 1.808 0.355 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CB . . . . . . . . . c30226_5ug5 1 . 19 . 5137 . 1 1 2 ARG CD C 8.392 3.190 1.332 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CD . . . . . . . . . c30226_5ug5 1 . 19 . 5138 . 1 1 2 ARG CG C 6.903 3.127 1.015 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CG . . . . . . . . . c30226_5ug5 1 . 19 . 5139 . 1 1 2 ARG CZ C 10.250 2.292 -0.038 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CZ . . . . . . . . . c30226_5ug5 1 . 19 . 5140 . 1 1 2 ARG H H 5.094 2.741 -1.566 . . . 1.0 . . . . . . . . . . . . A . 2 ARG H . . . . . . . . . c30226_5ug5 1 . 19 . 5141 . 1 1 2 ARG HA H 7.885 2.119 -1.263 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HA . . . . . . . . . c30226_5ug5 1 . 19 . 5142 . 1 1 2 ARG HB2 H 5.466 1.660 0.458 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB2 . . . . . . . . . c30226_5ug5 1 . 19 . 5143 . 1 1 2 ARG HB3 H 7.040 1.013 0.878 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB3 . . . . . . . . . c30226_5ug5 1 . 19 . 5144 . 1 1 2 ARG HD2 H 8.596 4.115 1.848 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD2 . . . . . . . . . c30226_5ug5 1 . 19 . 5145 . 1 1 2 ARG HD3 H 8.644 2.360 1.973 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD3 . . . . . . . . . c30226_5ug5 1 . 19 . 5146 . 1 1 2 ARG HE H 9.013 3.769 -0.592 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HE . . . . . . . . . c30226_5ug5 1 . 19 . 5147 . 1 1 2 ARG HG2 H 6.653 3.936 0.346 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG2 . . . . . . . . . c30226_5ug5 1 . 19 . 5148 . 1 1 2 ARG HG3 H 6.343 3.231 1.933 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG3 . . . . . . . . . c30226_5ug5 1 . 19 . 5149 . 1 1 2 ARG HH11 H 10.035 1.354 1.758 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH11 . . . . . . . . . c30226_5ug5 1 . 19 . 5150 . 1 1 2 ARG HH12 H 11.342 0.781 0.768 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH12 . . . . . . . . . c30226_5ug5 1 . 19 . 5151 . 1 1 2 ARG HH21 H 10.721 2.988 -1.883 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH21 . . . . . . . . . c30226_5ug5 1 . 19 . 5152 . 1 1 2 ARG HH22 H 11.735 1.709 -1.289 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH22 . . . . . . . . . c30226_5ug5 1 . 19 . 5153 . 1 1 2 ARG N N 5.983 2.532 -1.920 . . . 1.0 . . . . . . . . . . . . A . 2 ARG N . . . . . . . . . c30226_5ug5 1 . 19 . 5154 . 1 1 2 ARG NE N 9.225 3.130 0.130 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NE . . . . . . . . . c30226_5ug5 1 . 19 . 5155 . 1 1 2 ARG NH1 N 10.565 1.405 0.904 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH1 . . . . . . . . . c30226_5ug5 1 . 19 . 5156 . 1 1 2 ARG NH2 N 10.956 2.332 -1.159 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH2 . . . . . . . . . c30226_5ug5 1 . 19 . 5157 . 1 1 2 ARG O O 5.839 -0.223 -2.022 . . . 1.0 . . . . . . . . . . . . A . 2 ARG O . . . . . . . . . c30226_5ug5 1 . 19 . 5158 . 1 1 3 ASP C C 7.602 -2.599 -0.519 . . . 1.0 . . . . . . . . . . . . A . 3 ASP C . . . . . . . . . c30226_5ug5 1 . 19 . 5159 . 1 1 3 ASP CA C 8.116 -1.807 -1.701 . . . 1.0 . . . . . . . . . . . . A . 3 ASP CA . . . . . . . . . c30226_5ug5 1 . 19 . 5160 . 1 1 3 ASP CB C 9.572 -2.166 -2.023 . . . 1.0 . . . . . . . . . . . . A . 3 ASP CB . . . . . . . . . c30226_5ug5 1 . 19 . 5161 . 1 1 3 ASP CG C 9.760 -3.621 -2.402 . . . 1.0 . . . . . . . . . . . . A . 3 ASP CG . . . . . . . . . c30226_5ug5 1 . 19 . 5162 . 1 1 3 ASP H H 8.772 0.102 -1.057 . . . 1.0 . . . . . . . . . . . . A . 3 ASP H . . . . . . . . . c30226_5ug5 1 . 19 . 5163 . 1 1 3 ASP HA H 7.493 -2.011 -2.539 . . . 1.0 . . . . . . . . . . . . A . 3 ASP HA . . . . . . . . . c30226_5ug5 1 . 19 . 5164 . 1 1 3 ASP HB2 H 9.910 -1.556 -2.847 . . . 1.0 . . . . . . . . . . . . A . 3 ASP HB2 . . . . . . . . . c30226_5ug5 1 . 19 . 5165 . 1 1 3 ASP HB3 H 10.183 -1.958 -1.157 . . . 1.0 . . . . . . . . . . . . A . 3 ASP HB3 . . . . . . . . . c30226_5ug5 1 . 19 . 5166 . 1 1 3 ASP N N 7.995 -0.382 -1.399 . . . 1.0 . . . . . . . . . . . . A . 3 ASP N . . . . . . . . . c30226_5ug5 1 . 19 . 5167 . 1 1 3 ASP O O 7.548 -3.827 -0.502 . . . 1.0 . . . . . . . . . . . . A . 3 ASP O . . . . . . . . . c30226_5ug5 1 . 19 . 5168 . 1 1 3 ASP OD1 O 9.413 -3.992 -3.544 . . . 1.0 . . . . . . . . . . . . A . 3 ASP OD1 . . . . . . . . . c30226_5ug5 1 . 19 . 5169 . 1 1 3 ASP OD2 O 10.279 -4.396 -1.569 . . . 1.0 . . . . . . . . . . . . A . 3 ASP OD2 . . . . . . . . . c30226_5ug5 1 . 19 . 5170 . 1 1 4 GLU C C 5.104 -2.059 1.601 . . . 1.0 . . . . . . . . . . . . A . 4 GLU C . . . . . . . . . c30226_5ug5 1 . 19 . 5171 . 1 1 4 GLU CA C 6.599 -2.312 1.667 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CA . . . . . . . . . c30226_5ug5 1 . 19 . 5172 . 1 1 4 GLU CB C 7.189 -1.543 2.829 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CB . . . . . . . . . c30226_5ug5 1 . 19 . 5173 . 1 1 4 GLU CD C 9.276 -0.640 3.906 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CD . . . . . . . . . c30226_5ug5 1 . 19 . 5174 . 1 1 4 GLU CG C 8.697 -1.668 2.958 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CG . . . . . . . . . c30226_5ug5 1 . 19 . 5175 . 1 1 4 GLU H H 7.286 -0.876 0.329 . . . 1.0 . . . . . . . . . . . . A . 4 GLU H . . . . . . . . . c30226_5ug5 1 . 19 . 5176 . 1 1 4 GLU HA H 6.799 -3.361 1.776 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HA . . . . . . . . . c30226_5ug5 1 . 19 . 5177 . 1 1 4 GLU HB2 H 6.949 -0.503 2.705 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HB2 . . . . . . . . . c30226_5ug5 1 . 19 . 5178 . 1 1 4 GLU HB3 H 6.739 -1.896 3.727 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HB3 . . . . . . . . . c30226_5ug5 1 . 19 . 5179 . 1 1 4 GLU HG2 H 8.937 -2.654 3.328 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HG2 . . . . . . . . . c30226_5ug5 1 . 19 . 5180 . 1 1 4 GLU HG3 H 9.143 -1.530 1.984 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HG3 . . . . . . . . . c30226_5ug5 1 . 19 . 5181 . 1 1 4 GLU N N 7.194 -1.832 0.451 . . . 1.0 . . . . . . . . . . . . A . 4 GLU N . . . . . . . . . c30226_5ug5 1 . 19 . 5182 . 1 1 4 GLU O O 4.429 -1.976 2.619 . . . 1.0 . . . . . . . . . . . . A . 4 GLU O . . . . . . . . . c30226_5ug5 1 . 19 . 5183 . 1 1 4 GLU OE1 O 9.237 -0.865 5.130 . . . 1.0 . . . . . . . . . . . . A . 4 GLU OE1 . . . . . . . . . c30226_5ug5 1 . 19 . 5184 . 1 1 4 GLU OE2 O 9.763 0.409 3.426 . . . 1.0 . . . . . . . . . . . . A . 4 GLU OE2 . . . . . . . . . c30226_5ug5 1 . 19 . 5185 . 1 1 5 CYS C C 2.196 -2.225 0.875 . . . 1.0 . . . . . . . . . . . . A . 5 CYS C . . . . . . . . . c30226_5ug5 1 . 19 . 5186 . 1 1 5 CYS CA C 3.264 -1.468 0.089 . . . 1.0 . . . . . . . . . . . . A . 5 CYS CA . . . . . . . . . c30226_5ug5 1 . 19 . 5187 . 1 1 5 CYS CB C 2.984 -1.588 -1.411 . . . 1.0 . . . . . . . . . . . . A . 5 CYS CB . . . . . . . . . c30226_5ug5 1 . 19 . 5188 . 1 1 5 CYS H H 5.199 -2.170 -0.375 . . . 1.0 . . . . . . . . . . . . A . 5 CYS H . . . . . . . . . c30226_5ug5 1 . 19 . 5189 . 1 1 5 CYS HA H 3.214 -0.426 0.362 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HA . . . . . . . . . c30226_5ug5 1 . 19 . 5190 . 1 1 5 CYS HB2 H 3.767 -1.083 -1.958 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HB2 . . . . . . . . . c30226_5ug5 1 . 19 . 5191 . 1 1 5 CYS HB3 H 2.979 -2.633 -1.685 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HB3 . . . . . . . . . c30226_5ug5 1 . 19 . 5192 . 1 1 5 CYS N N 4.618 -1.934 0.376 . . . 1.0 . . . . . . . . . . . . A . 5 CYS N . . . . . . . . . c30226_5ug5 1 . 19 . 5193 . 1 1 5 CYS O O 1.224 -1.630 1.342 . . . 1.0 . . . . . . . . . . . . A . 5 CYS O . . . . . . . . . c30226_5ug5 1 . 19 . 5194 . 1 1 5 CYS SG S 1.396 -0.872 -1.931 . . . 1.0 . . . . . . . . . . . . A . 5 CYS SG . . . . . . . . . c30226_5ug5 1 . 19 . 5195 . 1 1 6 CYS C C 1.273 -3.993 3.175 . . . 1.0 . . . . . . . . . . . . A . 6 CYS C . . . . . . . . . c30226_5ug5 1 . 19 . 5196 . 1 1 6 CYS CA C 1.390 -4.361 1.702 . . . 1.0 . . . . . . . . . . . . A . 6 CYS CA . . . . . . . . . c30226_5ug5 1 . 19 . 5197 . 1 1 6 CYS CB C 1.750 -5.840 1.553 . . . 1.0 . . . . . . . . . . . . A . 6 CYS CB . . . . . . . . . c30226_5ug5 1 . 19 . 5198 . 1 1 6 CYS H H 3.233 -3.929 0.752 . . . 1.0 . . . . . . . . . . . . A . 6 CYS H . . . . . . . . . c30226_5ug5 1 . 19 . 5199 . 1 1 6 CYS HA H 0.441 -4.176 1.221 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HA . . . . . . . . . c30226_5ug5 1 . 19 . 5200 . 1 1 6 CYS HB2 H 2.048 -6.030 0.534 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HB2 . . . . . . . . . c30226_5ug5 1 . 19 . 5201 . 1 1 6 CYS HB3 H 2.574 -6.069 2.212 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HB3 . . . . . . . . . c30226_5ug5 1 . 19 . 5202 . 1 1 6 CYS N N 2.389 -3.524 1.050 . . . 1.0 . . . . . . . . . . . . A . 6 CYS N . . . . . . . . . c30226_5ug5 1 . 19 . 5203 . 1 1 6 CYS O O 0.215 -4.144 3.780 . . . 1.0 . . . . . . . . . . . . A . 6 CYS O . . . . . . . . . c30226_5ug5 1 . 19 . 5204 . 1 1 6 CYS SG S 0.389 -6.984 1.953 . . . 1.0 . . . . . . . . . . . . A . 6 CYS SG . . . . . . . . . c30226_5ug5 1 . 19 . 5205 . 1 1 7 SER C C 2.196 -1.557 5.219 . . . 1.0 . . . . . . . . . . . . A . 7 SER C . . . . . . . . . c30226_5ug5 1 . 19 . 5206 . 1 1 7 SER CA C 2.391 -3.055 5.117 . . . 1.0 . . . . . . . . . . . . A . 7 SER CA . . . . . . . . . c30226_5ug5 1 . 19 . 5207 . 1 1 7 SER CB C 3.732 -3.386 5.748 . . . 1.0 . . . . . . . . . . . . A . 7 SER CB . . . . . . . . . c30226_5ug5 1 . 19 . 5208 . 1 1 7 SER H H 3.190 -3.447 3.205 . . . 1.0 . . . . . . . . . . . . A . 7 SER H . . . . . . . . . c30226_5ug5 1 . 19 . 5209 . 1 1 7 SER HA H 1.610 -3.560 5.659 . . . 1.0 . . . . . . . . . . . . A . 7 SER HA . . . . . . . . . c30226_5ug5 1 . 19 . 5210 . 1 1 7 SER HB2 H 4.495 -3.336 4.989 . . . 1.0 . . . . . . . . . . . . A . 7 SER HB2 . . . . . . . . . c30226_5ug5 1 . 19 . 5211 . 1 1 7 SER HB3 H 3.943 -2.650 6.517 . . . 1.0 . . . . . . . . . . . . A . 7 SER HB3 . . . . . . . . . c30226_5ug5 1 . 19 . 5212 . 1 1 7 SER HG H 4.037 -4.636 7.228 . . . 1.0 . . . . . . . . . . . . A . 7 SER HG . . . . . . . . . c30226_5ug5 1 . 19 . 5213 . 1 1 7 SER N N 2.365 -3.505 3.737 . . . 1.0 . . . . . . . . . . . . A . 7 SER N . . . . . . . . . c30226_5ug5 1 . 19 . 5214 . 1 1 7 SER O O 1.700 -1.047 6.223 . . . 1.0 . . . . . . . . . . . . A . 7 SER O . . . . . . . . . c30226_5ug5 1 . 19 . 5215 . 1 1 7 SER OG O 3.739 -4.689 6.311 . . . 1.0 . . . . . . . . . . . . A . 7 SER OG . . . . . . . . . c30226_5ug5 1 . 19 . 5216 . 1 1 8 ASN C C 1.430 1.311 4.183 . . . 1.0 . . . . . . . . . . . . A . 8 ASN C . . . . . . . . . c30226_5ug5 1 . 19 . 5217 . 1 1 8 ASN CA C 2.764 0.577 4.285 . . . 1.0 . . . . . . . . . . . . A . 8 ASN CA . . . . . . . . . c30226_5ug5 1 . 19 . 5218 . 1 1 8 ASN CB C 3.715 1.072 3.199 . . . 1.0 . . . . . . . . . . . . A . 8 ASN CB . . . . . . . . . c30226_5ug5 1 . 19 . 5219 . 1 1 8 ASN CG C 3.931 2.569 3.259 . . . 1.0 . . . . . . . . . . . . A . 8 ASN CG . . . . . . . . . c30226_5ug5 1 . 19 . 5220 . 1 1 8 ASN H H 2.747 -1.302 3.317 . . . 1.0 . . . . . . . . . . . . A . 8 ASN H . . . . . . . . . c30226_5ug5 1 . 19 . 5221 . 1 1 8 ASN HA H 3.207 0.758 5.254 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HA . . . . . . . . . c30226_5ug5 1 . 19 . 5222 . 1 1 8 ASN HB2 H 4.671 0.583 3.313 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HB2 . . . . . . . . . c30226_5ug5 1 . 19 . 5223 . 1 1 8 ASN HB3 H 3.301 0.824 2.233 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HB3 . . . . . . . . . c30226_5ug5 1 . 19 . 5224 . 1 1 8 ASN HD21 H 5.437 2.332 4.529 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HD21 . . . . . . . . . c30226_5ug5 1 . 19 . 5225 . 1 1 8 ASN HD22 H 5.069 3.963 4.089 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HD22 . . . . . . . . . c30226_5ug5 1 . 19 . 5226 . 1 1 8 ASN N N 2.587 -0.852 4.180 . . . 1.0 . . . . . . . . . . . . A . 8 ASN N . . . . . . . . . c30226_5ug5 1 . 19 . 5227 . 1 1 8 ASN ND2 N 4.909 2.997 4.037 . . . 1.0 . . . . . . . . . . . . A . 8 ASN ND2 . . . . . . . . . c30226_5ug5 1 . 19 . 5228 . 1 1 8 ASN O O 0.749 1.240 3.158 . . . 1.0 . . . . . . . . . . . . A . 8 ASN O . . . . . . . . . c30226_5ug5 1 . 19 . 5229 . 1 1 8 ASN OD1 O 3.218 3.331 2.616 . . . 1.0 . . . . . . . . . . . . A . 8 ASN OD1 . . . . . . . . . c30226_5ug5 1 . 19 . 5230 . 1 1 9 PRO C C -0.445 3.744 4.206 . . . 1.0 . . . . . . . . . . . . A . 9 PRO C . . . . . . . . . c30226_5ug5 1 . 19 . 5231 . 1 1 9 PRO CA C -0.229 2.750 5.341 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CA . . . . . . . . . c30226_5ug5 1 . 19 . 5232 . 1 1 9 PRO CB C -0.107 3.495 6.669 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CB . . . . . . . . . c30226_5ug5 1 . 19 . 5233 . 1 1 9 PRO CD C 1.857 2.253 6.468 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CD . . . . . . . . . c30226_5ug5 1 . 19 . 5234 . 1 1 9 PRO CG C 0.836 2.697 7.458 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CG . . . . . . . . . c30226_5ug5 1 . 19 . 5235 . 1 1 9 PRO HA H -1.060 2.063 5.386 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HA . . . . . . . . . c30226_5ug5 1 . 19 . 5236 . 1 1 9 PRO HB2 H 0.301 4.466 6.492 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HB2 . . . . . . . . . c30226_5ug5 1 . 19 . 5237 . 1 1 9 PRO HB3 H -1.071 3.569 7.149 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HB3 . . . . . . . . . c30226_5ug5 1 . 19 . 5238 . 1 1 9 PRO HD2 H 2.602 3.021 6.318 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HD2 . . . . . . . . . c30226_5ug5 1 . 19 . 5239 . 1 1 9 PRO HD3 H 2.306 1.350 6.793 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HD3 . . . . . . . . . c30226_5ug5 1 . 19 . 5240 . 1 1 9 PRO HG2 H 1.287 3.315 8.218 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HG2 . . . . . . . . . c30226_5ug5 1 . 19 . 5241 . 1 1 9 PRO HG3 H 0.336 1.848 7.896 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HG3 . . . . . . . . . c30226_5ug5 1 . 19 . 5242 . 1 1 9 PRO N N 1.055 2.043 5.248 . . . 1.0 . . . . . . . . . . . . A . 9 PRO N . . . . . . . . . c30226_5ug5 1 . 19 . 5243 . 1 1 9 PRO O O -1.565 3.930 3.740 . . . 1.0 . . . . . . . . . . . . A . 9 PRO O . . . . . . . . . c30226_5ug5 1 . 19 . 5244 . 1 1 10 ALA C C 0.336 4.745 1.343 . . . 1.0 . . . . . . . . . . . . A . 10 ALA C . . . . . . . . . c30226_5ug5 1 . 19 . 5245 . 1 1 10 ALA CA C 0.545 5.380 2.713 . . . 1.0 . . . . . . . . . . . . A . 10 ALA CA . . . . . . . . . c30226_5ug5 1 . 19 . 5246 . 1 1 10 ALA CB C 1.791 6.253 2.712 . . . 1.0 . . . . . . . . . . . . A . 10 ALA CB . . . . . . . . . c30226_5ug5 1 . 19 . 5247 . 1 1 10 ALA H H 1.511 4.146 4.139 . . . 1.0 . . . . . . . . . . . . A . 10 ALA H . . . . . . . . . c30226_5ug5 1 . 19 . 5248 . 1 1 10 ALA HA H -0.303 6.011 2.935 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HA . . . . . . . . . c30226_5ug5 1 . 19 . 5249 . 1 1 10 ALA HB1 H 2.655 5.648 2.477 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HB1 . . . . . . . . . c30226_5ug5 1 . 19 . 5250 . 1 1 10 ALA HB2 H 1.919 6.701 3.687 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HB2 . . . . . . . . . c30226_5ug5 1 . 19 . 5251 . 1 1 10 ALA HB3 H 1.684 7.031 1.970 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HB3 . . . . . . . . . c30226_5ug5 1 . 19 . 5252 . 1 1 10 ALA N N 0.633 4.369 3.759 . . . 1.0 . . . . . . . . . . . . A . 10 ALA N . . . . . . . . . c30226_5ug5 1 . 19 . 5253 . 1 1 10 ALA O O -0.088 5.413 0.400 . . . 1.0 . . . . . . . . . . . . A . 10 ALA O . . . . . . . . . c30226_5ug5 1 . 19 . 5254 . 1 1 11 CYS C C -0.925 2.256 -0.008 . . . 1.0 . . . . . . . . . . . . A . 11 CYS C . . . . . . . . . c30226_5ug5 1 . 19 . 5255 . 1 1 11 CYS CA C 0.467 2.771 -0.031 . . . 1.0 . . . . . . . . . . . . A . 11 CYS CA . . . . . . . . . c30226_5ug5 1 . 19 . 5256 . 1 1 11 CYS CB C 1.475 1.630 -0.177 . . . 1.0 . . . . . . . . . . . . A . 11 CYS CB . . . . . . . . . c30226_5ug5 1 . 19 . 5257 . 1 1 11 CYS H H 0.759 2.912 2.043 . . . 1.0 . . . . . . . . . . . . A . 11 CYS H . . . . . . . . . c30226_5ug5 1 . 19 . 5258 . 1 1 11 CYS HA H 0.578 3.477 -0.835 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HA . . . . . . . . . c30226_5ug5 1 . 19 . 5259 . 1 1 11 CYS HB2 H 2.425 1.946 0.230 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HB2 . . . . . . . . . c30226_5ug5 1 . 19 . 5260 . 1 1 11 CYS HB3 H 1.116 0.766 0.381 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HB3 . . . . . . . . . c30226_5ug5 1 . 19 . 5261 . 1 1 11 CYS N N 0.615 3.452 1.233 . . . 1.0 . . . . . . . . . . . . A . 11 CYS N . . . . . . . . . c30226_5ug5 1 . 19 . 5262 . 1 1 11 CYS O O -1.717 2.399 -0.940 . . . 1.0 . . . . . . . . . . . . A . 11 CYS O . . . . . . . . . c30226_5ug5 1 . 19 . 5263 . 1 1 11 CYS SG S 1.746 1.122 -1.909 . . . 1.0 . . . . . . . . . . . . A . 11 CYS SG . . . . . . . . . c30226_5ug5 1 . 19 . 5264 . 1 1 12 ARG C C -3.592 2.274 1.344 . . . 1.0 . . . . . . . . . . . . A . 12 ARG C . . . . . . . . . c30226_5ug5 1 . 19 . 5265 . 1 1 12 ARG CA C -2.485 1.238 1.539 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CA . . . . . . . . . c30226_5ug5 1 . 19 . 5266 . 1 1 12 ARG CB C -2.388 0.820 2.978 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CB . . . . . . . . . c30226_5ug5 1 . 19 . 5267 . 1 1 12 ARG CD C -1.278 -0.852 4.436 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CD . . . . . . . . . c30226_5ug5 1 . 19 . 5268 . 1 1 12 ARG CG C -2.020 -0.631 3.145 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CG . . . . . . . . . c30226_5ug5 1 . 19 . 5269 . 1 1 12 ARG CZ C -1.280 -2.603 6.182 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CZ . . . . . . . . . c30226_5ug5 1 . 19 . 5270 . 1 1 12 ARG H H -0.460 1.596 1.801 . . . 1.0 . . . . . . . . . . . . A . 12 ARG H . . . . . . . . . c30226_5ug5 1 . 19 . 5271 . 1 1 12 ARG HA H -2.687 0.379 0.948 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HA . . . . . . . . . c30226_5ug5 1 . 19 . 5272 . 1 1 12 ARG HB2 H -1.631 1.418 3.463 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HB2 . . . . . . . . . c30226_5ug5 1 . 19 . 5273 . 1 1 12 ARG HB3 H -3.320 0.994 3.449 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HB3 . . . . . . . . . c30226_5ug5 1 . 19 . 5274 . 1 1 12 ARG HD2 H -0.226 -0.657 4.248 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HD2 . . . . . . . . . c30226_5ug5 1 . 19 . 5275 . 1 1 12 ARG HD3 H -1.650 -0.165 5.181 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HD3 . . . . . . . . . c30226_5ug5 1 . 19 . 5276 . 1 1 12 ARG HE H -1.688 -2.894 4.245 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HE . . . . . . . . . c30226_5ug5 1 . 19 . 5277 . 1 1 12 ARG HG2 H -2.919 -1.219 3.149 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HG2 . . . . . . . . . c30226_5ug5 1 . 19 . 5278 . 1 1 12 ARG HG3 H -1.390 -0.934 2.320 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HG3 . . . . . . . . . c30226_5ug5 1 . 19 . 5279 . 1 1 12 ARG HH11 H -0.870 -0.750 6.883 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH11 . . . . . . . . . c30226_5ug5 1 . 19 . 5280 . 1 1 12 ARG HH12 H -0.856 -2.007 8.073 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH12 . . . . . . . . . c30226_5ug5 1 . 19 . 5281 . 1 1 12 ARG HH21 H -1.681 -4.552 5.809 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH21 . . . . . . . . . c30226_5ug5 1 . 19 . 5282 . 1 1 12 ARG HH22 H -1.318 -4.174 7.463 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH22 . . . . . . . . . c30226_5ug5 1 . 19 . 5283 . 1 1 12 ARG N N -1.199 1.710 1.155 . . . 1.0 . . . . . . . . . . . . A . 12 ARG N . . . . . . . . . c30226_5ug5 1 . 19 . 5284 . 1 1 12 ARG NE N -1.440 -2.219 4.914 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NE . . . . . . . . . c30226_5ug5 1 . 19 . 5285 . 1 1 12 ARG NH1 N -0.978 -1.715 7.120 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NH1 . . . . . . . . . c30226_5ug5 1 . 19 . 5286 . 1 1 12 ARG NH2 N -1.439 -3.877 6.512 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NH2 . . . . . . . . . c30226_5ug5 1 . 19 . 5287 . 1 1 12 ARG O O -4.761 1.921 1.178 . . . 1.0 . . . . . . . . . . . . A . 12 ARG O . . . . . . . . . c30226_5ug5 1 . 19 . 5288 . 1 1 13 TYR C C -4.850 4.404 -0.259 . . . 1.0 . . . . . . . . . . . . A . 13 TYR C . . . . . . . . . c30226_5ug5 1 . 19 . 5289 . 1 1 13 TYR CA C -4.145 4.628 1.081 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CA . . . . . . . . . c30226_5ug5 1 . 19 . 5290 . 1 1 13 TYR CB C -3.376 5.941 1.074 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CB . . . . . . . . . c30226_5ug5 1 . 19 . 5291 . 1 1 13 TYR CD1 C -5.123 7.600 1.746 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CD1 . . . . . . . . . c30226_5ug5 1 . 19 . 5292 . 1 1 13 TYR CD2 C -4.116 7.804 -0.388 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CD2 . . . . . . . . . c30226_5ug5 1 . 19 . 5293 . 1 1 13 TYR CE1 C -5.903 8.709 1.492 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CE1 . . . . . . . . . c30226_5ug5 1 . 19 . 5294 . 1 1 13 TYR CE2 C -4.883 8.909 -0.657 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CE2 . . . . . . . . . c30226_5ug5 1 . 19 . 5295 . 1 1 13 TYR CG C -4.225 7.139 0.808 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CG . . . . . . . . . c30226_5ug5 1 . 19 . 5296 . 1 1 13 TYR CZ C -5.778 9.362 0.285 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CZ . . . . . . . . . c30226_5ug5 1 . 19 . 5297 . 1 1 13 TYR H H -2.300 3.774 1.595 . . . 1.0 . . . . . . . . . . . . A . 13 TYR H . . . . . . . . . c30226_5ug5 1 . 19 . 5298 . 1 1 13 TYR HA H -4.879 4.657 1.864 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HA . . . . . . . . . c30226_5ug5 1 . 19 . 5299 . 1 1 13 TYR HB2 H -2.895 6.080 2.029 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HB2 . . . . . . . . . c30226_5ug5 1 . 19 . 5300 . 1 1 13 TYR HB3 H -2.630 5.904 0.303 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HB3 . . . . . . . . . c30226_5ug5 1 . 19 . 5301 . 1 1 13 TYR HD1 H -5.207 7.076 2.683 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HD1 . . . . . . . . . c30226_5ug5 1 . 19 . 5302 . 1 1 13 TYR HD2 H -3.414 7.442 -1.119 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HD2 . . . . . . . . . c30226_5ug5 1 . 19 . 5303 . 1 1 13 TYR HE1 H -6.599 9.060 2.231 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HE1 . . . . . . . . . c30226_5ug5 1 . 19 . 5304 . 1 1 13 TYR HE2 H -4.779 9.410 -1.597 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HE2 . . . . . . . . . c30226_5ug5 1 . 19 . 5305 . 1 1 13 TYR HH H -6.572 11.039 0.796 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HH . . . . . . . . . c30226_5ug5 1 . 