data_c30643_6pv2 save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID c30643_6pv2 _Entry.Title ; Backbone-modified variant of zinc finger 2 from the transcription factor Sp1 DNA binding domain: Orn in the metal-binding turn ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2019-07-19 _Entry.Accession_date 2019-07-19 _Entry.Last_release_date 2019-09-11 _Entry.Original_release_date 2019-09-11 _Entry.Origination author _Entry.Format_name . _Entry.NMR_STAR_version 3.2.6.0 _Entry.NMR_STAR_dict_location . _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype SOLUTION _Entry.Source_data_format . _Entry.Source_data_format_version . _Entry.Generated_software_name . _Entry.Generated_software_version . _Entry.Generated_software_ID . _Entry.Generated_software_label . _Entry.Generated_date . _Entry.DOI . _Entry.UUID . _Entry.Related_coordinate_file_name . _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_experimental_methods.ID _Entry_experimental_methods.Method _Entry_experimental_methods.Subtype _Entry_experimental_methods.Entry_ID 1 'SOLUTION NMR' 'SOLUTION NMR' c30643_6pv2 stop_ loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.ORCID _Entry_author.Entry_ID 1 S. Rao S. R. . . c30643_6pv2 2 W. Horne W. S. . . c30643_6pv2 stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID 'DNA BINDING PROTEIN' . c30643_6pv2 foldamer . c30643_6pv2 proteomimetic . c30643_6pv2 'zinc finger' . c30643_6pv2 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 c30643_6pv2 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '1H chemical shifts' 206 c30643_6pv2 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 . . 2020-06-19 . original BMRB . c30643_6pv2 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 6PV2 . c30643_6pv2 stop_ save_ save_citation_1 _Citation.Sf_category citations _Citation.Sf_framecode citation_1 _Citation.Entry_ID c30643_6pv2 _Citation.ID 1 _Citation.Name . _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.PubMed_ID . _Citation.DOI . _Citation.Full_citation . _Citation.Title ; Backbone-modified variant of zinc finger 2 from the transcription factor Sp1 DNA binding domain: Orn in the metal-binding turn ; _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 S. Rao S. R. . . c30643_6pv2 1 2 W. Horne W. S. . . c30643_6pv2 1 stop_ save_ save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID c30643_6pv2 _Assembly.ID 1 _Assembly.Name 'Transcription factor Sp1' _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 . . . . . . c30643_6pv2 1 2 'ZINC ION' 2 $entity_ZN B A no . . . . . . c30643_6pv2 1 stop_ loop_ _Bond.ID _Bond.Type _Bond.Value_order _Bond.Assembly_atom_ID_1 _Bond.Entity_assembly_ID_1 _Bond.Entity_assembly_name_1 _Bond.Entity_ID_1 _Bond.Comp_ID_1 _Bond.Comp_index_ID_1 _Bond.Seq_ID_1 _Bond.Atom_ID_1 _Bond.Assembly_atom_ID_2 _Bond.Entity_assembly_ID_2 _Bond.Entity_assembly_name_2 _Bond.Entity_ID_2 _Bond.Comp_ID_2 _Bond.Comp_index_ID_2 _Bond.Seq_ID_2 _Bond.Atom_ID_2 _Bond.Auth_entity_assembly_ID_1 _Bond.Auth_entity_assembly_name_1 _Bond.Auth_asym_ID_1 _Bond.Auth_seq_ID_1 _Bond.Auth_comp_ID_1 _Bond.Auth_atom_ID_1 _Bond.Auth_entity_assembly_ID_2 _Bond.Auth_entity_assembly_name_2 _Bond.Auth_asym_ID_2 _Bond.Auth_seq_ID_2 _Bond.Auth_comp_ID_2 _Bond.Auth_atom_ID_2 _Bond.Entry_ID _Bond.Assembly_ID 1 coordination single . 1 . 1 CYS 5 5 SG . 2 . 2 ZN 1 1 ZN . . . . . . . . . . . . c30643_6pv2 1 2 coordination single . 1 . 1 CYS 9 9 SG . 2 . 2 ZN 1 1 ZN . . . . . . . . . . . . c30643_6pv2 1 3 coordination single . 1 . 1 HIS 22 22 NE2 . 2 . 2 ZN 1 1 ZN . . . . . . . . . . . . c30643_6pv2 1 4 coordination single . 1 . 1 HIS 26 26 NE2 . 2 . 2 ZN 1 1 ZN . . . . . . . . . . . . c30643_6pv2 1 stop_ save_ save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID c30643_6pv2 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name entity_1 _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID A _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; RPFXCTWXCGKRFTRSDELQ RHKRTHTGEKX ; _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 31 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all other bound' _Entity.Src_method syn _Entity.Parent_entity_ID 1 _Entity.Fragment 'DNA-binding domain, zinc finger 2 residues 654-684' _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 3697.285 _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 . ARG . c30643_6pv2 1 2 . PRO . c30643_6pv2 1 3 . PHE . c30643_6pv2 1 4 . NLE . c30643_6pv2 1 5 . CYS . c30643_6pv2 1 6 . THR . c30643_6pv2 1 7 . TRP . c30643_6pv2 1 8 . ORN . c30643_6pv2 1 9 . CYS . c30643_6pv2 1 10 . GLY . c30643_6pv2 1 11 . LYS . c30643_6pv2 1 12 . ARG . c30643_6pv2 1 13 . PHE . c30643_6pv2 1 14 . THR . c30643_6pv2 1 15 . ARG . c30643_6pv2 1 16 . SER . c30643_6pv2 1 17 . ASP . c30643_6pv2 1 18 . GLU . c30643_6pv2 1 19 . LEU . c30643_6pv2 1 20 . GLN . c30643_6pv2 1 21 . ARG . c30643_6pv2 1 22 . HIS . c30643_6pv2 1 23 . LYS . c30643_6pv2 1 24 . ARG . c30643_6pv2 1 25 . THR . c30643_6pv2 1 26 . HIS . c30643_6pv2 1 27 . THR . c30643_6pv2 1 28 . GLY . c30643_6pv2 1 29 . GLU . c30643_6pv2 1 30 . LYS . c30643_6pv2 1 31 . NH2 . c30643_6pv2 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 . ARG 1 1 c30643_6pv2 1 . PRO 2 2 c30643_6pv2 1 . PHE 3 3 c30643_6pv2 1 . NLE 4 4 c30643_6pv2 1 . CYS 5 5 c30643_6pv2 1 . THR 6 6 c30643_6pv2 1 . TRP 7 7 c30643_6pv2 1 . ORN 8 8 c30643_6pv2 1 . CYS 9 9 c30643_6pv2 1 . GLY 10 10 c30643_6pv2 1 . LYS 11 11 c30643_6pv2 1 . ARG 12 12 c30643_6pv2 1 . PHE 13 13 c30643_6pv2 1 . THR 14 14 c30643_6pv2 1 . ARG 15 15 c30643_6pv2 1 . SER 16 16 c30643_6pv2 1 . ASP 17 17 c30643_6pv2 1 . GLU 18 18 c30643_6pv2 1 . LEU 19 19 c30643_6pv2 1 . GLN 20 20 c30643_6pv2 1 . ARG 21 21 c30643_6pv2 1 . HIS 22 22 c30643_6pv2 1 . LYS 23 23 c30643_6pv2 1 . ARG 24 24 c30643_6pv2 1 . THR 25 25 c30643_6pv2 1 . HIS 26 26 c30643_6pv2 1 . THR 27 27 c30643_6pv2 1 . GLY 28 28 c30643_6pv2 1 . GLU 29 29 c30643_6pv2 1 . LYS 30 30 c30643_6pv2 1 . NH2 31 31 c30643_6pv2 1 stop_ save_ save_entity_ZN _Entity.Sf_category entity _Entity.Sf_framecode entity_ZN _Entity.Entry_ID c30643_6pv2 _Entity.ID 2 _Entity.BMRB_code ZN _Entity.Name entity_ZN _Entity.Type non-polymer _Entity.Polymer_common_type . _Entity.Polymer_type . _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code . _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states . _Entity.Ambiguous_chem_comp_sites . _Entity.Nstd_monomer . _Entity.Nstd_chirality . _Entity.Nstd_linkage . _Entity.Nonpolymer_comp_ID ZN _Entity.Nonpolymer_comp_label $chem_comp_ZN _Entity.Number_of_monomers . _Entity.Number_of_nonpolymer_components 1 _Entity.Paramagnetic . _Entity.Thiol_state . _Entity.Src_method . _Entity.Parent_entity_ID 2 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 65.409 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_common_name.Name _Entity_common_name.Type _Entity_common_name.Entry_ID _Entity_common_name.Entity_ID 'ZINC ION' BMRB c30643_6pv2 2 stop_ loop_ _Entity_systematic_name.Name _Entity_systematic_name.Naming_system _Entity_systematic_name.Entry_ID _Entity_systematic_name.Entity_ID 'ZINC ION' BMRB c30643_6pv2 2 ZN 'Three letter code' c30643_6pv2 2 stop_ loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 1 ZN $chem_comp_ZN c30643_6pv2 2 stop_ save_ 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 c30643_6pv2 _Entity_natural_src_list.ID 1 loop_ _Entity_natural_src.ID _Entity_natural_src.Entity_ID _Entity_natural_src.Entity_label _Entity_natural_src.Entity_chimera_segment_ID _Entity_natural_src.NCBI_taxonomy_ID _Entity_natural_src.Type _Entity_natural_src.Common _Entity_natural_src.Organism_name_scientific _Entity_natural_src.Organism_name_common _Entity_natural_src.Organism_acronym _Entity_natural_src.ICTVdb_decimal_code _Entity_natural_src.Superkingdom _Entity_natural_src.Kingdom _Entity_natural_src.Genus _Entity_natural_src.Species _Entity_natural_src.Strain _Entity_natural_src.Variant _Entity_natural_src.Organ _Entity_natural_src.Tissue _Entity_natural_src.Tissue_fraction _Entity_natural_src.Cell_line _Entity_natural_src.Cell_type _Entity_natural_src.ATCC_number _Entity_natural_src.Organelle _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Details _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $entity_1 . 9606 organism . 'Homo sapiens' Human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . c30643_6pv2 1 stop_ save_ 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 c30643_6pv2 _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' . . . . . . . . . . . . . . . . c30643_6pv2 1 stop_ save_ save_chem_comp_NH2 _Chem_comp.Sf_category chem_comp _Chem_comp.Sf_framecode chem_comp_NH2 _Chem_comp.Entry_ID c30643_6pv2 _Chem_comp.ID NH2 _Chem_comp.Provenance PDB _Chem_comp.Name 'AMINO GROUP' _Chem_comp.Type NON-POLYMER _Chem_comp.BMRB_code NH2 _Chem_comp.PDB_code NH2 _Chem_comp.Ambiguous_flag yes _Chem_comp.Initial_date 2012-11-20 _Chem_comp.Modified_date 2012-11-20 _Chem_comp.Release_status REL _Chem_comp.Replaced_by . _Chem_comp.Replaces . _Chem_comp.One_letter_code . _Chem_comp.Three_letter_code NH2 _Chem_comp.Number_atoms_all 3 _Chem_comp.Number_atoms_nh 1 _Chem_comp.Atom_nomenclature_source . _Chem_comp.PubChem_code . _Chem_comp.Subcomponent_list . _Chem_comp.InChI_code InChI=1/H3N/h1H3 _Chem_comp.Mon_nstd_flag . _Chem_comp.Mon_nstd_class . _Chem_comp.Mon_nstd_details . _Chem_comp.Mon_nstd_parent . _Chem_comp.Mon_nstd_parent_comp_ID . _Chem_comp.Std_deriv_one_letter_code . _Chem_comp.Std_deriv_three_letter_code . _Chem_comp.Std_deriv_BMRB_code . _Chem_comp.Std_deriv_PDB_code . _Chem_comp.Std_deriv_chem_comp_name . _Chem_comp.Synonyms . _Chem_comp.Formal_charge 0 _Chem_comp.Paramagnetic . _Chem_comp.Aromatic no _Chem_comp.Formula 'H2 N' _Chem_comp.Formula_weight 16.023 _Chem_comp.Formula_mono_iso_wt_nat . _Chem_comp.Formula_mono_iso_wt_13C . _Chem_comp.Formula_mono_iso_wt_15N . _Chem_comp.Formula_mono_iso_wt_13C_15N . _Chem_comp.Image_file_name . _Chem_comp.Image_file_format . _Chem_comp.Topo_file_name . _Chem_comp.Topo_file_format . _Chem_comp.Struct_file_name . _Chem_comp.Struct_file_format . _Chem_comp.Stereochem_param_file_name . _Chem_comp.Stereochem_param_file_format . _Chem_comp.Model_details . _Chem_comp.Model_erf . _Chem_comp.Model_source . _Chem_comp.Model_coordinates_details . _Chem_comp.Model_coordinates_missing_flag no _Chem_comp.Ideal_coordinates_details 'OpenEye OEToolkits' _Chem_comp.Ideal_coordinates_missing_flag no _Chem_comp.Model_coordinates_db_code 2FLY _Chem_comp.Processing_site RCSB _Chem_comp.Vendor . _Chem_comp.Vendor_product_code . _Chem_comp.Details . _Chem_comp.DB_query_date . _Chem_comp.DB_last_query_revised_last_date . loop_ _Chem_comp_descriptor.Descriptor _Chem_comp_descriptor.Type _Chem_comp_descriptor.Program _Chem_comp_descriptor.Program_version _Chem_comp_descriptor.Entry_ID _Chem_comp_descriptor.Comp_ID InChI=1/H3N/h1H3 InChI InChI 1.02b c30643_6pv2 NH2 N SMILES ACDLabs 10.04 c30643_6pv2 NH2 QGZKDVFQNNGYKY-UHFFFAOYAF InChIKey InChI 1.02b c30643_6pv2 NH2 [NH2] SMILES CACTVS 3.341 c30643_6pv2 NH2 [NH2] SMILES 'OpenEye OEToolkits' 1.5.0 c30643_6pv2 NH2 [NH2] SMILES_CANONICAL CACTVS 3.341 c30643_6pv2 NH2 [NH2] SMILES_CANONICAL 'OpenEye OEToolkits' 1.5.0 c30643_6pv2 NH2 stop_ loop_ _Chem_comp_identifier.Identifier _Chem_comp_identifier.Type _Chem_comp_identifier.Program _Chem_comp_identifier.Program_version _Chem_comp_identifier.Entry_ID _Chem_comp_identifier.Comp_ID ammonia 'SYSTEMATIC NAME' ACDLabs 10.04 c30643_6pv2 NH2 l^{2}-azane 'SYSTEMATIC NAME' 'OpenEye OEToolkits' 1.5.0 c30643_6pv2 NH2 stop_ loop_ _Chem_comp_atom.Atom_ID _Chem_comp_atom.BMRB_code _Chem_comp_atom.PDB_atom_ID _Chem_comp_atom.Alt_atom_ID _Chem_comp_atom.Auth_atom_ID _Chem_comp_atom.Type_symbol _Chem_comp_atom.Isotope_number _Chem_comp_atom.Chirality _Chem_comp_atom.Stereo_config _Chem_comp_atom.Charge _Chem_comp_atom.Partial_charge _Chem_comp_atom.Oxidation_number _Chem_comp_atom.Unpaired_electron_number _Chem_comp_atom.Align _Chem_comp_atom.Aromatic_flag _Chem_comp_atom.Leaving_atom_flag _Chem_comp_atom.Substruct_code _Chem_comp_atom.Ionizable _Chem_comp_atom.Drawing_2D_coord_x _Chem_comp_atom.Drawing_2D_coord_y _Chem_comp_atom.Model_Cartn_x _Chem_comp_atom.Model_Cartn_x_esd _Chem_comp_atom.Model_Cartn_y _Chem_comp_atom.Model_Cartn_y_esd _Chem_comp_atom.Model_Cartn_z _Chem_comp_atom.Model_Cartn_z_esd _Chem_comp_atom.Model_Cartn_x_ideal _Chem_comp_atom.Model_Cartn_y_ideal _Chem_comp_atom.Model_Cartn_z_ideal _Chem_comp_atom.PDBX_ordinal _Chem_comp_atom.Details _Chem_comp_atom.Entry_ID _Chem_comp_atom.Comp_ID N N N N . N . . N 0 . . . 1 no no . . . . 10.091 . 8.978 . -7.810 . 0.000 0.000 0.000 1 . c30643_6pv2 NH2 HN1 HN1 HN1 1HN . H . . N 0 . . . 1 no no . . . . 9.517 . 8.769 . -7.044 . -0.385 -0.545 -0.771 2 . c30643_6pv2 NH2 HN2 HN2 HN2 2HN . H . . N 0 . . . 1 no no . . . . 10.323 . 9.890 . -8.082 . 1.020 0.000 0.000 3 . c30643_6pv2 NH2 stop_ loop_ _Chem_comp_bond.ID _Chem_comp_bond.Type _Chem_comp_bond.Value_order _Chem_comp_bond.Atom_ID_1 _Chem_comp_bond.Atom_ID_2 _Chem_comp_bond.Aromatic_flag _Chem_comp_bond.Stereo_config _Chem_comp_bond.Ordinal _Chem_comp_bond.Details _Chem_comp_bond.Entry_ID _Chem_comp_bond.Comp_ID 1 . SING N HN1 no N 1 . c30643_6pv2 NH2 2 . SING N HN2 no N 2 . c30643_6pv2 NH2 stop_ save_ save_chem_comp_NLE _Chem_comp.Sf_category chem_comp _Chem_comp.Sf_framecode chem_comp_NLE _Chem_comp.Entry_ID c30643_6pv2 _Chem_comp.ID NLE _Chem_comp.Provenance PDB _Chem_comp.Name NORLEUCINE _Chem_comp.Type 'L-PEPTIDE LINKING' _Chem_comp.BMRB_code NLE _Chem_comp.PDB_code NLE _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 L _Chem_comp.Three_letter_code NLE _Chem_comp.Number_atoms_all 22 _Chem_comp.Number_atoms_nh 9 _Chem_comp.Atom_nomenclature_source . _Chem_comp.PubChem_code . _Chem_comp.Subcomponent_list . _Chem_comp.InChI_code InChI=1S/C6H13NO2/c1-2-3-4-5(7)6(8)9/h5H,2-4,7H2,1H3,(H,8,9)/t5-/m0/s1 _Chem_comp.Mon_nstd_flag . _Chem_comp.Mon_nstd_class . _Chem_comp.Mon_nstd_details . _Chem_comp.Mon_nstd_parent . _Chem_comp.Mon_nstd_parent_comp_ID LEU _Chem_comp.Std_deriv_one_letter_code . _Chem_comp.Std_deriv_three_letter_code . _Chem_comp.Std_deriv_BMRB_code . _Chem_comp.Std_deriv_PDB_code . _Chem_comp.Std_deriv_chem_comp_name . _Chem_comp.Synonyms . _Chem_comp.Formal_charge 0 _Chem_comp.Paramagnetic . _Chem_comp.Aromatic no _Chem_comp.Formula 'C6 H13 N O2' _Chem_comp.Formula_weight 131.173 _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 EBI _Chem_comp.Vendor . _Chem_comp.Vendor_product_code . _Chem_comp.Details . _Chem_comp.DB_query_date . _Chem_comp.DB_last_query_revised_last_date . loop_ _Chem_comp_descriptor.Descriptor _Chem_comp_descriptor.Type _Chem_comp_descriptor.Program _Chem_comp_descriptor.Program_version _Chem_comp_descriptor.Entry_ID _Chem_comp_descriptor.Comp_ID CCCCC(C(=O)O)N SMILES 'OpenEye OEToolkits' 1.5.0 c30643_6pv2 NLE CCCC[C@@H](C(=O)O)N SMILES_CANONICAL 'OpenEye OEToolkits' 1.5.0 c30643_6pv2 NLE CCCC[C@H](N)C(O)=O SMILES_CANONICAL CACTVS 3.341 c30643_6pv2 NLE CCCC[CH](N)C(O)=O SMILES CACTVS 3.341 c30643_6pv2 NLE InChI=1S/C6H13NO2/c1-2-3-4-5(7)6(8)9/h5H,2-4,7H2,1H3,(H,8,9)/t5-/m0/s1 InChI InChI 1.03 c30643_6pv2 NLE LRQKBLKVPFOOQJ-YFKPBYRVSA-N InChIKey InChI 1.03 c30643_6pv2 NLE O=C(O)C(N)CCCC SMILES ACDLabs 10.04 c30643_6pv2 NLE stop_ loop_ _Chem_comp_identifier.Identifier _Chem_comp_identifier.Type _Chem_comp_identifier.Program _Chem_comp_identifier.Program_version _Chem_comp_identifier.Entry_ID _Chem_comp_identifier.Comp_ID '(2S)-2-aminohexanoic acid' 'SYSTEMATIC NAME' 'OpenEye OEToolkits' 1.5.0 c30643_6pv2 NLE L-norleucine 'SYSTEMATIC NAME' ACDLabs 10.04 c30643_6pv2 NLE 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 . . . . 16.557 . 39.518 . 17.898 . 0.720 1.773 0.288 1 . c30643_6pv2 NLE CA CA CA CA . C . . S 0 . . . 1 no no . . . . 15.812 . 40.611 . 17.285 . 0.763 0.319 0.492 2 . c30643_6pv2 NLE C C C C . C . . N 0 . . . 1 no no . . . . 16.773 . 41.690 . 16.789 . 2.084 -0.218 0.003 3 . c30643_6pv2 NLE O O O O . O . . N 0 . . . 1 no no . . . . 16.479 . 42.322 . 15.753 . 2.747 0.426 -0.776 4 . c30643_6pv2 NLE OXT OXT OXT OXT . O . . N 0 . . . 1 no yes . . . . 17.818 . 41.883 . 17.441 . 2.524 -1.411 0.433 5 . c30643_6pv2 NLE CB CB CB CB . C . . N 0 . . . 1 no no . . . . 14.816 . 41.205 . 18.283 . -0.375 -0.340 -0.289 6 . c30643_6pv2 NLE CG CG CG CG . C . . N 0 . . . 1 no no . . . . 13.697 . 40.254 . 18.678 . -1.718 0.110 0.290 7 . c30643_6pv2 NLE CD CD CD CD . C . . N 0 . . . 