19 . 5306 . 1 1 13 TYR N N -3.222 3.549 1.364 . . . 1.0 . . . . . . . . . . . . A . 13 TYR N . . . . . . . . . c30226_5ug5 1 . 19 . 5307 . 1 1 13 TYR O O -6.035 4.692 -0.407 . . . 1.0 . . . . . . . . . . . . A . 13 TYR O . . . . . . . . . c30226_5ug5 1 . 19 . 5308 . 1 1 13 TYR OH O -6.553 10.467 0.017 . . . 1.0 . . . . . . . . . . . . A . 13 TYR OH . . . . . . . . . c30226_5ug5 1 . 19 . 5309 . 1 1 14 ASN C C -4.646 2.060 -2.722 . . . 1.0 . . . . . . . . . . . . A . 14 ASN C . . . . . . . . . c30226_5ug5 1 . 19 . 5310 . 1 1 14 ASN CA C -4.675 3.562 -2.533 . . . 1.0 . . . . . . . . . . . . A . 14 ASN CA . . . . . . . . . c30226_5ug5 1 . 19 . 5311 . 1 1 14 ASN CB C -3.894 4.250 -3.654 . . . 1.0 . . . . . . . . . . . . A . 14 ASN CB . . . . . . . . . c30226_5ug5 1 . 19 . 5312 . 1 1 14 ASN CG C -4.055 5.761 -3.650 . . . 1.0 . . . . . . . . . . . . A . 14 ASN CG . . . . . . . . . c30226_5ug5 1 . 19 . 5313 . 1 1 14 ASN H H -3.167 3.648 -1.047 . . . 1.0 . . . . . . . . . . . . A . 14 ASN H . . . . . . . . . c30226_5ug5 1 . 19 . 5314 . 1 1 14 ASN HA H -5.702 3.899 -2.548 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HA . . . . . . . . . c30226_5ug5 1 . 19 . 5315 . 1 1 14 ASN HB2 H -2.847 4.020 -3.542 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HB2 . . . . . . . . . c30226_5ug5 1 . 19 . 5316 . 1 1 14 ASN HB3 H -4.240 3.873 -4.603 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HB3 . . . . . . . . . c30226_5ug5 1 . 19 . 5317 . 1 1 14 ASN HD21 H -5.958 5.607 -3.094 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HD21 . . . . . . . . . c30226_5ug5 1 . 19 . 5318 . 1 1 14 ASN HD22 H -5.369 7.217 -3.324 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HD22 . . . . . . . . . c30226_5ug5 1 . 19 . 5319 . 1 1 14 ASN N N -4.112 3.880 -1.228 . . . 1.0 . . . . . . . . . . . . A . 14 ASN N . . . . . . . . . c30226_5ug5 1 . 19 . 5320 . 1 1 14 ASN ND2 N -5.245 6.242 -3.320 . . . 1.0 . . . . . . . . . . . . A . 14 ASN ND2 . . . . . . . . . c30226_5ug5 1 . 19 . 5321 . 1 1 14 ASN O O -4.776 1.544 -3.832 . . . 1.0 . . . . . . . . . . . . A . 14 ASN O . . . . . . . . . c30226_5ug5 1 . 19 . 5322 . 1 1 14 ASN OD1 O -3.114 6.493 -3.964 . . . 1.0 . . . . . . . . . . . . A . 14 ASN OD1 . . . . . . . . . c30226_5ug5 1 . 19 . 5323 . 1 1 15 ASN C C -4.923 -0.721 -0.407 . . . 1.0 . . . . . . . . . . . . A . 15 ASN C . . . . . . . . . c30226_5ug5 1 . 19 . 5324 . 1 1 15 ASN CA C -4.244 -0.068 -1.612 . . . 1.0 . . . . . . . . . . . . A . 15 ASN CA . . . . . . . . . c30226_5ug5 1 . 19 . 5325 . 1 1 15 ASN CB C -2.737 -0.285 -1.638 . . . 1.0 . . . . . . . . . . . . A . 15 ASN CB . . . . . . . . . c30226_5ug5 1 . 19 . 5326 . 1 1 15 ASN CG C -2.224 -1.558 -0.972 . . . 1.0 . . . . . . . . . . . . A . 15 ASN CG . . . . . . . . . c30226_5ug5 1 . 19 . 5327 . 1 1 15 ASN H H -4.449 1.847 -0.755 . . . 1.0 . . . . . . . . . . . . A . 15 ASN H . . . . . . . . . c30226_5ug5 1 . 19 . 5328 . 1 1 15 ASN HA H -4.677 -0.468 -2.511 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HA . . . . . . . . . c30226_5ug5 1 . 19 . 5329 . 1 1 15 ASN HB2 H -2.410 -0.297 -2.667 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HB2 . . . . . . . . . c30226_5ug5 1 . 19 . 5330 . 1 1 15 ASN HB3 H -2.300 0.565 -1.152 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HB3 . . . . . . . . . c30226_5ug5 1 . 19 . 5331 . 1 1 15 ASN HD21 H -0.617 -0.568 -0.350 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HD21 . . . . . . . . . c30226_5ug5 1 . 19 . 5332 . 1 1 15 ASN HD22 H -0.702 -2.239 0.101 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HD22 . . . . . . . . . c30226_5ug5 1 . 19 . 5333 . 1 1 15 ASN N N -4.462 1.368 -1.612 . . . 1.0 . . . . . . . . . . . . A . 15 ASN N . . . . . . . . . c30226_5ug5 1 . 19 . 5334 . 1 1 15 ASN ND2 N -1.068 -1.447 -0.344 . . . 1.0 . . . . . . . . . . . . A . 15 ASN ND2 . . . . . . . . . c30226_5ug5 1 . 19 . 5335 . 1 1 15 ASN O O -4.315 -1.022 0.617 . . . 1.0 . . . . . . . . . . . . A . 15 ASN O . . . . . . . . . c30226_5ug5 1 . 19 . 5336 . 1 1 15 ASN OD1 O -2.857 -2.619 -1.009 . . . 1.0 . . . . . . . . . . . . A . 15 ASN OD1 . . . . . . . . . c30226_5ug5 1 . 19 . 5337 . 1 1 16 HYP C C -7.372 -2.971 0.028 . . . 1.0 . . . . . . . . . . . . A . 16 HYP C . . . . . . . . . c30226_5ug5 1 . 19 . 5338 . 1 1 16 HYP CA C -7.053 -1.564 0.497 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CA . . . . . . . . . c30226_5ug5 1 . 19 . 5339 . 1 1 16 HYP CB C -8.269 -0.654 0.487 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CB . . . . . . . . . c30226_5ug5 1 . 19 . 5340 . 1 1 16 HYP CD C -7.094 -0.199 -1.492 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CD . . . . . . . . . c30226_5ug5 1 . 19 . 5341 . 1 1 16 HYP CG C -8.090 0.415 -0.582 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CG . . . . . . . . . c30226_5ug5 1 . 19 . 5342 . 1 1 16 HYP HA H -6.594 -1.586 1.460 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HA . . . . . . . . . c30226_5ug5 1 . 19 . 5343 . 1 1 16 HYP HB2 H -8.371 -0.176 1.447 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HB2 . . . . . . . . . c30226_5ug5 1 . 19 . 5344 . 1 1 16 HYP HB3 H -9.154 -1.241 0.273 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HB3 . . . . . . . . . c30226_5ug5 1 . 19 . 5345 . 1 1 16 HYP HD1 H -6.498 1.441 -0.061 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HD1 . . . . . . . . . c30226_5ug5 1 . 19 . 5346 . 1 1 16 HYP HD22 H -7.553 -0.910 -2.147 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HD22 . . . . . . . . . c30226_5ug5 1 . 19 . 5347 . 1 1 16 HYP HD23 H -6.551 0.553 -2.042 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HD23 . . . . . . . . . c30226_5ug5 1 . 19 . 5348 . 1 1 16 HYP HG H -9.019 0.648 -1.075 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HG . . . . . . . . . c30226_5ug5 1 . 19 . 5349 . 1 1 16 HYP N N -6.236 -0.851 -0.493 . . . 1.0 . . . . . . . . . . . . A . 16 HYP N . . . . . . . . . c30226_5ug5 1 . 19 . 5350 . 1 1 16 HYP O O -7.988 -3.771 0.728 . . . 1.0 . . . . . . . . . . . . A . 16 HYP O . . . . . . . . . c30226_5ug5 1 . 19 . 5351 . 1 1 16 HYP OD1 O -7.468 1.577 -0.036 . . . 1.0 . . . . . . . . . . . . A . 16 HYP OD1 . . . . . . . . . c30226_5ug5 1 . 19 . 5352 . 1 1 17 HIS C C -6.079 -4.679 -2.970 . . . 1.0 . . . . . . . . . . . . A . 17 HIS C . . . . . . . . . c30226_5ug5 1 . 19 . 5353 . 1 1 17 HIS CA C -7.085 -4.540 -1.820 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CA . . . . . . . . . c30226_5ug5 1 . 19 . 5354 . 1 1 17 HIS CB C -8.527 -4.700 -2.331 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CB . . . . . . . . . c30226_5ug5 1 . 19 . 5355 . 1 1 17 HIS CD2 C -9.114 -7.223 -2.118 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CD2 . . . . . . . . . c30226_5ug5 1 . 19 . 5356 . 1 1 17 HIS CE1 C -9.299 -7.689 -4.250 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CE1 . . . . . . . . . c30226_5ug5 1 . 19 . 5357 . 1 1 17 HIS CG C -8.869 -6.083 -2.806 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CG . . . . . . . . . c30226_5ug5 1 . 19 . 5358 . 1 1 17 HIS H H -6.473 -2.519 -1.662 . . . 1.0 . . . . . . . . . . . . A . 17 HIS H . . . . . . . . . c30226_5ug5 1 . 19 . 5359 . 1 1 17 HIS HA H -6.880 -5.303 -1.082 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HA . . . . . . . . . c30226_5ug5 1 . 19 . 5360 . 1 1 17 HIS HB2 H -9.209 -4.451 -1.534 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HB2 . . . . . . . . . c30226_5ug5 1 . 19 . 5361 . 1 1 17 HIS HB3 H -8.682 -4.019 -3.155 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HB3 . . . . . . . . . c30226_5ug5 1 . 19 . 5362 . 1 1 17 HIS HD1 H -8.864 -5.796 -4.898 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HD1 . . . . . . . . . c30226_5ug5 1 . 19 . 5363 . 1 1 17 HIS HD2 H -9.101 -7.338 -1.043 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HD2 . . . . . . . . . c30226_5ug5 1 . 19 . 5364 . 1 1 17 HIS HE1 H -9.461 -8.223 -5.175 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HE1 . . . . . . . . . c30226_5ug5 1 . 19 . 5365 . 1 1 17 HIS HE2 H -9.498 -9.159 -2.839 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HE2 . . . . . . . . . c30226_5ug5 1 . 19 . 5366 . 1 1 17 HIS N N -6.923 -3.240 -1.180 . . . 1.0 . . . . . . . . . . . . A . 17 HIS N . . . . . . . . . c30226_5ug5 1 . 19 . 5367 . 1 1 17 HIS ND1 N -8.992 -6.411 -4.140 . . . 1.0 . . . . . . . . . . . . A . 17 HIS ND1 . . . . . . . . . c30226_5ug5 1 . 19 . 5368 . 1 1 17 HIS NE2 N -9.378 -8.203 -3.039 . . . 1.0 . . . . . . . . . . . . A . 17 HIS NE2 . . . . . . . . . c30226_5ug5 1 . 19 . 5369 . 1 1 17 HIS O O -6.345 -5.326 -3.978 . . . 1.0 . . . . . . . . . . . . A . 17 HIS O . . . . . . . . . c30226_5ug5 1 . 19 . 5370 . 1 1 18 VAL C C -2.932 -5.254 -3.558 . . . 1.0 . . . . . . . . . . . . A . 18 VAL C . . . . . . . . . c30226_5ug5 1 . 19 . 5371 . 1 1 18 VAL CA C -3.888 -4.100 -3.834 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CA . . . . . . . . . c30226_5ug5 1 . 19 . 5372 . 1 1 18 VAL CB C -3.134 -2.762 -3.867 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CB . . . . . . . . . c30226_5ug5 1 . 19 . 5373 . 1 1 18 VAL CG1 C -1.799 -2.889 -4.553 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CG1 . . . . . . . . . c30226_5ug5 1 . 19 . 5374 . 1 1 18 VAL CG2 C -3.972 -1.684 -4.531 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CG2 . . . . . . . . . c30226_5ug5 1 . 19 . 5375 . 1 1 18 VAL H H -4.735 -3.560 -1.995 . . . 1.0 . . . . . . . . . . . . A . 18 VAL H . . . . . . . . . c30226_5ug5 1 . 19 . 5376 . 1 1 18 VAL HA H -4.359 -4.253 -4.781 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HA . . . . . . . . . c30226_5ug5 1 . 19 . 5377 . 1 1 18 VAL HB H -2.957 -2.462 -2.850 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HB . . . . . . . . . c30226_5ug5 1 . 19 . 5378 . 1 1 18 VAL HG11 H -1.221 -3.643 -4.049 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG11 . . . . . . . . . c30226_5ug5 1 . 19 . 5379 . 1 1 18 VAL HG12 H -1.283 -1.945 -4.505 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG12 . . . . . . . . . c30226_5ug5 1 . 19 . 5380 . 1 1 18 VAL HG13 H -1.948 -3.173 -5.581 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG13 . . . . . . . . . c30226_5ug5 1 . 19 . 5381 . 1 1 18 VAL HG21 H -4.982 -1.732 -4.154 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG21 . . . . . . . . . c30226_5ug5 1 . 19 . 5382 . 1 1 18 VAL HG22 H -3.975 -1.830 -5.600 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG22 . . . . . . . . . c30226_5ug5 1 . 19 . 5383 . 1 1 18 VAL HG23 H -3.549 -0.713 -4.295 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG23 . . . . . . . . . c30226_5ug5 1 . 19 . 5384 . 1 1 18 VAL N N -4.918 -4.055 -2.817 . . . 1.0 . . . . . . . . . . . . A . 18 VAL N . . . . . . . . . c30226_5ug5 1 . 19 . 5385 . 1 1 18 VAL O O -2.382 -5.870 -4.476 . . . 1.0 . . . . . . . . . . . . A . 18 VAL O . . . . . . . . . c30226_5ug5 1 . 19 . 5386 . 1 1 19 CYS C C -2.800 -7.890 -1.658 . . . 1.0 . . . . . . . . . . . . A . 19 CYS C . . . . . . . . . c30226_5ug5 1 . 19 . 5387 . 1 1 19 CYS CA C -1.938 -6.649 -1.840 . . . 1.0 . . . . . . . . . . . . A . 19 CYS CA . . . . . . . . . c30226_5ug5 1 . 19 . 5388 . 1 1 19 CYS CB C -1.231 -6.305 -0.527 . . . 1.0 . . . . . . . . . . . . A . 19 CYS CB . . . . . . . . . c30226_5ug5 1 . 19 . 5389 . 1 1 19 CYS H H -3.223 -4.995 -1.621 . . . 1.0 . . . . . . . . . . . . A . 19 CYS H . . . . . . . . . c30226_5ug5 1 . 19 . 5390 . 1 1 19 CYS HA H -1.199 -6.844 -2.602 . . . 1.0 . . . . . . . . . . . . A . 19 CYS HA . . . . . . . . . c30226_5ug5 1 . 19 . 5391 . 1 1 19 CYS HB2 H -0.586 -5.453 -0.685 . . . 1.0 . . . . . . . . . . . . A . 19 CYS HB2 . . . . . . . . . c30226_5ug5 1 . 19 . 5392 . 1 1 19 CYS HB3 H -1.970 -6.057 0.219 . . . 1.0 . . . . . . . . . . . . A . 19 CYS HB3 . . . . . . . . . c30226_5ug5 1 . 19 . 5393 . 1 1 19 CYS N N -2.764 -5.541 -2.284 . . . 1.0 . . . . . . . . . . . . A . 19 CYS N . . . . . . . . . c30226_5ug5 1 . 19 . 5394 . 1 1 19 CYS O O -2.627 -8.858 -2.427 . . . 1.0 . . . . . . . . . . . . A . 19 CYS O . . . . . . . . . c30226_5ug5 1 . 19 . 5395 . 1 1 19 CYS OXT O -3.680 -7.873 -0.775 . . . 1.0 . . . . . . . . . . . . A . 19 CYS OXT . . . . . . . . . c30226_5ug5 1 . 19 . 5396 . 1 1 19 CYS SG S -0.204 -7.659 0.135 . . . 1.0 . . . . . . . . . . . . A . 19 CYS SG . . . . . . . . . c30226_5ug5 1 . 20 . 5397 . 1 1 1 ILE C C 1.081 -7.101 -2.762 . . . 1.0 . . . . . . . . . . . . A . 1 ILE C . . . . . . . . . c30226_5ug5 1 . 20 . 5398 . 1 1 1 ILE CA C -0.184 -7.747 -2.211 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CA . . . . . . . . . c30226_5ug5 1 . 20 . 5399 . 1 1 1 ILE CB C 0.207 -8.865 -1.210 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CB . . . . . . . . . c30226_5ug5 1 . 20 . 5400 . 1 1 1 ILE CD1 C -0.019 -11.044 -2.568 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CD1 . . . . . . . . . c30226_5ug5 1 . 20 . 5401 . 1 1 1 ILE CG1 C 0.914 -10.041 -1.912 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CG1 . . . . . . . . . c30226_5ug5 1 . 20 . 5402 . 1 1 1 ILE CG2 C -1.021 -9.345 -0.448 . . . 1.0 . . . . . . . . . . . . A . 1 ILE CG2 . . . . . . . . . c30226_5ug5 1 . 20 . 5403 . 1 1 1 ILE H1 H -0.509 -8.926 -3.899 . . . 1.0 . . . . . . . . . . . . A . 1 ILE H1 . . . . . . . . . c30226_5ug5 1 . 20 . 5404 . 1 1 1 ILE H2 H -1.340 -7.457 -3.917 . . . 1.0 . . . . . . . . . . . . A . 1 ILE H2 . . . . . . . . . c30226_5ug5 1 . 20 . 5405 . 1 1 1 ILE H3 H -1.883 -8.716 -2.934 . . . 1.0 . . . . . . . . . . . . A . 1 ILE H3 . . . . . . . . . c30226_5ug5 1 . 20 . 5406 . 1 1 1 ILE HA H -0.744 -6.995 -1.674 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HA . . . . . . . . . c30226_5ug5 1 . 20 . 5407 . 1 1 1 ILE HB H 0.886 -8.433 -0.488 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HB . . . . . . . . . c30226_5ug5 1 . 20 . 5408 . 1 1 1 ILE HD11 H -0.663 -10.534 -3.267 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HD11 . . . . . . . . . c30226_5ug5 1 . 20 . 5409 . 1 1 1 ILE HD12 H -0.620 -11.528 -1.812 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HD12 . . . . . . . . . c30226_5ug5 1 . 20 . 5410 . 1 1 1 ILE HD13 H 0.565 -11.786 -3.092 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HD13 . . . . . . . . . c30226_5ug5 1 . 20 . 5411 . 1 1 1 ILE HG12 H 1.561 -9.650 -2.681 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG12 . . . . . . . . . c30226_5ug5 1 . 20 . 5412 . 1 1 1 ILE HG13 H 1.511 -10.572 -1.186 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG13 . . . . . . . . . c30226_5ug5 1 . 20 . 5413 . 1 1 1 ILE HG21 H -1.416 -8.533 0.142 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG21 . . . . . . . . . c30226_5ug5 1 . 20 . 5414 . 1 1 1 ILE HG22 H -0.746 -10.162 0.201 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG22 . . . . . . . . . c30226_5ug5 1 . 20 . 5415 . 1 1 1 ILE HG23 H -1.769 -9.679 -1.149 . . . 1.0 . . . . . . . . . . . . A . 1 ILE HG23 . . . . . . . . . c30226_5ug5 1 . 20 . 5416 . 1 1 1 ILE N N -1.037 -8.248 -3.315 . . . 1.0 . . . . . . . . . . . . A . 1 ILE N . . . . . . . . . c30226_5ug5 1 . 20 . 5417 . 1 1 1 ILE O O 1.496 -7.387 -3.884 . . . 1.0 . . . . . . . . . . . . A . 1 ILE O . . . . . . . . . c30226_5ug5 1 . 20 . 5418 . 1 1 2 ARG C C 4.065 -5.982 -1.480 . . . 1.0 . . . . . . . . . . . . A . 2 ARG C . . . . . . . . . c30226_5ug5 1 . 20 . 5419 . 1 1 2 ARG CA C 2.907 -5.540 -2.370 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CA . . . . . . . . . c30226_5ug5 1 . 20 . 5420 . 1 1 2 ARG CB C 2.724 -4.009 -2.313 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CB . . . . . . . . . c30226_5ug5 1 . 20 . 5421 . 1 1 2 ARG CD C 2.164 -3.631 -4.746 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CD . . . . . . . . . c30226_5ug5 1 . 20 . 5422 . 1 1 2 ARG CG C 1.692 -3.490 -3.304 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CG . . . . . . . . . c30226_5ug5 1 . 20 . 5423 . 1 1 2 ARG CZ C 4.122 -2.777 -5.994 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CZ . . . . . . . . . c30226_5ug5 1 . 20 . 5424 . 1 1 2 ARG H H 1.295 -6.021 -1.098 . . . 1.0 . . . . . . . . . . . . A . 2 ARG H . . . . . . . . . c30226_5ug5 1 . 20 . 5425 . 1 1 2 ARG HA H 3.122 -5.830 -3.381 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HA . . . . . . . . . c30226_5ug5 1 . 20 . 5426 . 1 1 2 ARG HB2 H 2.409 -3.715 -1.312 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB2 . . . . . . . . . c30226_5ug5 1 . 20 . 5427 . 1 1 2 ARG HB3 H 3.669 -3.539 -2.533 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB3 . . . . . . . . . c30226_5ug5 1 . 20 . 5428 . 1 1 2 ARG HD2 H 2.621 -4.600 -4.867 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD2 . . . . . . . . . c30226_5ug5 1 . 20 . 5429 . 1 1 2 ARG HD3 H 1.308 -3.555 -5.398 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD3 . . . . . . . . . c30226_5ug5 1 . 20 . 5430 . 1 1 2 ARG HE H 3.026 -1.716 -4.698 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HE . . . . . . . . . c30226_5ug5 1 . 20 . 5431 . 1 1 2 ARG HG2 H 0.781 -4.053 -3.182 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG2 . . . . . . . . . c30226_5ug5 1 . 20 . 5432 . 1 1 2 ARG HG3 H 1.503 -2.446 -3.097 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG3 . . . . . . . . . c30226_5ug5 1 . 20 . 5433 . 1 1 2 ARG HH11 H 3.713 -4.736 -6.341 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH11 . . . . . . . . . c30226_5ug5 1 . 20 . 5434 . 1 1 2 ARG HH12 H 5.062 -4.094 -7.221 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH12 . . . . . . . . . c30226_5ug5 1 . 20 . 5435 . 1 1 2 ARG HH21 H 4.785 -0.864 -5.874 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH21 . . . . . . . . . c30226_5ug5 1 . 20 . 5436 . 1 1 2 ARG HH22 H 5.669 -1.890 -6.960 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH22 . . . . . . . . . c30226_5ug5 1 . 20 . 5437 . 1 1 2 ARG N N 1.681 -6.216 -1.972 . . . 1.0 . . . . . . . . . . . . A . 2 ARG N . . . . . . . . . c30226_5ug5 1 . 20 . 5438 . 1 1 2 ARG NE N 3.133 -2.600 -5.115 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NE . . . . . . . . . c30226_5ug5 1 . 20 . 5439 . 1 1 2 ARG NH1 N 4.311 -3.963 -6.566 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH1 . . . . . . . . . c30226_5ug5 1 . 20 . 5440 . 1 1 2 ARG NH2 N 4.920 -1.762 -6.301 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH2 . . . . . . . . . c30226_5ug5 1 . 20 . 5441 . 1 1 2 ARG O O 3.913 -6.903 -0.679 . . . 1.0 . . . . . . . . . . . . A . 2 ARG O . . . . . . . . . c30226_5ug5 1 . 20 . 5442 . 1 1 3 ASP C C 6.136 -5.011 0.582 . . . 1.0 . . . . . . . . . . . . A . 3 ASP C . . . . . . . . . c30226_5ug5 1 . 20 . 5443 . 1 1 3 ASP CA C 6.383 -5.613 -0.793 . . . 1.0 . . . . . . . . . . . . A . 3 ASP CA . . . . . . . . . c30226_5ug5 1 . 20 . 5444 . 1 1 3 ASP CB C 7.642 -5.015 -1.440 . . . 1.0 . . . . . . . . . . . . A . 3 ASP CB . . . . . . . . . c30226_5ug5 1 . 20 . 5445 . 1 1 3 ASP CG C 8.930 -5.630 -0.923 . . . 1.0 . . . . . . . . . . . . A . 3 ASP CG . . . . . . . . . c30226_5ug5 1 . 20 . 5446 . 1 1 3 ASP H H 5.304 -4.687 -2.362 . . . 1.0 . . . . . . . . . . . . A . 3 ASP H . . . . . . . . . c30226_5ug5 1 . 20 . 5447 . 1 1 3 ASP HA H 6.513 -6.668 -0.682 . . . 1.0 . . . . . . . . . . . . A . 3 ASP HA . . . . . . . . . c30226_5ug5 1 . 20 . 5448 . 1 1 3 ASP HB2 H 7.598 -5.173 -2.506 . . . 1.0 . . . . . . . . . . . . A . 3 ASP HB2 . . . . . . . . . c30226_5ug5 1 . 20 . 5449 . 1 1 3 ASP HB3 H 7.667 -3.954 -1.242 . . . 1.0 . . . . . . . . . . . . A . 3 ASP HB3 . . . . . . . . . c30226_5ug5 1 . 20 . 5450 . 1 1 3 ASP N N 5.222 -5.351 -1.644 . . . 1.0 . . . . . . . . . . . . A . 3 ASP N . . . . . . . . . c30226_5ug5 1 . 20 . 5451 . 1 1 3 ASP O O 5.050 -5.136 1.142 . . . 1.0 . . . . . . . . . . . . A . 3 ASP O . . . . . . . . . c30226_5ug5 1 . 20 . 5452 . 1 1 3 ASP OD1 O 9.351 -6.677 -1.455 . . . 1.0 . . . . . . . . . . . . A . 3 ASP OD1 . . . . . . . . . c30226_5ug5 1 . 20 . 5453 . 1 1 3 ASP OD2 O 9.522 -5.074 0.027 . . . 1.0 . . . . . . . . . . . . A . 3 ASP OD2 . . . . . . . . . c30226_5ug5 1 . 20 . 5454 . 1 1 4 GLU C C 5.935 -2.490 2.159 . . . 1.0 . . . . . . . . . . . . A . 4 GLU C . . . . . . . . . c30226_5ug5 1 . 20 . 5455 . 1 1 4 GLU CA C 6.963 -3.602 2.359 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CA . . . . . . . . . c30226_5ug5 1 . 20 . 5456 . 1 1 4 GLU CB C 8.289 -3.016 2.821 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CB . . . . . . . . . c30226_5ug5 1 . 20 . 5457 . 1 1 4 GLU CD C 10.531 -3.520 3.833 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CD . . . . . . . . . c30226_5ug5 1 . 20 . 5458 . 1 1 4 GLU CG C 9.353 -4.066 3.066 . . . 1.0 . . . . . . . . . . . . A . 4 GLU CG . . . . . . . . . c30226_5ug5 1 . 20 . 5459 . 1 1 4 GLU H H 8.017 -4.414 0.699 . . . 1.0 . . . . . . . . . . . . A . 4 GLU H . . . . . . . . . c30226_5ug5 1 . 20 . 5460 . 1 1 4 GLU HA H 6.596 -4.282 3.114 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HA . . . . . . . . . c30226_5ug5 1 . 20 . 5461 . 1 1 4 GLU HB2 H 8.651 -2.333 2.069 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HB2 . . . . . . . . . c30226_5ug5 1 . 20 . 5462 . 1 1 4 GLU HB3 H 8.130 -2.476 3.738 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HB3 . . . . . . . . . c30226_5ug5 1 . 20 . 5463 . 1 1 4 GLU HG2 H 8.920 -4.879 3.626 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HG2 . . . . . . . . . c30226_5ug5 1 . 20 . 5464 . 1 1 4 GLU HG3 H 9.702 -4.432 2.111 . . . 1.0 . . . . . . . . . . . . A . 4 GLU HG3 . . . . . . . . . c30226_5ug5 1 . 20 . 5465 . 1 1 4 GLU N N 7.134 -4.360 1.125 . . . 1.0 . . . . . . . . . . . . A . 4 GLU N . . . . . . . . . c30226_5ug5 1 . 20 . 5466 . 1 1 4 GLU O O 5.437 -1.903 3.117 . . . 1.0 . . . . . . . . . . . . A . 4 GLU O . . . . . . . . . c30226_5ug5 1 . 20 . 5467 . 1 1 4 GLU OE1 O 10.581 -3.717 5.066 . . . 1.0 . . . . . . . . . . . . A . 4 GLU OE1 . . . . . . . . . c30226_5ug5 1 . 20 . 5468 . 1 1 4 GLU OE2 O 11.405 -2.886 3.214 . . . 1.0 . . . . . . . . . . . . A . 4 GLU OE2 . . . . . . . . . c30226_5ug5 1 . 20 . 5469 . 1 1 5 CYS C C 3.206 -1.849 1.070 . . . 1.0 . . . . . . . . . . . . A . 5 CYS C . . . . . . . . . c30226_5ug5 1 . 20 . 5470 . 1 1 5 CYS CA C 4.541 -1.301 0.549 . . . 1.0 . . . . . . . . . . . . A . 5 CYS CA . . . . . . . . . c30226_5ug5 1 . 20 . 5471 . 1 1 5 CYS CB C 4.486 -1.121 -0.975 . . . 1.0 . . . . . . . . . . . . A . 5 CYS CB . . . . . . . . . c30226_5ug5 1 . 20 . 5472 . 1 1 5 CYS H H 6.134 -2.642 0.180 . . . 1.0 . . . . . . . . . . . . A . 5 CYS H . . . . . . . . . c30226_5ug5 1 . 20 . 5473 . 1 1 5 CYS HA H 4.742 -0.349 1.016 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HA . . . . . . . . . c30226_5ug5 1 . 20 . 5474 . 1 1 5 CYS HB2 H 5.462 -1.328 -1.385 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HB2 . . . . . . . . . c30226_5ug5 1 . 20 . 5475 . 1 1 5 CYS HB3 H 3.777 -1.825 -1.384 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HB3 . . . . . . . . . c30226_5ug5 1 . 20 . 5476 . 1 1 5 CYS N N 5.616 -2.218 0.899 . . . 1.0 . . . . . . . . . . . . A . 5 CYS N . . . . . . . . . c30226_5ug5 1 . 20 . 5477 . 1 1 5 CYS O O 2.256 -1.106 1.291 . . . 1.0 . . . . . . . . . . . . A . 5 CYS O . . . . . . . . . c30226_5ug5 1 . 20 . 5478 . 1 1 5 CYS SG S 3.998 0.544 -1.543 . . . 1.0 . . . . . . . . . . . . A . 5 CYS SG . . . . . . . . . c30226_5ug5 1 . 20 . 5479 . 1 1 6 CYS C C 1.762 -3.499 3.271 . . . 1.0 . . . . . . . . . . . . A . 6 CYS C . . . . . . . . . c30226_5ug5 1 . 20 . 5480 . 1 1 6 CYS CA C 1.952 -3.808 1.792 . . . 1.0 . . . . . . . . . . . . A . 6 CYS CA . . . . . . . . . c30226_5ug5 1 . 20 . 5481 . 1 1 6 CYS CB C 2.037 -5.322 1.569 . . . 1.0 . . . . . . . . . . . . A . 6 CYS CB . . . . . . . . . c30226_5ug5 1 . 20 . 5482 . 1 1 6 CYS H H 3.967 -3.697 1.159 . . . 1.0 . . . . . . . . . . . . A . 6 CYS H . . . . . . . . . c30226_5ug5 1 . 20 . 5483 . 1 1 6 CYS HA H 1.111 -3.414 1.240 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HA . . . . . . . . . c30226_5ug5 1 . 20 . 5484 . 1 1 6 CYS HB2 H 2.345 -5.509 0.551 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HB2 . . . . . . . . . c30226_5ug5 1 . 20 . 5485 . 1 1 6 CYS HB3 H 2.776 -5.734 2.241 . . . 1.0 . . . . . . . . . . . . A . 6 CYS HB3 . . . . . . . . . c30226_5ug5 1 . 20 . 5486 . 1 1 6 CYS N N 3.159 -3.156 1.301 . . . 1.0 . . . . . . . . . . . . A . 6 CYS N . . . . . . . . . c30226_5ug5 1 . 20 . 5487 . 1 1 6 CYS O O 0.649 -3.546 3.789 . . . 1.0 . . . . . . . . . . . . A . 6 CYS O . . . . . . . . . c30226_5ug5 1 . 20 . 5488 . 1 1 6 CYS SG S 0.475 -6.219 1.846 . . . 1.0 . . . . . . . . . . . . A . 6 CYS SG . . . . . . . . . c30226_5ug5 1 . 20 . 5489 . 1 1 7 SER C C 2.463 -1.274 5.376 . . . 1.0 . . . . . . . . . . . . A . 7 SER C . . . . . . . . . c30226_5ug5 1 . 20 . 5490 . 1 1 7 SER CA C 2.813 -2.747 5.323 . . . 1.0 . . . . . . . . . . . . A . 7 SER CA . . . . . . . . . c30226_5ug5 1 . 20 . 5491 . 1 1 7 SER CB C 4.175 -2.930 5.967 . . . 1.0 . . . . . . . . . . . . A . 7 SER CB . . . . . . . . . c30226_5ug5 1 . 20 . 5492 . 1 1 7 SER H H 3.735 -3.267 3.515 . . . 1.0 . . . . . . . . . . . . A . 7 SER H . . . . . . . . . c30226_5ug5 1 . 20 . 5493 . 1 1 7 SER HA H 2.074 -3.324 5.855 . . . 1.0 . . . . . . . . . . . . A . 7 SER HA . . . . . . . . . c30226_5ug5 1 . 20 . 5494 . 1 1 7 SER HB2 H 4.719 -1.996 5.896 . . . 1.0 . . . . . . . . . . . . A . 7 SER HB2 . . . . . . . . . c30226_5ug5 1 . 20 . 5495 . 1 1 7 SER HB3 H 4.044 -3.193 7.000 . . . 1.0 . . . . . . . . . . . . A . 7 SER HB3 . . . . . . . . . c30226_5ug5 1 . 20 . 5496 . 1 1 7 SER HG H 5.837 -3.903 5.613 . . . 1.0 . . . . . . . . . . . . A . 7 SER HG . . . . . . . . . c30226_5ug5 1 . 20 . 5497 . 1 1 7 SER N N 2.861 -3.187 3.947 . . . 1.0 . . . . . . . . . . . . A . 7 SER N . . . . . . . . . c30226_5ug5 1 . 20 . 5498 . 1 1 7 SER O O 1.788 -0.810 6.290 . . . 1.0 . . . . . . . . . . . . A . 7 SER O . . . . . . . . . c30226_5ug5 1 . 20 . 5499 . 1 1 7 SER OG O 4.918 -3.955 5.324 . . . 1.0 . . . . . . . . . . . . A . 7 SER OG . . . . . . . . . c30226_5ug5 1 . 20 . 5500 . 1 1 8 ASN C C 1.447 1.410 4.296 . . . 1.0 . . . . . . . . . . . . A . 8 ASN C . . . . . . . . . c30226_5ug5 1 . 20 . 5501 . 1 1 8 ASN CA C 2.876 0.883 4.356 . . . 1.0 . . . . . . . . . . . . A . 8 ASN CA . . . . . . . . . c30226_5ug5 1 . 20 . 5502 . 1 1 8 ASN CB C 3.657 1.385 3.156 . . . 1.0 . . . . . . . . . . . . A . 8 ASN CB . . . . . . . . . c30226_5ug5 1 . 20 . 5503 . 1 1 8 ASN CG C 5.131 1.572 3.451 . . . 1.0 . . . . . . . . . . . . A . 8 ASN CG . . . . . . . . . c30226_5ug5 1 . 20 . 5504 . 1 1 8 ASN H H 3.292 -1.004 3.581 . . . 1.0 . . . . . . . . . . . . A . 8 ASN H . . . . . . . . . c30226_5ug5 1 . 20 . 5505 . 1 1 8 ASN HA H 3.356 1.227 5.258 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HA . . . . . . . . . c30226_5ug5 1 . 20 . 5506 . 1 1 8 ASN HB2 H 3.557 0.665 2.354 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HB2 . . . . . . . . . c30226_5ug5 1 . 20 . 5507 . 1 1 8 ASN HB3 H 3.246 2.314 2.840 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HB3 . . . . . . . . . c30226_5ug5 1 . 20 . 5508 . 1 1 8 ASN HD21 H 5.575 1.310 1.535 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HD21 . . . . . . . . . c30226_5ug5 1 . 20 . 5509 . 1 1 8 ASN HD22 H 6.915 1.601 2.585 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HD22 . . . . . . . . . c30226_5ug5 1 . 20 . 5510 . 1 1 8 ASN N N 2.921 -0.553 4.364 . . . 1.0 . . . . . . . . . . . . A . 8 ASN N . . . . . . . . . c30226_5ug5 1 . 20 . 5511 . 1 1 8 ASN ND2 N 5.954 1.485 2.421 . . . 1.0 . . . . . . . . . . . . A . 8 ASN ND2 . . . . . . . . . c30226_5ug5 1 . 20 . 5512 . 1 1 8 ASN O O 0.754 1.223 3.296 . . . 1.0 . . . . . . . . . . . . A . 8 ASN O . . . . . . . . . c30226_5ug5 1 . 20 . 5513 . 1 1 8 ASN OD1 O 5.523 1.815 4.592 . . . 1.0 . . . . . . . . . . . . A . 8 ASN OD1 . . . . . . . . . c30226_5ug5 1 . 20 . 5514 . 1 1 9 PRO C C -0.647 3.626 4.307 . . . 1.0 . . . . . . . . . . . . A . 9 PRO C . . . . . . . . . c30226_5ug5 1 . 20 . 5515 . 1 1 9 PRO CA C -0.348 2.669 5.452 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CA . . . . . . . . . c30226_5ug5 1 . 20 . 5516 . 1 1 9 PRO CB C -0.299 3.429 6.776 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CB . . . . . . . . . c30226_5ug5 1 . 20 . 5517 . 1 1 9 PRO CD C 1.759 2.339 6.603 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CD . . . . . . . . . c30226_5ug5 1 . 20 . 5518 . 1 1 9 PRO CG C 0.690 2.701 7.577 . . . 1.0 . . . . . . . . . . . . A . 9 PRO CG . . . . . . . . . c30226_5ug5 1 . 20 . 5519 . 1 1 9 PRO HA H -1.111 1.906 5.496 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HA . . . . . . . . . c30226_5ug5 1 . 20 . 5520 . 1 1 9 PRO HB2 H 0.041 4.426 6.599 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HB2 . . . . . . . . . c30226_5ug5 1 . 20 . 5521 . 1 1 9 PRO HB3 H -1.271 3.436 7.245 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HB3 . . . . . . . . . c30226_5ug5 1 . 20 . 5522 . 1 1 9 PRO HD2 H 2.451 3.156 6.477 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HD2 . . . . . . . . . c30226_5ug5 1 . 20 . 5523 . 1 1 9 PRO HD3 H 2.262 1.463 6.925 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HD3 . . . . . . . . . c30226_5ug5 1 . 20 . 5524 . 1 1 9 PRO HG2 H 1.081 3.349 8.343 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HG2 . . . . . . . . . c30226_5ug5 1 . 20 . 5525 . 1 1 9 PRO HG3 H 0.250 1.815 8.007 . . . 1.0 . . . . . . . . . . . . A . 9 PRO HG3 . . . . . . . . . c30226_5ug5 1 . 20 . 5526 . 1 1 9 PRO N N 0.997 2.088 5.366 . . . 1.0 . . . . . . . . . . . . A . 9 PRO N . . . . . . . . . c30226_5ug5 1 . 20 . 5527 . 1 1 9 PRO O O -1.788 3.744 3.871 . . . 1.0 . . . . . . . . . . . . A . 9 PRO O . . . . . . . . . c30226_5ug5 1 . 20 . 5528 . 1 1 10 ALA C C 0.165 4.558 1.374 . . . 1.0 . . . . . . . . . . . . A . 10 ALA C . . . . . . . . . c30226_5ug5 1 . 20 . 5529 . 1 1 10 ALA CA C 0.231 5.258 2.730 . . . 1.0 . . . . . . . . . . . . A . 10 ALA CA . . . . . . . . . c30226_5ug5 1 . 20 . 5530 . 1 1 10 ALA CB C 1.371 6.260 2.737 . . . 1.0 . . . . . . . . . . . . A . 10 ALA CB . . . . . . . . . c30226_5ug5 1 . 20 . 5531 . 1 1 10 ALA H H 1.276 4.164 4.219 . . . 1.0 . . . . . . . . . . . . A . 10 ALA H . . . . . . . . . c30226_5ug5 1 . 20 . 5532 . 1 1 10 ALA HA H -0.690 5.797 2.889 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HA . . . . . . . . . c30226_5ug5 1 . 20 . 5533 . 1 1 10 ALA HB1 H 2.298 5.752 2.517 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HB1 . . . . . . . . . c30226_5ug5 1 . 20 . 5534 . 1 1 10 ALA HB2 H 1.437 6.724 3.709 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HB2 . . . . . . . . . c30226_5ug5 1 . 20 . 5535 . 1 1 10 ALA HB3 H 1.189 7.016 1.989 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HB3 . . . . . . . . . c30226_5ug5 1 . 20 . 5536 . 1 1 10 ALA N N 0.386 4.303 3.821 . . . 1.0 . . . . . . . . . . . . A . 10 ALA N . . . . . . . . . c30226_5ug5 1 . 20 . 5537 . 1 1 10 ALA O O -0.238 5.154 0.377 . . . 1.0 . . . . . . . . . . . . A . 10 ALA O . . . . . . . . . c30226_5ug5 1 . 20 . 5538 . 1 1 11 CYS C C -0.751 1.931 -0.026 . . . 1.0 . . . . . . . . . . . . A . 11 CYS C . . . . . . . . . c30226_5ug5 1 . 20 . 5539 . 1 1 11 CYS CA C 0.596 2.559 0.095 . . . 1.0 . . . . . . . . . . . . A . 11 CYS CA . . . . . . . . . c30226_5ug5 1 . 20 . 5540 . 1 1 11 CYS CB C 1.703 1.509 0.156 . . . 1.0 . . . . . . . . . . . . A . 11 CYS CB . . . . . . . . . c30226_5ug5 1 . 20 . 5541 . 1 1 11 CYS H H 0.621 2.776 2.180 . . . 1.0 . . . . . . . . . . . . A . 11 CYS H . . . . . . . . . c30226_5ug5 1 . 20 . 5542 . 1 1 11 CYS HA H 0.765 3.249 -0.717 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HA . . . . . . . . . c30226_5ug5 1 . 20 . 5543 . 1 1 11 CYS HB2 H 2.633 1.996 0.407 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HB2 . . . . . . . . . c30226_5ug5 1 . 20 . 5544 . 1 1 11 CYS HB3 H 1.460 0.793 0.933 . . . 1.0 . . . . . . . . . . . . A . 11 CYS HB3 . . . . . . . . . c30226_5ug5 1 . 20 . 5545 . 1 1 11 CYS N N 0.543 3.288 1.340 . . . 1.0 . . . . . . . . . . . . A . 11 CYS N . . . . . . . . . c30226_5ug5 1 . 20 . 5546 . 1 1 11 CYS O O -1.514 2.131 -0.976 . . . 1.0 . . . . . . . . . . . . A . 11 CYS O . . . . . . . . . c30226_5ug5 1 . 20 . 5547 . 1 1 11 CYS SG S 1.974 0.583 -1.388 . . . 1.0 . . . . . . . . . . . . A . 11 CYS SG . . . . . . . . . c30226_5ug5 1 . 20 . 5548 . 1 1 12 ARG C C -3.408 1.774 1.178 . . . 1.0 . . . . . . . . . . . . A . 12 ARG C . . . . . . . . . c30226_5ug5 1 . 20 . 5549 . 1 1 12 ARG CA C -2.316 0.725 1.376 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CA . . . . . . . . . c30226_5ug5 1 . 20 . 5550 . 1 1 12 ARG CB C -2.259 0.316 2.823 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CB . . . . . . . . . c30226_5ug5 1 . 20 . 5551 . 1 1 12 ARG CD C -1.119 -1.173 4.439 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CD . . . . . . . . . c30226_5ug5 1 . 20 . 5552 . 1 1 12 ARG CG C -1.673 -1.062 3.041 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CG . . . . . . . . . c30226_5ug5 1 . 20 . 5553 . 1 1 12 ARG CZ C -1.942 -0.681 6.727 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CZ . . . . . . . . . c30226_5ug5 1 . 20 . 5554 . 1 1 12 ARG H H -0.276 0.955 1.627 . . . 1.0 . . . . . . . . . . . . A . 12 ARG H . . . . . . . . . c30226_5ug5 1 . 20 . 5555 . 1 1 12 ARG HA H -2.503 -0.127 0.786 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HA . . . . . . . . . c30226_5ug5 1 . 20 . 5556 . 1 1 12 ARG HB2 H -1.645 1.028 3.354 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HB2 . . . . . . . . . c30226_5ug5 1 . 20 . 5557 . 1 1 12 ARG HB3 H -3.239 0.346 3.224 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HB3 . . . . . . . . . c30226_5ug5 1 . 20 . 5558 . 1 1 12 ARG HD2 H -0.685 -2.154 4.570 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HD2 . . . . . . . . . c30226_5ug5 1 . 20 . 5559 . 1 1 12 ARG HD3 H -0.356 -0.417 4.551 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HD3 . . . . . . . . . c30226_5ug5 1 . 20 . 5560 . 1 1 12 ARG HE H -3.096 -1.051 5.139 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HE . . . . . . . . . c30226_5ug5 1 . 20 . 5561 . 1 1 12 ARG HG2 H -2.447 -1.805 2.905 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HG2 . . . . . . . . . c30226_5ug5 1 . 20 . 5562 . 1 1 12 ARG HG3 H -0.877 -1.228 2.330 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HG3 . . . . . . . . . c30226_5ug5 1 . 20 . 5563 . 1 1 12 ARG HH11 H 0.087 -0.710 6.591 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH11 . . . . . . . . . c30226_5ug5 1 . 20 . 5564 . 1 1 12 ARG HH12 H -0.550 -0.358 8.166 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH12 . . . . . . . . . c30226_5ug5 1 . 20 . 5565 . 1 1 12 ARG HH21 H -3.912 -0.605 7.190 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH21 . . . . . . . . . c30226_5ug5 1 . 20 . 5566 . 1 1 12 ARG HH22 H -2.825 -0.294 8.508 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH22 . . . . . . . . . c30226_5ug5 1 . 20 . 5567 . 1 1 12 ARG N N -1.022 1.207 1.035 . . . 1.0 . . . . . . . . . . . . A . 12 ARG N . . . . . . . . . c30226_5ug5 1 . 20 . 5568 . 1 1 12 ARG NE N -2.162 -0.966 5.445 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NE . . . . . . . . . c30226_5ug5 1 . 20 . 5569 . 1 1 12 ARG NH1 N -0.706 -0.575 7.199 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NH1 . . . . . . . . . c30226_5ug5 1 . 20 . 5570 . 1 1 12 ARG NH2 N -2.973 -0.516 7.541 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NH2 . . . . . . . . . c30226_5ug5 1 . 20 . 5571 . 1 1 12 ARG O O -4.513 1.455 0.758 . . . 1.0 . . . . . . . . . . . . A . 12 ARG O . . . . . . . . . c30226_5ug5 1 . 20 . 5572 . 1 1 13 TYR C C -4.728 4.213 0.069 . . . 1.0 . . . . . . . . . . . . A . 13 TYR C . . . . . . . . . c30226_5ug5 1 . 20 . 5573 . 1 1 13 TYR CA C -3.993 4.147 1.405 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CA . . . . . . . . . c30226_5ug5 1 . 20 . 5574 . 1 1 13 TYR CB C -3.218 5.435 1.635 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CB . . . . . . . . . c30226_5ug5 1 . 20 . 5575 . 1 1 13 TYR CD1 C -4.938 6.791 2.835 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CD1 . . . . . . . . . c30226_5ug5 1 . 20 . 5576 . 1 1 13 TYR CD2 C -4.009 7.650 0.834 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CD2 . . . . . . . . . c30226_5ug5 1 . 20 . 5577 . 1 1 13 TYR CE1 C -5.722 7.917 2.962 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CE1 . . . . . . . . . c30226_5ug5 1 . 20 . 5578 . 1 1 13 TYR CE2 C -4.782 8.775 0.946 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CE2 . . . . . . . . . c30226_5ug5 1 . 20 . 5579 . 1 1 13 TYR CG C -4.075 6.648 1.772 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CG . . . . . . . . . c30226_5ug5 1 . 20 . 5580 . 1 1 13 TYR CZ C -5.641 8.909 2.012 . . . 1.0 . . . . . . . . . . . . A . 13 TYR CZ . . . . . . . . . c30226_5ug5 1 . 20 . 5581 . 1 1 13 TYR H H -2.162 3.203 1.794 . . . 1.0 . . . . . . . . . . . . A . 13 TYR H . . . . . . . . . c30226_5ug5 1 . 20 . 5582 . 1 1 13 TYR HA H -4.713 4.037 2.192 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HA . . . . . . . . . c30226_5ug5 1 . 20 . 5583 . 1 1 13 TYR HB2 H -2.631 5.342 2.535 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HB2 . . . . . . . . . c30226_5ug5 1 . 20 . 5584 . 1 1 13 TYR HB3 H -2.564 5.602 0.800 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HB3 . . . . . . . . . c30226_5ug5 1 . 20 . 5585 . 1 1 13 TYR HD1 H -4.988 6.006 3.571 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HD1 . . . . . . . . . c30226_5ug5 1 . 20 . 5586 . 1 1 13 TYR HD2 H -3.337 7.538 0.000 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HD2 . . . . . . . . . c30226_5ug5 1 . 20 . 5587 . 1 1 13 TYR HE1 H -6.391 8.016 3.795 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HE1 . . . . . . . . . c30226_5ug5 1 . 20 . 5588 . 1 1 13 TYR HE2 H -4.711 9.542 0.202 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HE2 . . . . . . . . . c30226_5ug5 1 . 20 . 5589 . 1 1 13 TYR HH H -6.307 10.413 3.014 . . . 1.0 . . . . . . . . . . . . A . 13 TYR HH . . . . . . . . . c30226_5ug5 1 . 20 . 5590 . 1 1 13 TYR N N -3.071 3.024 1.482 . . . 1.0 . . . . . . . . . . . . A . 13 TYR N . . . . . . . . . c30226_5ug5 1 . 20 . 5591 . 1 1 13 TYR O O -5.896 4.594 0.018 . . . 1.0 . . . . . . . . . . . . A . 13 TYR O . . . . . . . . . c30226_5ug5 1 . 20 . 5592 . 1 1 13 TYR OH O -6.420 10.037 2.129 . . . 1.0 . . . . . . . . . . . . A . 13 TYR OH . . . . . . . . . c30226_5ug5 1 . 20 . 5593 . 1 1 14 ASN C C -4.823 2.492 -2.854 . . . 1.0 . . . . . . . . . . . . A . 14 ASN C . . . . . . . . . c30226_5ug5 1 . 20 . 5594 . 1 1 14 ASN CA C -4.677 3.897 -2.326 . . . 1.0 . . . . . . . . . . . . A . 14 ASN CA . . . . . . . . . c30226_5ug5 1 . 20 . 5595 . 1 1 14 ASN CB C -3.859 4.751 -3.297 . . . 1.0 . . . . . . . . . . . . A . 14 ASN CB . . . . . . . . . c30226_5ug5 1 . 20 . 5596 . 1 1 14 ASN CG C -3.824 6.212 -2.894 . . . 1.0 . . . . . . . . . . . . A . 14 ASN CG . . . . . . . . . c30226_5ug5 1 . 20 . 5597 . 1 1 14 ASN H H -3.143 3.462 -0.921 . . . 1.0 . . . . . . . . . . . . A . 14 ASN H . . . . . . . . . c30226_5ug5 1 . 20 . 5598 . 1 1 14 ASN HA H -5.660 4.330 -2.211 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HA . . . . . . . . . c30226_5ug5 1 . 20 . 5599 . 1 1 14 ASN HB2 H -2.845 4.381 -3.327 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HB2 . . . . . . . . . c30226_5ug5 1 . 20 . 5600 . 1 1 14 ASN HB3 H -4.293 4.678 -4.282 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HB3 . . . . . . . . . c30226_5ug5 1 . 20 . 5601 . 1 1 14 ASN HD21 H -2.086 5.947 -1.976 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HD21 . . . . . . . . . c30226_5ug5 1 . 20 . 5602 . 1 1 14 ASN HD22 H -2.728 7.552 -1.924 . . . 1.0 . . . . . . . . . . . . A . 14 ASN HD22 . . . . . . . . . c30226_5ug5 1 . 20 . 5603 . 1 1 14 ASN N N -4.054 3.844 -1.011 . . . 1.0 . . . . . . . . . . . . A . 14 ASN N . . . . . . . . . c30226_5ug5 1 . 20 . 5604 . 1 1 14 ASN ND2 N -2.777 6.610 -2.193 . . . 1.0 . . . . . . . . . . . . A . 14 ASN ND2 . . . . . . . . . c30226_5ug5 1 . 20 . 5605 . 1 1 14 ASN O O -5.223 2.263 -3.995 . . . 1.0 . . . . . . . . . . . . A . 14 ASN O . . . . . . . . . c30226_5ug5 1 . 20 . 5606 . 1 1 14 ASN OD1 O -4.724 6.984 -3.229 . . . 1.0 . . . . . . . . . . . . A . 14 ASN OD1 . . . . . . . . . c30226_5ug5 1 . 20 . 5607 . 1 1 15 ASN C C -4.912 -0.769 -1.287 . . . 1.0 . . . . . . . . . . . . A . 15 ASN C . . . . . . . . . c30226_5ug5 1 . 20 . 5608 . 1 1 15 ASN CA C -4.368 0.158 -2.373 . . . 1.0 . . . . . . . . . . . . A . 15 ASN CA . . . . . . . . . c30226_5ug5 1 . 20 . 5609 . 1 1 15 ASN CB C -2.897 -0.125 -2.589 . . . 1.0 . . . . . . . . . . . . A . 15 ASN CB . . . . . . . . . c30226_5ug5 1 . 20 . 5610 . 1 1 15 ASN CG C -2.346 0.473 -3.870 . . . 1.0 . . . . . . . . . . . . A . 15 ASN CG . . . . . . . . . c30226_5ug5 1 . 20 . 5611 . 1 1 15 ASN H H -4.290 1.804 -1.063 . . . 1.0 . . . . . . . . . . . . A . 15 ASN H . . . . . . . . . c30226_5ug5 1 . 20 . 5612 . 1 1 15 ASN HA H -4.910 0.007 -3.284 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HA . . . . . . . . . c30226_5ug5 1 . 20 . 5613 . 1 1 15 ASN HB2 H -2.370 0.326 -1.764 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HB2 . . . . . . . . . c30226_5ug5 1 . 20 . 5614 . 1 1 15 ASN HB3 H -2.725 -1.190 -2.591 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HB3 . . . . . . . . . c30226_5ug5 1 . 20 . 5615 . 1 1 15 ASN HD21 H -1.650 2.040 -2.865 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HD21 . . . . . . . . . c30226_5ug5 1 . 20 . 5616 . 1 1 15 ASN HD22 H -1.357 2.045 -4.572 . . . 1.0 . . . . . . . . . . . . A . 15 ASN HD22 . . . . . . . . . c30226_5ug5 1 . 20 . 5617 . 1 1 15 ASN N N -4.486 1.551 -1.992 . . . 1.0 . . . . . . . . . . . . A . 15 ASN N . . . . . . . . . c30226_5ug5 1 . 20 . 5618 . 1 1 15 ASN ND2 N -1.723 1.635 -3.759 . . . 1.0 . . . . . . . . . . . . A . 15 ASN ND2 . . . . . . . . . c30226_5ug5 1 . 20 . 5619 . 1 1 15 ASN O O -4.191 -1.618 -0.762 . . . 1.0 . . . . . . . . . . . . A . 15 ASN O . . . . . . . . . c30226_5ug5 1 . 20 . 5620 . 1 1 15 ASN OD1 O -2.454 -0.115 -4.944 . . . 1.0 . . . . . . . . . . . . A . 15 ASN OD1 . . . . . . . . . c30226_5ug5 1 . 20 . 5621 . 1 1 16 HYP C C -7.341 -2.694 -0.163 . . . 1.0 . . . . . . . . . . . . A . 16 HYP C . . . . . . . . . c30226_5ug5 1 . 20 . 5622 . 1 1 16 HYP CA C -6.799 -1.329 0.200 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CA . . . . . . . . . c30226_5ug5 1 . 20 . 5623 . 1 1 16 HYP CB C -7.905 -0.352 0.545 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CB . . . . . . . . . c30226_5ug5 1 . 20 . 5624 . 1 1 16 HYP CD C -7.173 0.258 -1.607 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CD . . . . . . . . . c30226_5ug5 1 . 20 . 5625 . 1 1 16 HYP CG C -7.887 0.811 -0.427 . . . 1.0 . . . . . . . . . . . . A . 16 HYP CG . . . . . . . . . c30226_5ug5 1 . 20 . 5626 . 1 1 16 HYP HA H -6.117 -1.423 1.011 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HA . . . . . . . . . c30226_5ug5 1 . 20 . 5627 . 1 1 16 HYP HB2 H -7.753 0.024 1.543 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HB2 . . . . . . . . . c30226_5ug5 1 . 20 . 5628 . 1 1 16 HYP HB3 H -8.859 -0.859 0.489 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HB3 . . . . . . . . . c30226_5ug5 1 . 20 . 5629 . 1 1 16 HYP HD1 H -6.161 1.693 -0.217 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HD1 . . . . . . . . . c30226_5ug5 1 . 20 . 5630 . 1 1 16 HYP HD22 H -7.840 -0.295 -2.232 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HD22 . . . . . . . . . c30226_5ug5 1 . 20 . 5631 . 1 1 16 HYP HD23 H -6.678 1.040 -2.162 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HD23 . . . . . . . . . c30226_5ug5 1 . 20 . 5632 . 1 1 16 HYP HG H -8.886 1.150 -0.662 . . . 1.0 . . . . . . . . . . . . A . 16 HYP HG . . . . . . . . . c30226_5ug5 1 . 20 . 5633 . 1 1 16 HYP N N -6.190 -0.626 -0.944 . . . 1.0 . . . . . . . . . . . . A . 16 HYP N . . . . . . . . . c30226_5ug5 1 . 20 . 5634 . 1 1 16 HYP O O -7.669 -3.508 0.697 . . . 1.0 . . . . . . . . . . . . A . 16 HYP O . . . . . . . . . c30226_5ug5 1 . 20 . 5635 . 1 1 16 HYP OD1 O -7.079 1.865 0.071 . . . 1.0 . . . . . . . . . . . . A . 16 HYP OD1 . . . . . . . . . c30226_5ug5 1 . 20 . 5636 . 1 1 17 HIS C C -6.604 -4.962 -2.499 . . . 1.0 . . . . . . . . . . . . A . 17 HIS C . . . . . . . . . c30226_5ug5 1 . 20 . 5637 . 1 1 17 HIS CA C -7.830 -4.227 -1.966 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CA . . . . . . . . . c30226_5ug5 1 . 20 . 5638 . 1 1 17 HIS CB C -8.891 -4.063 -3.063 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CB . . . . . . . . . c30226_5ug5 1 . 20 . 5639 . 1 1 17 HIS CD2 C -10.388 -6.134 -2.608 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CD2 . . . . . . . . . c30226_5ug5 1 . 20 . 5640 . 1 1 17 HIS CE1 C -10.362 -7.004 -4.618 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CE1 . . . . . . . . . c30226_5ug5 1 . 20 . 5641 . 1 1 17 HIS CG C -9.625 -5.332 -3.387 . . . 1.0 . . . . . . . . . . . . A . 17 HIS CG . . . . . . . . . c30226_5ug5 1 . 20 . 5642 . 1 1 17 HIS H H -7.159 -2.218 -2.063 . . . 