1 no no . . . . 12.730 . 40.911 . 19.645 . -2.857 -0.549 -0.491 8 . c30643_6pv2 NLE CE CE CE CE . C . . N 0 . . . 1 no no . . . . 11.636 . 39.956 . 20.071 . -4.200 -0.099 0.087 9 . c30643_6pv2 NLE H H H 1HN . H . . N 0 . . . 1 no no . . . . 16.728 . 38.807 . 17.216 . 0.822 2.004 -0.689 10 . c30643_6pv2 NLE HN2 HN2 HN2 2HN . H . . N 0 . . . 1 no yes . . . . 17.429 . 39.863 . 18.245 . -0.129 2.166 0.666 11 . c30643_6pv2 NLE HA HA HA HA . H . . N 0 . . . 1 no no . . . . 15.250 . 40.215 . 16.426 . 0.652 0.097 1.553 12 . c30643_6pv2 NLE HXT HXT HXT HXT . H . . N 0 . . . 1 no yes . . . . 18.329 . 42.568 . 17.026 . 3.377 -1.713 0.092 13 . c30643_6pv2 NLE HB2 HB2 HB2 1HB . H . . N 0 . . . 1 no no . . . . 15.369 . 41.477 . 19.194 . -0.315 -0.046 -1.337 14 . c30643_6pv2 NLE HB3 HB3 HB3 2HB . H . . N 0 . . . 1 no no . . . . 14.345 . 42.069 . 17.792 . -0.290 -1.424 -0.211 15 . c30643_6pv2 NLE HG2 HG2 HG2 1HG . H . . N 0 . . . 1 no no . . . . 13.147 . 39.956 . 17.773 . -1.779 -0.184 1.338 16 . c30643_6pv2 NLE HG3 HG3 HG3 2HG . H . . N 0 . . . 1 no no . . . . 14.143 . 39.379 . 19.173 . -1.803 1.194 0.211 17 . c30643_6pv2 NLE HD2 HD2 HD2 1HD . H . . N 0 . . . 1 no no . . . . 13.286 . 41.234 . 20.538 . -2.796 -0.255 -1.539 18 . c30643_6pv2 NLE HD3 HD3 HD3 2HD . H . . N 0 . . . 1 no no . . . . 12.263 . 41.768 . 19.138 . -2.772 -1.633 -0.413 19 . c30643_6pv2 NLE HE1 HE1 HE1 1HE . H . . N 0 . . . 1 no no . . . . 11.747 . 39.724 . 21.141 . -4.284 0.985 0.009 20 . c30643_6pv2 NLE HE2 HE2 HE2 2HE . H . . N 0 . . . 1 no no . . . . 10.655 . 40.422 . 19.897 . -5.011 -0.568 -0.469 21 . c30643_6pv2 NLE HE3 HE3 HE3 3HE . H . . N 0 . . . 1 no no . . . . 11.711 . 39.028 . 19.485 . -4.260 -0.393 1.135 22 . c30643_6pv2 NLE 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 . c30643_6pv2 NLE 2 . SING N H no N 2 . c30643_6pv2 NLE 3 . SING N HN2 no N 3 . c30643_6pv2 NLE 4 . SING CA C no N 4 . c30643_6pv2 NLE 5 . SING CA CB no N 5 . c30643_6pv2 NLE 6 . SING CA HA no N 6 . c30643_6pv2 NLE 7 . DOUB C O no N 7 . c30643_6pv2 NLE 8 . SING C OXT no N 8 . c30643_6pv2 NLE 9 . SING OXT HXT no N 9 . c30643_6pv2 NLE 10 . SING CB CG no N 10 . c30643_6pv2 NLE 11 . SING CB HB2 no N 11 . c30643_6pv2 NLE 12 . SING CB HB3 no N 12 . c30643_6pv2 NLE 13 . SING CG CD no N 13 . c30643_6pv2 NLE 14 . SING CG HG2 no N 14 . c30643_6pv2 NLE 15 . SING CG HG3 no N 15 . c30643_6pv2 NLE 16 . SING CD CE no N 16 . c30643_6pv2 NLE 17 . SING CD HD2 no N 17 . c30643_6pv2 NLE 18 . SING CD HD3 no N 18 . c30643_6pv2 NLE 19 . SING CE HE1 no N 19 . c30643_6pv2 NLE 20 . SING CE HE2 no N 20 . c30643_6pv2 NLE 21 . SING CE HE3 no N 21 . c30643_6pv2 NLE stop_ save_ save_chem_comp_ORN _Chem_comp.Sf_category chem_comp _Chem_comp.Sf_framecode chem_comp_ORN _Chem_comp.Entry_ID c30643_6pv2 _Chem_comp.ID ORN _Chem_comp.Provenance PDB _Chem_comp.Name L-ornithine _Chem_comp.Type 'L-PEPTIDE LINKING' _Chem_comp.BMRB_code ORN _Chem_comp.PDB_code ORN _Chem_comp.Ambiguous_flag no _Chem_comp.Initial_date 2012-11-20 _Chem_comp.Modified_date 2012-11-20 _Chem_comp.Release_status REL _Chem_comp.Replaced_by . _Chem_comp.Replaces . _Chem_comp.One_letter_code A _Chem_comp.Three_letter_code ORN _Chem_comp.Number_atoms_all 21 _Chem_comp.Number_atoms_nh 9 _Chem_comp.Atom_nomenclature_source . _Chem_comp.PubChem_code . _Chem_comp.Subcomponent_list . _Chem_comp.InChI_code InChI=1S/C5H12N2O2/c6-3-1-2-4(7)5(8)9/h4H,1-3,6-7H2,(H,8,9)/t4-/m0/s1 _Chem_comp.Mon_nstd_flag . _Chem_comp.Mon_nstd_class . _Chem_comp.Mon_nstd_details . _Chem_comp.Mon_nstd_parent . _Chem_comp.Mon_nstd_parent_comp_ID ALA _Chem_comp.Std_deriv_one_letter_code . _Chem_comp.Std_deriv_three_letter_code . _Chem_comp.Std_deriv_BMRB_code . _Chem_comp.Std_deriv_PDB_code . _Chem_comp.Std_deriv_chem_comp_name . _Chem_comp.Synonyms . _Chem_comp.Formal_charge 0 _Chem_comp.Paramagnetic . _Chem_comp.Aromatic no _Chem_comp.Formula 'C5 H12 N2 O2' _Chem_comp.Formula_weight 132.161 _Chem_comp.Formula_mono_iso_wt_nat . _Chem_comp.Formula_mono_iso_wt_13C . _Chem_comp.Formula_mono_iso_wt_15N . _Chem_comp.Formula_mono_iso_wt_13C_15N . _Chem_comp.Image_file_name . _Chem_comp.Image_file_format . _Chem_comp.Topo_file_name . _Chem_comp.Topo_file_format . _Chem_comp.Struct_file_name . _Chem_comp.Struct_file_format . _Chem_comp.Stereochem_param_file_name . _Chem_comp.Stereochem_param_file_format . _Chem_comp.Model_details . _Chem_comp.Model_erf . _Chem_comp.Model_source . _Chem_comp.Model_coordinates_details . _Chem_comp.Model_coordinates_missing_flag no _Chem_comp.Ideal_coordinates_details Corina _Chem_comp.Ideal_coordinates_missing_flag no _Chem_comp.Model_coordinates_db_code . _Chem_comp.Processing_site RCSB _Chem_comp.Vendor . _Chem_comp.Vendor_product_code . _Chem_comp.Details . _Chem_comp.DB_query_date . _Chem_comp.DB_last_query_revised_last_date . loop_ _Chem_comp_descriptor.Descriptor _Chem_comp_descriptor.Type _Chem_comp_descriptor.Program _Chem_comp_descriptor.Program_version _Chem_comp_descriptor.Entry_ID _Chem_comp_descriptor.Comp_ID AHLPHDHHMVZTML-BYPYZUCNSA-N InChIKey InChI 1.03 c30643_6pv2 ORN C(CC(C(=O)O)N)CN SMILES 'OpenEye OEToolkits' 1.7.6 c30643_6pv2 ORN C(C[C@@H](C(=O)O)N)CN SMILES_CANONICAL 'OpenEye OEToolkits' 1.7.6 c30643_6pv2 ORN InChI=1S/C5H12N2O2/c6-3-1-2-4(7)5(8)9/h4H,1-3,6-7H2,(H,8,9)/t4-/m0/s1 InChI InChI 1.03 c30643_6pv2 ORN NCCC[C@H](N)C(O)=O SMILES_CANONICAL CACTVS 3.370 c30643_6pv2 ORN NCCC[CH](N)C(O)=O SMILES CACTVS 3.370 c30643_6pv2 ORN O=C(O)C(N)CCCN SMILES ACDLabs 12.01 c30643_6pv2 ORN stop_ loop_ _Chem_comp_identifier.Identifier _Chem_comp_identifier.Type _Chem_comp_identifier.Program _Chem_comp_identifier.Program_version _Chem_comp_identifier.Entry_ID _Chem_comp_identifier.Comp_ID '(2S)-2,5-bis(azanyl)pentanoic acid' 'SYSTEMATIC NAME' 'OpenEye OEToolkits' 1.7.6 c30643_6pv2 ORN L-ornithine 'SYSTEMATIC NAME' ACDLabs 12.01 c30643_6pv2 ORN stop_ loop_ _Chem_comp_atom.Atom_ID _Chem_comp_atom.BMRB_code _Chem_comp_atom.PDB_atom_ID _Chem_comp_atom.Alt_atom_ID _Chem_comp_atom.Auth_atom_ID _Chem_comp_atom.Type_symbol _Chem_comp_atom.Isotope_number _Chem_comp_atom.Chirality _Chem_comp_atom.Stereo_config _Chem_comp_atom.Charge _Chem_comp_atom.Partial_charge _Chem_comp_atom.Oxidation_number _Chem_comp_atom.Unpaired_electron_number _Chem_comp_atom.Align _Chem_comp_atom.Aromatic_flag _Chem_comp_atom.Leaving_atom_flag _Chem_comp_atom.Substruct_code _Chem_comp_atom.Ionizable _Chem_comp_atom.Drawing_2D_coord_x _Chem_comp_atom.Drawing_2D_coord_y _Chem_comp_atom.Model_Cartn_x _Chem_comp_atom.Model_Cartn_x_esd _Chem_comp_atom.Model_Cartn_y _Chem_comp_atom.Model_Cartn_y_esd _Chem_comp_atom.Model_Cartn_z _Chem_comp_atom.Model_Cartn_z_esd _Chem_comp_atom.Model_Cartn_x_ideal _Chem_comp_atom.Model_Cartn_y_ideal _Chem_comp_atom.Model_Cartn_z_ideal _Chem_comp_atom.PDBX_ordinal _Chem_comp_atom.Details _Chem_comp_atom.Entry_ID _Chem_comp_atom.Comp_ID N N N N . N . . N 0 . . . 1 no no . . . . 60.217 . 198.291 . 50.550 . 0.747 1.775 0.281 1 . c30643_6pv2 ORN CA CA CA CA . C . . S 0 . . . 1 no no . . . . 58.991 . 198.276 . 49.700 . 0.791 0.322 0.493 2 . c30643_6pv2 ORN CB CB CB CB . C . . N 0 . . . 1 no no . . . . 58.217 . 196.979 . 49.925 . -0.353 -0.340 -0.275 3 . c30643_6pv2 ORN CG CG CG CG . C . . N 0 . . . 1 no no . . . . 57.679 . 196.811 . 51.343 . -1.692 0.114 0.310 4 . c30643_6pv2 ORN CD CD CD CD . C . . N 0 . . . 1 no no . . . . 56.975 . 195.478 . 51.502 . -2.836 -0.549 -0.459 5 . c30643_6pv2 ORN NE NE NE NE . N . . N 0 . . . 1 no no . . . . 56.147 . 195.435 . 52.723 . -4.121 -0.113 0.104 6 . c30643_6pv2 ORN C C C C . C . . N 0 . . . 1 no no . . . . 58.092 . 199.492 . 49.963 . 2.108 -0.218 -0.001 7 . c30643_6pv2 ORN O O O O . O . . N 0 . . . 1 no no . . . . 58.299 . 200.196 . 50.976 . 2.766 0.421 -0.789 8 . c30643_6pv2 ORN OXT OXT OXT OXT . O . . N 0 . . . 1 no yes . . . . 57.212 . 199.757 . 49.119 . 2.551 -1.408 0.433 9 . c30643_6pv2 ORN H H H H . H . . N 0 . . . 1 no no . . . . 60.718 . 199.143 . 50.398 . 0.842 2.000 -0.698 10 . c30643_6pv2 ORN H2 H2 H2 H2 . H . . N 0 . . . 1 no yes . . . . 59.956 . 198.226 . 51.513 . -0.099 2.171 0.663 11 . c30643_6pv2 ORN HA HA HA HA . H . . N 0 . . . 1 no no . . . . 59.300 . 198.307 . 48.645 . 0.687 0.108 1.557 12 . c30643_6pv2 ORN HB2 HB2 HB2 HB2 . H . . N 0 . . . 1 no no . . . . 57.366 . 196.960 . 49.228 . -0.300 -0.053 -1.326 13 . c30643_6pv2 ORN HB3 HB3 HB3 HB3 . H . . N 0 . . . 1 no no . . . . 58.888 . 196.135 . 49.708 . -0.269 -1.424 -0.191 14 . c30643_6pv2 ORN HG2 HG2 HG2 HG2 . H . . N 0 . . . 1 no no . . . . 58.517 . 196.863 . 52.054 . -1.745 -0.174 1.360 15 . c30643_6pv2 ORN HG3 HG3 HG3 HG3 . H . . N 0 . . . 1 no no . . . . 56.967 . 197.622 . 51.556 . -1.776 1.197 0.225 16 . c30643_6pv2 ORN HD2 HD2 HD2 HD2 . H . . N 0 . . . 1 no no . . . . 56.329 . 195.311 . 50.628 . -2.783 -0.262 -1.509 17 . c30643_6pv2 ORN HD3 HD3 HD3 HD3 . H . . N 0 . . . 1 no no . . . . 57.731 . 194.681 . 51.557 . -2.751 -1.633 -0.374 18 . c30643_6pv2 ORN HE1 HE1 HE1 HE1 . H . . N 0 . . . 1 no no . . . . 55.700 . 194.543 . 52.792 . -4.197 0.893 0.095 19 . c30643_6pv2 ORN HE2 HE2 HE2 HE2 . H . . N 0 . . . 1 no yes . . . . 56.727 . 195.580 . 53.524 . -4.894 -0.537 -0.387 20 . c30643_6pv2 ORN HXT HXT HXT HXT . H . . N 0 . . . 1 no yes . . . . 56.755 . 200.549 . 49.376 . 3.401 -1.713 0.087 21 . c30643_6pv2 ORN stop_ loop_ _Chem_comp_bond.ID _Chem_comp_bond.Type _Chem_comp_bond.Value_order _Chem_comp_bond.Atom_ID_1 _Chem_comp_bond.Atom_ID_2 _Chem_comp_bond.Aromatic_flag _Chem_comp_bond.Stereo_config _Chem_comp_bond.Ordinal _Chem_comp_bond.Details _Chem_comp_bond.Entry_ID _Chem_comp_bond.Comp_ID 1 . SING N CA no N 1 . c30643_6pv2 ORN 2 . SING N H no N 2 . c30643_6pv2 ORN 3 . SING N H2 no N 3 . c30643_6pv2 ORN 4 . SING CA CB no N 4 . c30643_6pv2 ORN 5 . SING CA C no N 5 . c30643_6pv2 ORN 6 . SING CA HA no N 6 . c30643_6pv2 ORN 7 . SING CB CG no N 7 . c30643_6pv2 ORN 8 . SING CB HB2 no N 8 . c30643_6pv2 ORN 9 . SING CB HB3 no N 9 . c30643_6pv2 ORN 10 . SING CG CD no N 10 . c30643_6pv2 ORN 11 . SING CG HG2 no N 11 . c30643_6pv2 ORN 12 . SING CG HG3 no N 12 . c30643_6pv2 ORN 13 . SING CD NE no N 13 . c30643_6pv2 ORN 14 . SING CD HD2 no N 14 . c30643_6pv2 ORN 15 . SING CD HD3 no N 15 . c30643_6pv2 ORN 16 . SING NE HE1 no N 16 . c30643_6pv2 ORN 17 . SING NE HE2 no N 17 . c30643_6pv2 ORN 18 . DOUB C O no N 18 . c30643_6pv2 ORN 19 . SING C OXT no N 19 . c30643_6pv2 ORN 20 . SING OXT HXT no N 20 . c30643_6pv2 ORN stop_ save_ save_chem_comp_ZN _Chem_comp.Sf_category chem_comp _Chem_comp.Sf_framecode chem_comp_ZN _Chem_comp.Entry_ID c30643_6pv2 _Chem_comp.ID ZN _Chem_comp.Provenance PDB _Chem_comp.Name 'ZINC ION' _Chem_comp.Type NON-POLYMER _Chem_comp.BMRB_code ZN _Chem_comp.PDB_code ZN _Chem_comp.Ambiguous_flag no _Chem_comp.Initial_date 2012-11-20 _Chem_comp.Modified_date 2012-11-20 _Chem_comp.Release_status REL _Chem_comp.Replaced_by . _Chem_comp.Replaces . _Chem_comp.One_letter_code . _Chem_comp.Three_letter_code ZN _Chem_comp.Number_atoms_all 1 _Chem_comp.Number_atoms_nh 1 _Chem_comp.Atom_nomenclature_source . _Chem_comp.PubChem_code . _Chem_comp.Subcomponent_list . _Chem_comp.InChI_code InChI=1S/Zn/q+2 _Chem_comp.Mon_nstd_flag . _Chem_comp.Mon_nstd_class . _Chem_comp.Mon_nstd_details . _Chem_comp.Mon_nstd_parent . _Chem_comp.Mon_nstd_parent_comp_ID . _Chem_comp.Std_deriv_one_letter_code . _Chem_comp.Std_deriv_three_letter_code . _Chem_comp.Std_deriv_BMRB_code . _Chem_comp.Std_deriv_PDB_code . _Chem_comp.Std_deriv_chem_comp_name . _Chem_comp.Synonyms . _Chem_comp.Formal_charge 2 _Chem_comp.Paramagnetic . _Chem_comp.Aromatic no _Chem_comp.Formula Zn _Chem_comp.Formula_weight 65.409 _Chem_comp.Formula_mono_iso_wt_nat . _Chem_comp.Formula_mono_iso_wt_13C . _Chem_comp.Formula_mono_iso_wt_15N . _Chem_comp.Formula_mono_iso_wt_13C_15N . _Chem_comp.Image_file_name . _Chem_comp.Image_file_format . _Chem_comp.Topo_file_name . _Chem_comp.Topo_file_format . _Chem_comp.Struct_file_name . _Chem_comp.Struct_file_format . _Chem_comp.Stereochem_param_file_name . _Chem_comp.Stereochem_param_file_format . _Chem_comp.Model_details . _Chem_comp.Model_erf . _Chem_comp.Model_source . _Chem_comp.Model_coordinates_details . _Chem_comp.Model_coordinates_missing_flag no _Chem_comp.Ideal_coordinates_details . _Chem_comp.Ideal_coordinates_missing_flag no _Chem_comp.Model_coordinates_db_code . _Chem_comp.Processing_site RCSB _Chem_comp.Vendor . _Chem_comp.Vendor_product_code . _Chem_comp.Details . _Chem_comp.DB_query_date . _Chem_comp.DB_last_query_revised_last_date . loop_ _Chem_comp_descriptor.Descriptor _Chem_comp_descriptor.Type _Chem_comp_descriptor.Program _Chem_comp_descriptor.Program_version _Chem_comp_descriptor.Entry_ID _Chem_comp_descriptor.Comp_ID InChI=1S/Zn/q+2 InChI InChI 1.03 c30643_6pv2 ZN PTFCDOFLOPIGGS-UHFFFAOYSA-N InChIKey InChI 1.03 c30643_6pv2 ZN [Zn++] SMILES CACTVS 3.341 c30643_6pv2 ZN [Zn++] SMILES_CANONICAL CACTVS 3.341 c30643_6pv2 ZN [Zn+2] SMILES ACDLabs 10.04 c30643_6pv2 ZN [Zn+2] SMILES 'OpenEye OEToolkits' 1.5.0 c30643_6pv2 ZN [Zn+2] SMILES_CANONICAL 'OpenEye OEToolkits' 1.5.0 c30643_6pv2 ZN stop_ loop_ _Chem_comp_identifier.Identifier _Chem_comp_identifier.Type _Chem_comp_identifier.Program _Chem_comp_identifier.Program_version _Chem_comp_identifier.Entry_ID _Chem_comp_identifier.Comp_ID zinc 'SYSTEMATIC NAME' ACDLabs 10.04 c30643_6pv2 ZN 'zinc(+2) cation' 'SYSTEMATIC NAME' 'OpenEye OEToolkits' 1.5.0 c30643_6pv2 ZN stop_ loop_ _Chem_comp_atom.Atom_ID _Chem_comp_atom.BMRB_code _Chem_comp_atom.PDB_atom_ID _Chem_comp_atom.Alt_atom_ID _Chem_comp_atom.Auth_atom_ID _Chem_comp_atom.Type_symbol _Chem_comp_atom.Isotope_number _Chem_comp_atom.Chirality _Chem_comp_atom.Stereo_config _Chem_comp_atom.Charge _Chem_comp_atom.Partial_charge _Chem_comp_atom.Oxidation_number _Chem_comp_atom.Unpaired_electron_number _Chem_comp_atom.Align _Chem_comp_atom.Aromatic_flag _Chem_comp_atom.Leaving_atom_flag _Chem_comp_atom.Substruct_code _Chem_comp_atom.Ionizable _Chem_comp_atom.Drawing_2D_coord_x _Chem_comp_atom.Drawing_2D_coord_y _Chem_comp_atom.Model_Cartn_x _Chem_comp_atom.Model_Cartn_x_esd _Chem_comp_atom.Model_Cartn_y _Chem_comp_atom.Model_Cartn_y_esd _Chem_comp_atom.Model_Cartn_z _Chem_comp_atom.Model_Cartn_z_esd _Chem_comp_atom.Model_Cartn_x_ideal _Chem_comp_atom.Model_Cartn_y_ideal _Chem_comp_atom.Model_Cartn_z_ideal _Chem_comp_atom.PDBX_ordinal _Chem_comp_atom.Details _Chem_comp_atom.Entry_ID _Chem_comp_atom.Comp_ID ZN ZN ZN ZN . ZN . . N 2 . . . 0 no no . . . . 0.000 . 0.000 . 0.000 . 0.000 0.000 0.000 1 . c30643_6pv2 ZN stop_ save_ save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID c30643_6pv2 _Sample.ID 1 _Sample.Name . _Sample.Type solution _Sample.Sub_type . _Sample.Details ; 1.2 mM zinc finger 2 from transcription factor Sp1 DNA-binding domain, Orn turn variant, 10 mM [U-2H] TRIS, 0.05 mM DSS, 1.8 mM zinc chloride, 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 entity_1 'natural abundance' . . 1 $entity_1 . . 1.2 . . mM . . . . c30643_6pv2 1 2 TRIS [U-2H] . . . . . . 10 . . mM . . . . c30643_6pv2 1 3 DSS 'natural abundance' . . . . . . 0.05 . . mM . . . . c30643_6pv2 1 4 'zinc chloride' 'natural abundance' . . . . . . 1.8 . . mM . . . . c30643_6pv2 1 stop_ save_ save_sample_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_1 _Sample_condition_list.Entry_ID c30643_6pv2 _Sample_condition_list.ID 1 _Sample_condition_list.Name . _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' 10 . mM c30643_6pv2 1 pH 6 . pH* c30643_6pv2 1 pressure 1 . atm c30643_6pv2 1 temperature 298 . K c30643_6pv2 1 stop_ save_ save_software_1 _Software.Sf_category software _Software.Sf_framecode software_1 _Software.Entry_ID c30643_6pv2 _Software.ID 1 _Software.Type . _Software.Name TopSpin _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Bruker Biospin' . . c30643_6pv2 1 stop_ loop_ _Task.Software_module _Task.Task _Task.Entry_ID _Task.Software_ID . processing c30643_6pv2 1 stop_ save_ save_software_2 _Software.Sf_category software _Software.Sf_framecode software_2 _Software.Entry_ID c30643_6pv2 _Software.ID 2 _Software.Type . _Software.Name Sparky _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Goddard . . c30643_6pv2 2 stop_ loop_ _Task.Software_module _Task.Task _Task.Entry_ID _Task.Software_ID . 'data analysis' c30643_6pv2 2 stop_ save_ save_software_3 _Software.Sf_category software _Software.Sf_framecode software_3 _Software.Entry_ID c30643_6pv2 _Software.ID 3 _Software.Type . _Software.Name ARIA _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID "Linge, O'Donoghue and Nilges" . . c30643_6pv2 3 stop_ loop_ _Task.Software_module _Task.Task _Task.Entry_ID _Task.Software_ID . refinement c30643_6pv2 3 . 