1.0 . . . . . . . . . . . . A . 17 HIS H . . . . . . . . . c30226_5ug5 1 . 20 . 5643 . 1 1 17 HIS HA H -8.248 -4.795 -1.148 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HA . . . . . . . . . c30226_5ug5 1 . 20 . 5644 . 1 1 17 HIS HB2 H -9.619 -3.333 -2.740 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HB2 . . . . . . . . . c30226_5ug5 1 . 20 . 5645 . 1 1 17 HIS HB3 H -8.416 -3.714 -3.966 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HB3 . . . . . . . . . c30226_5ug5 1 . 20 . 5646 . 1 1 17 HIS HD1 H -9.165 -5.559 -5.436 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HD1 . . . . . . . . . c30226_5ug5 1 . 20 . 5647 . 1 1 17 HIS HD2 H -10.605 -5.991 -1.559 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HD2 . . . . . . . . . c30226_5ug5 1 . 20 . 5648 . 1 1 17 HIS HE1 H -10.545 -7.659 -5.456 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HE1 . . . . . . . . . c30226_5ug5 1 . 20 . 5649 . 1 1 17 HIS HE2 H -11.303 -7.966 -3.073 . . . 1.0 . . . . . . . . . . . . A . 17 HIS HE2 . . . . . . . . . c30226_5ug5 1 . 20 . 5650 . 1 1 17 HIS N N -7.412 -2.933 -1.446 . . . 1.0 . . . . . . . . . . . . A . 17 HIS N . . . . . . . . . c30226_5ug5 1 . 20 . 5651 . 1 1 17 HIS ND1 N -9.630 -5.905 -4.641 . . . 1.0 . . . . . . . . . . . . A . 17 HIS ND1 . . . . . . . . . c30226_5ug5 1 . 20 . 5652 . 1 1 17 HIS NE2 N -10.832 -7.165 -3.396 . . . 1.0 . . . . . . . . . . . . A . 17 HIS NE2 . . . . . . . . . c30226_5ug5 1 . 20 . 5653 . 1 1 17 HIS O O -6.703 -6.008 -3.139 . . . 1.0 . . . . . . . . . . . . A . 17 HIS O . . . . . . . . . c30226_5ug5 1 . 20 . 5654 . 1 1 18 VAL C C -3.674 -5.900 -1.538 . . . 1.0 . . . . . . . . . . . . A . 18 VAL C . . . . . . . . . c30226_5ug5 1 . 20 . 5655 . 1 1 18 VAL CA C -4.180 -4.950 -2.611 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CA . . . . . . . . . c30226_5ug5 1 . 20 . 5656 . 1 1 18 VAL CB C -3.169 -3.816 -2.847 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CB . . . . . . . . . c30226_5ug5 1 . 20 . 5657 . 1 1 18 VAL CG1 C -1.754 -4.333 -2.853 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CG1 . . . . . . . . . c30226_5ug5 1 . 20 . 5658 . 1 1 18 VAL CG2 C -3.479 -3.080 -4.140 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CG2 . . . . . . . . . c30226_5ug5 1 . 20 . 5659 . 1 1 18 VAL H H -5.436 -3.541 -1.732 . . . 1.0 . . . . . . . . . . . . A . 18 VAL H . . . . . . . . . c30226_5ug5 1 . 20 . 5660 . 1 1 18 VAL HA H -4.314 -5.485 -3.523 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HA . . . . . . . . . c30226_5ug5 1 . 20 . 5661 . 1 1 18 VAL HB H -3.264 -3.116 -2.035 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HB . . . . . . . . . c30226_5ug5 1 . 20 . 5662 . 1 1 18 VAL HG11 H -1.635 -5.045 -3.650 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG11 . . . . . . . . . c30226_5ug5 1 . 20 . 5663 . 1 1 18 VAL HG12 H -1.553 -4.809 -1.909 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG12 . . . . . . . . . c30226_5ug5 1 . 20 . 5664 . 1 1 18 VAL HG13 H -1.076 -3.510 -2.996 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG13 . . . . . . . . . c30226_5ug5 1 . 20 . 5665 . 1 1 18 VAL HG21 H -4.503 -2.738 -4.123 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG21 . . . . . . . . . c30226_5ug5 1 . 20 . 5666 . 1 1 18 VAL HG22 H -3.332 -3.742 -4.981 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG22 . . . . . . . . . c30226_5ug5 1 . 20 . 5667 . 1 1 18 VAL HG23 H -2.820 -2.225 -4.231 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG23 . . . . . . . . . c30226_5ug5 1 . 20 . 5668 . 1 1 18 VAL N N -5.444 -4.385 -2.221 . . . 1.0 . . . . . . . . . . . . A . 18 VAL N . . . . . . . . . c30226_5ug5 1 . 20 . 5669 . 1 1 18 VAL O O -3.120 -6.962 -1.826 . . . 1.0 . . . . . . . . . . . . A . 18 VAL O . . . . . . . . . c30226_5ug5 1 . 20 . 5670 . 1 1 19 CYS C C -4.678 -6.722 1.660 . . . 1.0 . . . . . . . . . . . . A . 19 CYS C . . . . . . . . . c30226_5ug5 1 . 20 . 5671 . 1 1 19 CYS CA C -3.467 -6.303 0.838 . . . 1.0 . . . . . . . . . . . . A . 19 CYS CA . . . . . . . . . c30226_5ug5 1 . 20 . 5672 . 1 1 19 CYS CB C -2.471 -5.520 1.698 . . . 1.0 . . . . . . . . . . . . A . 19 CYS CB . . . . . . . . . c30226_5ug5 1 . 20 . 5673 . 1 1 19 CYS H H -4.352 -4.666 -0.153 . . . 1.0 . . . . . . . . . . . . A . 19 CYS H . . . . . . . . . c30226_5ug5 1 . 20 . 5674 . 1 1 19 CYS HA H -2.982 -7.191 0.462 . . . 1.0 . . . . . . . . . . . . A . 19 CYS HA . . . . . . . . . c30226_5ug5 1 . 20 . 5675 . 1 1 19 CYS HB2 H -2.925 -4.589 2.004 . . . 1.0 . . . . . . . . . . . . A . 19 CYS HB2 . . . . . . . . . c30226_5ug5 1 . 20 . 5676 . 1 1 19 CYS HB3 H -2.229 -6.101 2.576 . . . 1.0 . . . . . . . . . . . . A . 19 CYS HB3 . . . . . . . . . c30226_5ug5 1 . 20 . 5677 . 1 1 19 CYS N N -3.888 -5.510 -0.302 . . . 1.0 . . . . . . . . . . . . A . 19 CYS N . . . . . . . . . c30226_5ug5 1 . 20 . 5678 . 1 1 19 CYS O O -5.242 -7.799 1.371 . . . 1.0 . . . . . . . . . . . . A . 19 CYS O . . . . . . . . . c30226_5ug5 1 . 20 . 5679 . 1 1 19 CYS OXT O -5.075 -5.972 2.573 . . . 1.0 . . . . . . . . . . . . A . 19 CYS OXT . . . . . . . . . c30226_5ug5 1 . 20 . 5680 . 1 1 19 CYS SG S -0.909 -5.121 0.844 . . . 1.0 . . . . . . . . . . . . A . 19 CYS SG . . . . . . . . . c30226_5ug5 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 c30226_5ug5 _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 5ug5.mr . . 'MR format' 1 comment 'Not applicable' 'Not applicable' 0 c30226_5ug5 1 1 5ug5.mr . . XPLOR/CNS 2 distance 'hydrogen bond' simple 3 c30226_5ug5 1 1 5ug5.mr . . XPLOR/CNS 3 distance NOE simple 456 c30226_5ug5 1 1 5ug5.mr . . XPLOR/CNS 4 'dihedral angle' 'Not applicable' 'Not applicable' 24 c30226_5ug5 1 1 5ug5.mr . . 'MR format' 5 'nomenclature mapping' 'Not applicable' 'Not applicable' 0 c30226_5ug5 1 stop_ save_ save_CNS/XPLOR_distance_constraints_3 _Gen_dist_constraint_list.Sf_category general_distance_constraints _Gen_dist_constraint_list.Sf_framecode CNS/XPLOR_distance_constraints_3 _Gen_dist_constraint_list.Entry_ID c30226_5ug5 _Gen_dist_constraint_list.ID 2 _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 3 loop_ _Gen_dist_constraint_software.Software_ID _Gen_dist_constraint_software.Software_label _Gen_dist_constraint_software.Method_ID _Gen_dist_constraint_software.Method_label _Gen_dist_constraint_software.Entry_ID _Gen_dist_constraint_software.Gen_dist_constraint_list_ID . . . . c30226_5ug5 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 . . . . . 2.663 1.777 3.549 . . . . . A . 2 ARG H . . A . 2 ARG HA . A . 2 . HN . . . A . 2 . HA . . c30226_5ug5 1 2 1 . . 1 1 3 3 ASP H H . . . 1 1 3 3 ASP HA H . . . . . 2.571 1.745 3.397 . . . . . A . 3 ASP H . . A . 3 ASP HA . A . 3 . HN . . . A . 3 . HA . . c30226_5ug5 1 3 1 . . 1 1 2 2 ARG HA H . . . 1 1 3 3 ASP H H . . . . . 2.101 1.549 2.653 . . . . . A . 2 ARG HA . . A . 3 ASP H . A . 2 . HA . . . A . 3 . HN . . c30226_5ug5 1 4 1 . . 1 1 4 4 GLU H H . . . 1 1 4 4 GLU HA H . . . . . 2.687 1.785 3.589 . . . . . A . 4 GLU H . . A . 4 GLU HA . A . 4 . HN . . . A . 4 . HA . . c30226_5ug5 1 5 1 . . 1 1 5 5 CYS H H . . . 1 1 5 5 CYS HA H . . . . . 2.650 1.772 3.528 . . . . . A . 5 CYS H . . A . 5 CYS HA . A . 5 . HN . . . A . 5 . HA . . c30226_5ug5 1 6 1 . . 1 1 6 6 CYS H H . . . 1 1 6 6 CYS HA H . . . . . 2.654 1.773 3.535 . . . . . A . 6 CYS H . . A . 6 CYS HA . A . 6 . HN . . . A . 6 . HA . . c30226_5ug5 1 7 1 . . 1 1 7 7 SER H H . . . 1 1 7 7 SER HA H . . . . . 2.547 1.736 3.358 . . . . . A . 7 SER H . . A . 7 SER HA . A . 7 . HN . . . A . 7 . HA . . c30226_5ug5 1 8 1 . . 1 1 7 7 SER HA H . . . 1 1 8 8 ASN H H . . . . . 2.810 1.823 3.797 . . . . . A . 7 SER HA . . A . 8 ASN H . A . 7 . HA . . . A . 8 . HN . . c30226_5ug5 1 9 1 . . 1 1 8 8 ASN H H . . . 1 1 8 8 ASN HA H . . . . . 2.614 1.760 3.468 . . . . . A . 8 ASN H . . A . 8 ASN HA . A . 8 . HN . . . A . 8 . HA . . c30226_5ug5 1 10 1 . . 1 1 10 10 ALA H H . . . 1 1 10 10 ALA HA H . . . . . 2.502 1.719 3.285 . . . . . A . 10 ALA H . . A . 10 ALA HA . A . 10 . HN . . . A . 10 . HA . . c30226_5ug5 1 11 1 . . 1 1 11 11 CYS H H . . . 1 1 11 11 CYS HA H . . . . . 2.321 1.648 2.994 . . . . . A . 11 CYS H . . A . 11 CYS HA . A . 11 . HN . . . A . 11 . HA . . c30226_5ug5 1 12 1 . . 1 1 12 12 ARG H H . . . 1 1 12 12 ARG HA H . . . . . 2.693 1.786 3.600 . . . . . A . 12 ARG H . . A . 12 ARG HA . A . 12 . HN . . . A . 12 . HA . . c30226_5ug5 1 13 1 . . 1 1 13 13 TYR H H . . . 1 1 13 13 TYR HA H . . . . . 2.398 1.679 3.117 . . . . . A . 13 TYR H . . A . 13 TYR HA . A . 13 . HN . . . A . 13 . HA . . c30226_5ug5 1 14 1 . . 1 1 14 14 ASN H H . . . 1 1 14 14 ASN HA H . . . . . 2.585 1.749 3.421 . . . . . A . 14 ASN H . . A . 14 ASN HA . A . 14 . HN . . . A . 14 . HA . . c30226_5ug5 1 15 1 . . 1 1 15 15 ASN H H . . . 1 1 15 15 ASN HA H . . . . . 2.944 1.861 4.027 . . . . . A . 15 ASN H . . A . 15 ASN HA . A . 15 . HN . . . A . 15 . HA . . c30226_5ug5 1 16 1 . . 1 1 17 17 HIS H H . . . 1 1 17 17 HIS HA H . . . . . 2.492 1.716 3.268 . . . . . A . 17 HIS H . . A . 17 HIS HA . A . 17 . HN . . . A . 17 . HA . . c30226_5ug5 1 17 1 . . 1 1 18 18 VAL H H . . . 1 1 18 18 VAL HA H . . . . . 2.940 1.860 4.020 . . . . . A . 18 VAL H . . A . 18 VAL HA . A . 18 . HN . . . A . 18 . HA . . c30226_5ug5 1 18 1 . . 1 1 19 19 CYS H H . . . 1 1 19 19 CYS HA H . . . . . 2.843 1.833 3.853 . . . . . A . 19 CYS H . . A . 19 CYS HA . A . 19 . HN . . . A . 19 . HA . . c30226_5ug5 1 19 1 . . 1 1 2 2 ARG H H . . . 1 1 1 1 ILE HB H . . . . . 2.840 1.832 3.848 . . . . . A . 2 ARG H . . A . 1 ILE HB . A . 2 . HN . . . A . 1 . HB . . c30226_5ug5 1 20 1 . . 1 1 2 2 ARG H H . . . 1 1 2 2 ARG HB2 H . . . . . 2.441 1.696 3.186 . . . . . A . 2 ARG H . . A . 2 ARG HB2 . A . 2 . HN . . . A . 2 . HB2 . . c30226_5ug5 1 21 1 . . 1 1 2 2 ARG H H . . . 1 1 2 2 ARG HB3 H . . . . . 3.027 1.881 4.173 . . . . . A . 2 ARG H . . A . 2 ARG HB3 . A . 2 . HN . . . A . 2 . HB1 . . c30226_5ug5 1 22 1 . . 1 1 2 2 ARG HA H . . . 1 1 2 2 ARG HB2 H . . . . . 2.416 1.686 3.146 . . . . . A . 2 ARG HA . . A . 2 ARG HB2 . A . 2 . HA . . . A . 2 . HB2 . . c30226_5ug5 1 23 1 . . 1 1 2 2 ARG HA H . . . 1 1 2 2 ARG HB3 H . . . . . 2.821 1.826 3.816 . . . . . A . 2 ARG HA . . A . 2 ARG HB3 . A . 2 . HA . . . A . 2 . HB1 . . c30226_5ug5 1 24 1 . . 1 1 6 6 CYS HA H . . . 1 1 12 12 ARG HG2 H . . . . . 2.840 1.832 3.848 . . . . . A . 6 CYS HA . . A . 12 ARG HG2 . A . 6 . HA . . . A . 12 . HG2 . . c30226_5ug5 1 25 1 . . 1 1 2 2 ARG HB2 H . . . 1 1 2 2 ARG HB3 H . . . . . 2.374 1.670 3.078 . . . . . A . 2 ARG HB2 . . A . 2 ARG HB3 . A . 2 . HB2 . . . A . 2 . HB1 . . c30226_5ug5 1 26 1 . . 1 1 2 2 ARG H H . . . 1 1 2 2 ARG HA H . . . . . 2.213 1.601 2.825 . . . . . A . 2 ARG H . . A . 2 ARG HA . A . 2 . HN . . . A . 2 . HA . . c30226_5ug5 1 27 1 . . 1 1 2 2 ARG H H . . . 1 1 1 1 ILE HA H . . . . . 2.159 1.577 2.741 . . . . . A . 2 ARG H . . A . 1 ILE HA . A . 2 . HN . . . A . 1 . HA . . c30226_5ug5 1 28 1 . . 1 1 2 2 ARG H H . . . 1 1 2 2 ARG HB2 H . . . . . 2.562 1.741 3.383 . . . . . A . 2 ARG H . . A . 2 ARG HB2 . A . 2 . HN . . . A . 2 . HB2 . . c30226_5ug5 1 29 1 . . 1 1 2 2 ARG H H . . . 1 1 2 2 ARG HB3 H . . . . . 3.218 1.924 4.512 . . . . . A . 2 ARG H . . A . 2 ARG HB3 . A . 2 . HN . . . A . 2 . HB1 . . c30226_5ug5 1 30 1 . . 1 1 3 3 ASP H H . . . 1 1 3 3 ASP HB2 H . . . . . 2.545 1.736 3.354 . . . . . A . 3 ASP H . . A . 3 ASP HB2 . A . 3 . HN . . . A . 3 . HB2 . . c30226_5ug5 1 31 1 . . 1 1 3 3 ASP H H . . . 1 1 3 3 ASP HB3 H . . . . . 2.533 1.731 3.335 . . . . . A . 3 ASP H . . A . 3 ASP HB3 . A . 3 . HN . . . A . 3 . HB1 . . c30226_5ug5 1 32 1 . . 1 1 3 3 ASP HA H . . . 1 1 3 3 ASP HB2 H . . . . . 2.288 1.634 2.942 . . . . . A . 3 ASP HA . . A . 3 ASP HB2 . A . 3 . HA . . . A . 3 . HB2 . . c30226_5ug5 1 33 1 . . 1 1 3 3 ASP HA H . . . 1 1 3 3 ASP HB3 H . . . . . 2.416 1.686 3.146 . . . . . A . 3 ASP HA . . A . 3 ASP HB3 . A . 3 . HA . . . A . 3 . HB1 . . c30226_5ug5 1 34 1 . . 1 1 14 14 ASN HB2 H . . . 1 1 14 14 ASN HB3 H . . . . . 2.005 1.503 2.507 . . . . . A . 14 ASN HB2 . . A . 14 ASN HB3 . A . 14 . HB2 . . . A . 14 . HB1 . . c30226_5ug5 1 35 1 . . 1 1 3 3 ASP HB2 H . . . 1 1 3 3 ASP HB3 H . . . . . 1.884 1.440 2.328 . . . . . A . 3 ASP HB2 . . A . 3 ASP HB3 . A . 3 . HB2 . . . A . 3 . HB1 . . c30226_5ug5 1 36 1 . . 1 1 3 3 ASP H H . . . 1 1 3 3 ASP HA H . . . . . 2.673 1.780 3.566 . . . . . A . 3 ASP H . . A . 3 ASP HA . A . 3 . HN . . . A . 3 . HA . . c30226_5ug5 1 37 1 . . 1 1 3 3 ASP H H . . . 1 1 3 3 ASP HB2 H . . . . . 2.645 1.771 3.519 . . . . . A . 3 ASP H . . A . 3 ASP HB2 . A . 3 . HN . . . A . 3 . HB2 . . c30226_5ug5 1 38 1 . . 1 1 3 3 ASP H H . . . 1 1 3 3 ASP HB2 H . . . . . 2.812 1.824 3.800 . . . . . A . 3 ASP H . . A . 3 ASP HB2 . A . 3 . HN . . . A . 3 . HB2 . . c30226_5ug5 1 39 1 . . 1 1 3 3 ASP H H . . . 1 1 3 3 ASP HB3 H . . . . . 2.651 1.773 3.529 . . . . . A . 3 ASP H . . A . 3 ASP HB3 . A . 3 . HN . . . A . 3 . HB1 . . c30226_5ug5 1 40 1 . . 1 1 4 4 GLU H H . . . 1 1 4 4 GLU HG2 H . . . . . 2.758 1.807 3.709 . . . . . A . 4 GLU H . . A . 4 GLU HG2 . A . 4 . HN . . . A . 4 . HG2 . . c30226_5ug5 1 41 1 . . 1 1 4 4 GLU H H . . . 1 1 4 4 GLU HB2 H . . . . . 2.652 1.773 3.531 . . . . . A . 4 GLU H . . A . 4 GLU HB2 . A . 4 . HN . . . A . 4 . HB2 . . c30226_5ug5 1 42 1 . . 1 1 4 4 GLU H H . . . 1 1 4 4 GLU HB3 H . . . . . 2.545 1.736 3.354 . . . . . A . 4 GLU H . . A . 4 GLU HB3 . A . 4 . HN . . . A . 4 . HB1 . . c30226_5ug5 1 43 1 . . 1 1 5 5 CYS H H . . . 1 1 5 5 CYS HB2 H . . . . . 2.275 1.628 2.922 . . . . . A . 5 CYS H . . A . 5 CYS HB2 . A . 5 . HN . . . A . 5 . HB2 . . c30226_5ug5 1 44 1 . . 1 1 5 5 CYS H H . . . 1 1 5 5 CYS HB3 H . . . . . 3.533 1.973 5.093 . . . . . A . 5 CYS H . . A . 5 CYS HB3 . A . 5 . HN . . . A . 5 . HB1 . . c30226_5ug5 1 45 1 . . 1 1 5 5 CYS H H . . . 1 1 5 5 CYS HB3 H . . . . . 2.315 1.645 2.985 . . . . . A . 5 CYS H . . A . 5 CYS HB3 . A . 5 . HN . . . A . 5 . HB1 . . c30226_5ug5 1 46 1 . . 1 1 4 4 GLU HA H . . . 1 1 4 4 GLU HG2 H . . . . . 2.753 1.806 3.700 . . . . . A . 4 GLU HA . . A . 4 GLU HG2 . A . 4 . HA . . . A . 4 . HG2 . . c30226_5ug5 1 47 1 . . 1 1 4 4 GLU HA H . . . 1 1 4 4 GLU HB2 H . . . . . 2.254 1.619 2.889 . . . . . A . 4 GLU HA . . A . 4 GLU HB2 . A . 4 . HA . . . A . 4 . HB2 . . c30226_5ug5 1 48 1 . . 1 1 4 4 GLU HA H . . . 1 1 4 4 GLU HB3 H . . . . . 2.590 1.752 3.428 . . . . . A . 4 GLU HA . . A . 4 GLU HB3 . A . 4 . HA . . . A . 4 . HB1 . . c30226_5ug5 1 49 1 . . 1 1 4 4 GLU HG2 H . . . 1 1 4 4 GLU HB2 H . . . . . 2.640 1.769 3.511 . . . . . A . 4 GLU HG2 . . A . 4 GLU HB2 . A . 4 . HG2 . . . A . 4 . HB2 . . c30226_5ug5 1 50 1 . . 1 1 4 4 GLU HG2 H . . . 1 1 4 4 GLU HB3 H . . . . . 2.593 1.752 3.434 . . . . . A . 4 GLU HG2 . . A . 4 GLU HB3 . A . 4 . HG2 . . . A . 4 . HB1 . . c30226_5ug5 1 51 1 . . 1 1 4 4 GLU HB2 H . . . 1 1 4 4 GLU HB3 H . . . . . 1.825 1.409 2.241 . . . . . A . 4 GLU HB2 . . A . 4 GLU HB3 . A . 4 . HB2 . . . A . 4 . HB1 . . c30226_5ug5 1 52 1 . . 1 1 4 4 GLU H H . . . 1 1 4 4 GLU HA H . . . . . 2.613 1.760 3.466 . . . . . A . 4 GLU H . . A . 4 GLU HA . A . 4 . HN . . . A . 4 . HA . . c30226_5ug5 1 53 1 . . 1 1 4 4 GLU H H . . . 1 1 4 4 GLU HG2 H . . . . . 3.148 1.909 4.387 . . . . . A . 4 GLU H . . A . 4 GLU HG2 . A . 4 . HN . . . A . 4 . HG2 . . c30226_5ug5 1 54 1 . . 1 1 4 4 GLU H H . . . 1 1 4 4 GLU HB2 H . . . . . 2.809 1.822 3.796 . . . . . A . 4 GLU H . . A . 4 GLU HB2 . A . 4 . HN . . . A . 4 . HB2 . . c30226_5ug5 1 55 1 . . 1 1 4 4 GLU H H . . . 1 1 4 4 GLU HB3 H . . . . . 2.743 1.803 3.683 . . . . . A . 4 GLU H . . A . 4 GLU HB3 . A . 4 . HN . . . A . 4 . HB1 . . c30226_5ug5 1 56 1 . . 1 1 4 4 GLU HA H . . . 1 1 4 4 GLU HG2 H . . . . . 2.887 1.845 3.929 . . . . . A . 4 GLU HA . . A . 4 GLU HG2 . A . 4 . HA . . . A . 4 . HG2 . . c30226_5ug5 1 57 1 . . 1 1 4 4 GLU HA H . . . 1 1 4 4 GLU HB2 H . . . . . 2.314 1.645 2.983 . . . . . A . 4 GLU HA . . A . 4 GLU HB2 . A . 4 . HA . . . A . 4 . HB2 . . c30226_5ug5 1 58 1 . . 1 1 4 4 GLU HA H . . . 1 1 4 4 GLU HB3 H . . . . . 2.598 1.754 3.442 . . . . . A . 4 GLU HA . . A . 4 GLU HB3 . A . 4 . HA . . . A . 4 . HB1 . . c30226_5ug5 1 59 1 . . 1 1 4 4 GLU HG2 H . . . 1 1 4 4 GLU HB2 H . . . . . 2.497 1.717 3.277 . . . . . A . 4 GLU HG2 . . A . 4 GLU HB2 . A . 4 . HG2 . . . A . 4 . HB2 . . c30226_5ug5 1 60 1 . . 1 1 4 4 GLU HG2 H . . . 1 1 4 4 GLU HB3 H . . . . . 2.479 1.711 3.247 . . . . . A . 4 GLU HG2 . . A . 4 GLU HB3 . A . 4 . HG2 . . . A . 4 . HB1 . . c30226_5ug5 1 61 1 . . 1 1 4 4 GLU HB2 H . . . 1 1 4 4 GLU HB3 H . . . . . 1.803 1.397 2.209 . . . . . A . 4 GLU HB2 . . A . 4 GLU HB3 . A . 4 . HB2 . . . A . 4 . HB1 . . c30226_5ug5 1 62 1 . . 1 1 5 5 CYS HA H . . . 1 1 5 5 CYS HB2 H . . . . . 2.386 1.674 3.098 . . . . . A . 5 CYS HA . . A . 5 CYS HB2 . A . 5 . HA . . . A . 5 . HB2 . . c30226_5ug5 1 63 1 . . 1 1 5 5 CYS HA H . . . 1 1 5 5 CYS HB3 H . . . . . 2.539 1.733 3.345 . . . . . A . 5 CYS HA . . A . 5 CYS HB3 . A . 5 . HA . . . A . 5 . HB1 . . c30226_5ug5 1 64 1 . . 1 1 5 5 CYS HB2 H . . . 1 1 5 5 CYS HB3 H . . . . . 1.944 1.472 2.416 . . . . . A . 5 CYS HB2 . . A . 5 CYS HB3 . A . 5 . HB2 . . . A . 5 . HB1 . . c30226_5ug5 1 65 1 . . 1 1 5 5 CYS H H . . . 1 1 5 5 CYS HA H . . . . . 2.541 1.734 3.348 . . . . . A . 5 CYS H . . A . 5 CYS HA . A . 5 . HN . . . A . 5 . HA . . c30226_5ug5 1 66 1 . . 1 1 5 5 CYS H H . . . 1 1 5 5 CYS HB2 H . . . . . 2.509 1.722 3.296 . . . . . A . 5 CYS H . . A . 5 CYS HB2 . A . 5 . HN . . . A . 5 . HB2 . . c30226_5ug5 1 67 1 . . 1 1 5 5 CYS H H . . . 1 1 5 5 CYS HB3 H . . . . . 2.534 1.731 3.337 . . . . . A . 5 CYS H . . A . 5 CYS HB3 . A . 5 . HN . . . A . 5 . HB1 . . c30226_5ug5 1 68 1 . . 1 1 5 5 CYS HA H . . . 1 1 5 5 CYS HB2 H . . . . . 2.640 1.769 3.511 . . . . . A . 5 CYS HA . . A . 5 CYS HB2 . A . 5 . HA . . . A . 5 . HB2 . . c30226_5ug5 1 69 1 . . 1 1 5 5 CYS HA H . . . 1 1 5 5 CYS HB3 H . . . . . 2.943 1.860 4.026 . . . . . A . 5 CYS HA . . A . 5 CYS HB3 . A . 5 . HA . . . A . 5 . HB1 . . c30226_5ug5 1 70 1 . . 1 1 5 5 CYS HB2 H . . . 1 1 5 5 CYS HB3 H . . . . . 2.005 1.503 2.507 . . . . . A . 5 CYS HB2 . . A . 5 CYS HB3 . A . 5 . HB2 . . . A . 5 . HB1 . . c30226_5ug5 1 71 1 . . 1 1 6 6 CYS H H . . . 1 1 6 6 CYS HB2 H . . . . . 2.393 1.677 3.109 . . . . . A . 6 CYS H . . A . 6 CYS HB2 . A . 6 . HN . . . A . 6 . HB2 . . c30226_5ug5 1 72 1 . . 1 1 6 6 CYS H H . . . 1 1 6 6 CYS HB3 H . . . . . 2.351 1.660 3.042 . . . . . A . 6 CYS H . . A . 6 CYS HB3 . A . 6 . HN . . . A . 6 . HB1 . . c30226_5ug5 1 73 1 . . 1 1 6 6 CYS HA H . . . 1 1 6 6 CYS HB2 H . . . . . 2.383 1.673 3.093 . . . . . A . 6 CYS HA . . A . 6 CYS HB2 . A . 6 . HA . . . A . 6 . HB2 . . c30226_5ug5 1 74 1 . . 1 1 6 6 CYS HA H . . . 1 1 6 6 CYS HB3 H . . . . . 2.523 1.727 3.319 . . . . . A . 6 CYS HA . . A . 6 CYS HB3 . A . 6 . HA . . . A . 6 . HB1 . . c30226_5ug5 1 75 1 . . 1 1 6 6 CYS HB2 H . . . 1 1 6 6 CYS HB3 H . . . . . 1.930 1.464 2.396 . . . . . A . 6 CYS HB2 . . A . 6 CYS HB3 . A . 6 . HB2 . . . A . 6 . HB1 . . c30226_5ug5 1 76 1 . . 1 1 6 6 CYS H H . . . 1 1 6 6 CYS HA H . . . . . 2.720 1.795 3.645 . . . . . A . 6 CYS H . . A . 6 CYS HA . A . 6 . HN . . . A . 6 . HA . . c30226_5ug5 1 77 1 . . 1 1 6 6 CYS H H . . . 1 1 6 6 CYS HB2 H . . . . . 2.626 1.764 3.488 . . . . . A . 6 CYS H . . A . 6 CYS HB2 . A . 6 . HN . . . A . 6 . HB2 . . c30226_5ug5 1 78 1 . . 1 1 6 6 CYS H H . . . 1 1 6 6 CYS HB3 H . . . . . 2.548 1.737 3.359 . . . . . A . 6 CYS H . . A . 6 CYS HB3 . A . 6 . HN . . . A . 6 . HB1 . . c30226_5ug5 1 79 1 . . 1 1 6 6 CYS HA H . . . 1 1 6 6 CYS HB3 H . . . . . 2.704 1.790 3.618 . . . . . A . 6 CYS HA . . A . 6 CYS HB3 . A . 6 . HA . . . A . 6 . HB1 . . c30226_5ug5 1 80 1 . . 1 1 6 6 CYS HA H . . . 1 1 6 6 CYS HB2 H . . . . . 2.547 1.736 3.358 . . . . . A . 6 CYS HA . . A . 6 CYS HB2 . A . 6 . HA . . . A . 6 . HB2 . . c30226_5ug5 1 81 1 . . 1 1 7 7 SER H H . . . 1 1 7 7 SER HB2 H . . . . . 2.559 1.741 3.377 . . . . . A . 7 SER H . . A . 7 SER HB2 . A . 7 . HN . . . A . 7 . HB2 . . c30226_5ug5 1 82 1 . . 1 1 7 7 SER H H . . . 1 1 7 7 SER HB3 H . . . . . 2.696 1.788 3.604 . . . . . A . 7 SER H . . A . 7 SER HB3 . A . 7 . HN . . . A . 7 . HB1 . . c30226_5ug5 1 83 1 . . 1 1 7 7 SER HA H . . . 1 1 7 7 SER HB2 H . . . . . 2.266 1.624 2.908 . . . . . A . 7 SER HA . . A . 7 SER HB2 . A . 7 . HA . . . A . 7 . HB2 . . c30226_5ug5 1 84 1 . . 1 1 7 7 SER HA H . . . 1 1 7 7 SER HB3 H . . . . . 2.274 1.628 2.920 . . . . . A . 7 SER HA . . A . 7 SER HB3 . A . 7 . HA . . . A . 7 . HB1 . . c30226_5ug5 1 85 1 . . 1 1 7 7 SER HB2 H . . . 1 1 7 7 SER HB3 H . . . . . 1.861 1.428 2.294 . . . . . A . 7 SER HB2 . . A . 7 SER HB3 . A . 7 . HB2 . . . A . 7 . HB1 . . c30226_5ug5 1 86 1 . . 1 1 7 7 SER H H . . . 1 1 7 7 SER HA H . . . . . 2.425 1.690 3.160 . . . . . A . 7 SER H . . A . 7 SER HA . A . 7 . HN . . . A . 7 . HA . . c30226_5ug5 1 87 1 . . 1 1 7 7 SER H H . . . 1 1 7 7 SER HB2 H . . . . . 2.683 1.783 3.583 . . . . . A . 7 SER H . . A . 7 SER HB2 . A . 7 . HN . . . A . 7 . HB2 . . c30226_5ug5 1 88 1 . . 1 1 7 7 SER H H . . . 1 1 7 7 SER HB3 H . . . . . 2.623 1.763 3.483 . . . . . A . 7 SER H . . A . 7 SER HB3 . A . 7 . HN . . . A . 7 . HB1 . . c30226_5ug5 1 89 1 . . 1 1 7 7 SER HA H . . . 1 1 7 7 SER HB2 H . . . . . 3.282 1.935 4.629 . . . . . A . 7 SER HA . . A . 7 SER HB2 . A . 7 . HA . . . A . 7 . HB2 . . c30226_5ug5 1 90 1 . . 1 1 7 7 SER HA H . . . 1 1 7 7 SER HB3 H . . . . . 3.122 1.904 4.340 . . . . . A . 7 SER HA . . A . 7 SER HB3 . A . 7 . HA . . . A . 7 . HB1 . . c30226_5ug5 1 91 1 . . 1 1 7 7 SER HB2 H . . . 1 1 7 7 SER HB3 H . . . . . 1.865 1.430 2.300 . . . . . A . 7 SER HB2 . . A . 7 SER HB3 . A . 7 . HB2 . . . A . 7 . HB1 . . c30226_5ug5 1 92 1 . . 1 1 8 8 ASN H H . . . 1 1 8 8 ASN HB2 H . . . . . 2.400 1.680 3.120 . . . . . A . 8 ASN H . . A . 8 ASN HB2 . A . 8 . HN . . . A . 8 . HB2 . . c30226_5ug5 1 93 1 . . 1 1 8 8 ASN H H . . . 1 1 8 8 ASN HB3 H . . . . . 2.365 1.666 3.064 . . . . . A . 8 ASN H . . A . 8 ASN HB3 . A . 8 . HN . . . A . 8 . HB1 . . c30226_5ug5 1 94 1 . . 1 1 8 8 ASN HA H . . . 1 1 8 8 ASN HB2 H . . . . . 2.864 1.838 3.890 . . . . . A . 8 ASN HA . . A . 8 ASN HB2 . A . 8 . HA . . . A . 8 . HB2 . . c30226_5ug5 1 95 1 . . 1 1 8 8 ASN H H . . . 1 1 8 8 ASN HA H . . . . . 3.277 1.935 4.619 . . . . . A . 8 ASN H . . A . 8 ASN HA . A . 8 . HN . . . A . 8 . HA . . c30226_5ug5 1 96 1 . . 1 1 8 8 ASN H H . . . 1 1 8 8 ASN HB2 H . . . . . 2.451 1.700 3.202 . . . . . A . 8 ASN H . . A . 8 ASN HB2 . A . 8 . HN . . . A . 8 . HB2 . . c30226_5ug5 1 97 1 . . 1 1 8 8 ASN H H . . . 1 1 8 8 ASN HB3 H . . . . . 