'structure calculation' c30643_6pv2 3 stop_ save_ save_NMR_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_1 _NMR_spectrometer.Entry_ID c30643_6pv2 _NMR_spectrometer.ID 1 _NMR_spectrometer.Name . _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 700 save_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID c30643_6pv2 _NMR_spectrometer_list.ID 1 _NMR_spectrometer_list.Name . loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 NMR_spectrometer_1 Bruker Avance . 700 . . . c30643_6pv2 1 stop_ save_ save_experiment_list _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode experiment_list _Experiment_list.Entry_ID c30643_6pv2 _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 . . . . . . . . . . . . . . . . c30643_6pv2 1 2 '2D 1H-1H COSY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . c30643_6pv2 1 3 '2D 1H-1H NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . c30643_6pv2 1 stop_ save_ 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 c30643_6pv2 _Chem_shift_reference.ID 1 _Chem_shift_reference.Name . _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 . . . . . c30643_6pv2 1 stop_ save_ 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 c30643_6pv2 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name . _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chem_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-1H TOCSY' . . . c30643_6pv2 1 2 '2D 1H-1H COSY' . . . c30643_6pv2 1 3 '2D 1H-1H NOESY' . . . c30643_6pv2 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_assembly_asym_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Ambiguity_set_ID _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 . 1 1 1 ARG HA H 1 4.243 0.000 . 1 . . . . A 1 ARG HA . c30643_6pv2 1 2 . 1 . 1 1 1 ARG HB2 H 1 1.802 0.000 . 1 . . . . A 1 ARG HB2 . c30643_6pv2 1 3 . 1 . 1 1 1 ARG HB3 H 1 1.802 0.000 . 1 . . . . A 1 ARG HB3 . c30643_6pv2 1 4 . 1 . 1 1 1 ARG HG2 H 1 1.603 0.000 . 2 . . . . A 1 ARG HG2 . c30643_6pv2 1 5 . 1 . 1 1 1 ARG HG3 H 1 1.541 0.000 . 2 . . . . A 1 ARG HG3 . c30643_6pv2 1 6 . 1 . 1 1 1 ARG HD2 H 1 3.132 0.001 . 1 . . . . A 1 ARG HD2 . c30643_6pv2 1 7 . 1 . 1 1 1 ARG HD3 H 1 3.132 0.001 . 1 . . . . A 1 ARG HD3 . c30643_6pv2 1 8 . 1 . 1 2 2 PRO HA H 1 4.511 0.002 . 1 . . . . A 2 PRO HA . c30643_6pv2 1 9 . 1 . 1 2 2 PRO HB2 H 1 2.203 0.001 . 2 . . . . A 2 PRO HB2 . c30643_6pv2 1 10 . 1 . 1 2 2 PRO HB3 H 1 1.674 0.001 . 2 . . . . A 2 PRO HB3 . c30643_6pv2 1 11 . 1 . 1 2 2 PRO HG2 H 1 1.958 0.001 . 2 . . . . A 2 PRO HG2 . c30643_6pv2 1 12 . 1 . 1 2 2 PRO HG3 H 1 1.900 0.000 . 2 . . . . A 2 PRO HG3 . c30643_6pv2 1 13 . 1 . 1 2 2 PRO HD2 H 1 3.684 0.001 . 2 . . . . A 2 PRO HD2 . c30643_6pv2 1 14 . 1 . 1 2 2 PRO HD3 H 1 3.563 0.004 . 2 . . . . A 2 PRO HD3 . c30643_6pv2 1 15 . 1 . 1 3 3 PHE H H 1 8.574 0.000 . 1 . . . . A 3 PHE H . c30643_6pv2 1 16 . 1 . 1 3 3 PHE HA H 1 4.649 0.001 . 1 . . . . A 3 PHE HA . c30643_6pv2 1 17 . 1 . 1 3 3 PHE HB2 H 1 3.065 0.000 . 2 . . . . A 3 PHE HB2 . c30643_6pv2 1 18 . 1 . 1 3 3 PHE HB3 H 1 2.988 0.003 . 2 . . . . A 3 PHE HB3 . c30643_6pv2 1 19 . 1 . 1 3 3 PHE HD1 H 1 7.178 0.000 . 1 . . . . A 3 PHE HD1 . c30643_6pv2 1 20 . 1 . 1 3 3 PHE HD2 H 1 7.178 0.000 . 1 . . . . A 3 PHE HD2 . c30643_6pv2 1 21 . 1 . 1 3 3 PHE HE1 H 1 7.419 0.000 . 1 . . . . A 3 PHE HE1 . c30643_6pv2 1 22 . 1 . 1 3 3 PHE HE2 H 1 7.419 0.000 . 1 . . . . A 3 PHE HE2 . c30643_6pv2 1 23 . 1 . 1 4 4 NLE H H 1 8.406 0.001 . 1 . . . . A 4 NLE H . c30643_6pv2 1 24 . 1 . 1 4 4 NLE HA H 1 5.124 0.001 . 1 . . . . A 4 NLE HA . c30643_6pv2 1 25 . 1 . 1 4 4 NLE HB2 H 1 1.509 0.004 . 2 . . . . A 4 NLE HB2 . c30643_6pv2 1 26 . 1 . 1 4 4 NLE HB3 H 1 1.677 0.002 . 2 . . . . A 4 NLE HB3 . c30643_6pv2 1 27 . 1 . 1 4 4 NLE QD H 1 1.201 0.004 . 1 . . . . A 4 NLE QD . c30643_6pv2 1 28 . 1 . 1 4 4 NLE QE H 1 0.796 0.002 . 1 . . . . A 4 NLE QE . c30643_6pv2 1 29 . 1 . 1 4 4 NLE QG H 1 1.099 0.006 . 1 . . . . A 4 NLE QG . c30643_6pv2 1 30 . 1 . 1 5 5 CYS H H 1 9.197 0.000 . 1 . . . . A 5 CYS H . c30643_6pv2 1 31 . 1 . 1 5 5 CYS HA H 1 4.551 0.001 . 1 . . . . A 5 CYS HA . c30643_6pv2 1 32 . 1 . 1 5 5 CYS HB2 H 1 3.412 0.002 . 2 . . . . A 5 CYS HB2 . c30643_6pv2 1 33 . 1 . 1 5 5 CYS HB3 H 1 2.927 0.000 . 2 . . . . A 5 CYS HB3 . c30643_6pv2 1 34 . 1 . 1 6 6 THR H H 1 8.057 0.000 . 1 . . . . A 6 THR H . c30643_6pv2 1 35 . 1 . 1 6 6 THR HA H 1 4.819 0.002 . 1 . . . . A 6 THR HA . c30643_6pv2 1 36 . 1 . 1 6 6 THR HB H 1 4.686 0.000 . 1 . . . . A 6 THR HB . c30643_6pv2 1 37 . 1 . 1 6 6 THR HG21 H 1 1.185 0.001 . 1 . . . . A 6 THR HG21 . c30643_6pv2 1 38 . 1 . 1 6 6 THR HG22 H 1 1.185 0.001 . 1 . . . . A 6 THR HG22 . c30643_6pv2 1 39 . 1 . 1 6 6 THR HG23 H 1 1.185 0.001 . 1 . . . . A 6 THR HG23 . c30643_6pv2 1 40 . 1 . 1 7 7 TRP H H 1 8.735 0.001 . 1 . . . . A 7 TRP H . c30643_6pv2 1 41 . 1 . 1 7 7 TRP HA H 1 4.231 0.001 . 1 . . . . A 7 TRP HA . c30643_6pv2 1 42 . 1 . 1 7 7 TRP HB2 H 1 2.792 0.001 . 2 . . . . A 7 TRP HB2 . c30643_6pv2 1 43 . 1 . 1 7 7 TRP HB3 H 1 2.757 0.000 . 2 . . . . A 7 TRP HB3 . c30643_6pv2 1 44 . 1 . 1 7 7 TRP HD1 H 1 6.879 0.000 . 1 . . . . A 7 TRP HD1 . c30643_6pv2 1 45 . 1 . 1 7 7 TRP HE1 H 1 10.049 0.000 . 1 . . . . A 7 TRP HE1 . c30643_6pv2 1 46 . 1 . 1 7 7 TRP HE3 H 1 7.414 0.000 . 1 . . . . A 7 TRP HE3 . c30643_6pv2 1 47 . 1 . 1 7 7 TRP HZ2 H 1 7.433 0.000 . 1 . . . . A 7 TRP HZ2 . c30643_6pv2 1 48 . 1 . 1 7 7 TRP HZ3 H 1 7.110 0.000 . 1 . . . . A 7 TRP HZ3 . c30643_6pv2 1 49 . 1 . 1 7 7 TRP HH2 H 1 7.192 0.000 . 1 . . . . A 7 TRP HH2 . c30643_6pv2 1 50 . 1 . 1 8 8 ORN HA H 1 3.976 0.001 . 1 . . . . A 8 ORN HA . c30643_6pv2 1 51 . 1 . 1 8 8 ORN HD2 H 1 2.842 0.001 . 2 . . . . A 8 ORN HD2 . c30643_6pv2 1 52 . 1 . 1 8 8 ORN HD3 H 1 3.390 0.002 . 2 . . . . A 8 ORN HD3 . c30643_6pv2 1 53 . 1 . 1 8 8 ORN HE1 H 1 7.778 0.001 . 1 . . . . A 8 ORN HE1 . c30643_6pv2 1 54 . 1 . 1 8 8 ORN QB H 1 1.740 0.000 . 1 . . . . A 8 ORN QB . c30643_6pv2 1 55 . 1 . 1 8 8 ORN QG H 1 1.612 0.001 . 1 . . . . A 8 ORN QG . c30643_6pv2 1 56 . 1 . 1 9 9 CYS HA H 1 4.024 0.000 . 1 . . . . A 9 CYS HA . c30643_6pv2 1 57 . 1 . 1 9 9 CYS HB2 H 1 3.346 0.000 . 2 . . . . A 9 CYS HB2 . c30643_6pv2 1 58 . 1 . 1 9 9 CYS HB3 H 1 3.212 0.000 . 2 . . . . A 9 CYS HB3 . c30643_6pv2 1 59 . 1 . 1 10 10 GLY H H 1 8.475 0.001 . 1 . . . . A 10 GLY H . c30643_6pv2 1 60 . 1 . 1 10 10 GLY HA2 H 1 4.080 0.000 . 2 . . . . A 10 GLY HA2 . c30643_6pv2 1 61 . 1 . 1 10 10 GLY HA3 H 1 3.959 0.000 . 2 . . . . A 10 GLY HA3 . c30643_6pv2 1 62 . 1 . 1 11 11 LYS H H 1 8.084 0.001 . 1 . . . . A 11 LYS H . c30643_6pv2 1 63 . 1 . 1 11 11 LYS HA H 1 3.975 0.001 . 1 . . . . A 11 LYS HA . c30643_6pv2 1 64 . 1 . 1 11 11 LYS HB2 H 1 1.413 0.000 . 1 . . . . A 11 LYS HB2 . c30643_6pv2 1 65 . 1 . 1 11 11 LYS HB3 H 1 1.413 0.000 . 1 . . . . A 11 LYS HB3 . c30643_6pv2 1 66 . 1 . 1 11 11 LYS HG2 H 1 1.288 0.000 . 1 . . . . A 11 LYS HG2 . c30643_6pv2 1 67 . 1 . 1 11 11 LYS HG3 H 1 1.288 0.000 . 1 . . . . A 11 LYS HG3 . c30643_6pv2 1 68 . 1 . 1 11 11 LYS HD2 H 1 1.454 0.001 . 1 . . . . A 11 LYS HD2 . c30643_6pv2 1 69 . 1 . 1 11 11 LYS HD3 H 1 1.454 0.001 . 1 . . . . A 11 LYS HD3 . c30643_6pv2 1 70 . 1 . 1 11 11 LYS HE2 H 1 2.980 0.000 . 1 . . . . A 11 LYS HE2 . c30643_6pv2 1 71 . 1 . 1 11 11 LYS HE3 H 1 2.980 0.000 . 1 . . . . A 11 LYS HE3 . c30643_6pv2 1 72 . 1 . 1 12 12 ARG H H 1 7.814 0.001 . 1 . . . . A 12 ARG H . c30643_6pv2 1 73 . 1 . 1 12 12 ARG HA H 1 5.050 0.002 . 1 . . . . A 12 ARG HA . c30643_6pv2 1 74 . 1 . 1 12 12 ARG HB2 H 1 1.525 0.002 . 1 . . . . A 12 ARG HB2 . c30643_6pv2 1 75 . 1 . 1 12 12 ARG HB3 H 1 1.525 0.002 . 1 . . . . A 12 ARG HB3 . c30643_6pv2 1 76 . 1 . 1 12 12 ARG HG2 H 1 1.660 0.001 . 2 . . . . A 12 ARG HG2 . c30643_6pv2 1 77 . 1 . 1 12 12 ARG HG3 H 1 1.444 0.002 . 2 . . . . A 12 ARG HG3 . c30643_6pv2 1 78 . 1 . 1 12 12 ARG HD2 H 1 3.107 0.002 . 1 . . . . A 12 ARG HD2 . c30643_6pv2 1 79 . 1 . 1 12 12 ARG HD3 H 1 3.107 0.002 . 1 . . . . A 12 ARG HD3 . c30643_6pv2 1 80 . 1 . 1 12 12 ARG HE H 1 7.200 0.000 . 1 . . . . A 12 ARG HE . c30643_6pv2 1 81 . 1 . 1 13 13 PHE H H 1 8.763 0.000 . 1 . . . . A 13 PHE H . c30643_6pv2 1 82 . 1 . 1 13 13 PHE HA H 1 4.878 0.002 . 1 . . . . A 13 PHE HA . c30643_6pv2 1 83 . 1 . 1 13 13 PHE HB2 H 1 3.580 0.002 . 2 . . . . A 13 PHE HB2 . c30643_6pv2 1 84 . 1 . 1 13 13 PHE HB3 H 1 2.632 0.002 . 2 . . . . A 13 PHE HB3 . c30643_6pv2 1 85 . 1 . 1 13 13 PHE HD1 H 1 7.191 0.001 . 1 . . . . A 13 PHE HD1 . c30643_6pv2 1 86 . 1 . 1 13 13 PHE HD2 H 1 7.191 0.001 . 1 . . . . A 13 PHE HD2 . c30643_6pv2 1 87 . 1 . 1 13 13 PHE HE1 H 1 6.913 0.000 . 1 . . . . A 13 PHE HE1 . c30643_6pv2 1 88 . 1 . 1 13 13 PHE HE2 H 1 6.913 0.000 . 1 . . . . A 13 PHE HE2 . c30643_6pv2 1 89 . 1 . 1 13 13 PHE HZ H 1 6.258 0.001 . 1 . . . . A 13 PHE HZ . c30643_6pv2 1 90 . 1 . 1 14 14 THR H H 1 9.169 0.001 . 1 . . . . A 14 THR H . c30643_6pv2 1 91 . 1 . 1 14 14 THR HA H 1 4.587 0.001 . 1 . . . . A 14 THR HA . c30643_6pv2 1 92 . 1 . 1 14 14 THR HB H 1 4.466 0.001 . 1 . . . . A 14 THR HB . c30643_6pv2 1 93 . 1 . 1 14 14 THR HG21 H 1 1.330 0.001 . 1 . . . . A 14 THR HG21 . c30643_6pv2 1 94 . 1 . 1 14 14 THR HG22 H 1 1.330 0.001 . 1 . . . . A 14 THR HG22 . c30643_6pv2 1 95 . 1 . 1 14 14 THR HG23 H 1 1.330 0.001 . 1 . . . . A 14 THR HG23 . c30643_6pv2 1 96 . 1 . 1 15 15 ARG H H 1 7.744 0.001 . 1 . . . . A 15 ARG H . c30643_6pv2 1 97 . 1 . 1 15 15 ARG HA H 1 4.714 0.001 . 1 . . . . A 15 ARG HA . c30643_6pv2 1 98 . 1 . 1 15 15 ARG HB2 H 1 2.156 0.001 . 1 . . . . A 15 ARG HB2 . c30643_6pv2 1 99 . 1 . 1 15 15 ARG HB3 H 1 2.156 0.001 . 1 . . . . A 15 ARG HB3 . c30643_6pv2 1 100 . 1 . 1 15 15 ARG HG2 H 1 1.671 0.002 . 2 . . . . A 15 ARG HG2 . c30643_6pv2 1 101 . 1 . 1 15 15 ARG HG3 H 1 1.645 0.001 . 2 . . . . A 15 ARG HG3 . c30643_6pv2 1 102 . 1 . 1 15 15 ARG HD2 H 1 3.311 0.002 . 2 . . . . A 15 ARG HD2 . c30643_6pv2 1 103 . 1 . 1 15 15 ARG HD3 H 1 3.263 0.003 . 2 . . . . A 15 ARG HD3 . c30643_6pv2 1 104 . 1 . 1 15 15 ARG HE H 1 8.063 0.001 . 1 . . . . A 15 ARG HE . c30643_6pv2 1 105 . 1 . 1 16 16 SER H H 1 8.557 0.000 . 1 . . . . A 16 SER H . c30643_6pv2 1 106 . 1 . 1 16 16 SER HA H 1 3.105 0.000 . 1 . . . . A 16 SER HA . c30643_6pv2 1 107 . 1 . 1 16 16 SER HB2 H 1 3.542 0.002 . 2 . . . . A 16 SER HB2 . c30643_6pv2 1 108 . 1 . 1 16 16 SER HB3 H 1 3.433 0.002 . 2 . . . . A 16 SER HB3 . c30643_6pv2 1 109 . 1 . 1 17 17 ASP H H 1 8.728 0.000 . 1 . . . . A 17 ASP H . c30643_6pv2 1 110 . 1 . 1 17 17 ASP HA H 1 4.210 0.001 . 1 . . . . A 17 ASP HA . c30643_6pv2 1 111 . 1 . 1 17 17 ASP HB2 H 1 2.675 0.001 . 2 . . . . A 17 ASP HB2 . c30643_6pv2 1 112 . 1 . 1 17 17 ASP HB3 H 1 2.592 0.003 . 2 . . . . A 17 ASP HB3 . c30643_6pv2 1 113 . 1 . 1 18 18 GLU H H 1 7.057 0.001 . 1 . . . . A 18 GLU H . c30643_6pv2 1 114 . 1 . 1 18 18 GLU HA H 1 3.865 0.000 . 1 . . . . A 18 GLU HA . c30643_6pv2 1 115 . 1 . 1 18 18 GLU HB2 H 1 2.273 0.001 . 1 . . . . A 18 GLU HB2 . c30643_6pv2 1 116 . 1 . 1 18 18 GLU HB3 H 1 2.273 0.001 . 1 . . . . A 18 GLU HB3 . c30643_6pv2 1 117 . 1 . 1 18 18 GLU HG2 H 1 2.320 0.001 . 2 . . . . A 18 GLU HG2 . c30643_6pv2 1 118 . 1 . 1 18 18 GLU HG3 H 1 2.099 0.000 . 2 . . . . A 18 GLU HG3 . c30643_6pv2 1 119 . 1 . 1 19 19 LEU H H 1 6.981 0.001 . 1 . . . . A 19 LEU H . c30643_6pv2 1 120 . 1 . 1 19 19 LEU HA H 1 3.230 0.001 . 1 . . . . A 19 LEU HA . c30643_6pv2 1 121 . 1 . 1 19 19 LEU HB2 H 1 1.991 0.000 . 2 . . . . A 19 LEU HB2 . c30643_6pv2 1 122 . 1 . 1 19 19 LEU HB3 H 1 1.258 0.005 . 2 . . . . A 19 LEU HB3 . c30643_6pv2 1 123 . 1 . 1 19 19 LEU HG H 1 1.532 0.001 . 1 . . . . A 19 LEU HG . c30643_6pv2 1 124 . 1 . 1 19 19 LEU HD11 H 1 1.062 0.001 . 2 . . . . A 19 LEU HD11 . c30643_6pv2 1 125 . 1 . 1 19 19 LEU HD12 H 1 1.062 0.001 . 2 . . . . A 19 LEU HD12 . c30643_6pv2 1 126 . 1 . 1 19 19 LEU HD13 H 1 1.062 0.001 . 2 . . . . A 19 LEU HD13 . c30643_6pv2 1 127 . 1 . 1 19 19 LEU HD21 H 1 1.095 0.002 . 2 . . . . A 19 LEU HD21 . c30643_6pv2 1 128 . 1 . 1 19 19 LEU HD22 H 1 1.095 0.002 . 2 . . . . A 19 LEU HD22 . c30643_6pv2 1 129 . 1 . 1 19 19 LEU HD23 H 1 1.095 0.002 . 2 . . . . A 19 LEU HD23 . c30643_6pv2 1 130 . 1 . 1 20 20 GLN H H 1 8.138 0.000 . 1 . . . . A 20 GLN H . c30643_6pv2 1 131 . 1 . 1 20 20 GLN HA H 1 3.856 0.001 . 1 . . . . A 20 GLN HA . c30643_6pv2 1 132 . 1 . 1 20 20 GLN HB2 H 1 2.073 0.001 . 1 . . . . A 20 GLN HB2 . c30643_6pv2 1 133 . 1 . 1 20 20 GLN HB3 H 1 2.073 0.001 . 1 . . . . A 20 GLN HB3 . c30643_6pv2 1 134 . 1 . 1 20 20 GLN HG2 H 1 2.413 0.001 . 2 . . . . A 20 GLN HG2 . c30643_6pv2 1 135 . 1 . 1 20 20 GLN HG3 H 1 2.388 0.000 . 2 . . . . A 20 GLN HG3 . c30643_6pv2 1 136 . 1 . 1 21 21 ARG H H 1 7.699 0.000 . 1 . . . . A 21 ARG H . c30643_6pv2 1 137 . 1 . 1 21 21 ARG HA H 1 3.896 0.001 . 1 . . . . A 21 ARG HA . c30643_6pv2 1 138 . 1 . 1 21 21 ARG HB2 H 1 1.821 0.000 . 2 . . . . A 21 ARG HB2 . c30643_6pv2 1 139 . 1 . 1 21 21 ARG HB3 H 1 1.768 0.000 . 2 . . . . A 21 ARG HB3 . c30643_6pv2 1 140 . 1 . 1 21 21 ARG HG2 H 1 1.517 0.000 . 1 . . . . A 21 ARG HG2 . c30643_6pv2 1 141 . 1 . 1 21 21 ARG HG3 H 1 1.517 0.000 . 1 . . . . A 21 ARG HG3 . c30643_6pv2 1 142 . 1 . 1 21 21 ARG HD2 H 1 3.232 0.000 . 2 . . . . A 21 ARG HD2 . c30643_6pv2 1 143 . 1 . 1 21 21 ARG HD3 H 1 3.148 0.002 . 2 . . . . A 21 ARG HD3 . c30643_6pv2 1 144 . 1 . 1 21 21 ARG HE H 1 7.316 0.001 . 1 . . . . A 21 ARG HE . c30643_6pv2 1 145 . 1 . 1 22 22 HIS H H 1 7.695 0.000 . 1 . . . . A 22 HIS H . c30643_6pv2 1 146 . 1 . 1 22 22 HIS HA H 1 4.265 0.001 . 1 . . . . A 22 HIS HA . c30643_6pv2 1 147 . 1 . 1 22 22 HIS HB2 H 1 3.030 0.002 . 2 . . . . A 22 HIS HB2 . c30643_6pv2 1 148 . 1 . 1 22 22 HIS HB3 H 1 2.912 0.000 . 2 . . . . A 22 HIS HB3 . c30643_6pv2 1 149 . 1 . 1 22 22 HIS HD2 H 1 7.138 0.000 . 1 . . . . A 22 HIS HD2 . c30643_6pv2 1 150 . 1 . 1 22 22 HIS HE1 H 1 7.944 0.000 . 1 . . . . A 22 HIS HE1 . c30643_6pv2 1 151 . 1 . 1 23 23 LYS H H 1 8.752 0.000 . 1 . . . . A 23 LYS H . c30643_6pv2 1 152 . 1 . 1 23 23 LYS HA H 1 3.632 0.001 . 1 . . . . A 23 LYS HA . c30643_6pv2 1 153 . 1 . 1 23 23 LYS HB2 H 1 1.912 0.000 . 1 . . . . A 23 LYS HB2 . c30643_6pv2 1 154 . 1 . 1 23 23 LYS HB3 H 1 1.912 0.000 . 1 . . . . A 23 LYS HB3 . c30643_6pv2 1 155 . 1 . 1 23 23 LYS HG2 H 1 1.705 0.000 . 1 . . . . A 23 LYS HG2 . c30643_6pv2 1 156 . 1 . 1 23 23 LYS HG3 H 1 1.705 0.000 . 1 . . . . A 23 LYS HG3 . c30643_6pv2 1 157 . 1 . 1 23 23 LYS HD2 H 1 1.636 0.000 . 1 . . . . A 23 LYS HD2 . c30643_6pv2 1 158 . 1 . 1 23 23 LYS HD3 H 1 1.636 0.000 . 1 . . . . A 23 LYS HD3 . c30643_6pv2 1 159 . 1 . 1 23 23 LYS HE2 H 1 3.014 0.001 . 2 . . . . A 23 LYS HE2 . c30643_6pv2 1 160 . 1 . 1 23 23 LYS HE3 H 1 2.896 0.000 . 2 . . . . A 23 LYS HE3 . c30643_6pv2 1 161 . 1 . 1 24 24 ARG H H 1 7.096 0.000 . 1 . . . . A 24 ARG H . c30643_6pv2 1 162 . 1 . 1 24 24 ARG HA H 1 4.122 0.001 . 1 . . . . A 24 ARG HA . c30643_6pv2 1 163 . 1 . 1 24 24 ARG HB2 H 1 1.833 0.000 . 2 . . . . A 24 ARG HB2 . c30643_6pv2 1 164 . 1 . 1 24 24 ARG HB3 H 1 1.802 0.000 . 2 . . . . A 24 ARG HB3 . c30643_6pv2 1 165 . 1 . 1 24 24 ARG HG2 H 1 1.896 0.000 . 2 . . . . A 24 ARG HG2 . c30643_6pv2 1 166 . 1 . 1 24 24 ARG HG3 H 1 1.644 0.000 . 2 . . . . A 24 ARG HG3 . c30643_6pv2 1 167 . 1 . 1 24 24 ARG HD2 H 1 3.169 0.000 . 1 . . . . A 24 ARG HD2 . c30643_6pv2 1 168 . 1 . 1 24 24 ARG HD3 H 1 3.169 0.000 . 1 . . . . A 24 ARG HD3 . c30643_6pv2 1 169 . 1 . 1 24 24 ARG HE H 1 7.241 0.000 . 1 . . . . A 24 ARG HE . c30643_6pv2 1 170 . 1 . 1 25 25 THR H H 1 7.678 0.000 . 1 . . . . A 25 THR H . c30643_6pv2 1 171 . 1 . 1 25 25 THR HA H 1 4.074 0.001 . 1 . . . . A 25 THR HA . c30643_6pv2 1 172 . 1 . 1 25 25 THR HB H 1 3.999 0.001 . 1 . . . . A 25 THR HB . c30643_6pv2 1 173 . 1 . 1 25 25 THR HG21 H 1 1.154 0.000 . 1 . . . . A 25 THR HG21 . c30643_6pv2 1 174 . 1 . 1 25 25 THR HG22 H 1 1.154 0.000 . 1 . . . . A 25 THR HG22 . c30643_6pv2 1 175 . 1 . 1 25 25 THR HG23 H 1 1.154 0.000 . 1 . . . . A 25 THR HG23 . c30643_6pv2 1 176 . 1 . 1 26 26 HIS H H 1 7.009 0.000 . 1 . . . . A 26 HIS H . c30643_6pv2 1 177 . 1 . 1 26 26 HIS HA H 1 4.396 0.000 . 1 . . . . A 26 HIS HA . c30643_6pv2 1 178 . 1 . 1 26 26 HIS HB2 H 1 2.231 0.001 . 2 . . . . A 26 HIS HB2 . c30643_6pv2 1 179 . 1 . 1 26 26 HIS HB3 H 1 1.552 0.000 . 2 . . . . A 26 HIS HB3 . c30643_6pv2 1 180 . 1 . 1 26 26 HIS HD2 H 1 6.330 0.000 . 1 . . . . A 26 HIS HD2 . c30643_6pv2 1 181 . 