2.421 1.688 3.154 . . . . . A . 8 ASN H . . A . 8 ASN HB3 . A . 8 . HN . . . A . 8 . HB1 . . c30226_5ug5 1 98 1 . . 1 1 8 8 ASN HA H . . . 1 1 8 8 ASN HB2 H . . . . . 2.515 1.725 3.305 . . . . . A . 8 ASN HA . . A . 8 ASN HB2 . A . 8 . HA . . . A . 8 . HB2 . . c30226_5ug5 1 99 1 . . 1 1 8 8 ASN HA H . . . 1 1 8 8 ASN HB3 H . . . . . 2.494 1.717 3.271 . . . . . A . 8 ASN HA . . A . 8 ASN HB3 . A . 8 . HA . . . A . 8 . HB1 . . c30226_5ug5 1 100 1 . . 1 1 8 8 ASN HB2 H . . . 1 1 12 12 ARG HD2 H . . . . . 1.238 1.046 1.430 . . . . . A . 8 ASN HB2 . . A . 12 ARG HD2 . A . 8 . HB2 . . . A . 12 . HD2 . . c30226_5ug5 1 101 1 . . 1 1 8 8 ASN HB2 H . . . 1 1 8 8 ASN HB3 H . . . . . 1.965 1.483 2.447 . . . . . A . 8 ASN HB2 . . A . 8 ASN HB3 . A . 8 . HB2 . . . A . 8 . HB1 . . c30226_5ug5 1 102 1 . . 1 1 10 10 ALA H H . . . 1 1 10 10 ALA MB H . . . . . 2.213 1.601 2.825 . . . . . A . 10 ALA H . . A . 10 ALA MB . A . 10 . HN . . . A . 10 . HB# . . c30226_5ug5 1 103 1 . . 1 1 10 10 ALA HA H . . . 1 1 10 10 ALA MB H . . . . . 2.218 1.603 2.833 . . . . . A . 10 ALA HA . . A . 10 ALA MB . A . 10 . HA . . . A . 10 . HB# . . c30226_5ug5 1 104 1 . . 1 1 10 10 ALA HA H . . . 1 1 10 10 ALA MB H . . . . . 2.161 1.577 2.745 . . . . . A . 10 ALA HA . . A . 10 ALA MB . A . 10 . HA . . . A . 10 . HB# . . c30226_5ug5 1 105 1 . . 1 1 12 12 ARG H H . . . 1 1 12 12 ARG HB2 H . . . . . 2.490 1.715 3.265 . . . . . A . 12 ARG H . . A . 12 ARG HB2 . A . 12 . HN . . . A . 12 . HB2 . . c30226_5ug5 1 106 1 . . 1 1 12 12 ARG H H . . . 1 1 12 12 ARG HB3 H . . . . . 2.578 1.748 3.408 . . . . . A . 12 ARG H . . A . 12 ARG HB3 . A . 12 . HN . . . A . 12 . HB1 . . c30226_5ug5 1 107 1 . . 1 1 12 12 ARG H H . . . 1 1 12 12 ARG HG2 H . . . . . 2.874 1.842 3.906 . . . . . A . 12 ARG H . . A . 12 ARG HG2 . A . 12 . HN . . . A . 12 . HG2 . . c30226_5ug5 1 108 1 . . 1 1 12 12 ARG H H . . . 1 1 12 12 ARG HG3 H . . . . . 2.866 1.839 3.893 . . . . . A . 12 ARG H . . A . 12 ARG HG3 . A . 12 . HN . . . A . 12 . HG1 . . c30226_5ug5 1 109 1 . . 1 1 12 12 ARG HA H . . . 1 1 12 12 ARG HE H . . . . . 3.622 1.982 5.262 . . . . . A . 12 ARG HA . . A . 12 ARG HE . A . 12 . HA . . . A . 12 . HE . . c30226_5ug5 1 110 1 . . 1 1 12 12 ARG HD2 H . . . 1 1 12 12 ARG HE H . . . . . 2.365 1.666 3.064 . . . . . A . 12 ARG HD2 . . A . 12 ARG HE . A . 12 . HD2 . . . A . 12 . HE . . c30226_5ug5 1 111 1 . . 1 1 12 12 ARG H H . . . 1 1 12 12 ARG HD2 H . . . . . 3.086 1.896 4.276 . . . . . A . 12 ARG H . . A . 12 ARG HD2 . A . 12 . HN . . . A . 12 . HD2 . . c30226_5ug5 1 112 1 . . 1 1 12 12 ARG HB2 H . . . 1 1 12 12 ARG HE H . . . . . 3.006 1.876 4.136 . . . . . A . 12 ARG HB2 . . A . 12 ARG HE . A . 12 . HB2 . . . A . 12 . HE . . c30226_5ug5 1 113 1 . . 1 1 12 12 ARG HB3 H . . . 1 1 12 12 ARG HE H . . . . . 3.141 1.908 4.374 . . . . . A . 12 ARG HB3 . . A . 12 ARG HE . A . 12 . HB1 . . . A . 12 . HE . . c30226_5ug5 1 114 1 . . 1 1 12 12 ARG HG2 H . . . 1 1 12 12 ARG HE H . . . . . 3.002 1.876 4.128 . . . . . A . 12 ARG HG2 . . A . 12 ARG HE . A . 12 . HG2 . . . A . 12 . HE . . c30226_5ug5 1 115 1 . . 1 1 12 12 ARG HG3 H . . . 1 1 12 12 ARG HE H . . . . . 3.003 1.876 4.130 . . . . . A . 12 ARG HG3 . . A . 12 ARG HE . A . 12 . HG1 . . . A . 12 . HE . . c30226_5ug5 1 116 1 . . 1 1 12 12 ARG HA H . . . 1 1 12 12 ARG HD2 H . . . . . 3.142 1.908 4.376 . . . . . A . 12 ARG HA . . A . 12 ARG HD2 . A . 12 . HA . . . A . 12 . HD2 . . c30226_5ug5 1 117 1 . . 1 1 12 12 ARG HA H . . . 1 1 12 12 ARG HB2 H . . . . . 2.502 1.720 3.284 . . . . . A . 12 ARG HA . . A . 12 ARG HB2 . A . 12 . HA . . . A . 12 . HB2 . . c30226_5ug5 1 118 1 . . 1 1 12 12 ARG HA H . . . 1 1 12 12 ARG HB3 H . . . . . 2.557 1.740 3.374 . . . . . A . 12 ARG HA . . A . 12 ARG HB3 . A . 12 . HA . . . A . 12 . HB1 . . c30226_5ug5 1 119 1 . . 1 1 12 12 ARG HA H . . . 1 1 12 12 ARG HG2 H . . . . . 2.714 1.793 3.635 . . . . . A . 12 ARG HA . . A . 12 ARG HG2 . A . 12 . HA . . . A . 12 . HG2 . . c30226_5ug5 1 120 1 . . 1 1 12 12 ARG HA H . . . 1 1 12 12 ARG HG3 H . . . . . 2.795 1.818 3.772 . . . . . A . 12 ARG HA . . A . 12 ARG HG3 . A . 12 . HA . . . A . 12 . HG1 . . c30226_5ug5 1 121 1 . . 1 1 12 12 ARG HD2 H . . . 1 1 12 12 ARG HB2 H . . . . . 2.710 1.792 3.628 . . . . . A . 12 ARG HD2 . . A . 12 ARG HB2 . A . 12 . HD2 . . . A . 12 . HB2 . . c30226_5ug5 1 122 1 . . 1 1 12 12 ARG HD2 H . . . 1 1 12 12 ARG HB3 H . . . . . 2.648 1.772 3.524 . . . . . A . 12 ARG HD2 . . A . 12 ARG HB3 . A . 12 . HD2 . . . A . 12 . HB1 . . c30226_5ug5 1 123 1 . . 1 1 12 12 ARG HG2 H . . . 1 1 12 12 ARG HD2 H . . . . . 2.384 1.674 3.094 . . . . . A . 12 ARG HG2 . . A . 12 ARG HD2 . A . 12 . HG2 . . . A . 12 . HD2 . . c30226_5ug5 1 124 1 . . 1 1 12 12 ARG HD2 H . . . 1 1 12 12 ARG HG3 H . . . . . 2.474 1.709 3.239 . . . . . A . 12 ARG HD2 . . A . 12 ARG HG3 . A . 12 . HD2 . . . A . 12 . HG1 . . c30226_5ug5 1 125 1 . . 1 1 12 12 ARG HB2 H . . . 1 1 12 12 ARG HB3 H . . . . . 2.150 1.572 2.728 . . . . . A . 12 ARG HB2 . . A . 12 ARG HB3 . A . 12 . HB2 . . . A . 12 . HB1 . . c30226_5ug5 1 126 1 . . 1 1 12 12 ARG HG2 H . . . 1 1 12 12 ARG HB2 H . . . . . 2.678 1.782 3.574 . . . . . A . 12 ARG HG2 . . A . 12 ARG HB2 . A . 12 . HG2 . . . A . 12 . HB2 . . c30226_5ug5 1 127 1 . . 1 1 12 12 ARG HB2 H . . . 1 1 12 12 ARG HG3 H . . . . . 2.839 1.832 3.846 . . . . . A . 12 ARG HB2 . . A . 12 ARG HG3 . A . 12 . HB2 . . . A . 12 . HG1 . . c30226_5ug5 1 128 1 . . 1 1 12 12 ARG HB2 H . . . 1 1 12 12 ARG HG3 H . . . . . 2.833 1.830 3.836 . . . . . A . 12 ARG HB2 . . A . 12 ARG HG3 . A . 12 . HB2 . . . A . 12 . HG1 . . c30226_5ug5 1 129 1 . . 1 1 12 12 ARG HG2 H . . . 1 1 12 12 ARG HB3 H . . . . . 2.574 1.746 3.402 . . . . . A . 12 ARG HG2 . . A . 12 ARG HB3 . A . 12 . HG2 . . . A . 12 . HB1 . . c30226_5ug5 1 130 1 . . 1 1 12 12 ARG HB3 H . . . 1 1 12 12 ARG HG3 H . . . . . 2.660 1.775 3.545 . . . . . A . 12 ARG HB3 . . A . 12 ARG HG3 . A . 12 . HB1 . . . A . 12 . HG1 . . c30226_5ug5 1 131 1 . . 1 1 12 12 ARG HG2 H . . . 1 1 12 12 ARG HG3 H . . . . . 2.111 1.554 2.668 . . . . . A . 12 ARG HG2 . . A . 12 ARG HG3 . A . 12 . HG2 . . . A . 12 . HG1 . . c30226_5ug5 1 132 1 . . 1 1 12 12 ARG H H . . . 1 1 12 12 ARG HA H . . . . . 2.640 1.769 3.511 . . . . . A . 12 ARG H . . A . 12 ARG HA . A . 12 . HN . . . A . 12 . HA . . c30226_5ug5 1 133 1 . . 1 1 12 12 ARG H H . . . 1 1 12 12 ARG HD2 H . . . . . 3.078 1.894 4.262 . . . . . A . 12 ARG H . . A . 12 ARG HD2 . A . 12 . HN . . . A . 12 . HD2 . . c30226_5ug5 1 134 1 . . 1 1 12 12 ARG H H . . . 1 1 12 12 ARG HB2 H . . . . . 2.786 1.816 3.756 . . . . . A . 12 ARG H . . A . 12 ARG HB2 . A . 12 . HN . . . A . 12 . HB2 . . c30226_5ug5 1 135 1 . . 1 1 12 12 ARG H H . . . 1 1 2 2 ARG HB2 H . . . . . 3.984 1.999 5.969 . . . . . A . 12 ARG H . . A . 2 ARG HB2 . A . 12 . HN . . . A . 2 . HB2 . . c30226_5ug5 1 136 1 . . 1 1 12 12 ARG H H . . . 1 1 12 12 ARG HB3 H . . . . . 2.801 1.820 3.782 . . . . . A . 12 ARG H . . A . 12 ARG HB3 . A . 12 . HN . . . A . 12 . HB1 . . c30226_5ug5 1 137 1 . . 1 1 12 12 ARG H H . . . 1 1 12 12 ARG HG2 H . . . . . 3.225 1.925 4.525 . . . . . A . 12 ARG H . . A . 12 ARG HG2 . A . 12 . HN . . . A . 12 . HG2 . . c30226_5ug5 1 138 1 . . 1 1 12 12 ARG H H . . . 1 1 12 12 ARG HG3 H . . . . . 3.224 1.925 4.523 . . . . . A . 12 ARG H . . A . 12 ARG HG3 . A . 12 . HN . . . A . 12 . HG1 . . c30226_5ug5 1 139 1 . . 1 1 12 12 ARG HA H . . . 1 1 12 12 ARG HD2 H . . . . . 3.031 1.883 4.179 . . . . . A . 12 ARG HA . . A . 12 ARG HD2 . A . 12 . HA . . . A . 12 . HD2 . . c30226_5ug5 1 140 1 . . 1 1 12 12 ARG HA H . . . 1 1 12 12 ARG HB2 H . . . . . 2.712 1.793 3.631 . . . . . A . 12 ARG HA . . A . 12 ARG HB2 . A . 12 . HA . . . A . 12 . HB2 . . c30226_5ug5 1 141 1 . . 1 1 12 12 ARG HA H . . . 1 1 12 12 ARG HB3 H . . . . . 2.751 1.805 3.697 . . . . . A . 12 ARG HA . . A . 12 ARG HB3 . A . 12 . HA . . . A . 12 . HB1 . . c30226_5ug5 1 142 1 OR . 1 1 2 2 ARG HB3 H . . . 1 1 7 7 SER HB3 H . . . . . 3.913 1.999 5.827 . . . . . A . 2 ARG HB3 . . A . 7 SER HB3 . A . 2 . HB1 . . . A . 7 . HB1 . . c30226_5ug5 1 142 2 OR . 1 1 12 12 ARG HG2 H . . . 1 1 7 7 SER HB3 H . . . . . 3.913 1.999 5.827 . . . . . A . 12 ARG HG2 . . A . 7 SER HB3 . A . 12 . HG2 . . . A . 7 . HB1 . . c30226_5ug5 1 142 3 OR . 1 1 12 12 ARG HG2 H . . . 1 1 9 9 PRO HD2 H . . . . . 3.913 1.999 5.827 . . . . . A . 12 ARG HG2 . . A . 9 PRO HD2 . A . 12 . HG2 . . . A . 9 . HD2 . . c30226_5ug5 1 143 1 . . 1 1 12 12 ARG HA H . . . 1 1 12 12 ARG HG2 H . . . . . 2.935 1.858 4.012 . . . . . A . 12 ARG HA . . A . 12 ARG HG2 . A . 12 . HA . . . A . 12 . HG2 . . c30226_5ug5 1 144 1 . . 1 1 12 12 ARG HA H . . . 1 1 12 12 ARG HG3 H . . . . . 2.998 1.874 4.122 . . . . . A . 12 ARG HA . . A . 12 ARG HG3 . A . 12 . HA . . . A . 12 . HG1 . . c30226_5ug5 1 145 1 . . 1 1 12 12 ARG HD2 H . . . 1 1 12 12 ARG HB2 H . . . . . 2.697 1.788 3.606 . . . . . A . 12 ARG HD2 . . A . 12 ARG HB2 . A . 12 . HD2 . . . A . 12 . HB2 . . c30226_5ug5 1 146 1 . . 1 1 2 2 ARG HB2 H . . . 1 1 8 8 ASN HB2 H . . . . . 2.738 1.801 3.675 . . . . . A . 2 ARG HB2 . . A . 8 ASN HB2 . A . 2 . HB2 . . . A . 8 . HB2 . . c30226_5ug5 1 147 1 . . 1 1 12 12 ARG HD2 H . . . 1 1 12 12 ARG HB3 H . . . . . 2.665 1.777 3.553 . . . . . A . 12 ARG HD2 . . A . 12 ARG HB3 . A . 12 . HD2 . . . A . 12 . HB1 . . c30226_5ug5 1 148 1 . . 1 1 12 12 ARG HG2 H . . . 1 1 12 12 ARG HD2 H . . . . . 2.490 1.715 3.265 . . . . . A . 12 ARG HG2 . . A . 12 ARG HD2 . A . 12 . HG2 . . . A . 12 . HD2 . . c30226_5ug5 1 149 1 . . 1 1 12 12 ARG HD2 H . . . 1 1 12 12 ARG HG3 H . . . . . 2.528 1.729 3.327 . . . . . A . 12 ARG HD2 . . A . 12 ARG HG3 . A . 12 . HD2 . . . A . 12 . HG1 . . c30226_5ug5 1 150 1 . . 1 1 12 12 ARG HB2 H . . . 1 1 12 12 ARG HB3 H . . . . . 2.119 1.558 2.680 . . . . . A . 12 ARG HB2 . . A . 12 ARG HB3 . A . 12 . HB2 . . . A . 12 . HB1 . . c30226_5ug5 1 151 1 . . 1 1 12 12 ARG HG2 H . . . 1 1 12 12 ARG HB2 H . . . . . 2.687 1.784 3.590 . . . . . A . 12 ARG HG2 . . A . 12 ARG HB2 . A . 12 . HG2 . . . A . 12 . HB2 . . c30226_5ug5 1 152 1 . . 1 1 12 12 ARG HB2 H . . . 1 1 12 12 ARG HG3 H . . . . . 2.874 1.842 3.906 . . . . . A . 12 ARG HB2 . . A . 12 ARG HG3 . A . 12 . HB2 . . . A . 12 . HG1 . . c30226_5ug5 1 153 1 . . 1 1 12 12 ARG HG2 H . . . 1 1 12 12 ARG HB3 H . . . . . 2.605 1.757 3.453 . . . . . A . 12 ARG HG2 . . A . 12 ARG HB3 . A . 12 . HG2 . . . A . 12 . HB1 . . c30226_5ug5 1 154 1 . . 1 1 12 12 ARG HB3 H . . . 1 1 12 12 ARG HG3 H . . . . . 2.689 1.785 3.593 . . . . . A . 12 ARG HB3 . . A . 12 ARG HG3 . A . 12 . HB1 . . . A . 12 . HG1 . . c30226_5ug5 1 155 1 . . 1 1 12 12 ARG HG2 H . . . 1 1 12 12 ARG HG3 H . . . . . 2.139 1.567 2.711 . . . . . A . 12 ARG HG2 . . A . 12 ARG HG3 . A . 12 . HG2 . . . A . 12 . HG1 . . c30226_5ug5 1 156 1 . . 1 1 14 14 ASN H H . . . 1 1 14 14 ASN HB2 H . . . . . 2.776 1.813 3.739 . . . . . A . 14 ASN H . . A . 14 ASN HB2 . A . 14 . HN . . . A . 14 . HB2 . . c30226_5ug5 1 157 1 . . 1 1 14 14 ASN H H . . . 1 1 14 14 ASN HB3 H . . . . . 2.540 1.734 3.346 . . . . . A . 14 ASN H . . A . 14 ASN HB3 . A . 14 . HN . . . A . 14 . HB1 . . c30226_5ug5 1 158 1 . . 1 1 14 14 ASN HA H . . . 1 1 14 14 ASN HB2 H . . . . . 2.172 1.582 2.762 . . . . . A . 14 ASN HA . . A . 14 ASN HB2 . A . 14 . HA . . . A . 14 . HB2 . . c30226_5ug5 1 159 1 . . 1 1 14 14 ASN HA H . . . 1 1 14 14 ASN HB3 H . . . . . 2.577 1.747 3.407 . . . . . A . 14 ASN HA . . A . 14 ASN HB3 . A . 14 . HA . . . A . 14 . HB1 . . c30226_5ug5 1 160 1 . . 1 1 14 14 ASN H H . . . 1 1 14 14 ASN HA H . . . . . 2.510 1.723 3.297 . . . . . A . 14 ASN H . . A . 14 ASN HA . A . 14 . HN . . . A . 14 . HA . . c30226_5ug5 1 161 1 . . 1 1 14 14 ASN H H . . . 1 1 14 14 ASN HB2 H . . . . . 2.877 1.842 3.912 . . . . . A . 14 ASN H . . A . 14 ASN HB2 . A . 14 . HN . . . A . 14 . HB2 . . c30226_5ug5 1 162 1 . . 1 1 14 14 ASN H H . . . 1 1 14 14 ASN HB3 H . . . . . 2.721 1.795 3.647 . . . . . A . 14 ASN H . . A . 14 ASN HB3 . A . 14 . HN . . . A . 14 . HB1 . . c30226_5ug5 1 163 1 . . 1 1 14 14 ASN HA H . . . 1 1 14 14 ASN HB2 H . . . . . 2.416 1.686 3.146 . . . . . A . 14 ASN HA . . A . 14 ASN HB2 . A . 14 . HA . . . A . 14 . HB2 . . c30226_5ug5 1 164 1 . . 1 1 14 14 ASN HA H . . . 1 1 14 14 ASN HB3 H . . . . . 2.754 1.806 3.702 . . . . . A . 14 ASN HA . . A . 14 ASN HB3 . A . 14 . HA . . . A . 14 . HB1 . . c30226_5ug5 1 165 1 . . 1 1 14 14 ASN HB2 H . . . 1 1 14 14 ASN HB3 H . . . . . 2.058 1.528 2.588 . . . . . A . 14 ASN HB2 . . A . 14 ASN HB3 . A . 14 . HB2 . . . A . 14 . HB1 . . c30226_5ug5 1 166 1 . . 1 1 15 15 ASN H H . . . 1 1 15 15 ASN HB2 H . . . . . 3.157 1.911 4.403 . . . . . A . 15 ASN H . . A . 15 ASN HB2 . A . 15 . HN . . . A . 15 . HB2 . . c30226_5ug5 1 167 1 . . 1 1 15 15 ASN H H . . . 1 1 15 15 ASN HB3 H . . . . . 2.380 1.672 3.088 . . . . . A . 15 ASN H . . A . 15 ASN HB3 . A . 15 . HN . . . A . 15 . HB1 . . c30226_5ug5 1 168 1 . . 1 1 15 15 ASN H H . . . 1 1 15 15 ASN HB3 H . . . . . 2.397 1.679 3.115 . . . . . A . 15 ASN H . . A . 15 ASN HB3 . A . 15 . HN . . . A . 15 . HB1 . . c30226_5ug5 1 169 1 . . 1 1 14 14 ASN HB3 H . . . 1 1 14 14 ASN HD21 H . . . . . 3.046 1.887 4.205 . . . . . A . 14 ASN HB3 . . A . 14 ASN HD21 . A . 14 . HB1 . . . A . 14 . HD21 . . c30226_5ug5 1 170 1 . . 1 1 15 15 ASN HA H . . . 1 1 15 15 ASN HB3 H . . . . . 2.336 1.654 3.018 . . . . . A . 15 ASN HA . . A . 15 ASN HB3 . A . 15 . HA . . . A . 15 . HB1 . . c30226_5ug5 1 171 1 . . 1 1 11 11 CYS H H . . . 1 1 11 11 CYS HB2 H . . . . . 2.484 1.713 3.255 . . . . . A . 11 CYS H . . A . 11 CYS HB2 . A . 11 . HN . . . A . 11 . HB2 . . c30226_5ug5 1 172 1 . . 1 1 11 11 CYS H H . . . 1 1 11 11 CYS HB3 H . . . . . 2.395 1.678 3.112 . . . . . A . 11 CYS H . . A . 11 CYS HB3 . A . 11 . HN . . . A . 11 . HB1 . . c30226_5ug5 1 173 1 . . 1 1 11 11 CYS HA H . . . 1 1 11 11 CYS HB2 H . . . . . 2.778 1.813 3.743 . . . . . A . 11 CYS HA . . A . 11 CYS HB2 . A . 11 . HA . . . A . 11 . HB2 . . c30226_5ug5 1 174 1 . . 1 1 11 11 CYS HA H . . . 1 1 11 11 CYS HB3 H . . . . . 2.455 1.702 3.208 . . . . . A . 11 CYS HA . . A . 11 CYS HB3 . A . 11 . HA . . . A . 11 . HB1 . . c30226_5ug5 1 175 1 . . 1 1 11 11 CYS HB2 H . . . 1 1 11 11 CYS HB3 H . . . . . 2.202 1.596 2.808 . . . . . A . 11 CYS HB2 . . A . 11 CYS HB3 . A . 11 . HB2 . . . A . 11 . HB1 . . c30226_5ug5 1 176 1 . . 1 1 11 11 CYS H H . . . 1 1 11 11 CYS HA H . . . . . 2.549 1.737 3.361 . . . . . A . 11 CYS H . . A . 11 CYS HA . A . 11 . HN . . . A . 11 . HA . . c30226_5ug5 1 177 1 . . 1 1 11 11 CYS H H . . . 1 1 11 11 CYS HB2 H . . . . . 2.804 1.822 3.786 . . . . . A . 11 CYS H . . A . 11 CYS HB2 . A . 11 . HN . . . A . 11 . HB2 . . c30226_5ug5 1 178 1 . . 1 1 11 11 CYS H H . . . 1 1 11 11 CYS HB3 H . . . . . 2.654 1.774 3.534 . . . . . A . 11 CYS H . . A . 11 CYS HB3 . A . 11 . HN . . . A . 11 . HB1 . . c30226_5ug5 1 179 1 . . 1 1 11 11 CYS HA H . . . 1 1 11 11 CYS HB3 H . . . . . 2.628 1.765 3.491 . . . . . A . 11 CYS HA . . A . 11 CYS HB3 . A . 11 . HA . . . A . 11 . HB1 . . c30226_5ug5 1 180 1 . . 1 1 11 11 CYS HB2 H . . . 1 1 11 11 CYS HB3 H . . . . . 2.184 1.588 2.780 . . . . . A . 11 CYS HB2 . . A . 11 CYS HB3 . A . 11 . HB2 . . . A . 11 . HB1 . . c30226_5ug5 1 181 1 . . 1 1 13 13 TYR H H . . . 1 1 13 13 TYR HB2 H . . . . . 2.123 1.560 2.686 . . . . . A . 13 TYR H . . A . 13 TYR HB2 . A . 13 . HN . . . A . 13 . HB2 . . c30226_5ug5 1 182 1 . . 1 1 11 11 CYS HA H . . . 1 1 11 11 CYS HB3 H . . . . . 2.476 1.710 3.242 . . . . . A . 11 CYS HA . . A . 11 CYS HB3 . A . 11 . HA . . . A . 11 . HB1 . . c30226_5ug5 1 183 1 . . 1 1 13 13 TYR HA H . . . 1 1 13 13 TYR HB2 H . . . . . 2.291 1.635 2.947 . . . . . A . 13 TYR HA . . A . 13 TYR HB2 . A . 13 . HA . . . A . 13 . HB2 . . c30226_5ug5 1 184 1 . . 1 1 13 13 TYR H H . . . 1 1 13 13 TYR HA H . . . . . 2.621 1.762 3.480 . . . . . A . 13 TYR H . . A . 13 TYR HA . A . 13 . HN . . . A . 13 . HA . . c30226_5ug5 1 185 1 . . 1 1 13 13 TYR H H . . . 1 1 13 13 TYR HB2 H . . . . . 2.182 1.587 2.777 . . . . . A . 13 TYR H . . A . 13 TYR HB2 . A . 13 . HN . . . A . 13 . HB2 . . c30226_5ug5 1 186 1 . . 1 1 13 13 TYR HA H . . . 1 1 13 13 TYR HB2 H . . . . . 2.257 1.620 2.894 . . . . . A . 13 TYR HA . . A . 13 TYR HB2 . A . 13 . HA . . . A . 13 . HB2 . . c30226_5ug5 1 187 1 . . 1 1 17 17 HIS H H . . . 1 1 17 17 HIS HB2 H . . . . . 2.887 1.845 3.929 . . . . . A . 17 HIS H . . A . 17 HIS HB2 . A . 17 . HN . . . A . 17 . HB2 . . c30226_5ug5 1 188 1 . . 1 1 17 17 HIS H H . . . 1 1 17 17 HIS HB3 H . . . . . 2.609 1.758 3.460 . . . . . A . 17 HIS H . . A . 17 HIS HB3 . A . 17 . HN . . . A . 17 . HB1 . . c30226_5ug5 1 189 1 . . 1 1 17 17 HIS HA H . . . 1 1 17 17 HIS HB2 H . . . . . 2.771 1.811 3.731 . . . . . A . 17 HIS HA . . A . 17 HIS HB2 . A . 17 . HA . . . A . 17 . HB2 . . c30226_5ug5 1 190 1 . . 1 1 17 17 HIS HA H . . . 1 1 17 17 HIS HB3 H . . . . . 2.860 1.838 3.882 . . . . . A . 17 HIS HA . . A . 17 HIS HB3 . A . 17 . HA . . . A . 17 . HB1 . . c30226_5ug5 1 191 1 . . 1 1 17 17 HIS HB2 H . . . 1 1 17 17 HIS HB3 H . . . . . 1.915 1.457 2.373 . . . . . A . 17 HIS HB2 . . A . 17 HIS HB3 . A . 17 . HB2 . . . A . 17 . HB1 . . c30226_5ug5 1 192 1 . . 1 1 17 17 HIS H H . . . 1 1 17 17 HIS HA H . . . . . 2.687 1.785 3.589 . . . . . A . 17 HIS H . . A . 17 HIS HA . A . 17 . HN . . . A . 17 . HA . . c30226_5ug5 1 193 1 . . 1 1 17 17 HIS H H . . . 1 1 17 17 HIS HB2 H . . . . . 2.924 1.855 3.993 . . . . . A . 17 HIS H . . A . 17 HIS HB2 . A . 17 . HN . . . A . 17 . HB2 . . c30226_5ug5 1 194 1 . . 1 1 17 17 HIS H H . . . 1 1 17 17 HIS HB3 H . . . . . 2.784 1.815 3.753 . . . . . A . 17 HIS H . . A . 17 HIS HB3 . A . 17 . HN . . . A . 17 . HB1 . . c30226_5ug5 1 195 1 . . 1 1 17 17 HIS HA H . . . 1 1 17 17 HIS HB2 H . . . . . 2.612 1.759 3.465 . . . . . A . 17 HIS HA . . A . 17 HIS HB2 . A . 17 . HA . . . A . 17 . HB2 . . c30226_5ug5 1 196 1 . . 1 1 17 17 HIS HA H . . . 1 1 17 17 HIS HB3 H . . . . . 2.780 1.814 3.746 . . . . . A . 17 HIS HA . . A . 17 HIS HB3 . A . 17 . HA . . . A . 17 . HB1 . . c30226_5ug5 1 197 1 . . 1 1 17 17 HIS HB2 H . . . 1 1 17 17 HIS HB3 H . . . . . 1.906 1.452 2.360 . . . . . A . 17 HIS HB2 . . A . 17 HIS HB3 . A . 17 . HB2 . . . A . 17 . HB1 . . c30226_5ug5 1 198 1 . . 1 1 18 18 VAL H H . . . 1 1 18 18 VAL HB H . . . . . 2.644 1.770 3.518 . . . . . A . 18 VAL H . . A . 18 VAL HB . A . 18 . HN . . . A . 18 . HB . . c30226_5ug5 1 199 1 . . 1 1 18 18 VAL H H . . . 1 1 18 18 VAL MG1 H . . . . . 2.452 1.701 3.203 . . . . . A . 18 VAL H . . A . 18 VAL MG1 . A . 18 . HN . . . A . 18 . HG1# . . c30226_5ug5 1 200 1 . . 1 1 18 18 VAL HA H . . . 1 1 18 18 VAL HB H . . . . . 2.254 1.619 2.889 . . . . . A . 18 VAL HA . . A . 18 VAL HB . A . 18 . HA . . . A . 18 . HB . . c30226_5ug5 1 201 1 . . 1 1 18 18 VAL HA H . . . 1 1 18 18 VAL MG1 H . . . . . 2.289 1.634 2.944 . . . . . A . 18 VAL HA . . A . 18 VAL MG1 . A . 18 . HA . . . A . 18 . HG1# . . c30226_5ug5 1 202 1 . . 1 1 18 18 VAL HB H . . . 1 1 18 18 VAL MG1 H . . . . . 2.193 1.592 2.794 . . . . . A . 18 VAL HB . . A . 18 VAL MG1 . A . 18 . HB . . . A . 18 . HG1# . . c30226_5ug5 1 203 1 . . 1 1 18 18 VAL H H . . . 1 1 18 18 VAL HA H . . . . . 2.752 1.806 3.698 . . . . . A . 18 VAL H . . A . 18 VAL HA . A . 18 . HN . . . A . 18 . HA . . c30226_5ug5 1 204 1 . . 1 1 18 18 VAL H H . . . 1 1 18 18 VAL HB H . . . . . 2.665 1.777 3.553 . . . . . A . 18 VAL H . . A . 18 VAL HB . A . 18 . HN . . . A . 18 . HB . . c30226_5ug5 1 205 1 . . 1 1 18 18 VAL H H . . . 1 1 18 18 VAL MG1 H . . . . . 2.530 1.730 3.330 . . . . . A . 18 VAL H . . A . 18 VAL MG1 . A . 18 . HN . . . A . 18 . HG1# . . c30226_5ug5 1 206 1 . . 1 1 18 18 VAL H H . . . 1 1 18 18 VAL MG2 H . . . . . 2.978 1.870 4.086 . . . . . A . 18 VAL H . . A . 18 VAL MG2 . A . 18 . HN . . . A . 18 . HG2# . . c30226_5ug5 1 207 1 . . 1 1 18 18 VAL H H . . . 1 1 18 18 VAL MG2 H . . . . . 2.496 1.717 3.275 . . . . . A . 18 VAL H . . A . 18 VAL MG2 . A . 18 . HN . . . A . 18 . HG2# . . c30226_5ug5 1 208 1 . . 1 1 18 18 VAL HA H . . . 1 1 18 18 VAL MG2 H . . . . . 2.289 1.634 2.944 . . . . . A . 18 VAL HA . . A . 18 VAL MG2 . A . 18 . HA . . . A . 18 . HG2# . . c30226_5ug5 1 209 1 . . 1 1 18 18 VAL HB H . . . 1 1 18 18 VAL MG2 H . . . . . 2.178 1.585 2.771 . . . . . A . 18 VAL HB . . A . 18 VAL MG2 . A . 18 . HB . . . A . 18 . HG2# . . c30226_5ug5 1 210 1 . . 1 1 18 18 VAL HA H . . . 1 1 18 18 VAL HB H . . . . . 2.377 1.671 3.083 . . . . . A . 18 VAL HA . . A . 18 VAL HB . A . 18 . HA . . . A . 18 . HB . . c30226_5ug5 1 211 1 . . 1 1 18 18 VAL HA H . . . 1 1 18 18 VAL MG1 H . . . . . 2.517 1.725 3.309 . . . . . A . 18 VAL HA . . A . 18 VAL MG1 . A . 18 . HA . . . A . 18 . HG1# . . c30226_5ug5 1 212 1 . . 1 1 18 18 VAL HA H . . . 1 1 18 18 VAL MG2 H . . . . . 2.434 1.693 3.175 . . . . . A . 18 VAL HA . . A . 18 VAL MG2 . A . 18 . HA . . . A . 18 . HG2# . . c30226_5ug5 1 213 1 . . 1 1 18 18 VAL HB H . . . 1 1 18 18 VAL MG1 H . . . . . 2.260 1.622 2.898 . . . . . A . 18 VAL HB . . A . 18 VAL MG1 . A . 18 . HB . . . A . 18 . HG1# . . c30226_5ug5 1 214 1 . . 1 1 18 18 VAL HB H . . . 1 1 18 18 VAL MG2 H . . . . . 2.265 1.624 2.906 . . . . . A . 18 VAL HB . . A . 18 VAL MG2 . A . 18 . HB . . . A . 18 . HG2# . . c30226_5ug5 1 215 1 . . 1 1 19 19 CYS H H . . . 1 1 19 19 CYS HB2 H . . . . . 3.004 1.876 4.132 . . . . . A . 19 CYS H . . A . 19 CYS HB2 . A . 19 . HN . . . A . 19 . HB2 . . c30226_5ug5 1 216 1 . . 1 1 19 19 CYS H H . . . 1 1 19 19 CYS HB3 H . . . . . 2.676 1.781 3.571 . . . . . A . 19 CYS H . . A . 19 CYS HB3 . A . 19 . HN . . . A . 19 . HB1 . . c30226_5ug5 1 217 1 . . 1 1 19 19 CYS HA H . . . 1 1 19 19 CYS HB2 H . . . . . 3.467 1.965 4.969 . . . . . A . 19 CYS HA . . A . 19 CYS HB2 . A . 19 . HA . . . A . 19 . HB2 . . c30226_5ug5 1 218 1 . . 1 1 19 19 CYS HA H . . . 1 1 19 19 CYS HB3 H . . . . . 4.607 1.954 7.260 . . . . . A . 19 CYS HA . . A . 19 CYS HB3 . A . 19 . HA . . . A . 19 . HB1 . . c30226_5ug5 1 219 1 . . 1 1 19 19 CYS HB2 H . . . 1 1 19 19 CYS HB3 H . . . . . 2.006 1.503 2.509 . . . . . A . 19 CYS HB2 . . A . 19 CYS HB3 . A . 19 . HB2 . . . A . 19 . HB1 . . c30226_5ug5 1 220 1 . . 1 1 16 16 HYP HA H . . . 1 1 16 16 HYP HB2 H . . . . . 2.208 1.598 2.818 . . . . . A . 16 HYP HA . . A . 16 HYP HB2 . A . 16 . HA . . . A . 16 . HB2 . . c30226_5ug5 1 221 1 . . 1 1 16 16 HYP HA H . . . 1 1 16 16 HYP HB3 H . . . . . 2.531 1.730 3.332 . . . . . A . 16 HYP HA . . A . 16 HYP HB3 . A . 16 . HA . . . A . 16 . HB3 . . c30226_5ug5 1 222 1 . . 1 1 16 16 HYP HG H . . . 1 1 16 16 HYP HD22 H . . . . . 2.432 1.693 3.171 . . . . . A . 16 HYP HG . . A . 16 HYP HD22 . A . 16 . HG . . . A . 16 . HD22 . . c30226_5ug5 1 223 1 . . 1 1 16 16 HYP HG H . . . 1 1 16 16 HYP HD1 H . . . . . 2.662 1.776 3.548 . . . . . A . 16 HYP HG . . A . 16 HYP HD1 . A . 16 . HG . . . A . 16 . HD1 . . c30226_5ug5 1 224 1 . . 1 1 16 16 HYP HB2 H . . . 1 1 16 16 HYP HG H . . . . . 2.743 1.803 3.683 . . . . . A . 16 HYP HB2 . . A . 16 HYP HG . A . 16 . HB2 . . . A . 16 . HG . . c30226_5ug5 1 225 1 . . 1 1 16 16 HYP HB3 H . . . 1 1 16 16 HYP HG H . . . . . 2.473 1.709 3.237 . . . . . A . 16 HYP HB3 . . A . 16 HYP HG . A . 16 . HB3 . . . A . 16 . HG . . c30226_5ug5 1 226 1 . . 1 1 16 16 HYP HD22 H . . . 1 1 16 16 HYP HD1 H . . . . . 1.931 1.465 2.397 . . . . . A . 16 HYP HD22 . . A . 16 HYP HD1 . A . 16 . HD22 . . . A . 16 . HD1 . . c30226_5ug5 1 227 1 . . 1 1 16 16 HYP HB2 H . . . 1 1 16 16 HYP HD22 H . . . . . 3.295 1.938 4.652 . . . . . A . 16 HYP HB2 . . A . 16 HYP HD22 . A . 16 . HB2 . . . A . 16 . HD22 . . c30226_5ug5 1 228 1 . . 1 1 16 16 HYP HB3 H . . . 1 1 16 16 HYP HD22 H . . . . . 3.018 1.879 4.157 . . . . . A . 16 HYP HB3 . . A . 16 HYP HD22 . A . 16 . HB3 . . . A . 16 . HD22 . . c30226_5ug5 1 229 1 . . 1 1 16 16 HYP HB2 H . . . 1 1 16 16 HYP HD1 H . . . . . 3.379 1.951 4.807 . . . . . A . 16 HYP HB2 . . A . 16 HYP HD1 . A . 16 . HB2 . . . A . 16 . HD1 . . c30226_5ug5 1 230 1 . . 1 1 16 16 HYP HB2 H . . . 1 1 16 16 HYP HD1 H . . . . . 3.340 1.946 4.734 . . . . . A . 16 HYP HB2 . . A . 16 HYP HD1 . A . 16 . HB2 . . . A . 16 . HD1 . . c30226_5ug5 1 231 1 . . 1 1 16 16 HYP HB3 H . . . 1 1 16 16 HYP HD1 H . . . . . 3.433 1.960 4.906 . . . . . A . 16 HYP HB3 . . A . 16 HYP HD1 . A . 16 . HB3 . . . A . 16 . HD1 . . c30226_5ug5 1 232 1 . . 1 1 12 12 ARG HB2 H . . . 1 1 16 16 HYP HD1 H . . . . . 3.294 1.938 4.650 . . . . . A . 12 ARG HB2 . . A . 16 HYP HD1 . A . 12 . HB2 . . . A . 16 . HD1 . . c30226_5ug5 1 233 1 . . 1 1 16 16 HYP HB2 H . . . 1 1 16 16 HYP HB3 H . . . . . 2.003 1.501 2.505 . . . . . A . 16 HYP HB2 . . A . 16 HYP HB3 . A . 16 . HB2 . . . A . 16 . HB3 . . c30226_5ug5 1 234 1 . . 1 1 9 9 PRO HD2 H . . . 1 1 9 9 PRO HA H . . . . . 2.960 1.865 4.055 . . . . . A . 9 PRO HD2 . . A . 9 PRO HA . A . 9 . HD2 . . . A . 9 . HA . . c30226_5ug5 1 235 1 . . 1 1 9 9 PRO HA H . . . 1 1 9 9 PRO HG2 H . . . . . 3.367 1.950 4.784 . . . . . A . 9 PRO HA . . A . 9 PRO HG2 . A . 9 . HA . . . A . 9 . HG2 . . c30226_5ug5 1 236 1 . . 1 1 9 9 PRO HA H . . . 1 1 9 9 PRO HB2 H . . . . . 2.468 1.707 3.229 . . . . . A . 9 PRO HA . . A . 9 PRO HB2 . A . 9 . HA . . . A . 9 . HB2 . . c30226_5ug5 1 237 1 . . 1 1 12 12 ARG HB2 H . . . 1 1 9 9 PRO HA H . . . . . 3.123 1.904 4.342 . . . . . A . 12 ARG HB2 . . A . 9 PRO HA . A . 12 . HB2 . . . A . 9 . HA . . c30226_5ug5 1 238 1 . . 1 1 9 9 PRO HD2 H . . . 1 1 9 9 PRO HD3 H . . . . . 1.976 1.488 2.464 . . . . . A . 9 PRO HD2 . . A . 9 PRO HD3 . A . 9 . HD2 . . . A . 9 . HD1 . . c30226_5ug5 1 239 1 . . 1 1 9 9 PRO HG2 H . . . 1 1 9 9 PRO HD3 H . . . . . 2.744 1.803 3.685 . . . . . A . 9 PRO HG2 . . A . 9 PRO HD3 . A . 9 . HG2 . . . A . 9 . HD1 . . c30226_5ug5 1 240 1 . . 1 1 9 9 PRO HB2 H . . . 1 1 9 9 PRO HD3 H . . . . . 2.523 1.727 3.319 . . . . . A . 9 PRO HB2 . . A . 9 PRO HD3 . A . 9 . HB2 . . . A . 9 . HD1 . . c30226_5ug5 1 241 1 . . 1 1 9 9 PRO HD2 H . . . 1 1 9 9 PRO HG2 H . . . . . 2.608 1.758 3.458 . . . . . A . 9 PRO HD2 . . A . 9 PRO HG2 . A . 9 . HD2 . . . A . 9 . HG2 . . c30226_5ug5 1 242 1 . . 1 1 9 9 PRO HD2 H . . . 1 1 9 9 PRO HB2 H . . . . . 2.571 1.745 3.397 . . . . . A . 9 PRO HD2 . . A . 9 PRO HB2 . A . 9 . HD2 . . . A . 9 . HB2 . . c30226_5ug5 1 243 1 . . 1 1 9 9 PRO HG2 H . . . 1 1 9 9 PRO HB2 H . . . . . 1.795 1.392 2.198 . . . . . A . 9 PRO HG2 . . A . 9 PRO HB2 . A . 9 . HG2 . . . A . 9 . HB2 . . c30226_5ug5 1 244 1 . . 1 1 3 3 ASP HA H . . . 1 1 4 4 GLU H H . . . . . 2.168 1.580 2.756 . . . . . A . 3 ASP HA . . A . 4 GLU H . A . 3 . HA . . . A . 4 . HN . . c30226_5ug5 1 245 1 . . 1 1 4 4 GLU HA H . . . 1 1 5 5 CYS H H . . . . . 2.606 1.757 3.455 . . . . . A . 4 GLU HA . . A . 5 CYS H . A . 4 . HA . . . A . 5 . HN . . c30226_5ug5 1 246 1 . . 1 1 5 5 CYS HA H . . . 1 1 6 6 CYS H H . . . . . 3.170 1.914 4.426 . . . . . A . 5 CYS HA . . A . 6 CYS H . A . 5 . HA . . . A . 6 . HN . . c30226_5ug5 1 247 1 . . 1 1 14 14 ASN HA H . . . 1 1 15 15 ASN H H . . . . . 2.730 1.799 3.661 . . . . . A . 14 ASN HA . . A . 15 ASN H . A . 14 . HA . . . A . 15 . HN . . c30226_5ug5 1 248 1 . . 1 1 17 17 HIS HA H . . . 1 1 18 18 VAL H H . . . . . 2.716 1.794 3.638 . . . . . A . 17 HIS HA . . A . 18 VAL H . A . 17 . HA . . . A . 18 . HN . . c30226_5ug5 1 249 1 . . 1 1 11 11 CYS H H . . . 1 1 12 12 ARG HB3 H . . . . . 2.695 1.787 3.603 . . . . . A . 11 CYS H . . A . 12 ARG HB3 . A . 11 . HN . . . A . 12 . HB1 . . c30226_5ug5 1 250 1 . . 1 1 10 10 ALA H H . . . 1 1 9 9 PRO HB2 H . . . . . 2.614 1.760 3.468 . . . . . A . 10 ALA H . . A . 9 PRO HB2 . A . 10 . HN . . . A . 9 . HB2 . . c30226_5ug5 1 251 1 . . 1 1 1 1 ILE HB H . . . 1 1 1 1 ILE HA H . . . . . 2.702 1.789 3.615 . . . . . A . 1 ILE HB . . A . 1 ILE HA . A . 1 . HB . . . A . 1 . HA . . c30226_5ug5 1 252 1 . . 1 1 1 1 ILE HA H . . . 1 1 1 1 ILE HG12 H . . . . . 3.644 1.984 5.304 . . . . . A . 1 ILE HA . . A . 1 ILE HG12 . A . 1 . HA . . . A . 1 . HG12 . . c30226_5ug5 1 253 1 . . 1 1 1 1 ILE HA H . . . 1 1 1 1 ILE HG13 H . . . . . 3.722 1.990 5.454 . . . . . A . 1 ILE HA . . A . 1 ILE HG13 . A . 1 . HA . . . A . 1 . HG11 . . c30226_5ug5 1 254 1 . . 1 1 1 1 ILE HA H . . . 1 1 1 1 ILE MG H . . . . . 2.873 1.841 3.905 . . . . . A . 1 ILE HA . . A . 1 ILE MG . A . 1 . HA . . . A . 1 . HG2# . . c30226_5ug5 1 255 1 . . 1 1 1 1 ILE HA H . . . 1 1 1 1 ILE MD H . . . . . 3.886 1.998 5.774 . . . . . A . 1 ILE HA . . A . 1 ILE MD . A . 1 . HA . . . A . 1 . HD1# . . c30226_5ug5 1 256 1 . . 1 1 1 1 ILE HB H . . . 1 1 1 1 ILE HG13 H . . . . . 3.093 1.897 4.289 . . . . . A . 1 ILE HB . . A . 1 ILE HG13 . A . 1 . HB . . . A . 1 . HG11 . . c30226_5ug5 1 257 1 . . 1 1 1 1 ILE HB H . . . 1 1 1 1 ILE HG13 H . . . . . 3.047 1.886 4.208 . . . . . A . 1 ILE HB . . A . 1 ILE HG13 . A . 1 . HB . . . A . 1 . HG11 . . c30226_5ug5 1 258 1 . . 1 1 1 1 ILE HB H . . . 1 1 1 1 ILE HG12 H . . . . . 3.219 1.924 4.514 . . . . . A . 1 ILE HB . . A . 1 ILE HG12 . A . 1 . HB . . . A . 1 . HG12 . . c30226_5ug5 1 259 1 . . 1 1 1 1 ILE HB H . . . 1 1 1 1 ILE HG12 H . . . . . 3.264 1.932 4.596 . . . . . A . 1 ILE HB . . A . 1 ILE HG12 . A . 1 . HB . . . A . 1 . HG12 . . c30226_5ug5 1 260 1 . . 1 1 1 1 ILE HB H . . . 1 1 1 1 ILE MG H . . . . . 2.939 1.859 4.019 . . . . . A . 1 ILE HB . . A . 1 ILE MG . A . 1 . HB . . . A . 1 . HG2# . . c30226_5ug5 1 261 1 . . 1 1 1 1 ILE HB H . . . 1 1 1 1 ILE MG H . . . . . 2.859 1.837 3.881 . . . . . A . 1 ILE HB . . A . 1 ILE MG . A . 1 . HB . . . A . 1 . HG2# . . c30226_5ug5 1 262 1 . . 1 1 1 1 ILE HB H . . . 1 1 1 1 ILE MD H . . . . . 3.416 1.957 4.875 . . . . . A . 1 ILE HB . . A . 1 ILE MD . A . 1 . HB . . . A . 1 . HD1# . . c30226_5ug5 1 263 1 . . 1 1 1 1 ILE HG12 H . . . 1 1 1 1 ILE HG13 H . . . . . 2.756 1.807 3.705 . . . . . A . 1 ILE HG12 . . A . 1 ILE HG13 . A . 1 . HG12 . . . A . 1 . HG11 . . c30226_5ug5 1 264 1 . . 1 1 1 1 ILE HG12 H . . . 1 1 1 1 ILE HG13 H . . . . . 2.397 1.679 3.115 . . . . . A . 1 ILE HG12 . . A . 1 ILE HG13 . A . 1 . HG12 . . . A . 1 . HG11 . . c30226_5ug5 1 265 1 . . 1 1 1 1 ILE HG13 H . . . 1 1 1 1 ILE MG H . . . . . 3.270 1.933 4.607 . . . . . A . 1 ILE HG13 . . A . 1 ILE MG . A . 1 . HG11 . . . A . 1 . HG2# . . c30226_5ug5 1 266 1 . . 1 1 1 1 ILE HG13 H . . . 1 1 1 1 ILE MD H . . . . . 2.700 1.789 3.611 . . . . . A . 1 ILE HG13 . . A . 1 ILE MD . A . 1 . HG11 . . . A . 1 . HD1# . . c30226_5ug5 1 267 1 . . 1 1 17 17 HIS H H . . . 1 1 16 16 HYP HB3 H . . . . . 3.189 1.918 4.460 . . . . . A . 17 HIS H . . A . 16 HYP HB3 . A . 17 . HN . . . A . 16 . HB3 . . c30226_5ug5 1 268 1 . . 1 1 17 17 HIS H H . . . 1 1 16 16 HYP HB2 H . . . . . 3.145 1.908 4.382 . . . . . A . 17 HIS H . . A . 16 HYP HB2 . A . 17 . HN . . . A . 16 . HB2 . . c30226_5ug5 1 269 1 . . 1 1 5 5 CYS H H . . . 1 1 4 4 GLU HB2 H . . . . . 2.969 1.867 4.071 . . . . . A . 5 CYS H . . A . 4 GLU HB2 . A . 5 . HN . . . A . 4 . HB2 . . c30226_5ug5 1 270 1 . . 1 1 5 5 CYS H H . . . 1 1 4 4 GLU HB3 H . . . . . 3.089 1.896 4.282 . . . . . A . 5 CYS H . . A . 4 GLU HB3 . A . 5 . HN . . . A . 4 . HB1 . . c30226_5ug5 1 271 1 . . 1 1 19 19 CYS H H . . . 1 1 18 18 VAL HB H . . . . . 3.014 1.878 4.150 . . . . . A . 19 CYS H . . A . 18 VAL HB . A . 19 . HN . . . A . 18 . HB . . c30226_5ug5 1 272 1 . . 1 1 10 10 ALA H H . . . 1 1 9 9 PRO HG2 H . . . . . 3.009 1.877 4.141 . . . . . A . 10 ALA H . . A . 9 PRO HG2 . A . 10 . HN . . . A . 9 . HG2 . . c30226_5ug5 1 273 1 OR . 1 1 13 13 TYR H H . . . 1 1 12 12 ARG HG2 H . . . . . 3.274 1.934 4.614 . . . . . A . 13 TYR H . . A . 12 ARG HG2 . A . 13 . HN . . . A . 12 . HG2 . . c30226_5ug5 1 273 2 OR . 1 1 11 11 CYS H H . . . 1 1 12 12 ARG HG2 H . . . . . 3.274 1.934 4.614 . . . . . A . 11 CYS H . . A . 12 ARG HG2 . A . 11 . HN . . . A . 12 . HG2 . . c30226_5ug5 1 274 1 . . 1 1 4 4 GLU H H . . . 1 1 3 3 ASP HB2 H . . . . . 3.134 1.907 4.361 . . . . . A . 4 GLU H . . A . 3 ASP HB2 . A . 4 . HN . . . A . 3 . HB2 . . c30226_5ug5 1 275 1 . . 1 1 4 4 GLU H H . . . 1 1 3 3 ASP HB3 H . . . . . 2.838 1.831 3.845 . . . . . A . 4 GLU H . . A . 3 ASP HB3 . A . 4 . HN . . . A . 3 . HB1 . . c30226_5ug5 1 276 1 . . 1 1 10 10 ALA H H . . . 1 1 9 9 PRO HB3 H . . . . . 3.310 1.940 4.680 . . . . . A . 10 ALA H . . A . 9 PRO HB3 . A . 10 . HN . . . A . 9 . HB1 . . c30226_5ug5 1 277 1 . . 1 1 11 11 CYS H H . . . 1 1 10 10 ALA MB H . . . . . 2.510 1.722 3.298 . . . . . A . 11 CYS H . . A . 10 ALA MB . A . 11 . HN . . . A . 10 . HB# . . c30226_5ug5 1 278 1 . . 1 1 3 3 ASP H H . . . 1 1 2 2 ARG HB2 H . . . . . 2.782 1.815 3.749 . . . . . A . 3 ASP H . . A . 2 ARG HB2 . A . 3 . HN . . . A . 2 . HB2 . . c30226_5ug5 1 279 1 . . 1 1 6 6 CYS H H . . . 1 1 5 5 CYS HB3 H . . . . . 2.574 1.746 3.402 . . . . . A . 6 CYS H . . A . 5 CYS HB3 . A . 6 . HN . . . A . 5 . HB1 . . c30226_5ug5 1 280 1 . . 1 1 14 14 ASN H H . . . 1 1 15 15 ASN HB3 H . . . . . 2.323 1.649 2.997 . . . . . A . 14 ASN H . . A . 15 ASN HB3 . A . 14 . HN . . . A . 15 . HB1 . . c30226_5ug5 1 281 1 . . 1 1 19 19 CYS H H . . . 1 1 18 18 VAL MG1 H . . . . . 2.973 1.868 4.078 . . . . . A . 19 CYS H . . A . 18 VAL MG1 . A . 19 . HN . . . A . 18 . HG1# . . c30226_5ug5 1 282 1 . . 1 1 14 14 ASN H H . . . 1 1 13 13 TYR HB2 H . . . . . 2.619 1.762 3.476 . . . . . A . 14 ASN H . . A . 13 TYR HB2 . A . 14 . HN . . . A . 13 . HB2 . . c30226_5ug5 1 283 1 . . 1 1 12 12 ARG H H . . . 1 1 11 11 CYS HB3 H . . . . . 2.997 1.874 4.120 . . . . . A . 12 ARG H . . A . 11 CYS HB3 . A . 12 . HN . . . A . 11 . HB1 . . c30226_5ug5 1 284 1 . . 1 1 2 2 ARG H H . . . 1 1 1 1 ILE HA H . . . . . 2.231 1.609 2.853 . . . . . A . 2 ARG H . . A . 1 ILE HA . A . 2 . HN . . . A . 1 . HA . . c30226_5ug5 1 285 1 . . 1 1 17 17 HIS H H . . . 1 1 16 16 HYP HD22 H . . . . . 3.212 1.923 4.501 . . . . . A . 17 HIS H . . A . 16 HYP HD22 . A . 17 . HN . . . A . 16 . HD22 . . c30226_5ug5 1 286 1 . . 1 1 12 12 ARG H H . . . 1 1 11 11 CYS HB2 H . . . . . 2.762 1.808 3.716 . . . . . A . 12 ARG H . . A . 11 CYS HB2 . A . 12 . HN . . . A . 11 . HB2 . . c30226_5ug5 1 287 1 . . 1 1 11 11 CYS HA H . . . 1 1 12 12 ARG H H . . . . . 2.726 1.797 3.655 . . . . . A . 11 CYS HA . . A . 12 ARG H . A . 11 . HA . . . A . 12 . HN . . c30226_5ug5 1 288 1 . . 1 1 17 17 HIS H H . . . 1 1 16 16 HYP HG H . . . . . 2.915 1.852 3.978 . . . . . A . 17 HIS H . . A . 16 HYP HG . A . 17 . HN . . . A . 16 . HG . . c30226_5ug5 1 289 1 . . 1 1 17 17 HIS H H . . . 1 1 16 16 HYP HA H . . . . . 2.420 1.688 3.152 . . . . . A . 17 HIS H . . A . 16 HYP HA . A . 17 . HN . . . A . 16 . HA . . c30226_5ug5 1 290 1 . . 1 1 18 18 VAL HA H . . . 1 1 19 19 CYS H H . . . . . 2.492 1.716 3.268 . . . . . A . 18 VAL HA . . A . 19 CYS H . A . 18 . HA . . . A . 19 . HN . . c30226_5ug5 1 291 1 . . 1 1 6 6 CYS HA H . . . 1 1 7 7 SER H H . . . . . 2.989 1.872 4.106 . . . . . A . 6 CYS HA . . A . 7 SER H . A . 6 . HA . . . A . 7 . HN . . c30226_5ug5 1 292 1 . . 1 1 13 13 TYR HA H . . . 1 1 14 14 ASN H H . . . . . 2.707 1.791 3.623 . . . . . A . 13 TYR HA . . A . 14 ASN H . A . 13 . HA . . . A . 14 . HN . . c30226_5ug5 1 293 1 . . 1 1 4 4 GLU HA H . . . 1 1 6 6 CYS H H . . . . . 3.423 1.959 4.887 . . . . . A . 4 GLU HA . . A . 6 CYS H . A . 4 . HA . . . A . 6 . HN . . c30226_5ug5 1 294 1 . . 1 1 15 15 ASN H H . . . 1 1 16 16 HYP HD1 H . . . . . 3.037 1.884 4.190 . . . . . A . 15 ASN H . . A . 16 HYP HD1 . A . 15 . HN . . . A . 16 . HD1 . . c30226_5ug5 1 295 1 . . 1 1 12 12 ARG HB3 H . . . 1 1 9 9 PRO HA H . . . . . 2.903 1.850 3.956 . . . . . A . 12 ARG HB3 . . A . 9 PRO HA . A . 12 . HB1 . . . A . 9 . HA . . c30226_5ug5 1 296 1 . . 1 1 12 12 ARG HG2 H . . . 1 1 9 9 PRO HA H . . . . . 3.633 1.983 5.283 . . . . . A . 12 ARG HG2 . . A . 9 PRO HA . A . 12 . HG2 . . . A . 9 . HA . . c30226_5ug5 1 297 1 . . 1 1 12 12 ARG HG3 H . . . 1 1 9 9 PRO HA H . . . . . 3.389 1.954 4.824 . . . . . A . 12 ARG HG3 . . A . 9 PRO HA . A . 12 . HG1 . . . A . 9 . HA . . c30226_5ug5 1 298 1 . . 1 1 12 12 ARG HA H . . . 1 1 15 15 ASN HB3 H . . . . . 3.043 1.886 4.200 . . . . . A . 12 ARG HA . . A . 15 ASN HB3 . A . 12 . HA . . . A . 15 . HB1 . . c30226_5ug5 1 299 1 . . 1 1 15 15 ASN HB3 H . . . 1 1 16 16 HYP HD22 H . . . . . 2.855 1.836 3.874 . . . . . A . 15 ASN HB3 . . A . 16 HYP HD22 . A . 15 . HB1 . . . A . 16 . HD22 . . c30226_5ug5 1 300 1 . . 1 1 15 15 ASN HB3 H . . . 1 1 16 16 HYP HD1 H . . . . . 3.065 1.891 4.239 . . . . . A . 15 ASN HB3 . . A . 16 HYP HD1 . A . 15 . HB1 . . . A . 16 . HD1 . . c30226_5ug5 1 301 1 . . 1 1 15 15 ASN HB3 H . . . 1 1 18 18 VAL HB H . . . . . 2.820 1.826 3.814 . . . . . A . 15 ASN HB3 . . A . 18 VAL HB . A . 15 . HB1 . . . A . 18 . HB . . c30226_5ug5 1 302 1 . . 1 1 16 16 HYP HD22 H . . . 1 1 16 16 HYP HD1 H . . . . . 1.982 1.491 2.473 . . . . . A . 16 HYP HD22 . . A . 16 HYP HD1 . A . 16 . HD22 . . . A . 16 . HD1 . . c30226_5ug5 1 303 1 . . 1 1 16 16 HYP HB2 H . . . 1 1 16 16 HYP HD22 H . . . . . 3.178 1.915 4.441 . . . . . A . 16 HYP HB2 . . A . 16 HYP HD22 . A . 16 . HB2 . . . A . 16 . HD22 . . c30226_5ug5 1 304 1 . . 1 1 16 16 HYP HB3 H . . . 1 1 16 16 HYP HD22 H . . . . . 3.038 1.884 4.192 . . . . . A . 16 HYP HB3 . . A . 16 HYP HD22 . A . 16 . HB3 . . . A . 16 . HD22 . . c30226_5ug5 1 305 1 . . 1 1 4 4 GLU H H . . . 1 1 5 5 CYS H H . . . . . 2.638 1.768 3.508 . . . . . A . 4 GLU H . . A . 5 CYS H . A . 4 . HN . . . A . 5 . HN . . c30226_5ug5 1 306 1 . . 1 1 4 4 GLU H H . . . 1 1 5 5 CYS H H . . . . . 2.547 1.736 3.358 . . . . . A . 4 GLU H . . A . 5 CYS H . A . 4 . HN . . . A . 5 . HN . . c30226_5ug5 1 307 1 . . 1 1 5 5 CYS H H . . . 1 1 6 6 CYS H H . . . . . 2.594 1.753 3.435 . . . . . A . 5 CYS H . . A . 6 CYS H . A . 5 . HN . . . A . 6 . HN . . c30226_5ug5 1 308 1 . . 1 1 5 5 CYS H H . . . 1 1 6 6 CYS H H . . . . . 2.581 1.748 3.414 . . . . . A . 5 CYS H . . A . 6 CYS H . A . 5 . HN . . . A . 6 . HN . . c30226_5ug5 1 309 1 . . 1 1 17 17 HIS H H . . . 1 1 18 18 VAL H H . . . . . 2.702 1.790 3.614 . . . . . A . 17 HIS H . . A . 18 VAL H . A . 17 . HN . . . A . 18 . HN . . c30226_5ug5 1 310 1 . . 1 1 18 18 VAL H H . . . 1 1 19 19 CYS H H . . . . . 2.629 1.765 3.493 . . . . . A . 18 VAL H . . A . 19 CYS H . A . 18 . HN . . . A . 19 . HN . . c30226_5ug5 1 311 1 . . 1 1 6 6 CYS H H . . . 1 1 7 7 SER H H . . . . . 2.581 1.748 3.414 . . . . . A . 6 CYS H . . A . 7 SER H . A . 6 . HN . . . A . 7 . HN . . c30226_5ug5 1 312 1 . . 1 1 6 6 CYS H H . . . 1 1 8 8 ASN H H . . . . . 2.698 1.788 3.608 . . . . . A . 6 CYS H . . A . 8 ASN H . A . 6 . HN . . . A . 8 . HN . . c30226_5ug5 1 313 1 . . 1 1 14 14 ASN H H . . . 1 1 15 15 ASN H H . . . . . 2.506 1.721 3.291 . . . . . A . 14 ASN H . . A . 15 ASN H . A . 14 . HN . . . A . 15 . HN . . c30226_5ug5 1 314 1 . . 1 1 14 14 ASN H H . . . 1 1 15 15 ASN H H . . . . . 2.467 1.706 3.228 . . . . . A . 14 ASN H . . A . 15 ASN H . A . 14 . HN . . . A . 15 . HN . . c30226_5ug5 1 315 1 . . 1 1 18 18 VAL H H . . . 1 1 19 19 CYS H H . . . . . 2.658 1.775 3.541 . . . . . A . 18 VAL H . . A . 19 CYS H . A . 18 . HN . . . A . 19 . HN . . c30226_5ug5 1 316 1 . . 1 1 6 6 CYS H H . . . 1 1 7 7 SER H H . . . . . 2.544 1.735 3.353 . . . . . A . 6 CYS H . . A . 7 SER H . A . 6 . HN . . . A . 7 . HN . . c30226_5ug5 1 317 1 . . 1 1 10 10 ALA H H . . . 1 1 12 12 ARG H H . . . . . 3.168 1.913 4.423 . . . . . A . 10 ALA H . . A . 12 ARG H . A . 10 . HN . . . A . 12 . HN . . c30226_5ug5 1 318 1 . . 1 1 10 10 ALA H H . . . 1 1 11 11 CYS H H . . . . . 2.303 1.640 2.966 . . . . . A . 10 ALA H . . A . 11 CYS H . A . 10 . HN . . . A . 11 . HN . . c30226_5ug5 1 319 1 . . 1 1 8 8 ASN H H . . . 1 1 12 12 ARG H H . . . . . 3.201 1.920 4.482 . . . . . A . 8 ASN H . . A . 12 ARG H . A . 8 . HN . . . A . 12 . HN . . c30226_5ug5 1 320 1 . . 1 1 3 3 ASP H H . . . 1 1 4 4 GLU H H . . . . . 2.949 1.862 4.036 . . . . . A . 3 ASP H . . A . 4 GLU H . A . 3 . HN . . . A . 4 . HN . . c30226_5ug5 1 321 1 . . 1 1 3 3 ASP H H . . . 1 1 4 4 GLU H H . . . . . 2.998 1.875 4.121 . . . . . A . 3 ASP H . . A . 4 GLU H . A . 3 . HN . . . A . 4 . HN . . c30226_5ug5 1 322 1 . . 1 1 17 17 HIS H H . . . 1 1 18 18 VAL H H . . . . . 2.693 1.786 3.600 . . . . . A . 17 HIS H . . A . 18 VAL H . A . 17 . HN . . . A . 18 . HN . . c30226_5ug5 1 323 1 . . 1 1 12 12 ARG HD2 H . . . 1 1 11 11 CYS HB2 H . . . . . 2.994 1.873 4.115 . . . . . A . 12 ARG HD2 . . A . 11 CYS HB2 . A . 12 . HD2 . . . A . 11 . HB2 . . c30226_5ug5 1 324 1 . . 1 1 10 10 ALA HA H . . . 1 1 13 13 TYR HB2 H . . . . . 2.779 1.813 3.745 . . . . . A . 10 ALA HA . . A . 13 TYR HB2 . A . 10 . HA . . . A . 13 . HB2 . . c30226_5ug5 1 325 1 . . 1 1 12 12 ARG HD2 H . . . 1 1 9 9 PRO HA H . . . . . 3.291 1.937 4.645 . . . . . A . 12 ARG HD2 . . A . 9 PRO HA . A . 12 . HD2 . . . A . 9 . HA . . c30226_5ug5 1 326 1 . . 1 1 15 15 ASN HB3 H . . . 1 1 18 18 VAL HB H . . . . . 2.979 1.870 4.088 . . . . . A . 15 ASN HB3 . . A . 18 VAL HB . A . 15 . HB1 . . . A . 18 . HB . . c30226_5ug5 1 327 1 . . 1 1 15 15 ASN HA H . . . 1 1 16 16 HYP HD22 H . . . . . 2.565 1.743 3.387 . . . . . A . 15 ASN HA . . A . 16 HYP HD22 . A . 15 . HA . . . A . 16 . HD22 . . c30226_5ug5 1 328 1 . . 1 1 15 15 ASN HA H . . . 1 1 16 16 HYP HD1 H . . . . . 2.647 1.771 3.523 . . . . . A . 15 ASN HA . . A . 16 HYP HD1 . A . 15 . HA . . . A . 16 . HD1 . . c30226_5ug5 1 329 1 . . 1 1 11 11 CYS HA H . . . 1 1 11 11 CYS HB2 H . . . . . 3.076 1.894 4.258 . . . . . A . 11 CYS HA . . A . 11 CYS HB2 . A . 11 . HA . . . A . 11 . HB2 . . c30226_5ug5 1 330 1 . . 1 1 2 2 ARG HE H . . . 1 1 2 2 ARG HD2 H . . . . . 2.778 1.813 3.743 . . . . . A . 2 ARG HE . . A . 2 ARG HD2 . A . 2 . HE . . . A . 2 . HD2 . . c30226_5ug5 1 331 1 . . 1 1 2 2 ARG HB2 H . . . 1 1 2 2 ARG HE H . . . . . 3.276 1.934 4.618 . . . . . A . 2 ARG HB2 . . A . 2 ARG HE . A . 2 . HB2 . . . A . 2 . HE . . c30226_5ug5 1 332 1 . . 1 1 2 2 ARG HB3 H . . . 1 1 2 2 ARG HE H . . . . . 3.296 1.938 4.654 . . . . . A . 2 ARG HB3 . . A . 2 ARG HE . A . 2 . HB1 . . . A . 2 . HE . . c30226_5ug5 1 333 1 . . 1 1 12 12 ARG HD2 H . . . 1 1 9 9 PRO HA H . . . . . 3.007 1.877 4.137 . . . . . A . 12 ARG HD2 . . A . 9 PRO HA . A . 12 . HD2 . . . A . 9 . HA . . c30226_5ug5 1 334 1 . . 1 1 9 9 PRO HA H . . . 1 1 9 9 PRO HB3 H . . . . . 2.360 1.664 3.056 . . . . . A . 9 PRO HA . . A . 9 PRO HB3 . A . 9 . HA . . . A . 9 . HB1 . . c30226_5ug5 1 335 1 . . 1 1 9 9 PRO HA H . . . 1 1 9 9 PRO HG2 H . . . . . 3.070 1.892 4.248 . . . . . A . 9 PRO HA . . A . 9 PRO HG2 . A . 9 . HA . . . A . 9 . HG2 . . c30226_5ug5 1 336 1 . . 1 1 9 9 PRO HA H . . . 1 1 9 9 PRO HB2 H . . . . . 2.443 1.697 3.189 . . . . . A . 9 PRO HA . . A . 9 PRO HB2 . A . 9 . HA . . . A . 9 . HB2 . . c30226_5ug5 1 337 1 . . 1 1 9 9 PRO HD2 H . . . 1 1 9 9 PRO HB3 H . . . . . 3.216 1.923 4.509 . . . . . A . 9 PRO HD2 . . A . 9 PRO HB3 . A . 9 . HD2 . . . A . 9 . HB1 . . c30226_5ug5 1 338 1 . . 1 1 9 9 PRO HD2 H . . . 1 1 9 9 PRO HG2 H . . . . . 2.599 1.755 3.443 . . . . . A . 9 PRO HD2 . . A . 9 PRO HG2 . A . 9 . HD2 . . . A . 9 . HG2 . . c30226_5ug5 1 339 1 . . 1 1 9 9 PRO HD2 H . . . 1 1 9 9 PRO HB2 H . . . . . 2.525 1.728 3.322 . . . . . A . 9 PRO HD2 . . A . 9 PRO HB2 . A . 9 . HD2 . . . A . 9 . HB2 . . c30226_5ug5 1 340 1 . . 1 1 16 16 HYP HB2 H . . . 1 1 16 16 HYP HB3 H . . . . . 2.024 1.512 2.536 . . . . . A . 16 HYP HB2 . . A . 16 HYP HB3 . A . 16 . HB2 . . . A . 16 . HB3 . . c30226_5ug5 1 341 1 . . 1 1 12 12 ARG HD2 H . . . 1 1 12 12 ARG HE H . . . . . 2.354 1.661 3.047 . . . . . A . 12 ARG HD2 . . A . 12 ARG HE . A . 12 . HD2 . . . A . 12 . HE . . c30226_5ug5 1 342 1 . . 1 1 12 12 ARG HG3 H . . . 1 1 12 12 ARG HE H . . . . . 3.698 1.988 5.408 . . . . . A . 12 ARG HG3 . . A . 12 ARG HE . A . 12 . HG1 . . . A . 12 . HE . . c30226_5ug5 1 343 1 . . 1 1 12 12 ARG HB2 H . . . 1 1 12 12 ARG HE H . . . . . 3.239 1.928 4.550 . . . . . A . 12 ARG HB2 . . A . 12 ARG HE . A . 12 . HB2 . . . A . 12 . HE . . c30226_5ug5 1 344 1 . . 1 1 12 12 ARG HB3 H . . . 1 1 12 12 ARG HE H . . . . . 3.392 1.954 4.830 . . . . . A . 12 ARG HB3 . . A . 12 ARG HE . A . 12 . HB1 . . . A . 12 . HE . . c30226_5ug5 1 345 1 . . 1 1 12 12 ARG HG2 H . . . 1 1 12 12 ARG HE H . . . . . 3.172 1.915 4.429 . . . . . A . 12 ARG HG2 . . A . 12 ARG HE . A . 12 . HG2 . . . A . 12 . HE . . c30226_5ug5 1 346 1 . . 1 1 12 12 ARG HG3 H . . . 1 1 12 12 ARG HE H . . . . . 3.070 1.892 4.248 . . . . . A . 12 ARG HG3 . . A . 12 ARG HE . A . 12 . HG1 . . . A . 12 . HE . . c30226_5ug5 1 347 1 . . 1 1 2 2 ARG H H . . . 1 1 1 1 ILE HB H . . . . . 3.005 1.876 4.134 . . . . . A . 2 ARG H . . A . 1 ILE HB . A . 2 . HN . . . A . 1 . HB . . c30226_5ug5 1 348 1 . . 1 1 11 11 CYS H H . . . 1 1 12 12 ARG H H . . . . . 2.209 1.599 2.819 . . . . . A . 11 CYS H . . A . 12 ARG H . A . 11 . HN . . . A . 12 . HN . . c30226_5ug5 1 349 1 . . 1 1 11 11 CYS H H . . . 1 1 12 12 ARG H H . . . . . 2.251 1.618 2.884 . . . . . A . 11 CYS H . . A . 12 ARG H . A . 11 . HN . . . A . 12 . HN . . c30226_5ug5 1 350 1 . . 1 1 3 3 ASP HA H . . . 1 1 4 4 GLU H H . . . . . 2.124 1.560 2.688 . . . . . A . 3 ASP HA . . A . 4 GLU H . A . 3 . HA . . . A . 4 . HN . . c30226_5ug5 1 351 1 . . 1 1 17 17 HIS H H . . . 1 1 16 16 HYP HA H . . . . . 2.315 1.645 2.985 . . . . . A . 17 HIS H . . A . 16 HYP HA . A . 17 . HN . . . A . 16 . HA . . c30226_5ug5 1 352 1 . . 1 1 4 4 GLU HA H . . . 1 1 5 5 CYS H H . . . . . 