1 . 1 26 26 HIS HE1 H 1 8.078 0.000 . 1 . . . . A 26 HIS HE1 . c30643_6pv2 1 182 . 1 . 1 27 27 THR H H 1 7.538 0.001 . 1 . . . . A 27 THR H . c30643_6pv2 1 183 . 1 . 1 27 27 THR HA H 1 4.239 0.002 . 1 . . . . A 27 THR HA . c30643_6pv2 1 184 . 1 . 1 27 27 THR HB H 1 4.277 0.001 . 1 . . . . A 27 THR HB . c30643_6pv2 1 185 . 1 . 1 27 27 THR HG21 H 1 1.139 0.001 . 1 . . . . A 27 THR HG21 . c30643_6pv2 1 186 . 1 . 1 27 27 THR HG22 H 1 1.139 0.001 . 1 . . . . A 27 THR HG22 . c30643_6pv2 1 187 . 1 . 1 27 27 THR HG23 H 1 1.139 0.001 . 1 . . . . A 27 THR HG23 . c30643_6pv2 1 188 . 1 . 1 28 28 GLY H H 1 8.225 0.000 . 1 . . . . A 28 GLY H . c30643_6pv2 1 189 . 1 . 1 28 28 GLY HA2 H 1 4.045 0.000 . 2 . . . . A 28 GLY HA2 . c30643_6pv2 1 190 . 1 . 1 28 28 GLY HA3 H 1 3.958 0.000 . 2 . . . . A 28 GLY HA3 . c30643_6pv2 1 191 . 1 . 1 29 29 GLU H H 1 8.146 0.001 . 1 . . . . A 29 GLU H . c30643_6pv2 1 192 . 1 . 1 29 29 GLU HA H 1 4.242 0.001 . 1 . . . . A 29 GLU HA . c30643_6pv2 1 193 . 1 . 1 29 29 GLU HB2 H 1 2.044 0.003 . 2 . . . . A 29 GLU HB2 . c30643_6pv2 1 194 . 1 . 1 29 29 GLU HB3 H 1 1.941 0.001 . 2 . . . . A 29 GLU HB3 . c30643_6pv2 1 195 . 1 . 1 29 29 GLU HG2 H 1 2.252 0.001 . 1 . . . . A 29 GLU HG2 . c30643_6pv2 1 196 . 1 . 1 29 29 GLU HG3 H 1 2.252 0.001 . 1 . . . . A 29 GLU HG3 . c30643_6pv2 1 197 . 1 . 1 30 30 LYS H H 1 8.421 0.001 . 1 . . . . A 30 LYS H . c30643_6pv2 1 198 . 1 . 1 30 30 LYS HA H 1 4.226 0.001 . 1 . . . . A 30 LYS HA . c30643_6pv2 1 199 . 1 . 1 30 30 LYS HB2 H 1 1.822 0.001 . 2 . . . . A 30 LYS HB2 . c30643_6pv2 1 200 . 1 . 1 30 30 LYS HB3 H 1 1.741 0.001 . 2 . . . . A 30 LYS HB3 . c30643_6pv2 1 201 . 1 . 1 30 30 LYS HG2 H 1 1.441 0.001 . 2 . . . . A 30 LYS HG2 . c30643_6pv2 1 202 . 1 . 1 30 30 LYS HG3 H 1 1.379 0.002 . 2 . . . . A 30 LYS HG3 . c30643_6pv2 1 203 . 1 . 1 30 30 LYS HD2 H 1 1.652 0.001 . 1 . . . . A 30 LYS HD2 . c30643_6pv2 1 204 . 1 . 1 30 30 LYS HD3 H 1 1.652 0.001 . 1 . . . . A 30 LYS HD3 . c30643_6pv2 1 205 . 1 . 1 30 30 LYS HE2 H 1 2.975 0.003 . 1 . . . . A 30 LYS HE2 . c30643_6pv2 1 206 . 1 . 1 30 30 LYS HE3 H 1 2.975 0.003 . 1 . . . . A 30 LYS HE3 . c30643_6pv2 1 stop_ save_ save_conformer_statistics _Conformer_stat_list.Sf_category conformer_statistics _Conformer_stat_list.Sf_framecode conformer_statistics _Conformer_stat_list.Entry_ID c30643_6pv2 _Conformer_stat_list.ID 1 _Conformer_stat_list.Conf_family_coord_set_ID 1 _Conformer_stat_list.Conf_family_coord_set_label $Original_constraints_and_structures _Conformer_stat_list.Conformer_submitted_total_num 10 save_ 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 c30643_6pv2 _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 . . . c30643_6pv2 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 . . . . c30643_6pv2 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 ARG C C 11.491 -1.611 3.786 . . . 1.0 . . . . . . . . . . . . A . 1 ARG C . . . . . . . . . c30643_6pv2 1 . 1 . 2 . 1 1 1 ARG CA C 12.409 -2.340 4.762 . . . 1.0 . . . . . . . . . . . . A . 1 ARG CA . . . . . . . . . c30643_6pv2 1 . 1 . 3 . 1 1 1 ARG CB C 11.605 -2.876 5.955 . . . 1.0 . . . . . . . . . . . . A . 1 ARG CB . . . . . . . . . c30643_6pv2 1 . 1 . 4 . 1 1 1 ARG CD C 10.124 -2.387 7.935 . . . 1.0 . . . . . . . . . . . . A . 1 ARG CD . . . . . . . . . c30643_6pv2 1 . 1 . 5 . 1 1 1 ARG CG C 10.887 -1.799 6.757 . . . 1.0 . . . . . . . . . . . . A . 1 ARG CG . . . . . . . . . c30643_6pv2 1 . 1 . 6 . 1 1 1 ARG CZ C 10.719 -4.024 9.686 . . . 1.0 . . . . . . . . . . . . A . 1 ARG CZ . . . . . . . . . c30643_6pv2 1 . 1 . 7 . 1 1 1 ARG H1 H 14.074 -1.901 5.929 . . . 1.0 . . . . . . . . . . . . A . 1 ARG H1 . . . . . . . . . c30643_6pv2 1 . 1 . 8 . 1 1 1 ARG H2 H 13.055 -0.577 5.658 . . . 1.0 . . . . . . . . . . . . A . 1 ARG H2 . . . . . . . . . c30643_6pv2 1 . 1 . 9 . 1 1 1 ARG H3 H 14.065 -1.133 4.423 . . . 1.0 . . . . . . . . . . . . A . 1 ARG H3 . . . . . . . . . c30643_6pv2 1 . 1 . 10 . 1 1 1 ARG HA H 12.878 -3.167 4.249 . . . 1.0 . . . . . . . . . . . . A . 1 ARG HA . . . . . . . . . c30643_6pv2 1 . 1 . 11 . 1 1 1 ARG HB2 H 10.864 -3.570 5.589 . . . 1.0 . . . . . . . . . . . . A . 1 ARG HB2 . . . . . . . . . c30643_6pv2 1 . 1 . 12 . 1 1 1 ARG HB3 H 12.276 -3.399 6.619 . . . 1.0 . . . . . . . . . . . . A . 1 ARG HB3 . . . . . . . . . c30643_6pv2 1 . 1 . 13 . 1 1 1 ARG HD2 H 9.539 -1.604 8.397 . . . 1.0 . . . . . . . . . . . . A . 1 ARG HD2 . . . . . . . . . c30643_6pv2 1 . 1 . 14 . 1 1 1 ARG HD3 H 9.463 -3.160 7.571 . . . 1.0 . . . . . . . . . . . . A . 1 ARG HD3 . . . . . . . . . c30643_6pv2 1 . 1 . 15 . 1 1 1 ARG HE H 11.887 -2.521 9.074 . . . 1.0 . . . . . . . . . . . . A . 1 ARG HE . . . . . . . . . c30643_6pv2 1 . 1 . 16 . 1 1 1 ARG HG2 H 11.618 -1.094 7.128 . . . 1.0 . . . . . . . . . . . . A . 1 ARG HG2 . . . . . . . . . c30643_6pv2 1 . 1 . 17 . 1 1 1 ARG HG3 H 10.191 -1.288 6.108 . . . 1.0 . . . . . . . . . . . . A . 1 ARG HG3 . . . . . . . . . c30643_6pv2 1 . 1 . 18 . 1 1 1 ARG HH11 H 9.342 -5.457 10.083 . . . 1.0 . . . . . . . . . . . . A . 1 ARG HH11 . . . . . . . . . c30643_6pv2 1 . 1 . 19 . 1 1 1 ARG HH12 H 8.907 -4.337 8.835 . . . 1.0 . . . . . . . . . . . . A . 1 ARG HH12 . . . . . . . . . c30643_6pv2 1 . 1 . 20 . 1 1 1 ARG HH21 H 12.462 -3.981 10.719 . . . 1.0 . . . . . . . . . . . . A . 1 ARG HH21 . . . . . . . . . c30643_6pv2 1 . 1 . 21 . 1 1 1 ARG HH22 H 11.368 -5.254 11.163 . . . 1.0 . . . . . . . . . . . . A . 1 ARG HH22 . . . . . . . . . c30643_6pv2 1 . 1 . 22 . 1 1 1 ARG N N 13.473 -1.425 5.228 . . . 1.0 . . . . . . . . . . . . A . 1 ARG N . . . . . . . . . c30643_6pv2 1 . 1 . 23 . 1 1 1 ARG NE N 11.017 -2.961 8.940 . . . 1.0 . . . . . . . . . . . . A . 1 ARG NE . . . . . . . . . c30643_6pv2 1 . 1 . 24 . 1 1 1 ARG NH1 N 9.564 -4.656 9.521 . . . 1.0 . . . . . . . . . . . . A . 1 ARG NH1 . . . . . . . . . c30643_6pv2 1 . 1 . 25 . 1 1 1 ARG NH2 N 11.585 -4.456 10.595 . . . 1.0 . . . . . . . . . . . . A . 1 ARG NH2 . . . . . . . . . c30643_6pv2 1 . 1 . 26 . 1 1 1 ARG O O 11.153 -0.448 3.998 . . . 1.0 . . . . . . . . . . . . A . 1 ARG O . . . . . . . . . c30643_6pv2 1 . 1 . 27 . 1 1 2 PRO C C 8.747 -1.686 2.176 . . . 1.0 . . . . . . . . . . . . A . 2 PRO C . . . . . . . . . c30643_6pv2 1 . 1 . 28 . 1 1 2 PRO CA C 10.193 -1.683 1.699 . . . 1.0 . . . . . . . . . . . . A . 2 PRO CA . . . . . . . . . c30643_6pv2 1 . 1 . 29 . 1 1 2 PRO CB C 10.355 -2.601 0.489 . . . 1.0 . . . . . . . . . . . . A . 2 PRO CB . . . . . . . . . c30643_6pv2 1 . 1 . 30 . 1 1 2 PRO CD C 11.486 -3.652 2.320 . . . 1.0 . . . . . . . . . . . . A . 2 PRO CD . . . . . . . . . c30643_6pv2 1 . 1 . 31 . 1 1 2 PRO CG C 10.675 -3.931 1.078 . . . 1.0 . . . . . . . . . . . . A . 2 PRO CG . . . . . . . . . c30643_6pv2 1 . 1 . 32 . 1 1 2 PRO HA H 10.488 -0.677 1.440 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HA . . . . . . . . . c30643_6pv2 1 . 1 . 33 . 1 1 2 PRO HB2 H 9.432 -2.626 -0.074 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HB2 . . . . . . . . . c30643_6pv2 1 . 1 . 34 . 1 1 2 PRO HB3 H 11.161 -2.241 -0.136 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HB3 . . . . . . . . . c30643_6pv2 1 . 1 . 35 . 1 1 2 PRO HD2 H 11.228 -4.350 3.103 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HD2 . . . . . . . . . c30643_6pv2 1 . 1 . 36 . 1 1 2 PRO HD3 H 12.542 -3.704 2.099 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HD3 . . . . . . . . . c30643_6pv2 1 . 1 . 37 . 1 1 2 PRO HG2 H 9.760 -4.445 1.334 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HG2 . . . . . . . . . c30643_6pv2 1 . 1 . 38 . 1 1 2 PRO HG3 H 11.250 -4.515 0.375 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HG3 . . . . . . . . . c30643_6pv2 1 . 1 . 39 . 1 1 2 PRO N N 11.093 -2.275 2.688 . . . 1.0 . . . . . . . . . . . . A . 2 PRO N . . . . . . . . . c30643_6pv2 1 . 1 . 40 . 1 1 2 PRO O O 8.378 -2.451 3.070 . . . 1.0 . . . . . . . . . . . . A . 2 PRO O . . . . . . . . . c30643_6pv2 1 . 1 . 41 . 1 1 3 PHE C C 5.729 -1.669 1.016 . . . 1.0 . . . . . . . . . . . . A . 3 PHE C . . . . . . . . . c30643_6pv2 1 . 1 . 42 . 1 1 3 PHE CA C 6.529 -0.759 1.931 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CA . . . . . . . . . c30643_6pv2 1 . 1 . 43 . 1 1 3 PHE CB C 6.040 0.685 1.844 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CB . . . . . . . . . c30643_6pv2 1 . 1 . 44 . 1 1 3 PHE CD1 C 7.791 2.398 2.375 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CD1 . . . . . . . . . c30643_6pv2 1 . 1 . 45 . 1 1 3 PHE CD2 C 6.371 1.642 4.132 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CD2 . . . . . . . . . c30643_6pv2 1 . 1 . 46 . 1 1 3 PHE CE1 C 8.446 3.230 3.259 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CE1 . . . . . . . . . c30643_6pv2 1 . 1 . 47 . 1 1 3 PHE CE2 C 7.022 2.473 5.021 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CE2 . . . . . . . . . c30643_6pv2 1 . 1 . 48 . 1 1 3 PHE CG C 6.747 1.596 2.802 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CG . . . . . . . . . c30643_6pv2 1 . 1 . 49 . 1 1 3 PHE CZ C 8.062 3.269 4.585 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CZ . . . . . . . . . c30643_6pv2 1 . 1 . 50 . 1 1 3 PHE H H 8.279 -0.254 0.863 . . . 1.0 . . . . . . . . . . . . A . 3 PHE H . . . . . . . . . c30643_6pv2 1 . 1 . 51 . 1 1 3 PHE HA H 6.424 -1.109 2.949 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HA . . . . . . . . . c30643_6pv2 1 . 1 . 52 . 1 1 3 PHE HB2 H 6.203 1.057 0.845 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HB2 . . . . . . . . . c30643_6pv2 1 . 1 . 53 . 1 1 3 PHE HB3 H 4.988 0.717 2.069 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HB3 . . . . . . . . . c30643_6pv2 1 . 1 . 54 . 1 1 3 PHE HD1 H 8.092 2.369 1.337 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HD1 . . . . . . . . . c30643_6pv2 1 . 1 . 55 . 1 1 3 PHE HD2 H 5.556 1.021 4.472 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HD2 . . . . . . . . . c30643_6pv2 1 . 1 . 56 . 1 1 3 PHE HE1 H 9.259 3.850 2.913 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HE1 . . . . . . . . . c30643_6pv2 1 . 1 . 57 . 1 1 3 PHE HE2 H 6.718 2.500 6.056 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HE2 . . . . . . . . . c30643_6pv2 1 . 1 . 58 . 1 1 3 PHE HZ H 8.574 3.920 5.278 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HZ . . . . . . . . . c30643_6pv2 1 . 1 . 59 . 1 1 3 PHE N N 7.933 -0.836 1.578 . . . 1.0 . . . . . . . . . . . . A . 3 PHE N . . . . . . . . . c30643_6pv2 1 . 1 . 60 . 1 1 3 PHE O O 5.180 -1.238 0.005 . . . 1.0 . . . . . . . . . . . . A . 3 PHE O . . . . . . . . . c30643_6pv2 1 . 1 . 61 . 1 1 4 NLE C C 3.694 -4.309 0.971 . . . 1.0 . . . . . . . . . . . . A . 4 NLE C . . . . . . . . . c30643_6pv2 1 . 1 . 62 . 1 1 4 NLE CA C 5.109 -3.961 0.524 . . . 1.0 . . . . . . . . . . . . A . 4 NLE CA . . . . . . . . . c30643_6pv2 1 . 1 . 63 . 1 1 4 NLE CB C 5.992 -5.217 0.550 . . . 1.0 . . . . . . . . . . . . A . 4 NLE CB . . . . . . . . . c30643_6pv2 1 . 1 . 64 . 1 1 4 NLE CD C 6.360 -7.591 -0.176 . . . 1.0 . . . . . . . . . . . . A . 4 NLE CD . . . . . . . . . c30643_6pv2 1 . 1 . 65 . 1 1 4 NLE CE C 5.785 -8.737 -0.978 . . . 1.0 . . . . . . . . . . . . A . 4 NLE CE . . . . . . . . . c30643_6pv2 1 . 1 . 66 . 1 1 4 NLE CG C 5.453 -6.376 -0.273 . . . 1.0 . . . . . . . . . . . . A . 4 NLE CG . . . . . . . . . c30643_6pv2 1 . 1 . 67 . 1 1 4 NLE H H 6.072 -3.198 2.238 . . . 1.0 . . . . . . . . . . . . A . 4 NLE H . . . . . . . . . c30643_6pv2 1 . 1 . 68 . 1 1 4 NLE HA H 5.072 -3.577 -0.482 . . . 1.0 . . . . . . . . . . . . A . 4 NLE HA . . . . . . . . . c30643_6pv2 1 . 1 . 69 . 1 1 4 NLE HB2 H 6.089 -5.549 1.573 . . . 1.0 . . . . . . . . . . . . A . 4 NLE HB2 . . . . . . . . . c30643_6pv2 1 . 1 . 70 . 1 1 4 NLE HB3 H 6.972 -4.963 0.172 . . . 1.0 . . . . . . . . . . . . A . 4 NLE HB3 . . . . . . . . . c30643_6pv2 1 . 1 . 71 . 1 1 4 NLE HD2 H 6.444 -7.896 0.857 . . . 1.0 . . . . . . . . . . . . A . 4 NLE HD2 . . . . . . . . . c30643_6pv2 1 . 1 . 72 . 1 1 4 NLE HD3 H 7.335 -7.346 -0.572 . . . 1.0 . . . . . . . . . . . . A . 4 NLE HD3 . . . . . . . . . c30643_6pv2 1 . 1 . 73 . 1 1 4 NLE HE1 H 4.809 -8.992 -0.592 . . . 1.0 . . . . . . . . . . . . A . 4 NLE HE1 . . . . . . . . . c30643_6pv2 1 . 1 . 74 . 1 1 4 NLE HE2 H 6.438 -9.595 -0.901 . . . 1.0 . . . . . . . . . . . . A . 4 NLE HE2 . . . . . . . . . c30643_6pv2 1 . 1 . 75 . 1 1 4 NLE HE3 H 5.697 -8.444 -2.013 . . . 1.0 . . . . . . . . . . . . A . 4 NLE HE3 . . . . . . . . . c30643_6pv2 1 . 1 . 76 . 1 1 4 NLE HG2 H 5.381 -6.072 -1.308 . . . 1.0 . . . . . . . . . . . . A . 4 NLE HG2 . . . . . . . . . c30643_6pv2 1 . 1 . 77 . 1 1 4 NLE HG3 H 4.473 -6.641 0.094 . . . 1.0 . . . . . . . . . . . . A . 4 NLE HG3 . . . . . . . . . c30643_6pv2 1 . 1 . 78 . 1 1 4 NLE N N 5.696 -2.939 1.372 . . . 1.0 . . . . . . . . . . . . A . 4 NLE N . . . . . . . . . c30643_6pv2 1 . 1 . 79 . 1 1 4 NLE O O 3.432 -4.514 2.158 . . . 1.0 . . . . . . . . . . . . A . 4 NLE O . . . . . . . . . c30643_6pv2 1 . 1 . 80 . 1 1 5 CYS C C 1.456 -6.349 0.365 . . . 1.0 . . . . . . . . . . . . A . 5 CYS C . . . . . . . . . c30643_6pv2 1 . 1 . 81 . 1 1 5 CYS CA C 1.437 -4.826 0.261 . . . 1.0 . . . . . . . . . . . . A . 5 CYS CA . . . . . . . . . c30643_6pv2 1 . 1 . 82 . 1 1 5 CYS CB C 0.491 -4.373 -0.860 . . . 1.0 . . . . . . . . . . . . A . 5 CYS CB . . . . . . . . . c30643_6pv2 1 . 1 . 83 . 1 1 5 CYS H H 3.026 -4.062 -0.896 . . . 1.0 . . . . . . . . . . . . A . 5 CYS H . . . . . . . . . c30643_6pv2 1 . 1 . 84 . 1 1 5 CYS HA H 1.104 -4.409 1.199 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HA . . . . . . . . . c30643_6pv2 1 . 1 . 85 . 1 1 5 CYS HB2 H 0.517 -3.295 -0.931 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HB2 . . . . . . . . . c30643_6pv2 1 . 1 . 86 . 1 1 5 CYS HB3 H 0.824 -4.797 -1.794 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HB3 . . . . . . . . . c30643_6pv2 1 . 1 . 87 . 1 1 5 CYS N N 2.783 -4.354 0.010 . . . 1.0 . . . . . . . . . . . . A . 5 CYS N . . . . . . . . . c30643_6pv2 1 . 1 . 88 . 1 1 5 CYS O O 2.266 -7.007 -0.282 . . . 1.0 . . . . . . . . . . . . A . 5 CYS O . . . . . . . . . c30643_6pv2 1 . 1 . 89 . 1 1 5 CYS SG S -1.235 -4.863 -0.613 . . . 1.0 . . . . . . . . . . . . A . 5 CYS SG . . . . . . . . . c30643_6pv2 1 . 1 . 90 . 1 1 6 THR C C -0.973 -8.727 1.553 . . . 1.0 . . . . . . . . . . . . A . 6 THR C . . . . . . . . . c30643_6pv2 1 . 1 . 91 . 1 1 6 THR CA C 0.488 -8.349 1.318 . . . 1.0 . . . . . . . . . . . . A . 6 THR CA . . . . . . . . . c30643_6pv2 1 . 1 . 92 . 1 1 6 THR CB C 1.388 -8.904 2.445 . . . 1.0 . . . . . . . . . . . . A . 6 THR CB . . . . . . . . . c30643_6pv2 1 . 1 . 93 . 1 1 6 THR CG2 C 1.482 -10.422 2.371 . . . 1.0 . . . . . . . . . . . . A . 6 THR CG2 . . . . . . . . . c30643_6pv2 1 . 1 . 94 . 1 1 6 THR H H 0.053 -6.338 1.779 . . . 1.0 . . . . . . . . . . . . A . 6 THR H . . . . . . . . . c30643_6pv2 1 . 1 . 95 . 1 1 6 THR HA H 0.809 -8.779 0.380 . . . 1.0 . . . . . . . . . . . . A . 6 THR HA . . . . . . . . . c30643_6pv2 1 . 1 . 96 . 1 1 6 THR HB H 0.966 -8.623 3.399 . . . 1.0 . . . . . . . . . . . . A . 6 THR HB . . . . . . . . . c30643_6pv2 1 . 1 . 97 . 1 1 6 THR HG1 H 2.805 -7.943 1.453 . . . 1.0 . . . . . . . . . . . . A . 6 THR HG1 . . . . . . . . . c30643_6pv2 1 . 1 . 98 . 1 1 6 THR HG21 H 1.909 -10.711 1.423 . . . 1.0 . . . . . . . . . . . . A . 6 THR HG21 . . . . . . . . . c30643_6pv2 1 . 1 . 99 . 1 1 6 THR HG22 H 0.494 -10.847 2.465 . . . 1.0 . . . . . . . . . . . . A . 6 THR HG22 . . . . . . . . . c30643_6pv2 1 . 1 . 100 . 1 1 6 THR HG23 H 2.107 -10.783 3.173 . . . 1.0 . . . . . . . . . . . . A . 6 THR HG23 . . . . . . . . . c30643_6pv2 1 . 1 . 101 . 1 1 6 THR N N 0.607 -6.906 1.208 . . . 1.0 . . . . . . . . . . . . A . 6 THR N . . . . . . . . . c30643_6pv2 1 . 1 . 102 . 1 1 6 THR O O -1.321 -9.411 2.518 . . . 1.0 . . . . . . . . . . . . A . 6 THR O . . . . . . . . . c30643_6pv2 1 . 1 . 103 . 1 1 6 THR OG1 O 2.709 -8.348 2.325 . . . 1.0 . . . . . . . . . . . . A . 6 THR OG1 . . . . . . . . . c30643_6pv2 1 . 1 . 104 . 1 1 7 TRP C C -3.562 -9.839 0.044 . . . 1.0 . . . . . . . . . . . . A . 7 TRP C . . . . . . . . . c30643_6pv2 1 . 1 . 105 . 1 1 7 TRP CA C -3.254 -8.526 0.749 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CA . . . . . . . . . c30643_6pv2 1 . 1 . 106 . 1 1 7 TRP CB C -4.050 -7.377 0.122 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CB . . . . . . . . . c30643_6pv2 1 . 1 . 107 . 1 1 7 TRP CD1 C -6.440 -8.172 -0.339 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CD1 . . . . . . . . . c30643_6pv2 1 . 