2.645 1.770 3.520 . . . . . A . 4 GLU HA . . A . 5 CYS H . A . 4 . HA . . . A . 5 . HN . . c30226_5ug5 1 353 1 . . 1 1 11 11 CYS HA H . . . 1 1 12 12 ARG H H . . . . . 2.734 1.800 3.668 . . . . . A . 11 CYS HA . . A . 12 ARG H . A . 11 . HA . . . A . 12 . HN . . c30226_5ug5 1 354 1 . . 1 1 12 12 ARG H H . . . 1 1 11 11 CYS HB2 H . . . . . 2.970 1.868 4.072 . . . . . A . 12 ARG H . . A . 11 CYS HB2 . A . 12 . HN . . . A . 11 . HB2 . . c30226_5ug5 1 355 1 . . 1 1 12 12 ARG H H . . . 1 1 9 9 PRO HA H . . . . . 3.304 1.939 4.669 . . . . . A . 12 ARG H . . A . 9 PRO HA . A . 12 . HN . . . A . 9 . HA . . c30226_5ug5 1 356 1 . . 1 1 4 4 GLU H H . . . 1 1 3 3 ASP HB2 H . . . . . 3.123 1.904 4.342 . . . . . A . 4 GLU H . . A . 3 ASP HB2 . A . 4 . HN . . . A . 3 . HB2 . . c30226_5ug5 1 357 1 . . 1 1 4 4 GLU H H . . . 1 1 3 3 ASP HB3 H . . . . . 3.028 1.882 4.174 . . . . . A . 4 GLU H . . A . 3 ASP HB3 . A . 4 . HN . . . A . 3 . HB1 . . c30226_5ug5 1 358 1 . . 1 1 14 14 ASN HA H . . . 1 1 15 15 ASN H H . . . . . 2.547 1.736 3.358 . . . . . A . 14 ASN HA . . A . 15 ASN H . A . 14 . HA . . . A . 15 . HN . . c30226_5ug5 1 359 1 . . 1 1 17 17 HIS HA H . . . 1 1 18 18 VAL H H . . . . . 2.636 1.767 3.505 . . . . . A . 17 HIS HA . . A . 18 VAL H . A . 17 . HA . . . A . 18 . HN . . c30226_5ug5 1 360 1 . . 1 1 6 6 CYS HA H . . . 1 1 7 7 SER H H . . . . . 2.875 1.842 3.908 . . . . . A . 6 CYS HA . . A . 7 SER H . A . 6 . HA . . . A . 7 . HN . . c30226_5ug5 1 361 1 . . 1 1 5 5 CYS HA H . . . 1 1 6 6 CYS H H . . . . . 2.877 1.842 3.912 . . . . . A . 5 CYS HA . . A . 6 CYS H . A . 5 . HA . . . A . 6 . HN . . c30226_5ug5 1 362 1 . . 1 1 10 10 ALA H H . . . 1 1 10 10 ALA HA H . . . . . 2.588 1.751 3.425 . . . . . A . 10 ALA H . . A . 10 ALA HA . A . 10 . HN . . . A . 10 . HA . . c30226_5ug5 1 363 1 . . 1 1 10 10 ALA H H . . . 1 1 10 10 ALA MB H . . . . . 2.316 1.645 2.987 . . . . . A . 10 ALA H . . A . 10 ALA MB . A . 10 . HN . . . A . 10 . HB# . . c30226_5ug5 1 364 1 . . 1 1 13 13 TYR HA H . . . 1 1 14 14 ASN H H . . . . . 2.641 1.769 3.513 . . . . . A . 13 TYR HA . . A . 14 ASN H . A . 13 . HA . . . A . 14 . HN . . c30226_5ug5 1 365 1 . . 1 1 11 11 CYS HA H . . . 1 1 15 15 ASN HD21 H . . . . . 2.980 1.870 4.090 . . . . . A . 11 CYS HA . . A . 15 ASN HD21 . A . 11 . HA . . . A . 15 . HD21 . . c30226_5ug5 1 366 1 . . 1 1 10 10 ALA H H . . . 1 1 9 9 PRO HA H . . . . . 3.210 1.922 4.498 . . . . . A . 10 ALA H . . A . 9 PRO HA . A . 10 . HN . . . A . 9 . HA . . c30226_5ug5 1 367 1 . . 1 1 11 11 CYS H H . . . 1 1 12 12 ARG HA H . . . . . 2.932 1.857 4.007 . . . . . A . 11 CYS H . . A . 12 ARG HA . A . 11 . HN . . . A . 12 . HA . . c30226_5ug5 1 368 1 . . 1 1 4 4 GLU HA H . . . 1 1 6 6 CYS H H . . . . . 3.341 1.945 4.737 . . . . . A . 4 GLU HA . . A . 6 CYS H . A . 4 . HA . . . A . 6 . HN . . c30226_5ug5 1 369 1 . . 1 1 14 14 ASN H H . . . 1 1 13 13 TYR HB2 H . . . . . 2.626 1.764 3.488 . . . . . A . 14 ASN H . . A . 13 TYR HB2 . A . 14 . HN . . . A . 13 . HB2 . . c30226_5ug5 1 370 1 . . 1 1 13 13 TYR HA H . . . 1 1 13 13 TYR QD H . . . . . 2.572 1.745 3.399 . . . . . A . 13 TYR HA . . A . 13 TYR QD . A . 13 . HA . . . A . 13 . HD# . . c30226_5ug5 1 371 1 . . 1 1 12 12 ARG HB2 H . . . 1 1 9 9 PRO HA H . . . . . 3.094 1.897 4.291 . . . . . A . 12 ARG HB2 . . A . 9 PRO HA . A . 12 . HB2 . . . A . 9 . HA . . c30226_5ug5 1 372 1 . . 1 1 12 12 ARG HB3 H . . . 1 1 9 9 PRO HA H . . . . . 2.967 1.866 4.068 . . . . . A . 12 ARG HB3 . . A . 9 PRO HA . A . 12 . HB1 . . . A . 9 . HA . . c30226_5ug5 1 373 1 . . 1 1 15 15 ASN HB3 H . . . 1 1 16 16 HYP HD22 H . . . . . 2.841 1.832 3.850 . . . . . A . 15 ASN HB3 . . A . 16 HYP HD22 . A . 15 . HB1 . . . A . 16 . HD22 . . c30226_5ug5 1 374 1 . . 1 1 12 12 ARG HA H . . . 1 1 15 15 ASN HB3 H . . . . . 3.085 1.896 4.274 . . . . . A . 12 ARG HA . . A . 15 ASN HB3 . A . 12 . HA . . . A . 15 . HB1 . . c30226_5ug5 1 375 1 . . 1 1 15 15 ASN HB3 H . . . 1 1 16 16 HYP HD1 H . . . . . 3.013 1.878 4.148 . . . . . A . 15 ASN HB3 . . A . 16 HYP HD1 . A . 15 . HB1 . . . A . 16 . HD1 . . c30226_5ug5 1 376 1 . . 1 1 14 14 ASN HD21 H . . . 1 1 14 14 ASN HD22 H . . . . . 1.795 1.392 2.198 . . . . . A . 14 ASN HD21 . . A . 14 ASN HD22 . A . 14 . HD21 . . . A . 14 . HD22 . . c30226_5ug5 1 377 1 . . 1 1 15 15 ASN HD21 H . . . 1 1 15 15 ASN HD22 H . . . . . 1.857 1.426 2.288 . . . . . A . 15 ASN HD21 . . A . 15 ASN HD22 . A . 15 . HD21 . . . A . 15 . HD22 . . c30226_5ug5 1 378 1 . . 1 1 8 8 ASN HD21 H . . . 1 1 8 8 ASN HD22 H . . . . . 1.814 1.403 2.225 . . . . . A . 8 ASN HD21 . . A . 8 ASN HD22 . A . 8 . HD21 . . . A . 8 . HD22 . . c30226_5ug5 1 379 1 . . 1 1 13 13 TYR QD H . . . 1 1 13 13 TYR QE H . . . . . 1.980 1.490 2.470 . . . . . A . 13 TYR QD . . A . 13 TYR QE . A . 13 . HD# . . . A . 13 . HE# . . c30226_5ug5 1 380 1 . . 1 1 15 15 ASN HD21 H . . . 1 1 15 15 ASN HD22 H . . . . . 1.869 1.433 2.305 . . . . . A . 15 ASN HD21 . . A . 15 ASN HD22 . A . 15 . HD21 . . . A . 15 . HD22 . . c30226_5ug5 1 381 1 . . 1 1 8 8 ASN HD21 H . . . 1 1 8 8 ASN HD22 H . . . . . 1.802 1.396 2.208 . . . . . A . 8 ASN HD21 . . A . 8 ASN HD22 . A . 8 . HD21 . . . A . 8 . HD22 . . c30226_5ug5 1 382 1 . . 1 1 14 14 ASN HD21 H . . . 1 1 14 14 ASN HD22 H . . . . . 1.770 1.379 2.161 . . . . . A . 14 ASN HD21 . . A . 14 ASN HD22 . A . 14 . HD21 . . . A . 14 . HD22 . . c30226_5ug5 1 383 1 . . 1 1 13 13 TYR QD H . . . 1 1 13 13 TYR QE H . . . . . 1.913 1.455 2.371 . . . . . A . 13 TYR QD . . A . 13 TYR QE . A . 13 . HD# . . . A . 13 . HE# . . c30226_5ug5 1 384 1 . . 1 1 3 3 ASP HA H . . . 1 1 5 5 CYS H H . . . . . 2.998 1.874 4.122 . . . . . A . 3 ASP HA . . A . 5 CYS H . A . 3 . HA . . . A . 5 . HN . . c30226_5ug5 1 385 1 . . 1 1 13 13 TYR HA H . . . 1 1 13 13 TYR QD H . . . . . 2.448 1.699 3.197 . . . . . A . 13 TYR HA . . A . 13 TYR QD . A . 13 . HA . . . A . 13 . HD# . . c30226_5ug5 1 386 1 . . 1 1 11 11 CYS H H . . . 1 1 12 12 ARG HB3 H . . . . . 2.963 1.866 4.060 . . . . . A . 11 CYS H . . A . 12 ARG HB3 . A . 11 . HN . . . A . 12 . HB1 . . c30226_5ug5 1 387 1 . . 1 1 16 16 HYP HA H . . . 1 1 16 16 HYP HB2 H . . . . . 2.370 1.668 3.072 . . . . . A . 16 HYP HA . . A . 16 HYP HB2 . A . 16 . HA . . . A . 16 . HB2 . . c30226_5ug5 1 388 1 . . 1 1 16 16 HYP HA H . . . 1 1 16 16 HYP HB3 H . . . . . 2.630 1.765 3.495 . . . . . A . 16 HYP HA . . A . 16 HYP HB3 . A . 16 . HA . . . A . 16 . HB3 . . c30226_5ug5 1 389 1 . . 1 1 16 16 HYP HB2 H . . . 1 1 16 16 HYP HG H . . . . . 2.792 1.818 3.766 . . . . . A . 16 HYP HB2 . . A . 16 HYP HG . A . 16 . HB2 . . . A . 16 . HG . . c30226_5ug5 1 390 1 . . 1 1 16 16 HYP HB3 H . . . 1 1 16 16 HYP HG H . . . . . 2.585 1.749 3.421 . . . . . A . 16 HYP HB3 . . A . 16 HYP HG . A . 16 . HB3 . . . A . 16 . HG . . c30226_5ug5 1 391 1 . . 1 1 16 16 HYP HG H . . . 1 1 16 16 HYP HD22 H . . . . . 2.581 1.748 3.414 . . . . . A . 16 HYP HG . . A . 16 HYP HD22 . A . 16 . HG . . . A . 16 . HD22 . . c30226_5ug5 1 392 1 . . 1 1 16 16 HYP HG H . . . 1 1 16 16 HYP HD1 H . . . . . 2.892 1.846 3.938 . . . . . A . 16 HYP HG . . A . 16 HYP HD1 . A . 16 . HG . . . A . 16 . HD1 . . c30226_5ug5 1 393 1 . . 1 1 9 9 PRO HA H . . . 1 1 9 9 PRO HB3 H . . . . . 2.338 1.654 3.022 . . . . . A . 9 PRO HA . . A . 9 PRO HB3 . A . 9 . HA . . . A . 9 . HB1 . . c30226_5ug5 1 394 1 . . 1 1 2 2 ARG HA H . . . 1 1 2 2 ARG HB2 H . . . . . 2.605 1.757 3.453 . . . . . A . 2 ARG HA . . A . 2 ARG HB2 . A . 2 . HA . . . A . 2 . HB2 . . c30226_5ug5 1 395 1 . . 1 1 2 2 ARG HA H . . . 1 1 2 2 ARG HB3 H . . . . . 3.086 1.895 4.277 . . . . . A . 2 ARG HA . . A . 2 ARG HB3 . A . 2 . HA . . . A . 2 . HB1 . . c30226_5ug5 1 396 1 . . 1 1 2 2 ARG HA H . . . 1 1 2 2 ARG HB3 H . . . . . 2.944 1.860 4.028 . . . . . A . 2 ARG HA . . A . 2 ARG HB3 . A . 2 . HA . . . A . 2 . HB1 . . c30226_5ug5 1 397 1 . . 1 1 2 2 ARG HA H . . . 1 1 2 2 ARG HB3 H . . . . . 2.929 1.856 4.002 . . . . . A . 2 ARG HA . . A . 2 ARG HB3 . A . 2 . HA . . . A . 2 . HB1 . . c30226_5ug5 1 398 1 . . 1 1 13 13 TYR HB2 H . . . 1 1 13 13 TYR QD H . . . . . 2.063 1.531 2.595 . . . . . A . 13 TYR HB2 . . A . 13 TYR QD . A . 13 . HB2 . . . A . 13 . HD# . . c30226_5ug5 1 399 1 . . 1 1 13 13 TYR HB2 H . . . 1 1 13 13 TYR QE H . . . . . 2.961 1.865 4.057 . . . . . A . 13 TYR HB2 . . A . 13 TYR QE . A . 13 . HB2 . . . A . 13 . HE# . . c30226_5ug5 1 400 1 . . 1 1 12 12 ARG HE H . . . 1 1 12 12 ARG HD3 H . . . . . 2.689 1.785 3.593 . . . . . A . 12 ARG HE . . A . 12 ARG HD3 . A . 12 . HE . . . A . 12 . HD1 . . c30226_5ug5 1 401 1 . . 1 1 13 13 TYR H H . . . 1 1 12 12 ARG HB2 H . . . . . 3.935 1.999 5.871 . . . . . A . 13 TYR H . . A . 12 ARG HB2 . A . 13 . HN . . . A . 12 . HB2 . . c30226_5ug5 1 402 1 . . 1 1 13 13 TYR H H . . . 1 1 12 12 ARG HB2 H . . . . . 2.818 1.826 3.810 . . . . . A . 13 TYR H . . A . 12 ARG HB2 . A . 13 . HN . . . A . 12 . HB2 . . c30226_5ug5 1 403 1 . . 1 1 19 19 CYS H H . . . 1 1 18 18 VAL HB H . . . . . 3.036 1.884 4.188 . . . . . A . 19 CYS H . . A . 18 VAL HB . A . 19 . HN . . . A . 18 . HB . . c30226_5ug5 1 404 1 . . 1 1 10 10 ALA H H . . . 1 1 9 9 PRO HB2 H . . . . . 2.738 1.801 3.675 . . . . . A . 10 ALA H . . A . 9 PRO HB2 . A . 10 . HN . . . A . 9 . HB2 . . c30226_5ug5 1 405 1 . . 1 1 11 11 CYS H H . . . 1 1 12 12 ARG HB2 H . . . . . 3.126 1.904 4.348 . . . . . A . 11 CYS H . . A . 12 ARG HB2 . A . 11 . HN . . . A . 12 . HB2 . . c30226_5ug5 1 406 1 . . 1 1 15 15 ASN HB3 H . . . 1 1 18 18 VAL MG1 H . . . . . 2.465 1.705 3.225 . . . . . A . 15 ASN HB3 . . A . 18 VAL MG1 . A . 15 . HB1 . . . A . 18 . HG1# . . c30226_5ug5 1 407 1 . . 1 1 1 1 ILE HB H . . . 1 1 1 1 ILE HA H . . . . . 2.742 1.802 3.682 . . . . . A . 1 ILE HB . . A . 1 ILE HA . A . 1 . HB . . . A . 1 . HA . . c30226_5ug5 1 408 1 . . 1 1 2 2 ARG HB2 H . . . 1 1 1 1 ILE HA H . . . . . 3.543 1.974 5.112 . . . . . A . 2 ARG HB2 . . A . 1 ILE HA . A . 2 . HB2 . . . A . 1 . HA . . c30226_5ug5 1 409 1 . . 1 1 1 1 ILE HA H . . . 1 1 1 1 ILE HG12 H . . . . . 3.729 1.991 5.467 . . . . . A . 1 ILE HA . . A . 1 ILE HG12 . A . 1 . HA . . . A . 1 . HG12 . . c30226_5ug5 1 410 1 . . 1 1 1 1 ILE HA H . . . 1 1 1 1 ILE MG H . . . . . 2.850 1.835 3.865 . . . . . A . 1 ILE HA . . A . 1 ILE MG . A . 1 . HA . . . A . 1 . HG2# . . c30226_5ug5 1 411 1 . . 1 1 1 1 ILE HA H . . . 1 1 1 1 ILE MD H . . . . . 3.085 1.895 4.275 . . . . . A . 1 ILE HA . . A . 1 ILE MD . A . 1 . HA . . . A . 1 . HD1# . . c30226_5ug5 1 412 1 . . 1 1 1 1 ILE HG12 H . . . 1 1 1 1 ILE HG13 H . . . . . 2.466 1.706 3.226 . . . . . A . 1 ILE HG12 . . A . 1 ILE HG13 . A . 1 . HG12 . . . A . 1 . HG11 . . c30226_5ug5 1 413 1 . . 1 1 9 9 PRO HG2 H . . . 1 1 9 9 PRO HD3 H . . . . . 2.694 1.787 3.601 . . . . . A . 9 PRO HG2 . . A . 9 PRO HD3 . A . 9 . HG2 . . . A . 9 . HD1 . . c30226_5ug5 1 414 1 . . 1 1 9 9 PRO HB2 H . . . 1 1 9 9 PRO HD3 H . . . . . 2.395 1.678 3.112 . . . . . A . 9 PRO HB2 . . A . 9 PRO HD3 . A . 9 . HB2 . . . A . 9 . HD1 . . c30226_5ug5 1 415 1 . . 1 1 9 9 PRO HG2 H . . . 1 1 9 9 PRO HB3 H . . . . . 2.368 1.667 3.069 . . . . . A . 9 PRO HG2 . . A . 9 PRO HB3 . A . 9 . HG2 . . . A . 9 . HB1 . . c30226_5ug5 1 416 1 . . 1 1 9 9 PRO HB2 H . . . 1 1 9 9 PRO HB3 H . . . . . 1.965 1.482 2.448 . . . . . A . 9 PRO HB2 . . A . 9 PRO HB3 . A . 9 . HB2 . . . A . 9 . HB1 . . c30226_5ug5 1 417 1 . . 1 1 9 9 PRO HG2 H . . . 1 1 9 9 PRO HB3 H . . . . . 2.422 1.689 3.155 . . . . . A . 9 PRO HG2 . . A . 9 PRO HB3 . A . 9 . HG2 . . . A . 9 . HB1 . . c30226_5ug5 1 418 1 . . 1 1 9 9 PRO HB2 H . . . 1 1 9 9 PRO HB3 H . . . . . 1.963 1.481 2.445 . . . . . A . 9 PRO HB2 . . A . 9 PRO HB3 . A . 9 . HB2 . . . A . 9 . HB1 . . c30226_5ug5 1 419 1 . . 1 1 8 8 ASN HA H . . . 1 1 9 9 PRO HD3 H . . . . . 2.097 1.548 2.646 . . . . . A . 8 ASN HA . . A . 9 PRO HD3 . A . 8 . HA . . . A . 9 . HD1 . . c30226_5ug5 1 420 1 . . 1 1 8 8 ASN HA H . . . 1 1 9 9 PRO HD2 H . . . . . 2.120 1.558 2.682 . . . . . A . 8 ASN HA . . A . 9 PRO HD2 . A . 8 . HA . . . A . 9 . HD2 . . c30226_5ug5 1 421 1 . . 1 1 15 15 ASN HB3 H . . . 1 1 18 18 VAL MG1 H . . . . . 2.566 1.743 3.389 . . . . . A . 15 ASN HB3 . . A . 18 VAL MG1 . A . 15 . HB1 . . . A . 18 . HG1# . . c30226_5ug5 1 422 1 . . 1 1 15 15 ASN HB3 H . . . 1 1 18 18 VAL MG2 H . . . . . 2.914 1.853 3.975 . . . . . A . 15 ASN HB3 . . A . 18 VAL MG2 . A . 15 . HB1 . . . A . 18 . HG2# . . c30226_5ug5 1 423 1 . . 1 1 8 8 ASN HA H . . . 1 1 7 7 SER HB3 H . . . . . 2.546 1.736 3.356 . . . . . A . 8 ASN HA . . A . 7 SER HB3 . A . 8 . HA . . . A . 7 . HB1 . . c30226_5ug5 1 424 1 . . 1 1 13 13 TYR HB2 H . . . 1 1 13 13 TYR QD H . . . . . 2.187 1.589 2.785 . . . . . A . 13 TYR HB2 . . A . 13 TYR QD . A . 13 . HB2 . . . A . 13 . HD# . . c30226_5ug5 1 425 1 . . 1 1 15 15 ASN HB3 H . . . 1 1 15 15 ASN HD22 H . . . . . 2.732 1.799 3.665 . . . . . A . 15 ASN HB3 . . A . 15 ASN HD22 . A . 15 . HB1 . . . A . 15 . HD22 . . c30226_5ug5 1 426 1 . . 1 1 11 11 CYS H H . . . 1 1 10 10 ALA MB H . . . . . 2.642 1.769 3.515 . . . . . A . 11 CYS H . . A . 10 ALA MB . A . 11 . HN . . . A . 10 . HB# . . c30226_5ug5 1 427 1 . . 1 1 10 10 ALA H H . . . 1 1 9 9 PRO HB3 H . . . . . 3.406 1.956 4.856 . . . . . A . 10 ALA H . . A . 9 PRO HB3 . A . 10 . HN . . . A . 9 . HB1 . . c30226_5ug5 1 428 1 . . 1 1 13 13 TYR H H . . . 1 1 13 13 TYR QD H . . . . . 2.852 1.835 3.869 . . . . . A . 13 TYR H . . A . 13 TYR QD . A . 13 . HN . . . A . 13 . HD# . . c30226_5ug5 1 429 1 OR . 1 1 8 8 ASN HB3 H . . . 1 1 11 11 CYS HB2 H . . . . . 2.928 1.856 4.000 . . . . . A . 8 ASN HB3 . . A . 11 CYS HB2 . A . 8 . HB1 . . . A . 11 . HB2 . . c30226_5ug5 1 429 2 OR . 1 1 8 8 ASN HB3 H . . . 1 1 9 9 PRO HD3 H . . . . . 2.928 1.856 4.000 . . . . . A . 8 ASN HB3 . . A . 9 PRO HD3 . A . 8 . HB1 . . . A . 9 . HD1 . . c30226_5ug5 1 430 1 . . 1 1 5 5 CYS HA H . . . 1 1 11 11 CYS HB3 H . . . . . 3.084 1.895 4.273 . . . . . A . 5 CYS HA . . A . 11 CYS HB3 . A . 5 . HA . . . A . 11 . HB1 . . c30226_5ug5 1 431 1 . . 1 1 5 5 CYS HA H . . . 1 1 11 11 CYS HB2 H . . . . . 2.747 1.804 3.690 . . . . . A . 5 CYS HA . . A . 11 CYS HB2 . A . 5 . HA . . . A . 11 . HB2 . . c30226_5ug5 1 432 1 OR . 1 1 8 8 ASN HB3 H . . . 1 1 11 11 CYS HB2 H . . . . . 2.934 1.858 4.010 . . . . . A . 8 ASN HB3 . . A . 11 CYS HB2 . A . 8 . HB1 . . . A . 11 . HB2 . . c30226_5ug5 1 432 2 OR . 1 1 5 5 CYS HB3 H . . . 1 1 11 11 CYS HB2 H . . . . . 2.934 1.858 4.010 . . . . . A . 5 CYS HB3 . . A . 11 CYS HB2 . A . 5 . HB1 . . . A . 11 . HB2 . . c30226_5ug5 1 433 1 . . 1 1 10 10 ALA H H . . . 1 1 11 11 CYS H H . . . . . 2.245 1.615 2.875 . . . . . A . 10 ALA H . . A . 11 CYS H . A . 10 . HN . . . A . 11 . HN . . c30226_5ug5 1 434 1 . . 1 1 13 13 TYR H H . . . 1 1 13 13 TYR QD H . . . . . 3.090 1.897 4.283 . . . . . A . 13 TYR H . . A . 13 TYR QD . A . 13 . HN . . . A . 13 . HD# . . c30226_5ug5 1 435 1 . . 1 1 11 11 CYS H H . . . 1 1 9 9 PRO HA H . . . . . 3.555 1.975 5.135 . . . . . A . 11 CYS H . . A . 9 PRO HA . A . 11 . HN . . . A . 9 . HA . . c30226_5ug5 1 436 1 . . 1 1 10 10 ALA H H . . . 1 1 9 9 PRO HG2 H . . . . . 3.394 1.954 4.834 . . . . . A . 10 ALA H . . A . 9 PRO HG2 . A . 10 . HN . . . A . 9 . HG2 . . c30226_5ug5 1 437 1 . . 1 1 12 12 ARG HA H . . . 1 1 13 13 TYR H H . . . . . 2.855 1.836 3.874 . . . . . A . 12 ARG HA . . A . 13 TYR H . A . 12 . HA . . . A . 13 . HN . . c30226_5ug5 1 438 1 . . 1 1 11 11 CYS H H . . . 1 1 8 8 ASN HB2 H . . . . . 2.697 1.788 3.606 . . . . . A . 11 CYS H . . A . 8 ASN HB2 . A . 11 . HN . . . A . 8 . HB2 . . c30226_5ug5 1 439 1 . . 1 1 8 8 ASN HB3 H . . . 1 1 8 8 ASN HD22 H . . . . . 3.000 1.875 4.125 . . . . . A . 8 ASN HB3 . . A . 8 ASN HD22 . A . 8 . HB1 . . . A . 8 . HD22 . . c30226_5ug5 1 440 1 . . 1 1 14 14 ASN HB3 H . . . 1 1 14 14 ASN HD21 H . . . . . 2.798 1.819 3.777 . . . . . A . 14 ASN HB3 . . A . 14 ASN HD21 . A . 14 . HB1 . . . A . 14 . HD21 . . c30226_5ug5 1 441 1 . . 1 1 14 14 ASN HB2 H . . . 1 1 14 14 ASN HD21 H . . . . . 2.978 1.869 4.087 . . . . . A . 14 ASN HB2 . . A . 14 ASN HD21 . A . 14 . HB2 . . . A . 14 . HD21 . . c30226_5ug5 1 442 1 . . 1 1 14 14 ASN HB3 H . . . 1 1 14 14 ASN HD22 H . . . . . 3.115 1.902 4.328 . . . . . A . 14 ASN HB3 . . A . 14 ASN HD22 . A . 14 . HB1 . . . A . 14 . HD22 . . c30226_5ug5 1 443 1 . . 1 1 10 10 ALA H H . . . 1 1 12 12 ARG H H . . . . . 3.264 1.932 4.596 . . . . . A . 10 ALA H . . A . 12 ARG H . A . 10 . HN . . . A . 12 . HN . . c30226_5ug5 1 444 1 . . 1 1 5 5 CYS H H . . . 1 1 7 7 SER H H . . . . . 3.673 1.987 5.359 . . . . . A . 5 CYS H . . A . 7 SER H . A . 5 . HN . . . A . 7 . HN . . c30226_5ug5 1 445 1 . . 1 1 6 6 CYS H H . . . 1 1 5 5 CYS HB3 H . . . . . 2.854 1.836 3.872 . . . . . A . 6 CYS H . . A . 5 CYS HB3 . A . 6 . HN . . . A . 5 . HB1 . . c30226_5ug5 1 446 1 . . 1 1 15 15 ASN HB3 H . . . 1 1 15 15 ASN HD21 H . . . . . 2.341 1.656 3.026 . . . . . A . 15 ASN HB3 . . A . 15 ASN HD21 . A . 15 . HB1 . . . A . 15 . HD21 . . c30226_5ug5 1 447 1 . . 1 1 14 14 ASN HB3 H . . . 1 1 14 14 ASN HD21 H . . . . . 2.776 1.813 3.739 . . . . . A . 14 ASN HB3 . . A . 14 ASN HD21 . A . 14 . HB1 . . . A . 14 . HD21 . . c30226_5ug5 1 448 1 . . 1 1 14 14 ASN HB2 H . . . 1 1 14 14 ASN HD21 H . . . . . 3.007 1.876 4.138 . . . . . A . 14 ASN HB2 . . A . 14 ASN HD21 . A . 14 . HB2 . . . A . 14 . HD21 . . c30226_5ug5 1 449 1 . . 1 1 14 14 ASN HA H . . . 1 1 13 13 TYR QD H . . . . . 3.199 1.920 4.478 . . . . . A . 14 ASN HA . . A . 13 TYR QD . A . 14 . HA . . . A . 13 . HD# . . c30226_5ug5 1 450 1 . . 1 1 18 18 VAL MG1 H . . . 1 1 15 15 ASN HD21 H . . . . . 3.370 1.950 4.790 . . . . . A . 18 VAL MG1 . . A . 15 ASN HD21 . A . 18 . HG1# . . . A . 15 . HD21 . . c30226_5ug5 1 451 1 . . 1 1 13 13 TYR H H . . . 1 1 13 13 TYR HB3 H . . . . . 2.123 1.560 2.686 . . . . . A . 13 TYR H . . A . 13 TYR HB3 . A . 13 . HN . . . A . 13 . HB1 . . c30226_5ug5 1 452 1 . . 1 1 11 11 CYS HA H . . . 1 1 10 10 ALA MB H . . . . . 3.099 1.898 4.300 . . . . . A . 11 CYS HA . . A . 10 ALA MB . A . 11 . HA . . . A . 10 . HB# . . c30226_5ug5 1 453 1 . . 1 1 19 19 CYS HA H . . . 1 1 19 19 CYS HB2 H . . . . . 2.648 1.772 3.524 . . . . . A . 19 CYS HA . . A . 19 CYS HB2 . A . 19 . HA . . . A . 19 . HB2 . . c30226_5ug5 1 454 1 . . 1 1 19 19 CYS HA H . . . 1 1 19 19 CYS HB3 H . . . . . 2.845 1.833 3.857 . . . . . A . 19 CYS HA . . A . 19 CYS HB3 . A . 19 . HA . . . A . 19 . HB1 . . c30226_5ug5 1 455 1 . . 1 1 8 8 ASN HB2 H . . . 1 1 11 11 CYS HB2 H . . . . . 2.695 1.787 3.603 . . . . . A . 8 ASN HB2 . . A . 11 CYS HB2 . A . 8 . HB2 . . . A . 11 . HB2 . . c30226_5ug5 1 456 1 . . 1 1 10 10 ALA HA H . . . 1 1 13 13 TYR HB2 H . . . . . 2.643 1.770 3.516 . . . . . A . 10 ALA HA . . A . 13 TYR HB2 . A . 10 . HA . . . A . 13 . HB2 . . c30226_5ug5 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 c30226_5ug5 1 2 2 12 7 12 7 c30226_5ug5 1 3 3 22 7 22 7 c30226_5ug5 1 4 4 32 7 32 7 c30226_5ug5 1 5 5 42 7 42 7 c30226_5ug5 1 6 6 52 7 52 7 c30226_5ug5 1 7 7 62 7 62 7 c30226_5ug5 1 8 8 72 7 72 7 c30226_5ug5 1 9 9 82 7 82 7 c30226_5ug5 1 10 11 92 7 92 7 c30226_5ug5 1 11 12 102 7 102 7 c30226_5ug5 1 12 13 112 7 112 7 c30226_5ug5 1 13 14 122 7 122 7 c30226_5ug5 1 14 15 132 7 132 7 c30226_5ug5 1 15 16 142 7 142 7 c30226_5ug5 1 16 17 152 7 152 7 c30226_5ug5 1 17 18 162 7 162 7 c30226_5ug5 1 18 19 172 7 172 7 c30226_5ug5 1 19 20 182 7 182 7 c30226_5ug5 1 20 21 192 7 192 7 c30226_5ug5 1 21 22 202 7 202 7 c30226_5ug5 1 22 25 212 7 212 7 c30226_5ug5 1 23 26 222 7 222 7 c30226_5ug5 1 24 27 232 7 232 7 c30226_5ug5 1 25 29 242 7 242 7 c30226_5ug5 1 26 31 252 7 252 7 c30226_5ug5 1 27 32 262 7 262 7 c30226_5ug5 1 28 33 272 7 272 7 c30226_5ug5 1 29 34 282 7 282 7 c30226_5ug5 1 30 35 292 7 292 7 c30226_5ug5 1 31 36 302 7 302 7 c30226_5ug5 1 32 39 312 7 312 7 c30226_5ug5 1 33 40 322 7 322 7 c30226_5ug5 1 34 42 332 7 332 7 c30226_5ug5 1 35 43 342 7 342 7 c30226_5ug5 1 36 45 352 7 352 7 c30226_5ug5 1 37 46 362 7 362 7 c30226_5ug5 1 38 47 372 7 372 7 c30226_5ug5 1 39 48 382 7 382 7 c30226_5ug5 1 40 49 392 7 392 7 c30226_5ug5 1 41 50 402 7 402 7 c30226_5ug5 1 42 51 412 7 412 7 c30226_5ug5 1 43 52 422 7 422 7 c30226_5ug5 1 44 53 432 7 432 7 c30226_5ug5 1 45 54 442 7 442 7 c30226_5ug5 1 46 58 452 7 452 7 c30226_5ug5 1 47 59 462 7 462 7 c30226_5ug5 1 48 60 472 7 472 7 c30226_5ug5 1 49 62 482 7 482 7 c30226_5ug5 1 50 65 492 7 492 7 c30226_5ug5 1 51 67 502 7 502 7 c30226_5ug5 1 52 69 512 7 512 7 c30226_5ug5 1 53 70 522 7 522 7 c30226_5ug5 1 54 71 532 7 532 7 c30226_5ug5 1 55 72 542 7 542 7 c30226_5ug5 1 56 74 552 7 552 7 c30226_5ug5 1 57 76 562 7 562 7 c30226_5ug5 1 58 77 572 7 572 7 c30226_5ug5 1 59 78 582 7 582 7 c30226_5ug5 1 60 81 592 7 592 7 c30226_5ug5 1 61 82 602 7 602 7 c30226_5ug5 1 62 84 612 7 612 7 c30226_5ug5 1 63 85 622 7 622 7 c30226_5ug5 1 64 88 632 7 632 7 c30226_5ug5 1 65 89 642 7 642 7 c30226_5ug5 1 66 90 652 7 652 7 c30226_5ug5 1 67 92 662 7 662 7 c30226_5ug5 1 68 93 672 7 672 7 c30226_5ug5 1 69 94 682 7 682 7 c30226_5ug5 1 70 95 692 7 692 7 c30226_5ug5 1 71 97 702 7 702 7 c30226_5ug5 1 72 98 712 7 712 7 c30226_5ug5 1 73 99 722 7 722 7 c30226_5ug5 1 74 100 732 7 732 7 c30226_5ug5 1 75 102 742 7 742 7 c30226_5ug5 1 76 104 752 7 752 7 c30226_5ug5 1 77 105 762 7 762 7 c30226_5ug5 1 78 106 772 7 772 7 c30226_5ug5 1 79 107 782 7 782 7 c30226_5ug5 1 80 108 792 7 792 7 c30226_5ug5 1 81 109 802 7 802 7 c30226_5ug5 1 82 110 812 7 812 7 c30226_5ug5 1 83 112 822 7 822 7 c30226_5ug5 1 84 113 832 7 832 7 c30226_5ug5 1 85 115 842 7 842 7 c30226_5ug5 1 86 117 852 7 852 7 c30226_5ug5 1 87 118 862 7 862 7 c30226_5ug5 1 88 119 872 7 872 7 c30226_5ug5 1 89 120 882 7 882 7 c30226_5ug5 1 90 121 892 7 892 7 c30226_5ug5 1 91 122 902 7 902 7 c30226_5ug5 1 92 123 912 7 912 7 c30226_5ug5 1 93 124 922 7 922 7 c30226_5ug5 1 94 125 932 7 932 7 c30226_5ug5 1 95 126 942 7 942 7 c30226_5ug5 1 96 127 952 7 952 7 c30226_5ug5 1 97 128 962 7 962 7 c30226_5ug5 1 98 130 972 7 972 7 c30226_5ug5 1 99 131 982 7 982 7 c30226_5ug5 1 100 132 992 7 992 7 c30226_5ug5 1 101 133 1002 7 1002 7 c30226_5ug5 1 102 134 1012 7 1012 7 c30226_5ug5 1 103 136 1022 7 1022 7 c30226_5ug5 1 104 137 1032 7 1032 7 c30226_5ug5 1 105 139 1042 7 1042 7 c30226_5ug5 1 106 140 1052 7 1052 7 c30226_5ug5 1 107 141 1062 7 1062 7 c30226_5ug5 1 108 142 1072 7 1072 7 c30226_5ug5 1 109 143 1082 7 1082 7 c30226_5ug5 1 110 144 1092 7 1092 7 c30226_5ug5 1 111 145 1102 7 1102 7 c30226_5ug5 1 112 146 1112 7 1112 7 c30226_5ug5 1 113 147 1122 7 1122 7 c30226_5ug5 1 114 148 1132 7 1132 7 c30226_5ug5 1 115 149 1142 7 1142 7 c30226_5ug5 1 116 151 1152 7 1152 7 c30226_5ug5 1 117 152 1162 7 1162 7 c30226_5ug5 1 118 154 1172 7 1172 7 c30226_5ug5 1 119 155 1182 7 1182 7 c30226_5ug5 1 120 156 1192 7 1192 7 c30226_5ug5 1 121 157 1202 7 1202 7 c30226_5ug5 1 122 158 1212 7 1212 7 c30226_5ug5 1 123 159 1222 7 1222 7 c30226_5ug5 1 124 160 1232 7 1232 7 c30226_5ug5 1 125 162 1242 7 1242 7 c30226_5ug5 1 126 163 1252 7 1252 7 c30226_5ug5 1 127 164 1262 7 1262 7 c30226_5ug5 1 128 165 1272 7 1272 7 c30226_5ug5 1 129 167 1282 7 1282 7 c30226_5ug5 1 130 168 1292 7 1292 7 c30226_5ug5 1 131 170 1302 7 1302 7 c30226_5ug5 1 132 172 1312 7 1312 7 c30226_5ug5 1 133 173 1322 7 1322 7 c30226_5ug5 1 134 174 1332 7 1332 7 c30226_5ug5 1 135 175 1342 7 1342 7 c30226_5ug5 1 136 176 1352 7 1352 7 c30226_5ug5 1 137 178 1362 7 1362 7 c30226_5ug5 1 138 179 1372 7 1372 7 c30226_5ug5 1 139 180 1382 7 1382 7 c30226_5ug5 1 140 181 1392 7 1392 7 c30226_5ug5 1 141 182 1402 7 1402 7 c30226_5ug5 1 142 183 1412 7 1412 7 c30226_5ug5 1 143 183 1420 5 1420 5 c30226_5ug5 1 144 183 1426 5 1426 5 c30226_5ug5 1 145 184 1434 7 1434 7 c30226_5ug5 1 146 185 1444 7 1444 7 c30226_5ug5 1 147 186 1454 7 1454 7 c30226_5ug5 1 148 187 1464 7 1464 7 c30226_5ug5 1 149 188 1474 7 1474 7 c30226_5ug5 1 150 189 1484 7 1484 7 c30226_5ug5 1 151 190 1494 7 1494 7 c30226_5ug5 1 152 191 1504 7 1504 7 c30226_5ug5 1 153 192 1514 7 1514 7 c30226_5ug5 1 154 193 1524 7 1524 7 c30226_5ug5 1 155 194 1534 7 1534 7 c30226_5ug5 1 156 195 1544 7 1544 7 c30226_5ug5 1 157 196 1554 7 1554 7 c30226_5ug5 1 158 197 1564 7 1564 7 c30226_5ug5 1 159 198 1574 7 1574 7 c30226_5ug5 1 160 199 1584 7 1584 7 c30226_5ug5 1 161 200 1594 7 1594 7 c30226_5ug5 1 162 202 1604 7 1604 7 c30226_5ug5 1 163 203 1614 7 1614 7 c30226_5ug5 1 164 204 1624 7 1624 7 c30226_5ug5 1 165 205 1634 7 1634 7 c30226_5ug5 1 166 206 1644 7 1644 7 c30226_5ug5 1 167 207 1654 7 1654 7 c30226_5ug5 1 168 208 1664 7 1664 7 c30226_5ug5 1 169 209 1674 7 1674 7 c30226_5ug5 1 170 211 1684 7 1684 7 c30226_5ug5 1 171 212 1694 7 1694 7 c30226_5ug5 1 172 213 1704 7 1704 7 c30226_5ug5 1 173 215 1714 7 1714 7 c30226_5ug5 1 174 216 1724 7 1724 7 c30226_5ug5 1 175 218 1734 7 1734 7 c30226_5ug5 1 176 219 1744 7 1744 7 c30226_5ug5 1 177 221 1754 7 1754 7 c30226_5ug5 1 178 223 1764 7 1764 7 c30226_5ug5 1 179 224 1774 7 1774 7 c30226_5ug5 1 180 225 1784 7 1784 7 c30226_5ug5 1 181 226 1794 7 1794 7 c30226_5ug5 1 182 227 1804 7 1804 7 c30226_5ug5 1 183 229 1814 7 1814 7 c30226_5ug5 1 184 231 1824 7 1824 7 c30226_5ug5 1 185 232 1834 7 1834 7 c30226_5ug5 1 186 234 1844 7 1844 7 c30226_5ug5 1 187 235 1854 7 1854 7 c30226_5ug5 1 188 236 1864 7 1864 7 c30226_5ug5 1 189 239 1874 7 1874 7 c30226_5ug5 1 190 240 1884 7 1884 7 c30226_5ug5 1 191 243 1894 7 1894 7 c30226_5ug5 1 192 244 1904 7 1904 7 c30226_5ug5 1 193 246 1914 7 1914 7 c30226_5ug5 1 194 248 1924 7 1924 7 c30226_5ug5 1 195 249 1934 7 1934 7 c30226_5ug5 1 196 250 1944 7 1944 7 c30226_5ug5 1 197 251 1954 7 1954 7 c30226_5ug5 1 198 252 1964 7 1964 7 c30226_5ug5 1 199 253 1974 7 1974 7 c30226_5ug5 1 200 254 1984 7 1984 7 c30226_5ug5 1 201 255 1994 7 1994 7 c30226_5ug5 1 202 257 2004 7 2004 7 c30226_5ug5 1 203 258 2014 7 2014 7 c30226_5ug5 1 204 260 2024 7 2024 7 c30226_5ug5 1 205 262 2034 7 2034 7 c30226_5ug5 1 206 263 2044 7 2044 7 c30226_5ug5 1 207 264 2054 7 2054 7 c30226_5ug5 1 208 265 2064 7 2064 7 c30226_5ug5 1 209 266 2074 7 2074 7 c30226_5ug5 1 210 267 2084 7 2084 7 c30226_5ug5 1 211 268 2094 7 2094 7 c30226_5ug5 1 212 270 2104 7 2104 7 c30226_5ug5 1 213 271 2114 7 2114 7 c30226_5ug5 1 214 272 2124 7 2124 7 c30226_5ug5 1 215 273 2134 7 2134 7 c30226_5ug5 1 216 274 2144 7 2144 7 c30226_5ug5 1 217 275 2154 7 2154 7 c30226_5ug5 1 218 276 2164 7 2164 7 c30226_5ug5 1 219 278 2174 7 2174 7 c30226_5ug5 1 220 279 2184 7 2184 7 c30226_5ug5 1 221 280 2194 7 2194 7 c30226_5ug5 1 222 284 2204 7 2204 7 c30226_5ug5 1 223 285 2214 7 2214 7 c30226_5ug5 1 224 287 2224 7 2224 7 c30226_5ug5 1 225 288 2234 7 2234 7 c30226_5ug5 1 226 289 2244 7 2244 7 c30226_5ug5 1 227 290 2254 7 2254 7 c30226_5ug5 1 228 292 2264 7 2264 7 c30226_5ug5 1 229 293 2274 7 2274 7 c30226_5ug5 1 230 294 2284 7 2284 7 c30226_5ug5 1 231 296 2294 7 2294 7 c30226_5ug5 1 232 297 2304 7 2304 7 c30226_5ug5 1 233 298 2314 7 2314 7 c30226_5ug5 1 234 299 2324 7 2324 7 c30226_5ug5 1 235 301 2334 7 2334 7 c30226_5ug5 1 236 304 2344 7 2344 7 c30226_5ug5 1 237 305 2354 7 2354 7 c30226_5ug5 1 238 306 2364 7 2364 7 c30226_5ug5 1 239 307 2374 7 2374 7 c30226_5ug5 1 240 310 2384 7 2384 7 c30226_5ug5 1 241 311 2394 7 2394 7 c30226_5ug5 1 242 312 2404 7 2404 7 c30226_5ug5 1 243 313 2414 7 2414 7 c30226_5ug5 1 244 314 2424 7 2424 7 c30226_5ug5 1 245 316 2434 7 2434 7 c30226_5ug5 1 246 318 2444 7 2444 7 c30226_5ug5 1 247 319 2454 7 2454 7 c30226_5ug5 1 248 320 2464 7 2464 7 c30226_5ug5 1 249 321 2474 7 2474 7 c30226_5ug5 1 250 322 2484 7 2484 7 c30226_5ug5 1 251 325 2494 7 2494 7 c30226_5ug5 1 252 326 2504 7 2504 7 c30226_5ug5 1 253 328 2514 7 2514 7 c30226_5ug5 1 254 329 2524 7 2524 7 c30226_5ug5 1 255 330 2534 7 2534 7 c30226_5ug5 1 256 331 2544 7 2544 7 c30226_5ug5 1 257 332 2554 7 2554 7 c30226_5ug5 1 258 334 2564 7 2564 7 c30226_5ug5 1 259 335 2574 7 2574 7 c30226_5ug5 1 260 336 2584 7 2584 7 c30226_5ug5 1 261 337 2594 7 2594 7 c30226_5ug5 1 262 338 2604 7 2604 7 c30226_5ug5 1 263 339 2614 7 2614 7 c30226_5ug5 1 264 340 2624 7 2624 7 c30226_5ug5 1 265 342 2634 7 2634 7 c30226_5ug5 1 266 343 2644 7 2644 7 c30226_5ug5 1 267 344 2654 7 2654 7 c30226_5ug5 1 268 345 2664 7 2664 7 c30226_5ug5 1 269 347 2674 7 2674 7 c30226_5ug5 1 270 348 2684 7 2684 7 c30226_5ug5 1 271 349 2694 7 2694 7 c30226_5ug5 1 272 350 2704 7 2704 7 c30226_5ug5 1 273 351 2714 7 2714 7 c30226_5ug5 1 274 352 2724 7 2724 7 c30226_5ug5 1 275 353 2734 7 2734 7 c30226_5ug5 1 276 353 2742 5 2742 5 c30226_5ug5 1 277 354 2750 7 2750 7 c30226_5ug5 1 278 355 2760 7 2760 7 c30226_5ug5 1 279 356 2770 7 2770 7 c30226_5ug5 1 280 357 2780 7 2780 7 c30226_5ug5 1 281 358 2790 7 2790 7 c30226_5ug5 1 282 359 2800 7 2800 7 c30226_5ug5 1 283 360 2810 7 2810 7 c30226_5ug5 1 284 361 2820 7 2820 7 c30226_5ug5 1 285 362 2830 7 2830 7 c30226_5ug5 1 286 363 2840 7 2840 7 c30226_5ug5 1 287 364 2850 7 2850 7 c30226_5ug5 1 288 365 2860 7 2860 7 c30226_5ug5 1 289 366 2870 7 2870 7 c30226_5ug5 1 290 367 2880 7 2880 7 c30226_5ug5 1 291 368 2890 7 2890 7 c30226_5ug5 1 292 369 2900 7 2900 7 c30226_5ug5 1 293 370 2910 7 2910 7 c30226_5ug5 1 294 371 2920 7 2920 7 c30226_5ug5 1 295 372 2930 7 2930 7 c30226_5ug5 1 296 373 2940 7 2940 7 c30226_5ug5 1 297 374 2950 7 2950 7 c30226_5ug5 1 298 375 2960 7 2960 7 c30226_5ug5 1 299 376 2970 7 2970 7 c30226_5ug5 1 300 377 2980 7 2980 7 c30226_5ug5 1 301 378 2990 7 2990 7 c30226_5ug5 1 302 379 3000 7 3000 7 c30226_5ug5 1 303 380 3010 7 3010 7 c30226_5ug5 1 304 381 3020 7 3020 7 c30226_5ug5 1 305 382 3030 7 3030 7 c30226_5ug5 1 306 383 3040 7 3040 7 c30226_5ug5 1 307 384 3050 7 3050 7 c30226_5ug5 1 308 385 3060 7 3060 7 c30226_5ug5 1 309 387 3070 7 3070 7 c30226_5ug5 1 310 389 3080 7 3080 7 c30226_5ug5 1 311 390 3090 7 3090 7 c30226_5ug5 1 312 394 3100 7 3100 7 c30226_5ug5 1 313 397 3110 7 3110 7 c30226_5ug5 1 314 399 3120 7 3120 7 c30226_5ug5 1 315 400 3130 7 3130 7 c30226_5ug5 1 316 404 3140 7 3140 7 c30226_5ug5 1 317 405 3150 7 3150 7 c30226_5ug5 1 318 406 3160 7 3160 7 c30226_5ug5 1 319 408 3170 7 3170 7 c30226_5ug5 1 320 409 3180 7 3180 7 c30226_5ug5 1 321 411 3190 7 3190 7 c30226_5ug5 1 322 412 3200 7 3200 7 c30226_5ug5 1 323 413 3210 7 3210 7 c30226_5ug5 1 324 414 3220 7 3220 7 c30226_5ug5 1 325 415 3230 7 3230 7 c30226_5ug5 1 326 416 3240 7 3240 7 c30226_5ug5 1 327 417 3250 7 3250 7 c30226_5ug5 1 328 418 3260 7 3260 7 c30226_5ug5 1 329 419 3270 7 3270 7 c30226_5ug5 1 330 420 3280 7 3280 7 c30226_5ug5 1 331 421 3290 7 3290 7 c30226_5ug5 1 332 422 3300 7 3300 7 c30226_5ug5 1 333 423 3310 7 3310 7 c30226_5ug5 1 334 425 3320 7 3320 7 c30226_5ug5 1 335 426 3330 7 3330 7 c30226_5ug5 1 336 427 3340 7 3340 7 c30226_5ug5 1 337 428 3350 7 3350 7 c30226_5ug5 1 338 429 3360 7 3360 7 c30226_5ug5 1 339 430 3370 7 3370 7 c30226_5ug5 1 340 431 3380 7 3380 7 c30226_5ug5 1 341 432 3390 7 3390 7 c30226_5ug5 1 342 433 3400 7 3400 7 c30226_5ug5 1 343 434 3410 7 3410 7 c30226_5ug5 1 344 435 3420 7 3420 7 c30226_5ug5 1 345 436 3430 7 3430 7 c30226_5ug5 1 346 437 3440 7 3440 7 c30226_5ug5 1 347 438 3450 7 3450 7 c30226_5ug5 1 348 440 3460 7 3460 7 c30226_5ug5 1 349 442 3470 7 3470 7 c30226_5ug5 1 350 443 3480 7 3480 7 c30226_5ug5 1 351 444 3490 7 3490 7 c30226_5ug5 1 352 445 3500 7 3500 7 c30226_5ug5 1 353 446 3510 7 3510 7 c30226_5ug5 1 354 447 3520 7 3520 7 c30226_5ug5 1 355 448 3530 7 3530 7 c30226_5ug5 1 356 449 3540 7 3540 7 c30226_5ug5 1 357 450 3550 7 3550 7 c30226_5ug5 1 358 451 3560 7 3560 7 c30226_5ug5 1 359 452 3570 7 3570 7 c30226_5ug5 1 360 453 3580 7 3580 7 c30226_5ug5 1 361 454 3590 7 3590 7 c30226_5ug5 1 362 455 3600 7 3600 7 c30226_5ug5 1 363 456 3610 7 3610 7 c30226_5ug5 1 364 457 3620 7 3620 7 c30226_5ug5 1 365 458 3630 7 3630 7 c30226_5ug5 1 366 459 3640 7 3640 7 c30226_5ug5 1 367 460 3650 7 3650 7 c30226_5ug5 1 368 461 3660 7 3660 7 c30226_5ug5 1 369 462 3670 7 3670 7 c30226_5ug5 1 370 463 3680 7 3680 7 c30226_5ug5 1 371 464 3690 7 3690 7 c30226_5ug5 1 372 465 3700 7 3700 7 c30226_5ug5 1 373 466 3710 7 3710 7 c30226_5ug5 1 374 467 3720 7 3720 7 c30226_5ug5 1 375 468 3730 7 3730 7 c30226_5ug5 1 376 469 3740 7 3740 7 c30226_5ug5 1 377 470 3750 7 3750 7 c30226_5ug5 1 378 471 3760 7 3760 7 c30226_5ug5 1 379 472 3770 7 3770 7 c30226_5ug5 1 380 475 3780 7 3780 7 c30226_5ug5 1 381 478 3790 7 3790 7 c30226_5ug5 1 382 482 3800 7 3800 7 c30226_5ug5 1 383 484 3810 7 3810 7 c30226_5ug5 1 384 485 3820 7 3820 7 c30226_5ug5 1 385 486 3830 7 3830 7 c30226_5ug5 1 386 487 3840 7 3840 7 c30226_5ug5 1 387 488 3850 7 3850 7 c30226_5ug5 1 388 489 3860 7 3860 7 c30226_5ug5 1 389 490 3870 7 3870 7 c30226_5ug5 1 390 492 3880 7 3880 7 c30226_5ug5 1 391 493 3890 7 3890 7 c30226_5ug5 1 392 494 3900 7 3900 7 c30226_5ug5 1 393 495 3910 7 3910 7 c30226_5ug5 1 394 496 3920 7 3920 7 c30226_5ug5 1 395 497 3930 7 3930 7 c30226_5ug5 1 396 498 3940 7 3940 7 c30226_5ug5 1 397 499 3950 7 3950 7 c30226_5ug5 1 398 500 3960 7 3960 7 c30226_5ug5 1 399 501 3970 7 3970 7 c30226_5ug5 1 400 502 3980 7 3980 7 c30226_5ug5 1 401 503 3990 7 3990 7 c30226_5ug5 1 402 504 4000 7 4000 7 c30226_5ug5 1 403 505 4010 7 4010 7 c30226_5ug5 1 404 506 4020 7 4020 7 c30226_5ug5 1 405 507 4030 7 4030 7 c30226_5ug5 1 406 508 4040 7 4040 7 c30226_5ug5 1 407 509 4050 7 4050 7 c30226_5ug5 1 408 510 4060 7 4060 7 c30226_5ug5 1 409 511 4070 7 4070 7 c30226_5ug5 1 410 512 4080 7 4080 7 c30226_5ug5 1 411 513 4090 7 4090 7 c30226_5ug5 1 412 514 4100 7 4100 7 c30226_5ug5 1 413 515 4110 7 4110 7 c30226_5ug5 1 414 516 4120 7 4120 7 c30226_5ug5 1 415 517 4130 7 4130 7 c30226_5ug5 1 416 518 4140 7 4140 7 c30226_5ug5 1 417 519 4150 7 4150 7 c30226_5ug5 1 418 521 4160 7 4160 7 c30226_5ug5 1 419 522 4170 7 4170 7 c30226_5ug5 1 420 523 4180 7 4180 7 c30226_5ug5 1 421 524 4190 7 4190 7 c30226_5ug5 1 422 525 4200 7 4200 7 c30226_5ug5 1 423 526 4210 7 4210 7 c30226_5ug5 1 424 527 4220 7 4220 7 c30226_5ug5 1 425 528 4230 7 4230 7 c30226_5ug5 1 426 529 4240 7 4240 7 c30226_5ug5 1 427 530 4250 7 4250 7 c30226_5ug5 1 428 531 4260 7 4260 7 c30226_5ug5 1 429 532 4270 7 4270 7 c30226_5ug5 1 430 533 4280 7 4280 7 c30226_5ug5 1 431 534 4290 7 4290 7 c30226_5ug5 1 432 535 4300 7 4300 7 c30226_5ug5 1 433 535 4308 5 4308 5 c30226_5ug5 1 434 536 4316 7 4316 7 c30226_5ug5 1 435 537 4326 7 4326 7 c30226_5ug5 1 436 540 4336 7 4336 7 c30226_5ug5 1 437 540 4344 5 4344 5 c30226_5ug5 1 438 541 4352 7 4352 7 c30226_5ug5 1 439 542 4362 7 4362 7 c30226_5ug5 1 440 544 4372 7 4372 7 c30226_5ug5 1 441 545 4382 7 4382 7 c30226_5ug5 1 442 546 4392 7 4392 7 c30226_5ug5 1 443 547 4402 7 4402 7 c30226_5ug5 1 444 548 4412 7 4412 7 c30226_5ug5 1 445 549 4422 7 4422 7 c30226_5ug5 1 446 550 4432 7 4432 7 c30226_5ug5 1 447 551 4442 7 4442 7 c30226_5ug5 1 448 552 4452 7 4452 7 c30226_5ug5 1 449 553 4462 7 4462 7 c30226_5ug5 1 450 555 4472 7 4472 7 c30226_5ug5 1 451 556 4482 7 4482 7 c30226_5ug5 1 452 557 4492 7 4492 7 c30226_5ug5 1 453 558 4502 7 4502 7 c30226_5ug5 1 454 559 4512 7 4512 7 c30226_5ug5 1 455 561 4522 7 4522 7 c30226_5ug5 1 456 563 4532 7 4532 7 c30226_5ug5 1 457 566 4542 7 4542 7 c30226_5ug5 1 458 568 4552 7 4552 7 c30226_5ug5 1 459 569 4562 7 4562 7 c30226_5ug5 1 460 570 4572 7 4572 7 c30226_5ug5 1 461 571 4582 7 4582 7 c30226_5ug5 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 2: d8restraints' 1 1 1 33 c30226_5ug5 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 c30226_5ug5 _Gen_dist_constraint_list.ID 1 _Gen_dist_constraint_list.Constraint_type 'hydrogen bond' _Gen_dist_constraint_list.Details 'Generated by Wattos' _Gen_dist_constraint_list.Constraint_file_ID 1 _Gen_dist_constraint_list.Block_ID 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 . . . . c30226_5ug5 2 stop_ loop_ _Gen_dist_constraint.ID _Gen_dist_constraint.Member_ID _Gen_dist_constraint.Member_logic_code _Gen_dist_constraint.Assembly_atom_ID_1 _Gen_dist_constraint.Entity_assembly_ID_1 _Gen_dist_constraint.Entity_ID_1 _Gen_dist_constraint.Comp_index_ID_1 _Gen_dist_constraint.Seq_ID_1 _Gen_dist_constraint.Comp_ID_1 _Gen_dist_constraint.Atom_ID_1 _Gen_dist_constraint.Atom_type_1 _Gen_dist_constraint.Atom_isotope_number_1 _Gen_dist_constraint.Resonance_ID_1 _Gen_dist_constraint.Assembly_atom_ID_2 _Gen_dist_constraint.Entity_assembly_ID_2 _Gen_dist_constraint.Entity_ID_2 _Gen_dist_constraint.Comp_index_ID_2 _Gen_dist_constraint.Seq_ID_2 _Gen_dist_constraint.Comp_ID_2 _Gen_dist_constraint.Atom_ID_2 _Gen_dist_constraint.Atom_type_2 _Gen_dist_constraint.Atom_isotope_number_2 _Gen_dist_constraint.Resonance_ID_2 _Gen_dist_constraint.Intensity_val _Gen_dist_constraint.Intensity_lower_val_err _Gen_dist_constraint.Intensity_upper_val_err _Gen_dist_constraint.Distance_val _Gen_dist_constraint.Distance_lower_bound_val _Gen_dist_constraint.Distance_upper_bound_val _Gen_dist_constraint.Contribution_fractional_val _Gen_dist_constraint.Spectral_peak_ID _Gen_dist_constraint.Spectral_peak_list_ID _Gen_dist_constraint.PDB_record_ID_1 _Gen_dist_constraint.PDB_model_num_1 _Gen_dist_constraint.PDB_strand_ID_1 _Gen_dist_constraint.PDB_ins_code_1 _Gen_dist_constraint.PDB_residue_no_1 _Gen_dist_constraint.PDB_residue_name_1 _Gen_dist_constraint.PDB_atom_name_1 _Gen_dist_constraint.PDB_record_ID_2 _Gen_dist_constraint.PDB_model_num_2 _Gen_dist_constraint.PDB_strand_ID_2 _Gen_dist_constraint.PDB_ins_code_2 _Gen_dist_constraint.PDB_residue_no_2 _Gen_dist_constraint.PDB_residue_name_2 _Gen_dist_constraint.PDB_atom_name_2 _Gen_dist_constraint.Auth_entity_assembly_ID_1 _Gen_dist_constraint.Auth_asym_ID_1 _Gen_dist_constraint.Auth_chain_ID_1 _Gen_dist_constraint.Auth_seq_ID_1 _Gen_dist_constraint.Auth_comp_ID_1 _Gen_dist_constraint.Auth_atom_ID_1 _Gen_dist_constraint.Auth_alt_ID_1 _Gen_dist_constraint.Auth_atom_name_1 _Gen_dist_constraint.Auth_entity_assembly_ID_2 _Gen_dist_constraint.Auth_asym_ID_2 _Gen_dist_constraint.Auth_chain_ID_2 _Gen_dist_constraint.Auth_seq_ID_2 _Gen_dist_constraint.Auth_comp_ID_2 _Gen_dist_constraint.Auth_atom_ID_2 _Gen_dist_constraint.Auth_alt_ID_2 _Gen_dist_constraint.Auth_atom_name_2 _Gen_dist_constraint.Entry_ID _Gen_dist_constraint.Gen_dist_constraint_list_ID 1 1 . . 1 1 11 11 CYS H H . . . 1 1 8 8 ASN O O . . . . . 2.2 1.73 2.7 . . . . . A . 11 CYS H . . A . 8 ASN O . A . 11 . HN . . . A . 8 . O . . c30226_5ug5 2 2 1 . . 1 1 13 13 TYR H H . . . 1 1 9 9 PRO O O . . . . . 2.2 1.73 2.7 . . . . . A . 13 TYR H . . A . 9 PRO O . A . 13 . HN . . . A . 9 . O . . c30226_5ug5 2 3 1 . . 1 1 15 15 ASN H H . . . 1 1 11 11 CYS O O . . . . . 2.2 1.73 2.7 . . . . . A . 15 ASN H . . A . 11 CYS O . A . 15 . HN . . . A . 11 . O . . c30226_5ug5 2 stop_ loop_ _Gen_dist_constraint_parse_err.ID _Gen_dist_constraint_parse_err.Content _Gen_dist_constraint_parse_err.Begin_line _Gen_dist_constraint_parse_err.Begin_column _Gen_dist_constraint_parse_err.End_line _Gen_dist_constraint_parse_err.End_column _Gen_dist_constraint_parse_err.Entry_ID _Gen_dist_constraint_parse_err.Gen_dist_constraint_list_ID 1 '# Restraints file 1: D8hbondsrestraints' 1 1 1 39 c30226_5ug5 2 stop_ save_ save_CNS/XPLOR_dihedral_4 _Torsion_angle_constraint_list.Sf_category torsion_angle_constraints _Torsion_angle_constraint_list.Sf_framecode CNS/XPLOR_dihedral_4 _Torsion_angle_constraint_list.Entry_ID c30226_5ug5 _Torsion_angle_constraint_list.ID 1 _Torsion_angle_constraint_list.Details 'Generated by Wattos' _Torsion_angle_constraint_list.Constraint_file_ID 1 _Torsion_angle_constraint_list.Block_ID 4 loop_ _Torsion_angle_constraint_software.Software_ID _Torsion_angle_constraint_software.Software_label _Torsion_angle_constraint_software.Method_ID _Torsion_angle_constraint_software.Method_label _Torsion_angle_constraint_software.Entry_ID _Torsion_angle_constraint_software.Torsion_angle_constraint_list_ID . . . . c30226_5ug5 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 . . c30226_5ug5 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 . . c30226_5ug5 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 . -90.2 -49.4 . . . A . 4 GLU C . . A . 5 CYS N . . A . 5 CYS CA . . A . 5 CYS C . . . 4 . C . . . . . 5 . N . . . . . 5 . CA . . . . . 5 . C . . c30226_5ug5 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 . -55.6 -3.8 . . . A . 5 CYS N . . A . 5 CYS CA . . A . 5 CYS C . . A . 6 CYS N . . . 5 . N . . . . . 5 . CA . . . . . 5 . C . . . . . 6 . N . . c30226_5ug5 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 . -124.2 -50.4 . . . A . 5 CYS C . . A . 6 CYS N . . A . 6 CYS CA . . A . 6 CYS C . . . 5 . C . . . . . 6 . N . . . . . 6 . CA . . . . . 6 . C . . c30226_5ug5 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 . -59.4 14.2 . . . A . 6 CYS N . . A . 6 CYS CA . . A . 6 CYS C . . A . 7 SER N . . . 6 . N . . . . . 6 . CA . . . . . 6 . C . . . . . 7 . N . . c30226_5ug5 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 . -111.4 -62.8 . . . A . 6 CYS C . . A . 7 SER N . . A . 7 SER CA . . A . 7 SER C . . . 6 . C . . . . . 7 . N . . . . . 7 . CA . . . . . 7 . C . . c30226_5ug5 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 . -60.8 33.0 . . . A . 7 SER N . . A . 7 SER CA . . A . 7 SER C . . A . 8 ASN N . . . 7 . N . . . . . 7 . CA . . . . . 7 . C . . . . . 8 . N . . c30226_5ug5 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 . . c30226_5ug5 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 . . c30226_5ug5 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 . -74.5 -34.5 . . . A . 8 ASN C . . A . 9 PRO N . . A . 9 PRO CA . . A . 9 PRO C . . . 8 . C . . . . . 9 . N . . . . . 9 . CA . . . . . 9 . C . . c30226_5ug5 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 ALA N N . -52.7 -12.7 . . . A . 9 PRO N . . A . 9 PRO CA . . A . 9 PRO C . . A . 10 ALA N . . . 9 . N . . . . . 9 . CA . . . . . 9 . C . . . . . 10 . N . . c30226_5ug5 1 13 . . 1 1 9 9 PRO C C . . 1 1 10 10 ALA N N . . 1 1 10 10 ALA CA C . . 1 1 10 10 ALA C C . -86.8 -46.8 . . . A . 9 PRO C . . A . 10 ALA N . . A . 10 ALA CA . . A . 10 ALA C . . . 9 . C . . . . . 10 . N . . . . . 10 . CA . . . . . 10 . C . . c30226_5ug5 1 14 . . 1 1 10 10 ALA N N . . 1 1 10 10 ALA CA C . . 1 1 10 10 ALA C C . . 1 1 11 11 CYS N N . -50.8 -3.8 . . . A . 10 ALA N . . A . 10 ALA CA . . A . 10 ALA C . . A . 11 CYS N . . . 10 . N . . . . . 10 . CA . . . . . 10 . C . . . . . 11 . N . . c30226_5ug5 1 15 . . 1 1 10 10 ALA C C . . 1 1 11 11 CYS N N . . 1 1 11 11 CYS CA C . . 1 1 11 11 CYS C C . -83.4 -43.4 . . . A . 10 ALA C . . A . 11 CYS N . . A . 11 CYS CA . . A . 11 CYS C . . . 10 . C . . . . . 11 . N . . . . . 11 . CA . . . . . 11 . C . . c30226_5ug5 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 . -60.1 -20.1 . . . A . 11 CYS N . . A . 11 CYS CA . . A . 11 CYS C . . A . 12 ARG N . . . 11 . N . . . . . 11 . CA . . . . . 11 . C . . . . . 12 . N . . c30226_5ug5 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 . -91.2 -38.2 . . . A . 11 CYS C . . A . 12 ARG N . . A . 12 ARG CA . . A . 12 ARG C . . . 11 . C . . . . . 12 . N . . . . . 12 . CA . . . . . 12 . C . . c30226_5ug5 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 TYR N N . -62.3 -22.3 . . . A . 12 ARG N . . A . 12 ARG CA . . A . 12 ARG C . . A . 13 TYR N . . . 12 . N . . . . . 12 . CA . . . . . 12 . C . . . . . 13 . N . . c30226_5ug5 1 19 . . 1 1 12 12 ARG C C . . 1 1 13 13 TYR N N . . 1 1 13 13 TYR CA C . . 1 1 13 13 TYR C C . -84.2 -44.2 . . . A . 12 ARG C . . A . 13 TYR N . . A . 13 TYR CA . . A . 13 TYR C . . . 12 . C . . . . . 13 . N . . . . . 13 . CA . . . . . 13 . C . . c30226_5ug5 1 20 . . 1 1 13 13 TYR N N . . 1 1 13 13 TYR CA C . . 1 1 13 13 TYR C C . . 1 1 14 14 ASN N N . -67.7 -2.1 . . . A . 13 TYR N . . A . 13 TYR CA . . A . 13 TYR C . . A . 14 ASN N . . . 13 . N . . . . . 13 . CA . . . . . 13 . C . . . . . 14 . N . . c30226_5ug5 1 21 . . 1 1 13 13 TYR C C . . 1 1 14 14 ASN N N . . 1 1 14 14 ASN CA C . . 1 1 14 14 ASN C C . -110.5 -67.1 . . . A . 13 TYR C . . A . 14 ASN N . . A . 14 ASN CA . . A . 14 ASN C . . . 13 . C . . . . . 14 . N . . . . . 14 . CA . . . . . 14 . C . . c30226_5ug5 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 . -41.7 34.3 . . . A . 14 ASN N . . A . 14 ASN CA . . A . 14 ASN C . . A . 15 ASN N . . . 14 . N . . . . . 14 . CA . . . . . 14 . C . . . . . 15 . N . . c30226_5ug5 1 23 . . 1 1 14 14 ASN C C . . 1 1 15 15 ASN N N . . 1 1 15 15 ASN CA C . . 1 1 15 15 ASN C C . -177.3 -56.1 . . . A . 14 ASN C . . A . 15 ASN N . . A . 15 ASN CA . . A . 15 ASN C . . . 14 . C . . . . . 15 . N . . . . . 15 . CA . . . . . 15 . C . . c30226_5ug5 1 24 . . 1 1 15 15 ASN N N . . 1 1 15 15 ASN CA C . . 1 1 15 15 ASN C C . . 1 1 16 16 HYP N N . 41.2 179.4 . . . A . 15 ASN N . . A . 15 ASN CA . . A . 15 ASN C . . A . 16 HYP N . . . 15 . N . . . . . 15 . CA . . . . . 15 . C . . . . . 16 . N . . c30226_5ug5 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 c30226_5ug5 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: design8talos.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 c30226_5ug5 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 c30226_5ug5 _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 5UG5 *TITLE NMR SOLUTION STRUCTURE OF THE ALPHA-CONOTOXIN GID MUTANT V13Y *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 (NACHRS), *KEYWDS 2 TOXIN *EXPDTA SOLUTION NMR *NUMMDL 20 *AUTHOR A.HUSSEIN,A.E.LEFFLER,A.KURYATOV,H.A.ZEBROSKI,S.R.POWELL,P.FILIPENKO, *AUTHOR 2 J.GORSON,A.HEIZMANN,S.LYSKOV,A.NICKE,J.LINDSTROM,B.RUDY,R.BONNEAU, *AUTHOR 3 M.HOLFORD,S.F.POGET *REVDAT 1 06-SEP-17 5UG5 0' save_