1 . 108 . 1 1 7 TRP CD2 C -6.254 -6.753 1.378 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CD2 . . . . . . . . . c30643_6pv2 1 . 1 . 109 . 1 1 7 TRP CE2 C -7.609 -7.107 1.234 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CE2 . . . . . . . . . c30643_6pv2 1 . 1 . 110 . 1 1 7 TRP CE3 C -5.892 -5.868 2.393 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CE3 . . . . . . . . . c30643_6pv2 1 . 1 . 111 . 1 1 7 TRP CG C -5.525 -7.448 0.367 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CG . . . . . . . . . c30643_6pv2 1 . 1 . 112 . 1 1 7 TRP CH2 C -8.217 -5.736 3.057 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CH2 . . . . . . . . . c30643_6pv2 1 . 1 . 113 . 1 1 7 TRP CZ2 C -8.601 -6.603 2.070 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CZ2 . . . . . . . . . c30643_6pv2 1 . 1 . 114 . 1 1 7 TRP CZ3 C -6.877 -5.367 3.222 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CZ3 . . . . . . . . . c30643_6pv2 1 . 1 . 115 . 1 1 7 TRP H H -1.494 -7.711 -0.082 . . . 1.0 . . . . . . . . . . . . A . 7 TRP H . . . . . . . . . c30643_6pv2 1 . 1 . 116 . 1 1 7 TRP HA H -3.519 -8.615 1.791 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HA . . . . . . . . . c30643_6pv2 1 . 1 . 117 . 1 1 7 TRP HB2 H -3.694 -6.440 0.524 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HB2 . . . . . . . . . c30643_6pv2 1 . 1 . 118 . 1 1 7 TRP HB3 H -3.891 -7.383 -0.942 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HB3 . . . . . . . . . c30643_6pv2 1 . 1 . 119 . 1 1 7 TRP HD1 H -6.194 -8.807 -1.177 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HD1 . . . . . . . . . c30643_6pv2 1 . 1 . 120 . 1 1 7 TRP HE1 H -8.521 -8.393 -0.155 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HE1 . . . . . . . . . c30643_6pv2 1 . 1 . 121 . 1 1 7 TRP HE3 H -4.861 -5.573 2.533 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HE3 . . . . . . . . . c30643_6pv2 1 . 1 . 122 . 1 1 7 TRP HH2 H -8.954 -5.319 3.728 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HH2 . . . . . . . . . c30643_6pv2 1 . 1 . 123 . 1 1 7 TRP HZ2 H -9.640 -6.879 1.954 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HZ2 . . . . . . . . . c30643_6pv2 1 . 1 . 124 . 1 1 7 TRP HZ3 H -6.615 -4.679 4.013 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HZ3 . . . . . . . . . c30643_6pv2 1 . 1 . 125 . 1 1 7 TRP N N -1.832 -8.252 0.663 . . . 1.0 . . . . . . . . . . . . A . 7 TRP N . . . . . . . . . c30643_6pv2 1 . 1 . 126 . 1 1 7 TRP NE1 N -7.696 -7.978 0.179 . . . 1.0 . . . . . . . . . . . . A . 7 TRP NE1 . . . . . . . . . c30643_6pv2 1 . 1 . 127 . 1 1 7 TRP O O -3.979 -9.856 -1.117 . . . 1.0 . . . . . . . . . . . . A . 7 TRP O . . . . . . . . . c30643_6pv2 1 . 1 . 128 . 1 1 8 ORN C C -1.410 -10.831 -3.223 . . . 1.0 . . . . . . . . . . . . A . 8 ORN C . . . . . . . . . c30643_6pv2 1 . 1 . 129 . 1 1 8 ORN CA C -2.030 -12.019 -2.504 . . . 1.0 . . . . . . . . . . . . A . 8 ORN CA . . . . . . . . . c30643_6pv2 1 . 1 . 130 . 1 1 8 ORN CB C -1.394 -12.168 -1.120 . . . 1.0 . . . . . . . . . . . . A . 8 ORN CB . . . . . . . . . c30643_6pv2 1 . 1 . 131 . 1 1 8 ORN CD C -3.523 -12.292 0.217 . . . 1.0 . . . . . . . . . . . . A . 8 ORN CD . . . . . . . . . c30643_6pv2 1 . 1 . 132 . 1 1 8 ORN CG C -2.218 -12.992 -0.142 . . . 1.0 . . . . . . . . . . . . A . 8 ORN CG . . . . . . . . . c30643_6pv2 1 . 1 . 133 . 1 1 8 ORN H H -2.310 -14.061 -2.800 . . . 1.0 . . . . . . . . . . . . A . 8 ORN H . . . . . . . . . c30643_6pv2 1 . 1 . 134 . 1 1 8 ORN HA H -3.088 -11.837 -2.387 . . . 1.0 . . . . . . . . . . . . A . 8 ORN HA . . . . . . . . . c30643_6pv2 1 . 1 . 135 . 1 1 8 ORN HB2 H -1.255 -11.185 -0.696 . . . 1.0 . . . . . . . . . . . . A . 8 ORN HB2 . . . . . . . . . c30643_6pv2 1 . 1 . 136 . 1 1 8 ORN HB3 H -0.431 -12.641 -1.230 . . . 1.0 . . . . . . . . . . . . A . 8 ORN HB3 . . . . . . . . . c30643_6pv2 1 . 1 . 137 . 1 1 8 ORN HD2 H -4.033 -12.872 0.971 . . . 1.0 . . . . . . . . . . . . A . 8 ORN HD2 . . . . . . . . . c30643_6pv2 1 . 1 . 138 . 1 1 8 ORN HD3 H -4.140 -12.230 -0.664 . . . 1.0 . . . . . . . . . . . . A . 8 ORN HD3 . . . . . . . . . c30643_6pv2 1 . 1 . 139 . 1 1 8 ORN HE1 H -2.931 -10.852 1.637 . . . 1.0 . . . . . . . . . . . . A . 8 ORN HE1 . . . . . . . . . c30643_6pv2 1 . 1 . 140 . 1 1 8 ORN HG2 H -1.641 -13.144 0.759 . . . 1.0 . . . . . . . . . . . . A . 8 ORN HG2 . . . . . . . . . c30643_6pv2 1 . 1 . 141 . 1 1 8 ORN HG3 H -2.445 -13.948 -0.592 . . . 1.0 . . . . . . . . . . . . A . 8 ORN HG3 . . . . . . . . . c30643_6pv2 1 . 1 . 142 . 1 1 8 ORN N N -1.857 -13.263 -3.288 . . . 1.0 . . . . . . . . . . . . A . 8 ORN N . . . . . . . . . c30643_6pv2 1 . 1 . 143 . 1 1 8 ORN NE N -3.300 -10.942 0.730 . . . 1.0 . . . . . . . . . . . . A . 8 ORN NE . . . . . . . . . c30643_6pv2 1 . 1 . 144 . 1 1 8 ORN O O -0.330 -10.938 -3.800 . . . 1.0 . . . . . . . . . . . . A . 8 ORN O . . . . . . . . . c30643_6pv2 1 . 1 . 145 . 1 1 9 CYS C C -0.352 -8.016 -3.040 . . . 1.0 . . . . . . . . . . . . A . 9 CYS C . . . . . . . . . c30643_6pv2 1 . 1 . 146 . 1 1 9 CYS CA C -1.616 -8.463 -3.767 . . . 1.0 . . . . . . . . . . . . A . 9 CYS CA . . . . . . . . . c30643_6pv2 1 . 1 . 147 . 1 1 9 CYS CB C -2.700 -7.390 -3.662 . . . 1.0 . . . . . . . . . . . . A . 9 CYS CB . . . . . . . . . c30643_6pv2 1 . 1 . 148 . 1 1 9 CYS H H -2.989 -9.705 -2.749 . . . 1.0 . . . . . . . . . . . . A . 9 CYS H . . . . . . . . . c30643_6pv2 1 . 1 . 149 . 1 1 9 CYS HA H -1.389 -8.640 -4.807 . . . 1.0 . . . . . . . . . . . . A . 9 CYS HA . . . . . . . . . c30643_6pv2 1 . 1 . 150 . 1 1 9 CYS HB2 H -3.538 -7.674 -4.278 . . . 1.0 . . . . . . . . . . . . A . 9 CYS HB2 . . . . . . . . . c30643_6pv2 1 . 1 . 151 . 1 1 9 CYS HB3 H -3.025 -7.324 -2.636 . . . 1.0 . . . . . . . . . . . . A . 9 CYS HB3 . . . . . . . . . c30643_6pv2 1 . 1 . 152 . 1 1 9 CYS N N -2.110 -9.704 -3.189 . . . 1.0 . . . . . . . . . . . . A . 9 CYS N . . . . . . . . . c30643_6pv2 1 . 1 . 153 . 1 1 9 CYS O O -0.388 -7.761 -1.834 . . . 1.0 . . . . . . . . . . . . A . 9 CYS O . . . . . . . . . c30643_6pv2 1 . 1 . 154 . 1 1 9 CYS SG S -2.177 -5.742 -4.177 . . . 1.0 . . . . . . . . . . . . A . 9 CYS SG . . . . . . . . . c30643_6pv2 1 . 1 . 155 . 1 1 10 GLY C C 2.867 -6.607 -3.852 . . . 1.0 . . . . . . . . . . . . A . 10 GLY C . . . . . . . . . c30643_6pv2 1 . 1 . 156 . 1 1 10 GLY CA C 2.027 -7.638 -3.127 . . . 1.0 . . . . . . . . . . . . A . 10 GLY CA . . . . . . . . . c30643_6pv2 1 . 1 . 157 . 1 1 10 GLY H H 0.715 -8.034 -4.740 . . . 1.0 . . . . . . . . . . . . A . 10 GLY H . . . . . . . . . c30643_6pv2 1 . 1 . 158 . 1 1 10 GLY HA2 H 1.837 -7.283 -2.125 . . . 1.0 . . . . . . . . . . . . A . 10 GLY HA2 . . . . . . . . . c30643_6pv2 1 . 1 . 159 . 1 1 10 GLY HA3 H 2.586 -8.557 -3.066 . . . 1.0 . . . . . . . . . . . . A . 10 GLY HA3 . . . . . . . . . c30643_6pv2 1 . 1 . 160 . 1 1 10 GLY N N 0.758 -7.917 -3.767 . . . 1.0 . . . . . . . . . . . . A . 10 GLY N . . . . . . . . . c30643_6pv2 1 . 1 . 161 . 1 1 10 GLY O O 4.044 -6.843 -4.125 . . . 1.0 . . . . . . . . . . . . A . 10 GLY O . . . . . . . . . c30643_6pv2 1 . 1 . 162 . 1 1 11 LYS C C 3.951 -3.726 -3.736 . . . 1.0 . . . . . . . . . . . . A . 11 LYS C . . . . . . . . . c30643_6pv2 1 . 1 . 163 . 1 1 11 LYS CA C 3.028 -4.368 -4.766 . . . 1.0 . . . . . . . . . . . . A . 11 LYS CA . . . . . . . . . c30643_6pv2 1 . 1 . 164 . 1 1 11 LYS CB C 2.085 -3.312 -5.350 . . . 1.0 . . . . . . . . . . . . A . 11 LYS CB . . . . . . . . . c30643_6pv2 1 . 1 . 165 . 1 1 11 LYS CD C 0.559 -2.633 -7.225 . . . 1.0 . . . . . . . . . . . . A . 11 LYS CD . . . . . . . . . c30643_6pv2 1 . 1 . 166 . 1 1 11 LYS CE C -0.232 -3.095 -8.440 . . . 1.0 . . . . . . . . . . . . A . 11 LYS CE . . . . . . . . . c30643_6pv2 1 . 1 . 167 . 1 1 11 LYS CG C 1.315 -3.782 -6.573 . . . 1.0 . . . . . . . . . . . . A . 11 LYS CG . . . . . . . . . c30643_6pv2 1 . 1 . 168 . 1 1 11 LYS H H 1.321 -5.353 -3.988 . . . 1.0 . . . . . . . . . . . . A . 11 LYS H . . . . . . . . . c30643_6pv2 1 . 1 . 169 . 1 1 11 LYS HA H 3.630 -4.780 -5.562 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HA . . . . . . . . . c30643_6pv2 1 . 1 . 170 . 1 1 11 LYS HB2 H 1.369 -3.029 -4.592 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HB2 . . . . . . . . . c30643_6pv2 1 . 1 . 171 . 1 1 11 LYS HB3 H 2.664 -2.444 -5.626 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HB3 . . . . . . . . . c30643_6pv2 1 . 1 . 172 . 1 1 11 LYS HD2 H -0.124 -2.211 -6.504 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HD2 . . . . . . . . . c30643_6pv2 1 . 1 . 173 . 1 1 11 LYS HD3 H 1.269 -1.880 -7.534 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HD3 . . . . . . . . . c30643_6pv2 1 . 1 . 174 . 1 1 11 LYS HE2 H -0.939 -3.846 -8.127 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HE2 . . . . . . . . . c30643_6pv2 1 . 1 . 175 . 1 1 11 LYS HE3 H -0.765 -2.248 -8.847 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HE3 . . . . . . . . . c30643_6pv2 1 . 1 . 176 . 1 1 11 LYS HG2 H 2.012 -4.193 -7.289 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HG2 . . . . . . . . . c30643_6pv2 1 . 1 . 177 . 1 1 11 LYS HG3 H 0.610 -4.543 -6.275 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HG3 . . . . . . . . . c30643_6pv2 1 . 1 . 178 . 1 1 11 LYS HZ1 H 1.127 -4.517 -9.139 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HZ1 . . . . . . . . . c30643_6pv2 1 . 1 . 179 . 1 1 11 LYS HZ2 H 1.363 -2.973 -9.782 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HZ2 . . . . . . . . . c30643_6pv2 1 . 1 . 180 . 1 1 11 LYS HZ3 H 0.078 -3.928 -10.326 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HZ3 . . . . . . . . . c30643_6pv2 1 . 1 . 181 . 1 1 11 LYS N N 2.277 -5.462 -4.163 . . . 1.0 . . . . . . . . . . . . A . 11 LYS N . . . . . . . . . c30643_6pv2 1 . 1 . 182 . 1 1 11 LYS NZ N 0.645 -3.669 -9.494 . . . 1.0 . . . . . . . . . . . . A . 11 LYS NZ . . . . . . . . . c30643_6pv2 1 . 1 . 183 . 1 1 11 LYS O O 3.551 -3.492 -2.593 . . . 1.0 . . . . . . . . . . . . A . 11 LYS O . . . . . . . . . c30643_6pv2 1 . 1 . 184 . 1 1 12 ARG C C 6.315 -1.368 -3.527 . . . 1.0 . . . . . . . . . . . . A . 12 ARG C . . . . . . . . . c30643_6pv2 1 . 1 . 185 . 1 1 12 ARG CA C 6.169 -2.856 -3.243 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CA . . . . . . . . . c30643_6pv2 1 . 1 . 186 . 1 1 12 ARG CB C 7.529 -3.539 -3.392 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CB . . . . . . . . . c30643_6pv2 1 . 1 . 187 . 1 1 12 ARG CD C 8.896 -5.631 -3.164 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CD . . . . . . . . . c30643_6pv2 1 . 1 . 188 . 1 1 12 ARG CG C 7.501 -5.030 -3.109 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CG . . . . . . . . . c30643_6pv2 1 . 1 . 189 . 1 1 12 ARG CZ C 9.803 -7.712 -2.195 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CZ . . . . . . . . . c30643_6pv2 1 . 1 . 190 . 1 1 12 ARG H H 5.448 -3.677 -5.055 . . . 1.0 . . . . . . . . . . . . A . 12 ARG H . . . . . . . . . c30643_6pv2 1 . 1 . 191 . 1 1 12 ARG HA H 5.817 -2.985 -2.232 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HA . . . . . . . . . c30643_6pv2 1 . 1 . 192 . 1 1 12 ARG HB2 H 7.882 -3.393 -4.402 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HB2 . . . . . . . . . c30643_6pv2 1 . 1 . 193 . 1 1 12 ARG HB3 H 8.225 -3.077 -2.707 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HB3 . . . . . . . . . c30643_6pv2 1 . 1 . 194 . 1 1 12 ARG HD2 H 9.314 -5.454 -4.143 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HD2 . . . . . . . . . c30643_6pv2 1 . 1 . 195 . 1 1 12 ARG HD3 H 9.512 -5.151 -2.418 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HD3 . . . . . . . . . c30643_6pv2 1 . 1 . 196 . 1 1 12 ARG HE H 8.136 -7.586 -3.300 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HE . . . . . . . . . c30643_6pv2 1 . 1 . 197 . 1 1 12 ARG HG2 H 7.088 -5.190 -2.126 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HG2 . . . . . . . . . c30643_6pv2 1 . 1 . 198 . 1 1 12 ARG HG3 H 6.878 -5.514 -3.847 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HG3 . . . . . . . . . c30643_6pv2 1 . 1 . 199 . 1 1 12 ARG HH11 H 10.920 -6.061 -1.812 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH11 . . . . . . . . . c30643_6pv2 1 . 1 . 200 . 1 1 12 ARG HH12 H 11.520 -7.536 -1.128 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH12 . . . . . . . . . c30643_6pv2 1 . 1 . 201 . 1 1 12 ARG HH21 H 10.397 -9.506 -1.476 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH21 . . . . . . . . . c30643_6pv2 1 . 1 . 202 . 1 1 12 ARG HH22 H 8.942 -9.531 -2.420 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH22 . . . . . . . . . c30643_6pv2 1 . 1 . 203 . 1 1 12 ARG N N 5.188 -3.462 -4.135 . . . 1.0 . . . . . . . . . . . . A . 12 ARG N . . . . . . . . . c30643_6pv2 1 . 1 . 204 . 1 1 12 ARG NE N 8.880 -7.070 -2.910 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NE . . . . . . . . . c30643_6pv2 1 . 1 . 205 . 1 1 12 ARG NH1 N 10.829 -7.049 -1.671 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NH1 . . . . . . . . . c30643_6pv2 1 . 1 . 206 . 1 1 12 ARG NH2 N 9.705 -9.021 -2.014 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NH2 . . . . . . . . . c30643_6pv2 1 . 1 . 207 . 1 1 12 ARG O O 6.450 -0.955 -4.681 . . . 1.0 . . . . . . . . . . . . A . 12 ARG O . . . . . . . . . c30643_6pv2 1 . 1 . 208 . 1 1 13 PHE C C 7.588 1.383 -1.780 . . . 1.0 . . . . . . . . . . . . A . 13 PHE C . . . . . . . . . c30643_6pv2 1 . 1 . 209 . 1 1 13 PHE CA C 6.401 0.872 -2.585 . . . 1.0 . . . . . . . . . . . . A . 13 PHE CA . . . . . . . . . c30643_6pv2 1 . 1 . 210 . 1 1 13 PHE CB C 5.115 1.528 -2.080 . . . 1.0 . . . . . . . . . . . . A . 13 PHE CB . . . . . . . . . c30643_6pv2 1 . 1 . 211 . 1 1 13 PHE CD1 C 3.458 1.570 -3.957 . . . 1.0 . . . . . . . . . . . . A . 13 PHE CD1 . . . . . . . . . c30643_6pv2 1 . 1 . 212 . 1 1 13 PHE CD2 C 3.162 -0.026 -2.215 . . . 1.0 . . . . . . . . . . . . A . 13 PHE CD2 . . . . . . . . . c30643_6pv2 1 . 1 . 213 . 1 1 13 PHE CE1 C 2.329 1.093 -4.588 . . . 1.0 . . . . . . . . . . . . A . 13 PHE CE1 . . . . . . . . . c30643_6pv2 1 . 1 . 214 . 1 1 13 PHE CE2 C 2.033 -0.508 -2.840 . . . 1.0 . . . . . . . . . . . . A . 13 PHE CE2 . . . . . . . . . c30643_6pv2 1 . 1 . 215 . 1 1 13 PHE CG C 3.885 1.016 -2.764 . . . 1.0 . . . . . . . . . . . . A . 13 PHE CG . . . . . . . . . c30643_6pv2 1 . 1 . 216 . 1 1 13 PHE CZ C 1.616 0.053 -4.029 . . . 1.0 . . . . . . . . . . . . A . 13 PHE CZ . . . . . . . . . c30643_6pv2 1 . 1 . 217 . 1 1 13 PHE H H 6.201 -0.969 -1.575 . . . 1.0 . . . . . . . . . . . . A . 13 PHE H . . . . . . . . . c30643_6pv2 1 . 1 . 218 . 1 1 13 PHE HA H 6.540 1.120 -3.625 . . . 1.0 . . . . . . . . . . . . A . 13 PHE HA . . . . . . . . . c30643_6pv2 1 . 1 . 219 . 1 1 13 PHE HB2 H 5.012 1.338 -1.024 . . . 1.0 . . . . . . . . . . . . A . 13 PHE HB2 . . . . . . . . . c30643_6pv2 1 . 1 . 220 . 1 1 13 PHE HB3 H 5.172 2.593 -2.247 . . . 1.0 . . . . . . . . . . . . A . 13 PHE HB3 . . . . . . . . . c30643_6pv2 1 . 1 . 221 . 1 1 13 PHE HD1 H 4.015 2.385 -4.393 . . . 1.0 . . . . . . . . . . . . A . 13 PHE HD1 . . . . . . . . . c30643_6pv2 1 . 1 . 222 . 1 1 13 PHE HD2 H 3.493 -0.466 -1.286 . . . 1.0 . . . . . . . . . . . . A . 13 PHE HD2 . . . . . . . . . c30643_6pv2 1 . 1 . 223 . 1 1 13 PHE HE1 H 2.004 1.530 -5.518 . . . 1.0 . . . . . . . . . . . . A . 13 PHE HE1 . . . . . . . . . c30643_6pv2 1 . 1 . 224 . 1 1 13 PHE HE2 H 1.477 -1.321 -2.398 . . . 1.0 . . . . . . . . . . . . A . 13 PHE HE2 . . . . . . . . . c30643_6pv2 1 . 1 . 225 . 1 1 13 PHE HZ H 0.731 -0.321 -4.519 . . . 1.0 . . . . . . . . . . . . A . 13 PHE HZ . . . . . . . . . c30643_6pv2 1 . 1 . 226 . 1 1 13 PHE N N 6.296 -0.573 -2.469 . . . 1.0 . . . . . . . . . . . . A . 13 PHE N . . . . . . . . . c30643_6pv2 1 . 1 . 227 . 1 1 13 PHE O O 7.987 0.775 -0.782 . . . 1.0 . . . . . . . . . . . . A . 13 PHE O . . . . . . . . . c30643_6pv2 1 . 1 . 228 . 1 1 14 THR C C 8.743 4.157 -0.532 . . . 1.0 . . . . . . . . . . . . A . 14 THR C . . . . . . . . . c30643_6pv2 1 . 1 . 229 . 1 1 14 THR CA C 9.265 3.120 -1.524 . . . 1.0 . . . . . . . . . . . . A . 14 THR CA . . . . . . . . . c30643_6pv2 1 . 1 . 230 . 1 1 14 THR CB C 10.224 3.801 -2.521 . . . 1.0 . . . . . . . . . . . . A . 14 THR CB . . . . . . . . . c30643_6pv2 1 . 1 . 231 . 1 1 14 THR CG2 C 11.568 4.109 -1.869 . . . 1.0 . . . . . . . . . . . . A . 14 THR CG2 . . . . . . . . . c30643_6pv2 1 . 1 . 232 . 1 1 14 THR H H 7.827 2.897 -3.058 . . . 1.0 . . . . . . . . . . . . A . 14 THR H . . . . . . . . . c30643_6pv2 1 . 1 . 233 . 1 1 14 THR HA H 9.804 2.354 -0.989 . . . 1.0 . . . . . . . . . . . . A . 14 THR HA . . . . . . . . . c30643_6pv2 1 . 1 . 234 . 1 1 14 THR HB H 9.779 4.728 -2.854 . . . 1.0 . . . . . . . . . . . . A . 14 THR HB . . . . . . . . . c30643_6pv2 1 . 1 . 235 . 1 1 14 THR HG1 H 9.990 3.326 -4.424 . . . 1.0 . . . . . . . . . . . . A . 14 THR HG1 . . . . . . . . . c30643_6pv2 1 . 1 . 236 . 1 1 14 THR HG21 H 12.211 4.605 -2.581 . . . 1.0 . . . . . . . . . . . . A . 14 THR HG21 . . . . . . . . . c30643_6pv2 1 . 1 . 237 . 1 1 14 THR HG22 H 12.032 3.188 -1.548 . . . 1.0 . . . . . . . . . . . . A . 14 THR HG22 . . . . . . . . . c30643_6pv2 1 . 1 . 238 . 1 1 14 THR HG23 H 11.415 4.750 -1.014 . . . 1.0 . . . . . . . . . . . . A . 14 THR HG23 . . . . . . . . . c30643_6pv2 1 . 1 . 239 . 1 1 14 THR N N 8.156 2.493 -2.224 . . . 1.0 . . . . . . . . . . . . A . 14 THR N . . . . . . . . . c30643_6pv2 1 . 1 . 240 . 1 1 14 THR O O 9.462 4.599 0.365 . . . 1.0 . . . . . . . . . . . . A . 14 THR O . . . . . . . . . c30643_6pv2 1 . 1 . 241 . 1 1 14 THR OG1 O 10.431 2.942 -3.652 . . . 1.0 . . . . . . . . . . . . A . 14 THR OG1 . . . . . . . . . c30643_6pv2 1 . 1 . 242 . 1 1 15 ARG C C 5.678 4.983 0.929 . . . 1.0 . . . . . . . . . . . . A . 15 ARG C . . . . . . . . . c30643_6pv2 1 . 1 . 243 . 1 1 15 ARG CA C 6.871 5.546 0.160 . . . 1.0 . . . . . . . . . . . . A . 15 ARG CA . . . . . . . . . c30643_6pv2 1 . 1 . 244 . 1 1 15 ARG CB C 6.436 6.746 -0.680 . . . 1.0 . . . . . . . . . . . . A . 15 ARG CB . . . . . . . . . c30643_6pv2 1 . 1 . 245 . 1 1 15 ARG CD C 7.120 8.692 -2.124 . . . 1.0 . . . . . . . . . . . . A . 15 ARG CD . . . . . . . . . c30643_6pv2 1 . 1 . 246 . 1 1 15 ARG CG C 7.589 7.614 -1.159 . . . 1.0 . . . . . . . . . . . . A . 15 ARG CG . . . . . . . . . c30643_6pv2 1 . 1 . 247 . 1 1 15 ARG CZ C 5.573 10.619 -2.120 . . . 1.0 . . . . . . . . . . . . A . 15 ARG CZ . . . . . . . . . c30643_6pv2 1 . 1 . 248 . 1 1 15 ARG H H 6.937 4.102 -1.385 . . . 1.0 . . . . . . . . . . . . A . 15 ARG H . . . . . . . . . c30643_6pv2 1 . 1 . 249 . 1 1 15 ARG HA H 7.618 5.866 0.871 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HA . . . . . . . . . c30643_6pv2 1 . 1 . 250 . 1 1 15 ARG HB2 H 5.904 6.388 -1.548 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HB2 . . . . . . . . . c30643_6pv2 1 . 1 . 251 . 1 1 15 ARG HB3 H 5.774 7.362 -0.091 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HB3 . . . . . . . . . c30643_6pv2 1 . 1 . 252 . 1 1 15 ARG HD2 H 7.935 9.376 -2.300 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HD2 . . . . . . . . . c30643_6pv2 1 . 1 . 253 . 1 1 15 ARG HD3 H 6.841 8.223 -3.056 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HD3 . . . . . . . . . c30643_6pv2 1 . 1 . 254 . 1 1 15 ARG HE H 5.460 9.054 -0.867 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HE . . . . . . . . . c30643_6pv2 1 . 1 . 255 . 1 1 15 ARG HG2 H 8.052 8.084 -0.306 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HG2 . . . . . . . . . c30643_6pv2 1 . 1 . 256 . 1 1 15 ARG HG3 H 8.312 6.986 -1.662 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HG3 . . . . . . . . . c30643_6pv2 1 . 1 . 257 . 1 1 15 ARG HH11 H 7.057 10.732 -3.501 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HH11 . . . . . . . . . c30643_6pv2 1 . 1 . 258 . 1 1 15 ARG HH12 H 5.943 12.063 -3.494 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HH12 . . . . . . . . . c30643_6pv2 1 . 1 . 259 . 1 1 15 ARG HH21 H 3.974 10.778 -0.882 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HH21 . . . . . . . . . c30643_6pv2 1 . 1 . 260 . 1 1 15 ARG HH22 H 4.186 12.092 -2.002 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HH22 . . . . . . . . . c30643_6pv2 1 . 1 . 261 . 1 1 15 ARG N N 7.479 4.529 -0.688 . . . 1.0 . . . . . . . . . . . . A . 15 ARG N . . . . . . . . . c30643_6pv2 1 . 1 . 262 . 1 1 15 ARG NE N 5.974 9.451 -1.617 . . . 1.0 . . . . . . . . . . . . A . 15 ARG NE . . . . . . . . . c30643_6pv2 1 . 1 . 263 . 1 1 15 ARG NH1 N 6.244 11.183 -3.118 . . . 1.0 . . . . . . . . . . . . A . 15 ARG NH1 . . . . . . . . . c30643_6pv2 1 . 1 . 264 . 1 1 15 ARG NH2 N 4.493 11.212 -1.631 . . . 1.0 . . . . . . . . . . . . A . 15 ARG NH2 . . . . . . . . . c30643_6pv2 1 . 1 . 265 . 1 1 15 ARG O O 4.791 4.334 0.363 . . . 1.0 . . . . . . . . . . . . A . 15 ARG O . . . . . . . . . c30643_6pv2 1 . 1 . 266 . 1 1 16 SER C C 3.284 5.358 2.805 . . . 1.0 . . . . . . . . . . . . A . 16 SER C . . . . . . . . . c30643_6pv2 1 . 1 . 267 . 1 1 16 SER CA C 4.644 4.761 3.131 . . . 1.0 . . . . . . . . . . . . A . 16 SER CA . . . . . . . . . c30643_6pv2 1 . 1 . 268 . 1 1 16 SER CB C 5.039 5.106 4.563 . . . 1.0 . . . . . . . . . . . . A . 16 SER CB . . . . . . . . . c30643_6pv2 1 . 1 . 269 . 1 1 16 SER H H 6.387 5.815 2.600 . . . 1.0 . . . . . . . . . . . . A . 16 SER H . . . . . . . . . c30643_6pv2 1 . 1 . 270 . 1 1 16 SER HA H 4.595 3.688 3.028 . . . 1.0 . . . . . . . . . . . . A . 16 SER HA . . . . . . . . . c30643_6pv2 1 . 1 . 271 . 1 1 16 SER HB2 H 4.166 5.082 5.195 . . . 1.0 . . . . . . . . . . . . A . 16 SER HB2 . . . . . . . . . c30643_6pv2 1 . 1 . 272 . 1 1 16 SER HB3 H 5.764 4.389 4.920 . . . 1.0 . . . . . . . . . . . . A . 16 SER HB3 . . . . . . . . . c30643_6pv2 1 . 1 . 273 . 1 1 16 SER HG H 6.145 6.478 5.422 . . . 1.0 . . . . . . . . . . . . A . 16 SER HG . . . . . . . . . c30643_6pv2 1 . 1 . 274 . 1 1 16 SER N N 5.673 5.253 2.229 . . . 1.0 . . . . . . . . . . . . A . 16 SER N . . . . . . . . . c30643_6pv2 1 . 1 . 275 . 1 1 16 SER O O 2.256 4.694 2.940 . . . 1.0 . . . . . . . . . . . . A . 16 SER O . . . . . . . . . c30643_6pv2 1 . 1 . 276 . 1 1 16 SER OG O 5.611 6.401 4.621 . . . 1.0 . . . . . . . . . . . . A . 16 SER OG . . . . . . . . . c30643_6pv2 1 . 1 . 277 . 1 1 17 ASP C C 1.486 6.724 0.724 . . . 1.0 . . . . . . . . . . . . A . 17 ASP C . . . . . . . . . c30643_6pv2 1 . 1 . 278 . 1 1 17 ASP CA C 2.058 7.301 2.010 . . . 1.0 . . . . . . . . . . . . A . 17 ASP CA . . . . . . . . . c30643_6pv2 1 . 1 . 279 . 1 1 17 ASP CB C 2.299 8.809 1.860 . . . 1.0 . . . . . . . . . . . . A . 17 ASP CB . . . . . . . . . c30643_6pv2 1 . 1 . 280 . 1 1 17 ASP CG C 3.079 9.177 0.611 . . . 1.0 . . . . . . . . . . . . A . 17 ASP CG . . . . . . . . . c30643_6pv2 1 . 1 . 281 . 1 1 17 ASP H H 4.142 7.086 2.293 . . . 1.0 . . . . . . . . . . . . A . 17 ASP H . . . . . . . . . c30643_6pv2 1 . 1 . 282 . 1 1 17 ASP HA H 1.348 7.136 2.806 . . . 1.0 . . . . . . . . . . . . A . 17 ASP HA . . . . . . . . . c30643_6pv2 1 . 1 . 283 . 1 1 17 ASP HB2 H 1.348 9.310 1.823 . . . 1.0 . . . . . . . . . . . . A . 17 ASP HB2 . . . . . . . . . c30643_6pv2 1 . 1 . 284 . 1 1 17 ASP HB3 H 2.847 9.161 2.720 . . . 1.0 . . . . . . . . . . . . A . 17 ASP HB3 . . . . . . . . . c30643_6pv2 1 . 1 . 285 . 1 1 17 ASP N N 3.289 6.611 2.369 . . . 1.0 . . . . . . . . . . . . A . 17 ASP N . . . . . . . . . c30643_6pv2 1 . 1 . 286 . 1 1 17 ASP O O 0.272 6.694 0.534 . . . 1.0 . . . . . . . . . . . . A . 17 ASP O . . . . . . . . . c30643_6pv2 1 . 1 . 287 . 1 1 17 ASP OD1 O 2.510 9.866 -0.266 . . . 1.0 . . . . . . . . . . . . A . 17 ASP OD1 . . . . . . . . . c30643_6pv2 1 . 1 . 288 . 1 1 17 ASP OD2 O 4.264 8.790 0.503 . . . 1.0 . . . . . . . . . . . . A . 17 ASP OD2 . . . . . . . . . c30643_6pv2 1 . 1 . 289 . 1 1 18 GLU C C 1.363 4.233 -1.101 . . . 1.0 . . . . . . . . . . . . A . 18 GLU C . . . . . . . . . c30643_6pv2 1 . 1 . 290 . 1 1 18 GLU CA C 1.934 5.612 -1.383 . . . 1.0 . . . . . . . . . . . . A . 18 GLU CA . . . . . . . . . c30643_6pv2 1 . 1 . 291 . 1 1 18 GLU CB C 3.080 5.518 -2.388 . . . 1.0 . . . . . . . . . . . . A . 18 GLU CB . . . . . . . . . c30643_6pv2 1 . 1 . 292 . 1 1 18 GLU CD C 4.499 6.771 -4.046 . . . 1.0 . . . . . . . . . . . . A . 18 GLU CD . . . . . . . . . c30643_6pv2 1 . 1 . 293 . 1 1 18 GLU CG C 3.583 6.872 -2.848 . . . 1.0 . . . . . . . . . . . . A . 18 GLU CG . . . . . . . . . c30643_6pv2 1 . 1 . 294 . 1 1 18 GLU H H 3.318 6.322 0.047 . . . 1.0 . . . . . . . . . . . . A . 18 GLU H . . . . . . . . . c30643_6pv2 1 . 1 . 295 . 1 1 18 GLU HA H 1.152 6.224 -1.803 . . . 1.0 . . . . . . . . . . . . A . 18 GLU HA . . . . . . . . . c30643_6pv2 1 . 1 . 296 . 1 1 18 GLU HB2 H 3.903 4.988 -1.931 . . . 1.0 . . . . . . . . . . . . A . 18 GLU HB2 . . . . . . . . . c30643_6pv2 1 . 1 . 297 . 1 1 18 GLU HB3 H 2.742 4.968 -3.253 . . . 1.0 . . . . . . . . . . . . A . 18 GLU HB3 . . . . . . . . . c30643_6pv2 1 . 1 . 298 . 1 1 18 GLU HG2 H 2.736 7.487 -3.112 . . . 1.0 . . . . . . . . . . . . A . 18 GLU HG2 . . . . . . . . . c30643_6pv2 1 . 1 . 299 . 1 1 18 GLU HG3 H 4.128 7.333 -2.037 . . . 1.0 . . . . . . . . . . . . A . 18 GLU HG3 . . . . . . . . . c30643_6pv2 1 . 1 . 300 . 1 1 18 GLU N N 2.363 6.244 -0.146 . . . 1.0 . . . . . . . . . . . . A . 18 GLU N . . . . . . . . . c30643_6pv2 1 . 1 . 301 . 1 1 18 GLU O O 0.397 3.816 -1.741 . . . 1.0 . . . . . . . . . . . . A . 18 GLU O . . . . . . . . . c30643_6pv2 1 . 1 . 302 . 1 1 18 GLU OE1 O 5.672 6.391 -3.873 . . . 1.0 . . . . . . . . . . . . A . 18 GLU OE1 . . . . . . . . . c30643_6pv2 1 . 1 . 303 . 1 1 18 GLU OE2 O 4.048 7.069 -5.172 . . . 1.0 . . . . . . . . . . . . A . 18 GLU OE2 . . . . . . . . . c30643_6pv2 1 . 1 . 304 . 1 1 19 LEU C C 0.032 2.507 0.949 . . . 1.0 . . . . . . . . . . . . A . 19 LEU C . . . . . . . . . c30643_6pv2 1 . 1 . 305 . 1 1 19 LEU CA C 1.395 2.264 0.317 . . . 1.0 . . . . . . . . . . . . A . 19 LEU CA . . . . . . . . . c30643_6pv2 1 . 1 . 306 . 1 1 19 LEU CB C 2.318 1.574 1.323 . . . 1.0 . . . . . . . . . . . . A . 19 LEU CB . . . . . . . . . c30643_6pv2 1 . 1 . 307 . 1 1 19 LEU CD1 C 1.510 -0.776 0.930 . . . 1.0 . . . . . . . . . . . . A . 19 LEU CD1 . . . . . . . . . c30643_6pv2 1 . 1 . 308 . 1 1 19 LEU CD2 C 2.640 -0.198 3.081 . . . 1.0 . . . . . . . . . . . . A . 19 LEU CD2 . . . . . . . . . c30643_6pv2 1 . 1 . 309 . 1 1 19 LEU CG C 1.735 0.311 1.971 . . . 1.0 . . . . . . . . . . . . A . 19 LEU CG . . . . . . . . . c30643_6pv2 1 . 1 . 310 . 1 1 19 LEU H H 2.799 3.856 0.252 . . . 1.0 . . . . . . . . . . . . A . 19 LEU H . . . . . . . . . c30643_6pv2 1 . 1 . 311 . 1 1 19 LEU HA H 1.269 1.625 -0.546 . . . 1.0 . . . . . . . . . . . . A . 19 LEU HA . . . . . . . . . c30643_6pv2 1 . 1 . 312 . 1 1 19 LEU HB2 H 3.231 1.306 0.811 . . . 1.0 . . . . . . . . . . . . A . 19 LEU HB2 . . . . . . . . . c30643_6pv2 1 . 1 . 313 . 1 1 19 LEU HB3 H 2.556 2.278 2.105 . . . 1.0 . . . . . . . . . . . . A . 19 LEU HB3 . . . . . . . . . c30643_6pv2 1 . 1 . 314 . 1 1 19 LEU HD11 H 0.820 -0.419 0.179 . . . 1.0 . . . . . . . . . . . . A . 19 LEU HD11 . . . . . . . . . c30643_6pv2 1 . 1 . 315 . 1 1 19 LEU HD12 H 1.102 -1.653 1.408 . . . 1.0 . . . . . . . . . . . . A . 19 LEU HD12 . . . . . . . . . c30643_6pv2 1 . 1 . 316 . 1 1 19 LEU HD13 H 2.452 -1.025 0.464 . . . 1.0 . . . . . . . . . . . . A . 19 LEU HD13 . . . . . . . . . c30643_6pv2 1 . 1 . 317 . 1 1 19 LEU HD21 H 2.143 -0.998 3.609 . . . 1.0 . . . . . . . . . . . . A . 19 LEU HD21 . . . . . . . . . c30643_6pv2 1 . 1 . 318 . 1 1 19 LEU HD22 H 2.859 0.606 3.766 . . . 1.0 . . . . . . . . . . . . A . 19 LEU HD22 . . . . . . . . . c30643_6pv2 1 . 1 . 319 . 1 1 19 LEU HD23 H 3.559 -0.569 2.653 . . . 1.0 . . . . . . . . . . . . A . 19 LEU HD23 . . . . . . . . . c30643_6pv2 1 . 1 . 320 . 1 1 19 LEU HG H 0.774 0.553 2.407 . . . 1.0 . . . . . . . . . . . . A . 19 LEU HG . . . . . . . . . c30643_6pv2 1 . 1 . 321 . 1 1 19 LEU N N 1.957 3.527 -0.143 . . . 1.0 . . . . . . . . . . . . A . 19 LEU N . . . . . . . . . c30643_6pv2 1 . 1 . 322 . 1 1 19 LEU O O -0.909 1.762 0.708 . . . 1.0 . . . . . . . . . . . . A . 19 LEU O . . . . . . . . . c30643_6pv2 1 . 1 . 323 . 1 1 20 GLN C C -2.389 4.210 1.305 . . . 1.0 . . . . . . . . . . . . A . 20 GLN C . . . . . . . . . c30643_6pv2 1 . 1 . 324 . 1 1 20 GLN CA C -1.321 3.958 2.368 . . . 1.0 . . . . . . . . . . . . A . 20 GLN CA . . . . . . . . . c30643_6pv2 1 . 1 . 325 . 1 1 20 GLN CB C -1.112 5.213 3.218 . . . 1.0 . . . . . . . . . . . . A . 20 GLN CB . . . . . . . . . c30643_6pv2 1 . 1 . 326 . 1 1 20 GLN CD C -2.157 7.080 4.549 . . . 1.0 . . . . . . . . . . . . A . 20 GLN CD . . . . . . . . . c30643_6pv2 1 . 1 . 327 . 1 1 20 GLN CG C -2.399 5.825 3.740 . . . 1.0 . . . . . . . . . . . . A . 20 GLN CG . . . . . . . . . c30643_6pv2 1 . 1 . 328 . 1 1 20 GLN H H 0.752 4.077 1.950 . . . 1.0 . . . . . . . . . . . . A . 20 GLN H . . . . . . . . . c30643_6pv2 1 . 1 . 329 . 1 1 20 GLN HA H -1.646 3.149 3.006 . . . 1.0 . . . . . . . . . . . . A . 20 GLN HA . . . . . . . . . c30643_6pv2 1 . 1 . 330 . 1 1 20 GLN HB2 H -0.492 4.959 4.065 . . . 1.0 . . . . . . . . . . . . A . 20 GLN HB2 . . . . . . . . . c30643_6pv2 1 . 1 . 331 . 1 1 20 GLN HB3 H -0.602 5.955 2.621 . . . 1.0 . . . . . . . . . . . . A . 20 GLN HB3 . . . . . . . . . c30643_6pv2 1 . 1 . 332 . 1 1 20 GLN HE21 H -2.052 6.010 6.214 . . . 1.0 . . . . . . . . . . . . A . 20 GLN HE21 . . . . . . . . . c30643_6pv2 1 . 1 . 333 . 1 1 20 GLN HE22 H -1.852 7.717 6.403 . . . 1.0 . . . . . . . . . . . . A . 20 GLN HE22 . . . . . . . . . c30643_6pv2 1 . 1 . 334 . 1 1 20 GLN HG2 H -3.030 6.073 2.901 . . . 1.0 . . . . . . . . . . . . A . 20 GLN HG2 . . . . . . . . . c30643_6pv2 1 . 1 . 335 . 1 1 20 GLN HG3 H -2.901 5.101 4.365 . . . 1.0 . . . . . . . . . . . . A . 20 GLN HG3 . . . . . . . . . c30643_6pv2 1 . 1 . 336 . 1 1 20 GLN N N -0.060 3.559 1.752 . . . 1.0 . . . . . . . . . . . . A . 20 GLN N . . . . . . . . . c30643_6pv2 1 . 1 . 337 . 1 1 20 GLN NE2 N -2.002 6.919 5.851 . . . 1.0 . . . . . . . . . . . . A . 20 GLN NE2 . . . . . . . . . c30643_6pv2 1 . 1 . 338 . 1 1 20 GLN O O -3.495 3.660 1.372 . . . 1.0 . . . . . . . . . . . . A . 20 GLN O . . . . . . . . . c30643_6pv2 1 . 1 . 339 . 1 1 20 GLN OE1 O -2.113 8.188 4.007 . . . 1.0 . . . . . . . . . . . . A . 20 GLN OE1 . . . . . . . . . c30643_6pv2 1 . 1 . 340 . 1 1 21 ARG C C -3.360 4.041 -1.485 . . . 1.0 . . . . . . . . . . . . A . 21 ARG C . . . . . . . . . c30643_6pv2 1 . 1 . 341 . 1 1 21 ARG CA C -2.959 5.326 -0.782 . . . 1.0 . . . . . . . . . . . . A . 21 ARG CA . . . . . . . . . c30643_6pv2 1 . 1 . 342 . 1 1 21 ARG CB C -2.319 6.292 -1.784 . . . 1.0 . . . . . . . . . . . . A . 21 ARG CB . . . . . . . . . c30643_6pv2 1 . 1 . 343 . 1 1 21 ARG CD C -1.448 8.599 -2.270 . . . 1.0 . . . . . . . . . . . . A . 21 ARG CD . . . . . . . . . c30643_6pv2 1 . 1 . 344 . 1 1 21 ARG CG C -2.083 7.688 -1.230 . . . 1.0 . . . . . . . . . . . . A . 21 ARG CG . . . . . . . . . c30643_6pv2 1 . 1 . 345 . 1 1 21 ARG CZ C -2.255 9.807 -4.265 . . . 1.0 . . . . . . . . . . . . A . 21 ARG CZ . . . . . . . . . c30643_6pv2 1 . 1 . 346 . 1 1 21 ARG H H -1.153 5.445 0.327 . . . 1.0 . . . . . . . . . . . . A . 21 ARG H . . . . . . . . . c30643_6pv2 1 . 1 . 347 . 1 1 21 ARG HA H -3.844 5.785 -0.366 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HA . . . . . . . . . c30643_6pv2 1 . 1 . 348 . 1 1 21 ARG HB2 H -1.369 5.889 -2.097 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HB2 . . . . . . . . . c30643_6pv2 1 . 1 . 349 . 1 1 21 ARG HB3 H -2.966 6.375 -2.644 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HB3 . . . . . . . . . c30643_6pv2 1 . 1 . 350 . 1 1 21 ARG HD2 H -1.288 9.571 -1.830 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HD2 . . . . . . . . . c30643_6pv2 1 . 1 . 351 . 1 1 21 ARG HD3 H -0.497 8.180 -2.566 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HD3 . . . . . . . . . c30643_6pv2 1 . 1 . 352 . 1 1 21 ARG HE H -2.913 8.018 -3.663 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HE . . . . . . . . . c30643_6pv2 1 . 1 . 353 . 1 1 21 ARG HG2 H -3.029 8.111 -0.928 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HG2 . . . . . . . . . c30643_6pv2 1 . 1 . 354 . 1 1 21 ARG HG3 H -1.427 7.622 -0.375 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HG3 . . . . . . . . . c30643_6pv2 1 . 1 . 355 . 1 1 21 ARG HH11 H -0.829 10.800 -3.214 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HH11 . . . . . . . . . c30643_6pv2 1 . 1 . 356 . 1 1 21 ARG HH12 H -1.413 11.613 -4.632 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HH12 . . . . . . . . . c30643_6pv2 1 . 1 . 357 . 1 1 21 ARG HH21 H -3.671 9.085 -5.515 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HH21 . . . . . . . . . c30643_6pv2 1 . 1 . 358 . 1 1 21 ARG HH22 H -3.028 10.639 -5.943 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HH22 . . . . . . . . . c30643_6pv2 1 . 1 . 359 . 1 1 21 ARG N N -2.046 5.031 0.316 . . . 1.0 . . . . . . . . . . . . A . 21 ARG N . . . . . . . . . c30643_6pv2 1 . 1 . 360 . 1 1 21 ARG NE N -2.289 8.751 -3.455 . . . 1.0 . . . . . . . . . . . . A . 21 ARG NE . . . . . . . . . c30643_6pv2 1 . 1 . 361 . 1 1 21 ARG NH1 N -1.433 10.821 -4.018 . . . 1.0 . . . . . . . . . . . . A . 21 ARG NH1 . . . . . . . . . c30643_6pv2 1 . 1 . 362 . 1 1 21 ARG NH2 N -3.049 9.848 -5.326 . . . 1.0 . . . . . . . . . . . . A . 21 ARG NH2 . . . . . . . . . c30643_6pv2 1 . 1 . 363 . 1 1 21 ARG O O -4.538 3.812 -1.751 . . . 1.0 . . . . . . . . . . . . A . 21 ARG O . . . . . . . . . c30643_6pv2 1 . 1 . 364 . 1 1 22 HIS C C -3.631 1.096 -1.530 . . . 1.0 . . . . . . . . . . . . A . 22 HIS C . . . . . . . . . c30643_6pv2 1 . 1 . 365 . 1 1 22 HIS CA C -2.638 1.902 -2.370 . . . 1.0 . . . . . . . . . . . . A . 22 HIS CA . . . . . . . . . c30643_6pv2 1 . 1 . 366 . 1 1 22 HIS CB C -1.326 1.126 -2.546 . . . 1.0 . . . . . . . . . . . . A . 22 HIS CB . . . . . . . . . c30643_6pv2 1 . 1 . 367 . 1 1 22 HIS CD2 C -1.805 -1.375 -2.193 . . . 1.0 . . . . . . . . . . . . A . 22 HIS CD2 . . . . . . . . . c30643_6pv2 1 . 1 . 368 . 1 1 22 HIS CE1 C -1.861 -2.039 -4.263 . . . 1.0 . . . . . . . . . . . . A . 22 HIS CE1 . . . . . . . . . c30643_6pv2 1 . 1 . 369 . 1 1 22 HIS CG C -1.534 -0.292 -2.959 . . . 1.0 . . . . . . . . . . . . A . 22 HIS CG . . . . . . . . . c30643_6pv2 1 . 1 . 370 . 1 1 22 HIS H H -1.454 3.433 -1.526 . . . 1.0 . . . . . . . . . . . . A . 22 HIS H . . . . . . . . . c30643_6pv2 1 . 1 . 371 . 1 1 22 HIS HA H -3.073 2.083 -3.342 . . . 1.0 . . . . . . . . . . . . A . 22 HIS HA . . . . . . . . . c30643_6pv2 1 . 1 . 372 . 1 1 22 HIS HB2 H -0.726 1.610 -3.301 . . . 1.0 . . . . . . . . . . . . A . 22 HIS HB2 . . . . . . . . . c30643_6pv2 1 . 1 . 373 . 1 1 22 HIS HB3 H -0.786 1.125 -1.610 . . . 1.0 . . . . . . . . . . . . A . 22 HIS HB3 . . . . . . . . . c30643_6pv2 1 . 1 . 374 . 1 1 22 HIS HD1 H -1.384 -0.182 -5.076 . . . 1.0 . . . . . . . . . . . . A . 22 HIS HD1 . . . . . . . . . c30643_6pv2 1 . 1 . 375 . 1 1 22 HIS HD2 H -1.827 -1.409 -1.115 . . . 1.0 . . . . . . . . . . . . A . 22 HIS HD2 . . . . . . . . . c30643_6pv2 1 . 1 . 376 . 1 1 22 HIS HE1 H -1.964 -2.665 -5.135 . . . 1.0 . . . . . . . . . . . . A . 22 HIS HE1 . . . . . . . . . c30643_6pv2 1 . 1 . 377 . 1 1 22 HIS N N -2.380 3.189 -1.754 . . . 1.0 . . . . . . . . . . . . A . 22 HIS N . . . . . . . . . c30643_6pv2 1 . 1 . 378 . 1 1 22 HIS ND1 N -1.560 -0.731 -4.277 . . . 1.0 . . . . . . . . . . . . A . 22 HIS ND1 . . . . . . . . . c30643_6pv2 1 . 1 . 379 . 1 1 22 HIS NE2 N -2.014 -2.441 -3.028 . . . 1.0 . . . . . . . . . . . . A . 22 HIS NE2 . . . . . . . . . c30643_6pv2 1 . 1 . 380 . 1 1 22 HIS O O -4.598 0.537 -2.054 . . . 1.0 . . . . . . . . . . . . A . 22 HIS O . . . . . . . . . c30643_6pv2 1 . 1 . 381 . 1 1 23 LYS C C -5.657 0.872 0.707 . . . 1.0 . . . . . . . . . . . . A . 23 LYS C . . . . . . . . . c30643_6pv2 1 . 1 . 382 . 1 1 23 LYS CA C -4.240 0.322 0.703 . . . 1.0 . . . . . . . . . . . . A . 23 LYS CA . . . . . . . . . c30643_6pv2 1 . 1 . 383 . 1 1 23 LYS CB C -3.666 0.377 2.117 . . . 1.0 . . . . . . . . . . . . A . 23 LYS CB . . . . . . . . . c30643_6pv2 1 . 1 . 384 . 1 1 23 LYS CD C -2.683 -1.937 2.232 . . . 1.0 . . . . . . . . . . . . A . 23 LYS CD . . . . . . . . . c30643_6pv2 1 . 1 . 385 . 1 1 23 LYS CE C -1.477 -2.752 2.665 . . . 1.0 . . . . . . . . . . . . A . 23 LYS CE . . . . . . . . . c30643_6pv2 1 . 1 . 386 . 1 1 23 LYS CG C -2.404 -0.447 2.316 . . . 1.0 . . . . . . . . . . . . A . 23 LYS CG . . . . . . . . . c30643_6pv2 1 . 1 . 387 . 1 1 23 LYS H H -2.611 1.539 0.127 . . . 1.0 . . . . . . . . . . . . A . 23 LYS H . . . . . . . . . c30643_6pv2 1 . 1 . 388 . 1 1 23 LYS HA H -4.270 -0.704 0.375 . . . 1.0 . . . . . . . . . . . . A . 23 LYS HA . . . . . . . . . c30643_6pv2 1 . 1 . 389 . 1 1 23 LYS HB2 H -3.438 1.404 2.357 . . . 1.0 . . . . . . . . . . . . A . 23 LYS HB2 . . . . . . . . . c30643_6pv2 1 . 1 . 390 . 1 1 23 LYS HB3 H -4.415 0.015 2.806 . . . 1.0 . . . . . . . . . . . . A . 23 LYS HB3 . . . . . . . . . c30643_6pv2 1 . 1 . 391 . 1 1 23 LYS HD2 H -3.516 -2.177 2.875 . . . 1.0 . . . . . . . . . . . . A . 23 LYS HD2 . . . . . . . . . c30643_6pv2 1 . 1 . 392 . 1 1 23 LYS HD3 H -2.929 -2.192 1.214 . . . 1.0 . . . . . . . . . . . . A . 23 LYS HD3 . . . . . . . . . c30643_6pv2 1 . 1 . 393 . 1 1 23 LYS HE2 H -0.649 -2.518 2.016 . . . 1.0 . . . . . . . . . . . . A . 23 LYS HE2 . . . . . . . . . c30643_6pv2 1 . 1 . 394 . 1 1 23 LYS HE3 H -1.226 -2.489 3.681 . . . 1.0 . . . . . . . . . . . . A . 23 LYS HE3 . . . . . . . . . c30643_6pv2 1 . 1 . 395 . 1 1 23 LYS HG2 H -1.690 -0.183 1.552 . . . 1.0 . . . . . . . . . . . . A . 23 LYS HG2 . . . . . . . . . c30643_6pv2 1 . 1 . 396 . 1 1 23 LYS HG3 H -1.989 -0.222 3.288 . . . 1.0 . . . . . . . . . . . . A . 23 LYS HG3 . . . . . . . . . c30643_6pv2 1 . 1 . 397 . 1 1 23 LYS HZ1 H -0.941 -4.740 2.986 . . . 1.0 . . . . . . . . . . . . A . 23 LYS HZ1 . . . . . . . . . c30643_6pv2 1 . 1 . 398 . 1 1 23 LYS HZ2 H -1.894 -4.503 1.611 . . . 1.0 . . . . . . . . . . . . A . 23 LYS HZ2 . . . . . . . . . c30643_6pv2 1 . 1 . 399 . 1 1 23 LYS HZ3 H -2.598 -4.446 3.148 . . . 1.0 . . . . . . . . . . . . A . 23 LYS HZ3 . . . . . . . . . c30643_6pv2 1 . 1 . 400 . 1 1 23 LYS N N -3.390 1.057 -0.225 . . . 1.0 . . . . . . . . . . . . A . 23 LYS N . . . . . . . . . c30643_6pv2 1 . 1 . 401 . 1 1 23 LYS NZ N -1.745 -4.211 2.596 . . . 1.0 . . . . . . . . . . . . A . 23 LYS NZ . . . . . . . . . c30643_6pv2 1 . 1 . 402 . 1 1 23 LYS O O -6.602 0.149 1.018 . . . 1.0 . . . . . . . . . . . . A . 23 LYS O . . . . . . . . . c30643_6pv2 1 . 1 . 403 . 1 1 24 ARG C C -7.997 2.067 -0.758 . . . 1.0 . . . . . . . . . . . . A . 24 ARG C . . . . . . . . . c30643_6pv2 1 . 1 . 404 . 1 1 24 ARG CA C -7.112 2.777 0.269 . . . 1.0 . . . . . . . . . . . . A . 24 ARG CA . . . . . . . . . c30643_6pv2 1 . 1 . 405 . 1 1 24 ARG CB C -6.947 4.259 -0.080 . . . 1.0 . . . . . . . . . . . . A . 24 ARG CB . . . . . . . . . c30643_6pv2 1 . 1 . 406 . 1 1 24 ARG CD C -7.984 6.487 -0.528 . . . 1.0 . . . . . . . . . . . . A . 24 ARG CD . . . . . . . . . c30643_6pv2 1 . 1 . 407 . 1 1 24 ARG CG C -8.251 5.020 -0.242 . . . 1.0 . . . . . . . . . . . . A . 24 ARG CG . . . . . . . . . c30643_6pv2 1 . 1 . 408 . 1 1 24 ARG CZ C -9.316 8.555 -0.666 . . . 1.0 . . . . . . . . . . . . A . 24 ARG CZ . . . . . . . . . c30643_6pv2 1 . 1 . 409 . 1 1 24 ARG H H -4.994 2.682 0.139 . . . 1.0 . . . . . . . . . . . . A . 24 ARG H . . . . . . . . . c30643_6pv2 1 . 1 . 410 . 1 1 24 ARG HA H -7.578 2.696 1.239 . . . 1.0 . . . . . . . . . . . . A . 24 ARG HA . . . . . . . . . c30643_6pv2 1 . 1 . 411 . 1 1 24 ARG HB2 H -6.378 4.737 0.703 . . . 1.0 . . . . . . . . . . . . A . 24 ARG HB2 . . . . . . . . . c30643_6pv2 1 . 1 . 412 . 1 1 24 ARG HB3 H -6.397 4.335 -1.006 . . . 1.0 . . . . . . . . . . . . A . 24 ARG HB3 . . . . . . . . . c30643_6pv2 1 . 1 . 413 . 1 1 24 ARG HD2 H -7.503 6.926 0.333 . . . 1.0 . . . . . . . . . . . . A . 24 ARG HD2 . . . . . . . . . c30643_6pv2 1 . 1 . 414 . 1 1 24 ARG HD3 H -7.322 6.557 -1.379 . . . 1.0 . . . . . . . . . . . . A . 24 ARG HD3 . . . . . . . . . c30643_6pv2 1 . 1 . 415 . 1 1 24 ARG HE H -9.979 6.729 -1.144 . . . 1.0 . . . . . . . . . . . . A . 24 ARG HE . . . . . . . . . c30643_6pv2 1 . 1 . 416 . 1 1 24 ARG HG2 H -8.808 4.594 -1.064 . . . 1.0 . . . . . . . . . . . . A . 24 ARG HG2 . . . . . . . . . c30643_6pv2 1 . 1 . 417 . 1 1 24 ARG HG3 H -8.826 4.935 0.670 . . . 1.0 . . . . . . . . . . . . A . 24 ARG HG3 . . . . . . . . . c30643_6pv2 1 . 1 . 418 . 1 1 24 ARG HH11 H -8.377 10.261 -0.101 . . . 1.0 . . . . . . . . . . . . A . 24 ARG HH11 . . . . . . . . . c30643_6pv2 1 . 1 . 419 . 1 1 24 ARG HH12 H -7.426 8.815 0.016 . . . 1.0 . . . . . . . . . . . . A . 24 ARG HH12 . . . . . . . . . c30643_6pv2 1 . 1 . 420 . 1 1 24 ARG HH21 H -10.548 10.150 -0.861 . . . 1.0 . . . . . . . . . . . . A . 24 ARG HH21 . . . . . . . . . c30643_6pv2 1 . 1 . 421 . 1 1 24 ARG HH22 H -11.235 8.616 -1.322 . . . 1.0 . . . . . . . . . . . . A . 24 ARG HH22 . . . . . . . . . c30643_6pv2 1 . 1 . 422 . 1 1 24 ARG N N -5.800 2.145 0.349 . . . 1.0 . . . . . . . . . . . . A . 24 ARG N . . . . . . . . . c30643_6pv2 1 . 1 . 423 . 1 1 24 ARG NE N -9.205 7.236 -0.816 . . . 1.0 . . . . . . . . . . . . A . 24 ARG NE . . . . . . . . . c30643_6pv2 1 . 1 . 424 . 1 1 24 ARG NH1 N -8.291 9.267 -0.213 . . . 1.0 . . . . . . . . . . . . A . 24 ARG NH1 . . . . . . . . . c30643_6pv2 1 . 1 . 425 . 1 1 24 ARG NH2 N -10.455 9.157 -0.972 . . . 1.0 . . . . . . . . . . . . A . 24 ARG NH2 . . . . . . . . . c30643_6pv2 1 . 1 . 426 . 1 1 24 ARG O O -9.224 2.133 -0.686 . . . 1.0 . . . . . . . . . . . . A . 24 ARG O . . . . . . . . . c30643_6pv2 1 . 1 . 427 . 1 1 25 THR C C -8.617 -0.701 -2.153 . . . 1.0 . . . . . . . . . . . . A . 25 THR C . . . . . . . . . c30643_6pv2 1 . 1 . 428 . 1 1 25 THR CA C -8.103 0.628 -2.712 . . . 1.0 . . . . . . . . . . . . A . 25 THR CA . . . . . . . . . c30643_6pv2 1 . 1 . 429 . 1 1 25 THR CB C -7.224 0.349 -3.944 . . . 1.0 . . . . . . . . . . . . A . 25 THR CB . . . . . . . . . c30643_6pv2 1 . 1 . 430 . 1 1 25 THR CG2 C -8.063 0.322 -5.211 . . . 1.0 . . . . . . . . . . . . A . 25 THR CG2 . . . . . . . . . c30643_6pv2 1 . 1 . 431 . 1 1 25 THR H H -6.386 1.345 -1.704 . . . 1.0 . . . . . . . . . . . . A . 25 THR H . . . . . . . . . c30643_6pv2 1 . 1 . 432 . 1 1 25 THR HA H -8.945 1.230 -3.021 . . . 1.0 . . . . . . . . . . . . A . 25 THR HA . . . . . . . . . c30643_6pv2 1 . 1 . 433 . 1 1 25 THR HB H -6.751 -0.614 -3.820 . . . 1.0 . . . . . . . . . . . . A . 25 THR HB . . . . . . . . . c30643_6pv2 1 . 1 . 434 . 1 1 25 THR HG1 H -5.423 1.070 -3.588 . . . 1.0 . . . . . . . . . . . . A . 25 THR HG1 . . . . . . . . . c30643_6pv2 1 . 1 . 435 . 1 1 25 THR HG21 H -8.517 1.290 -5.363 . . . 1.0 . . . . . . . . . . . . A . 25 THR HG21 . . . . . . . . . c30643_6pv2 1 . 1 . 436 . 1 1 25 THR HG22 H -8.834 -0.427 -5.116 . . . 1.0 . . . . . . . . . . . . A . 25 THR HG22 . . . . . . . . . c30643_6pv2 1 . 1 . 437 . 1 1 25 THR HG23 H -7.432 0.084 -6.055 . . . 1.0 . . . . . . . . . . . . A . 25 THR HG23 . . . . . . . . . c30643_6pv2 1 . 1 . 438 . 1 1 25 THR N N -7.368 1.366 -1.696 . . . 1.0 . . . . . . . . . . . . A . 25 THR N . . . . . . . . . c30643_6pv2 1 . 1 . 439 . 1 1 25 THR O O -9.539 -1.305 -2.705 . . . 1.0 . . . . . . . . . . . . A . 25 THR O . . . . . . . . . c30643_6pv2 1 . 1 . 440 . 1 1 25 THR OG1 O -6.214 1.359 -4.062 . . . 1.0 . . . . . . . . . . . . A . 25 THR OG1 . . . . . . . . . c30643_6pv2 1 . 1 . 441 . 1 1 26 HIS C C -9.453 -2.065 0.691 . . . 1.0 . . . . . . . . . . . . A . 26 HIS C . . . . . . . . . c30643_6pv2 1 . 1 . 442 . 1 1 26 HIS CA C -8.444 -2.385 -0.405 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CA . . . . . . . . . c30643_6pv2 1 . 1 . 443 . 1 1 26 HIS CB C -7.262 -3.144 0.213 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CB . . . . . . . . . c30643_6pv2 1 . 1 . 444 . 1 1 26 HIS CD2 C -4.936 -3.438 -0.874 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CD2 . . . . . . . . . c30643_6pv2 1 . 1 . 445 . 1 1 26 HIS CE1 C -5.400 -4.963 -2.363 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CE1 . . . . . . . . . c30643_6pv2 1 . 1 . 446 . 1 1 26 HIS CG C -6.264 -3.696 -0.762 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CG . . . . . . . . . c30643_6pv2 1 . 1 . 447 . 1 1 26 HIS H H -7.268 -0.645 -0.673 . . . 1.0 . . . . . . . . . . . . A . 26 HIS H . . . . . . . . . c30643_6pv2 1 . 1 . 448 . 1 1 26 HIS HA H -8.918 -3.010 -1.147 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HA . . . . . . . . . c30643_6pv2 1 . 1 . 449 . 1 1 26 HIS HB2 H -6.729 -2.477 0.872 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HB2 . . . . . . . . . c30643_6pv2 1 . 1 . 450 . 1 1 26 HIS HB3 H -7.647 -3.970 0.794 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HB3 . . . . . . . . . c30643_6pv2 1 . 1 . 451 . 1 1 26 HIS HD1 H -7.429 -5.074 -1.892 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HD1 . . . . . . . . . c30643_6pv2 1 . 1 . 452 . 1 1 26 HIS HD2 H -4.369 -2.736 -0.283 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HD2 . . . . . . . . . c30643_6pv2 1 . 1 . 453 . 1 1 26 HIS HE1 H -5.298 -5.690 -3.154 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HE1 . . . . . . . . . c30643_6pv2 1 . 1 . 454 . 1 1 26 HIS N N -8.012 -1.156 -1.060 . . . 1.0 . . . . . . . . . . . . A . 26 HIS N . . . . . . . . . c30643_6pv2 1 . 1 . 455 . 1 1 26 HIS ND1 N -6.548 -4.666 -1.721 . . . 1.0 . . . . . . . . . . . . A . 26 HIS ND1 . . . . . . . . . c30643_6pv2 1 . 1 . 456 . 1 1 26 HIS NE2 N -4.424 -4.240 -1.874 . . . 1.0 . . . . . . . . . . . . A . 26 HIS NE2 . . . . . . . . . c30643_6pv2 1 . 1 . 457 . 1 1 26 HIS O O -10.481 -2.728 0.821 . . . 1.0 . . . . . . . . . . . . A . 26 HIS O . . . . . . . . . c30643_6pv2 1 . 1 . 458 . 1 1 27 THR C C -9.832 0.835 2.889 . . . 1.0 . . . . . . . . . . . . A . 27 THR C . . . . . . . . . c30643_6pv2 1 . 1 . 459 . 1 1 27 THR CA C -9.994 -0.655 2.590 . . . 1.0 . . . . . . . . . . . . A . 27 THR CA . . . . . . . . . c30643_6pv2 1 . 1 . 460 . 1 1 27 THR CB C -9.669 -1.486 3.853 . . . 1.0 . . . . . . . . . . . . A . 27 THR CB . . . . . . . . . c30643_6pv2 1 . 1 . 461 . 1 1 27 THR CG2 C -8.250 -1.221 4.337 . . . 1.0 . . . . . . . . . . . . A . 27 THR CG2 . . . . . . . . . c30643_6pv2 1 . 1 . 462 . 1 1 27 THR H H -8.338 -0.517 1.293 . . . 1.0 . . . . . . . . . . . . A . 27 THR H . . . . . . . . . c30643_6pv2 1 . 1 . 463 . 1 1 27 THR HA H -11.019 -0.847 2.311 . . . 1.0 . . . . . . . . . . . . A . 27 THR HA . . . . . . . . . c30643_6pv2 1 . 1 . 464 . 1 1 27 THR HB H -9.754 -2.535 3.603 . . . 1.0 . . . . . . . . . . . . A . 27 THR HB . . . . . . . . . c30643_6pv2 1 . 1 . 465 . 1 1 27 THR HG1 H -11.076 -1.987 5.144 . . . 1.0 . . . . . . . . . . . . A . 27 THR HG1 . . . . . . . . . c30643_6pv2 1 . 1 . 466 . 1 1 27 THR HG21 H -7.547 -1.503 3.567 . . . 1.0 . . . . . . . . . . . . A . 27 THR HG21 . . . . . . . . . c30643_6pv2 1 . 1 . 467 . 1 1 27 THR HG22 H -8.060 -1.799 5.229 . . . 1.0 . . . . . . . . . . . . A . 27 THR HG22 . . . . . . . . . c30643_6pv2 1 . 1 . 468 . 1 1 27 THR HG23 H -8.138 -0.170 4.558 . . . 1.0 . . . . . . . . . . . . A . 27 THR HG23 . . . . . . . . . c30643_6pv2 1 . 1 . 469 . 1 1 27 THR N N -9.151 -1.039 1.475 . . . 1.0 . . . . . . . . . . . . A . 27 THR N . . . . . . . . . c30643_6pv2 1 . 1 . 470 . 1 1 27 THR O O -8.827 1.445 2.519 . . . 1.0 . . . . . . . . . . . . A . 27 THR O . . . . . . . . . c30643_6pv2 1 . 1 . 471 . 1 1 27 THR OG1 O -10.596 -1.186 4.902 . . . 1.0 . . . . . . . . . . . . A . 27 THR OG1 . . . . . . . . . c30643_6pv2 1 . 1 . 472 . 1 1 28 GLY C C -11.719 3.604 2.928 . . . 1.0 . . . . . . . . . . . . A . 28 GLY C . . . . . . . . . c30643_6pv2 1 . 1 . 473 . 1 1 28 GLY CA C -10.794 2.832 3.836 . . . 1.0 . . . . . . . . . . . . A . 28 GLY CA . . . . . . . . . c30643_6pv2 1 . 1 . 474 . 1 1 28 GLY H H -11.586 0.870 3.844 . . . 1.0 . . . . . . . . . . . . A . 28 GLY H . . . . . . . . . c30643_6pv2 1 . 1 . 475 . 1 1 28 GLY HA2 H -11.094 2.990 4.861 . . . 1.0 . . . . . . . . . . . . A . 28 GLY HA2 . . . . . . . . . c30643_6pv2 1 . 1 . 476 . 1 1 28 GLY HA3 H -9.788 3.197 3.702 . . . 1.0 . . . . . . . . . . . . A . 28 GLY HA3 . . . . . . . . . c30643_6pv2 1 . 1 . 477 . 1 1 28 GLY N N -10.824 1.414 3.546 . . . 1.0 . . . . . . . . . . . . A . 28 GLY N . . . . . . . . . c30643_6pv2 1 . 1 . 478 . 1 1 28 GLY O O -12.186 4.690 3.271 . . . 1.0 . . . . . . . . . . . . A . 28 GLY O . . . . . . . . . c30643_6pv2 1 . 1 . 479 . 1 1 29 GLU C C -13.661 2.529 0.083 . . . 1.0 . . . . . . . . . . . . A . 29 GLU C . . . . . . . . . c30643_6pv2 1 . 1 . 480 . 1 1 29 GLU CA C -12.901 3.625 0.813 . . . 1.0 . . . . . . . . . . . . A . 29 GLU CA . . . . . . . . . c30643_6pv2 1 . 1 . 481 . 1 1 29 GLU CB C -12.149 4.502 -0.187 . . . 1.0 . . . . . . . . . . . . A . 29 GLU CB . . . . . . . . . c30643_6pv2 1 . 1 . 482 . 1 1 29 GLU CD C -12.348 6.234 -2.012 . . . 1.0 . . . . . . . . . . . . A . 29 GLU CD . . . . . . . . . c30643_6pv2 1 . 1 . 483 . 1 1 29 GLU CG C -13.063 5.190 -1.187 . . . 1.0 . . . . . . . . . . . . A . 29 GLU CG . . . . . . . . . c30643_6pv2 1 . 1 . 484 . 1 1 29 GLU H H -11.538 2.195 1.535 . . . 1.0 . . . . . . . . . . . . A . 29 GLU H . . . . . . . . . c30643_6pv2 1 . 1 . 485 . 1 1 29 GLU HA H -13.605 4.233 1.363 . . . 1.0 . . . . . . . . . . . . A . 29 GLU HA . . . . . . . . . c30643_6pv2 1 . 1 . 486 . 1 1 29 GLU HB2 H -11.601 5.259 0.354 . . . 1.0 . . . . . . . . . . . . A . 29 GLU HB2 . . . . . . . . . c30643_6pv2 1 . 1 . 487 . 1 1 29 GLU HB3 H -11.452 3.887 -0.735 . . . 1.0 . . . . . . . . . . . . A . 29 GLU HB3 . . . . . . . . . c30643_6pv2 1 . 1 . 488 . 1 1 29 GLU HG2 H -13.467 4.444 -1.855 . . . 1.0 . . . . . . . . . . . . A . 29 GLU HG2 . . . . . . . . . c30643_6pv2 1 . 1 . 489 . 1 1 29 GLU HG3 H -13.871 5.666 -0.651 . . . 1.0 . . . . . . . . . . . . A . 29 GLU HG3 . . . . . . . . . c30643_6pv2 1 . 1 . 490 . 1 1 29 GLU N N -11.981 3.037 1.764 . . . 1.0 . . . . . . . . . . . . A . 29 GLU N . . . . . . . . . c30643_6pv2 1 . 1 . 491 . 1 1 29 GLU O O -13.068 1.551 -0.374 . . . 1.0 . . . . . . . . . . . . A . 29 GLU O . . . . . . . . . c30643_6pv2 1 . 1 . 492 . 1 1 29 GLU OE1 O -12.295 7.402 -1.575 . . . 1.0 . . . . . . . . . . . . A . 29 GLU OE1 . . . . . . . . . c30643_6pv2 1 . 1 . 493 . 1 1 29 GLU OE2 O -11.842 5.902 -3.100 . . . 1.0 . . . . . . . . . . . . A . 29 GLU OE2 . . . . . . . . . c30643_6pv2 1 . 1 . 494 . 1 1 30 LYS C C -16.507 2.423 -1.864 . . . 1.0 . . . . . . . . . . . . A . 30 LYS C . . . . . . . . . c30643_6pv2 1 . 1 . 495 . 1 1 30 LYS CA C -15.805 1.732 -0.704 . . . 1.0 . . . . . . . . . . . . A . 30 LYS CA . . . . . . . . . c30643_6pv2 1 . 1 . 496 . 1 1 30 LYS CB C -16.828 1.107 0.252 . . . 1.0 . . . . . . . . . . . . A . 30 LYS CB . . . . . . . . . c30643_6pv2 1 . 1 . 497 . 1 1 30 LYS CD C -17.257 -0.313 2.281 . . . 1.0 . . . . . . . . . . . . A . 30 LYS CD . . . . . . . . . c30643_6pv2 1 . 1 . 498 . 1 1 30 LYS CE C -16.633 -1.107 3.419 . . . 1.0 . . . . . . . . . . . . A . 30 LYS CE . . . . . . . . . c30643_6pv2 1 . 1 . 499 . 1 1 30 LYS CG C -16.199 0.316 1.391 . . . 1.0 . . . . . . . . . . . . A . 30 LYS CG . . . . . . . . . c30643_6pv2 1 . 1 . 500 . 1 1 30 LYS H H -15.386 3.473 0.407 . . . 1.0 . . . . . . . . . . . . A . 30 LYS H . . . . . . . . . c30643_6pv2 1 . 1 . 501 . 1 1 30 LYS HA H -15.164 0.954 -1.095 . . . 1.0 . . . . . . . . . . . . A . 30 LYS HA . . . . . . . . . c30643_6pv2 1 . 1 . 502 . 1 1 30 LYS HB2 H -17.428 1.896 0.681 . . . 1.0 . . . . . . . . . . . . A . 30 LYS HB2 . . . . . . . . . c30643_6pv2 1 . 1 . 503 . 1 1 30 LYS HB3 H -17.469 0.444 -0.307 . . . 1.0 . . . . . . . . . . . . A . 30 LYS HB3 . . . . . . . . . c30643_6pv2 1 . 1 . 504 . 1 1 30 LYS HD2 H -17.872 0.469 2.699 . . . 1.0 . . . . . . . . . . . . A . 30 LYS HD2 . . . . . . . . . c30643_6pv2 1 . 1 . 505 . 1 1 30 LYS HD3 H -17.868 -0.974 1.686 . . . 1.0 . . . . . . . . . . . . A . 30 LYS HD3 . . . . . . . . . c30643_6pv2 1 . 1 . 506 . 1 1 30 LYS HE2 H -17.420 -1.606 3.965 . . . 1.0 . . . . . . . . . . . . A . 30 LYS HE2 . . . . . . . . . c30643_6pv2 1 . 1 . 507 . 1 1 30 LYS HE3 H -15.966 -1.846 3.000 . . . 1.0 . . . . . . . . . . . . A . 30 LYS HE3 . . . . . . . . . c30643_6pv2 1 . 1 . 508 . 1 1 30 LYS HG2 H -15.582 -0.466 0.974 . . . 1.0 . . . . . . . . . . . . A . 30 LYS HG2 . . . . . . . . . c30643_6pv2 1 . 1 . 509 . 1 1 30 LYS HG3 H -15.588 0.982 1.985 . . . 1.0 . . . . . . . . . . . . A . 30 LYS HG3 . . . . . . . . . c30643_6pv2 1 . 1 . 510 . 1 1 30 LYS HZ1 H -16.495 0.471 4.780 . . . 1.0 . . . . . . . . . . . . A . 30 LYS HZ1 . . . . . . . . . c30643_6pv2 1 . 1 . 511 . 1 1 30 LYS HZ2 H -15.100 0.248 3.856 . . . 1.0 . . . . . . . . . . . . A . 30 LYS HZ2 . . . . . . . . . c30643_6pv2 1 . 1 . 512 . 1 1 30 LYS HZ3 H -15.455 -0.817 5.120 . . . 1.0 . . . . . . . . . . . . A . 30 LYS HZ3 . . . . . . . . . c30643_6pv2 1 . 1 . 513 . 1 1 30 LYS N N -14.970 2.684 -0.003 . . . 1.0 . . . . . . . . . . . . A . 30 LYS N . . . . . . . . . c30643_6pv2 1 . 1 . 514 . 1 1 30 LYS NZ N -15.870 -0.241 4.359 . . . 1.0 . . . . . . . . . . . . A . 30 LYS NZ . . . . . . . . . c30643_6pv2 1 . 1 . 515 . 1 1 30 LYS O O -16.086 2.311 -3.014 . . . 1.0 . . . . . . . . . . . . A . 30 LYS O . . . . . . . . . c30643_6pv2 1 . 1 . 516 . 1 1 31 NH2 HN1 H -17.841 3.204 -0.622 . . . 1.0 . . . . . . . . . . . . A . 31 NH2 HN1 . . . . . . . . . c30643_6pv2 1 . 1 . 517 . 1 1 31 NH2 HN2 H -18.023 3.625 -2.287 . . . 1.0 . . . . . . . . . . . . A . 31 NH2 HN2 . . . . . . . . . c30643_6pv2 1 . 1 . 518 . 1 1 31 NH2 N N -17.561 3.157 -1.561 . . . 1.0 . . . . . . . . . . . . A . 31 NH2 N . . . . . . . . . c30643_6pv2 1 . 1 . 519 . 2 2 1 ZN ZN Zn -2.504 -4.275 -2.442 . . . 1.0 . . . . . . . . . . . . A . 101 ZN ZN . . . . . . . . . c30643_6pv2 1 . 2 . 520 . 1 1 1 ARG C C 11.521 -0.845 3.036 . . . 1.0 . . . . . . . . . . . . A . 1 ARG C . . . . . . . . . c30643_6pv2 1 . 2 . 521 . 1 1 1 ARG CA C 12.569 -1.136 4.107 . . . 1.0 . . . . . . . . . . . . A . 1 ARG CA . . . . . . . . . c30643_6pv2 1 . 2 . 522 . 1 1 1 ARG CB C 11.902 -1.194 5.490 . . . 1.0 . . . . . . . . . . . . A . 1 ARG CB . . . . . . . . . c30643_6pv2 1 . 2 . 523 . 1 1 1 ARG CD C 10.412 -0.049 7.170 . . . 1.0 . . . . . . . . . . . . A . 1 ARG CD . . . . . . . . . c30643_6pv2 1 . 2 . 524 . 1 1 1 ARG CG C 11.292 0.127 5.941 . . . 1.0 . . . . . . . . . . . . A . 1 ARG CG . . . . . . . . . c30643_6pv2 1 . 2 . 525 . 1 1 1 ARG CZ C 8.087 -0.844 7.448 . . . 1.0 . . . . . . . . . . . . A . 1 ARG CZ . . . . . . . . . c30643_6pv2 1 . 2 . 526 . 1 1 1 ARG H1 H 13.224 0.834 4.228 . . . 1.0 . . . . . . . . . . . . A . 1 ARG H1 . . . . . . . . . c30643_6pv2 1 . 2 . 527 . 1 1 1 ARG H2 H 14.114 -0.123 3.160 . . . 1.0 . . . . . . . . . . . . A . 1 ARG H2 . . . . . . . . . c30643_6pv2 1 . 2 . 528 . 1 1 1 ARG H3 H 14.330 -0.297 4.826 . . . 1.0 . . . . . . . . . . . . A . 1 ARG H3 . . . . . . . . . c30643_6pv2 1 . 2 . 529 . 1 1 1 ARG HA H 13.025 -2.092 3.895 . . . 1.0 . . . . . . . . . . . . A . 1 ARG HA . . . . . . . . . c30643_6pv2 1 . 2 . 530 . 1 1 1 ARG HB2 H 11.119 -1.936 5.466 . . . 1.0 . . . . . . . . . . . . A . 1 ARG HB2 . . . . . . . . . c30643_6pv2 1 . 2 . 531 . 1 1 1 ARG HB3 H 12.642 -1.490 6.220 . . . 1.0 . . . . . . . . . . . . A . 1 ARG HB3 . . . . . . . . . c30643_6pv2 1 . 2 . 532 . 1 1 1 ARG HD2 H 11.013 -0.447 7.975 . . . 1.0 . . . . . . . . . . . . A . 1 ARG HD2 . . . . . . . . . c30643_6pv2 1 . 2 . 533 . 1 1 1 ARG HD3 H 10.019 0.913 7.458 . . . 1.0 . . . . . . . . . . . . A . 1 ARG HD3 . . . . . . . . . c30643_6pv2 1 . 2 . 534 . 1 1 1 ARG HE H 9.469 -1.714 6.300 . . . 1.0 . . . . . . . . . . . . A . 1 ARG HE . . . . . . . . . c30643_6pv2 1 . 2 . 535 . 1 1 1 ARG HG2 H 12.088 0.816 6.178 . . . 1.0 . . . . . . . . . . . . A . 1 ARG HG2 . . . . . . . . . c30643_6pv2 1 . 2 . 536 . 1 1 1 ARG HG3 H 10.695 0.529 5.134 . . . 1.0 . . . . . . . . . . . . A . 1 ARG HG3 . . . . . . . . . c30643_6pv2 1 . 2 . 537 . 1 1 1 ARG HH11 H 6.896 0.238 8.683 . . . 1.0 . . . . . . . . . . . . A . 1 ARG HH11 . . . . . . . . . c30643_6pv2 1 . 2 . 538 . 1 1 1 ARG HH12 H 8.522 0.824 8.518 . . . 1.0 . . . . . . . . . . . . A . 1 ARG HH12 . . . . . . . . . c30643_6pv2 1 . 2 . 539 . 1 1 1 ARG HH21 H 7.346 -2.483 6.513 . . . 1.0 . . . . . . . . . . . . A . 1 ARG HH21 . . . . . . . . . c30643_6pv2 1 . 2 . 540 . 1 1 1 ARG HH22 H 6.230 -1.648 7.545 . . . 1.0 . . . . . . . . . . . . A . 1 ARG HH22 . . . . . . . . . c30643_6pv2 1 . 2 . 541 . 1 1 1 ARG N N 13.631 -0.110 4.080 . . . 1.0 . . . . . . . . . . . . A . 1 ARG N . . . . . . . . . c30643_6pv2 1 . 2 . 542 . 1 1 1 ARG NE N 9.299 -0.961 6.911 . . . 1.0 . . . . . . . . . . . . A . 1 ARG NE . . . . . . . . . c30643_6pv2 1 . 2 . 543 . 1 1 1 ARG NH1 N 7.813 0.153 8.282 . . . 1.0 . . . . . . . . . . . . A . 1 ARG NH1 . . . . . . . . . c30643_6pv2 1 . 2 . 544 . 1 1 1 ARG NH2 N 7.145 -1.726 7.143 . . . 1.0 . . . . . . . . . . . . A . 1 ARG NH2 . . . . . . . . . c30643_6pv2 1 . 2 . 545 . 1 1 1 ARG O O 11.004 0.269 2.951 . . . 1.0 . . . . . . . . . . . . A . 1 ARG O . . . . . . . . . c30643_6pv2 1 . 2 . 546 . 1 1 2 PRO C C 8.777 -1.762 1.730 . . . 1.0 . . . . . . . . . . . . A . 2 PRO C . . . . . . . . . c30643_6pv2 1 . 2 . 547 . 1 1 2 PRO CA C 10.185 -1.676 1.160 . . . 1.0 . . . . . . . . . . . . A . 2 PRO CA . . . . . . . . . c30643_6pv2 1 . 2 . 548 . 1 1 2 PRO CB C 10.455 -2.841 0.212 . . . 1.0 . . . . . . . . . . . . A . 2 PRO CB . . . . . . . . . c30643_6pv2 1 . 2 . 549 . 1 1 2 PRO CD C 11.805 -3.186 2.170 . . . 1.0 . . . . . . . . . . . . A . 2 PRO CD . . . . . . . . . c30643_6pv2 1 . 2 . 550 . 1 1 2 PRO CG C 11.049 -3.901 1.073 . . . 1.0 . . . . . . . . . . . . A . 2 PRO CG . . . . . . . . . c30643_6pv2 1 . 2 . 551 . 1 1 2 PRO HA H 10.303 -0.740 0.633 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HA . . . . . . . . . c30643_6pv2 1 . 2 . 552 . 1 1 2 PRO HB2 H 9.525 -3.165 -0.235 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HB2 . . . . . . . . . c30643_6pv2 1 . 2 . 553 . 1 1 2 PRO HB3 H 11.144 -2.528 -0.561 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HB3 . . . . . . . . . c30643_6pv2 1 . 2 . 554 . 1 1 2 PRO HD2 H 11.657 -3.688 3.115 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HD2 . . . . . . . . . c30643_6pv2 1 . 2 . 555 . 1 1 2 PRO HD3 H 12.857 -3.133 1.932 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HD3 . . . . . . . . . c30643_6pv2 1 . 2 . 556 . 1 1 2 PRO HG2 H 10.264 -4.510 1.495 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HG2 . . . . . . . . . c30643_6pv2 1 . 2 . 557 . 1 1 2 PRO HG3 H 11.724 -4.511 0.489 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HG3 . . . . . . . . . c30643_6pv2 1 . 2 . 558 . 1 1 2 PRO N N 11.201 -1.838 2.192 . . . 1.0 . . . . . . . . . . . . A . 2 PRO N . . . . . . . . . c30643_6pv2 1 . 2 . 559 . 1 1 2 PRO O O 8.461 -2.662 2.513 . . . 1.0 . . . . . . . . . . . . A . 2 PRO O . . . . . . . . . c30643_6pv2 1 . 2 . 560 . 1 1 3 PHE C C 5.700 -1.687 0.947 . . . 1.0 . . . . . . . . . . . . A . 3 PHE C . . . . . . . . . c30643_6pv2 1 . 2 . 561 . 1 1 3 PHE CA C 6.565 -0.777 1.805 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CA . . . . . . . . . c30643_6pv2 1 . 2 . 562 . 1 1 3 PHE CB C 6.049 0.663 1.766 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CB . . . . . . . . . c30643_6pv2 1 . 2 . 563 . 1 1 3 PHE CD1 C 7.800 2.406 2.163 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CD1 . . . . . . . . . c30643_6pv2 1 . 2 . 564 . 1 1 3 PHE CD2 C 6.523 1.644 4.025 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CD2 . . . . . . . . . c30643_6pv2 1 . 2 . 565 . 1 1 3 PHE CE1 C 8.500 3.262 2.989 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CE1 . . . . . . . . . c30643_6pv2 1 . 2 . 566 . 1 1 3 PHE CE2 C 7.220 2.497 4.857 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CE2 . . . . . . . . . c30643_6pv2 1 . 2 . 567 . 1 1 3 PHE CG C 6.806 1.589 2.670 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CG . . . . . . . . . c30643_6pv2 1 . 2 . 568 . 1 1 3 PHE CZ C 8.207 3.299 4.348 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CZ . . . . . . . . . c30643_6pv2 1 . 2 . 569 . 1 1 3 PHE H H 8.242 -0.153 0.684 . . . 1.0 . . . . . . . . . . . . A . 3 PHE H . . . . . . . . . c30643_6pv2 1 . 2 . 570 . 1 1 3 PHE HA H 6.550 -1.134 2.823 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HA . . . . . . . . . c30643_6pv2 1 . 2 . 571 . 1 1 3 PHE HB2 H 6.130 1.042 0.759 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HB2 . . . . . . . . . c30643_6pv2 1 . 2 . 572 . 1 1 3 PHE HB3 H 5.015 0.678 2.067 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HB3 . . . . . . . . . c30643_6pv2 1 . 2 . 573 . 1 1 3 PHE HD1 H 8.028 2.368 1.109 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HD1 . . . . . . . . . c30643_6pv2 1 . 2 . 574 . 1 1 3 PHE HD2 H 5.749 1.011 4.432 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HD2 . . . . . . . . . c30643_6pv2 1 . 2 . 575 . 1 1 3 PHE HE1 H 9.275 3.891 2.580 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HE1 . . . . . . . . . c30643_6pv2 1 . 2 . 576 . 1 1 3 PHE HE2 H 6.991 2.530 5.911 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HE2 . . . . . . . . . c30643_6pv2 1 . 2 . 577 . 1 1 3 PHE HZ H 8.752 3.964 5.002 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HZ . . . . . . . . . c30643_6pv2 1 . 2 . 578 . 1 1 3 PHE N N 7.937 -0.826 1.332 . . . 1.0 . . . . . . . . . . . . A . 3 PHE N . . . . . . . . . c30643_6pv2 1 . 2 . 579 . 1 1 3 PHE O O 5.200 -1.281 -0.100 . . . 1.0 . . . . . . . . . . . . A . 3 PHE O . . . . . . . . . c30643_6pv2 1 . 2 . 580 . 1 1 4 NLE C C 3.440 -4.153 1.047 . . . 1.0 . . . . . . . . . . . . A . 4 NLE C . . . . . . . . . c30643_6pv2 1 . 2 . 581 . 1 1 4 NLE CA C 4.876 -3.937 0.589 . . . 1.0 . . . . . . . . . . . . A . 4 NLE CA . . . . . . . . . c30643_6pv2 1 . 2 . 582 . 1 1 4 NLE CB C 5.649 -5.256 0.665 . . . 1.0 . . . . . . . . . . . . A . 4 NLE CB . . . . . . . . . c30643_6pv2 1 . 2 . 583 . 1 1 4 NLE CD C 5.847 -7.652 -0.070 . . . 1.0 . . . . . . . . . . . . A . 4 NLE CD . . . . . . . . . c30643_6pv2 1 . 2 . 584 . 1 1 4 NLE CE C 5.220 -8.725 -0.929 . . . 1.0 . . . . . . . . . . . . A . 4 NLE CE . . . . . . . . . c30643_6pv2 1 . 2 . 585 . 1 1 4 NLE CG C 5.062 -6.360 -0.202 . . . 1.0 . . . . . . . . . . . . A . 4 NLE CG . . . . . . . . . c30643_6pv2 1 . 2 . 586 . 1 1 4 NLE H H 5.880 -3.157 2.277 . . . 1.0 . . . . . . . . . . . . A . 4 NLE H . . . . . . . . . c30643_6pv2 1 . 2 . 587 . 1 1 4 NLE HA H 4.865 -3.595 -0.435 . . . 1.0 . . . . . . . . . . . . A . 4 NLE HA . . . . . . . . . c30643_6pv2 1 . 2 . 588 . 1 1 4 NLE HB2 H 5.652 -5.598 1.688 . . . 1.0 . . . . . . . . . . . . A . 4 NLE HB2 . . . . . . . . . c30643_6pv2 1 . 2 . 589 . 1 1 4 NLE HB3 H 6.669 -5.085 0.350 . . . 1.0 . . . . . . . . . . . . A . 4 NLE HB3 . . . . . . . . . c30643_6pv2 1 . 2 . 590 . 1 1 4 NLE HD2 H 5.838 -7.978 0.959 . . . 1.0 . . . . . . . . . . . . A . 4 NLE HD2 . . . . . . . . . c30643_6pv2 1 . 2 . 591 . 1 1 4 NLE HD3 H 6.863 -7.491 -0.402 . . . 1.0 . . . . . . . . . . . . A . 4 NLE HD3 . . . . . . . . . c30643_6pv2 1 . 2 . 592 . 1 1 4 NLE HE1 H 5.226 -8.410 -1.961 . . . 1.0 . . . . . . . . . . . . A . 4 NLE HE1 . . . . . . . . . c30643_6pv2 1 . 2 . 593 . 1 1 4 NLE HE2 H 4.202 -8.893 -0.610 . . . 1.0 . . . . . . . . . . . . A . 4 NLE HE2 . . . . . . . . . c30643_6pv2 1 . 2 . 594 . 1 1 4 NLE HE3 H 5.783 -9.640 -0.829 . . . 1.0 . . . . . . . . . . . . A . 4 NLE HE3 . . . . . . . . . c30643_6pv2 1 . 2 . 595 . 1 1 4 NLE HG2 H 5.083 -6.042 -1.234 . . . 1.0 . . . . . . . . . . . . A . 4 NLE HG2 . . . . . . . . . c30643_6pv2 1 . 2 . 596 . 1 1 4 NLE HG3 H 4.041 -6.538 0.101 . . . 1.0 . . . . . . . . . . . . A . 4 NLE HG3 . . . . . . . . . c30643_6pv2 1 . 2 . 597 . 1 1 4 NLE N N 5.546 -2.923 1.387 . . . 1.0 . . . . . . . . . . . . A . 4 NLE N . . . . . . . . . c30643_6pv2 1 . 2 . 598 . 1 1 4 NLE O O 3.156 -4.217 2.244 . . . 1.0 . . . . . . . . . . . . A . 4 NLE O . . . . . . . . . c30643_6pv2 1 . 2 . 599 . 1 1 5 CYS C C 1.023 -6.058 0.709 . . . 1.0 . . . . . . . . . . . . A . 5 CYS C . . . . . . . . . c30643_6pv2 1 . 2 . 600 . 1 1 5 CYS CA C 1.155 -4.585 0.345 . . . 1.0 . . . . . . . . . . . . A . 5 CYS CA . . . . . . . . . c30643_6pv2 1 . 2 . 601 . 1 1 5 CYS CB C 0.295 -4.266 -0.879 . . . 1.0 . . . . . . . . . . . . A . 5 CYS CB . . . . . . . . . c30643_6pv2 1 . 2 . 602 . 1 1 5 CYS H H 2.825 -4.096 -0.849 . . . 1.0 . . . . . . . . . . . . A . 5 CYS H . . . . . . . . . c30643_6pv2 1 . 2 . 603 . 1 1 5 CYS HA H 0.821 -3.985 1.178 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HA . . . . . . . . . c30643_6pv2 1 . 2 . 604 . 1 1 5 CYS HB2 H 0.228 -3.193 -0.994 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HB2 . . . . . . . . . c30643_6pv2 1 . 2 . 605 . 1 1 5 CYS HB3 H 0.761 -4.687 -1.753 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HB3 . . . . . . . . . c30643_6pv2 1 . 2 . 606 . 1 1 5 CYS N N 2.542 -4.255 0.079 . . . 1.0 . . . . . . . . . . . . A . 5 CYS N . . . . . . . . . c30643_6pv2 1 . 2 . 607 . 1 1 5 CYS O O 1.646 -6.921 0.087 . . . 1.0 . . . . . . . . . . . . A . 5 CYS O . . . . . . . . . c30643_6pv2 1 . 2 . 608 . 1 1 5 CYS SG S -1.392 -4.910 -0.790 . . . 1.0 . . . . . . . . . . . . A . 5 CYS SG . . . . . . . . . c30643_6pv2 1 . 2 . 609 . 1 1 6 THR C C -1.480 -8.078 2.019 . . . 1.0 . . . . . . . . . . . . A . 6 THR C . . . . . . . . . c30643_6pv2 1 . 2 . 610 . 1 1 6 THR CA C -0.011 -7.701 2.158 . . . 1.0 . . . . . . . . . . . . A . 6 THR CA . . . . . . . . . c30643_6pv2 1 . 2 . 611 . 1 1 6 THR CB C 0.440 -7.891 3.617 . . . 1.0 . . . . . . . . . . . . A . 6 THR CB . . . . . . . . . c30643_6pv2 1 . 2 . 612 . 1 1 6 THR CG2 C 1.954 -8.000 3.706 . . . 1.0 . . . . . . . . . . . . A . 6 THR CG2 . . . . . . . . . c30643_6pv2 1 . 2 . 613 . 1 1 6 THR H H -0.237 -5.606 2.184 . . . 1.0 . . . . . . . . . . . . A . 6 THR H . . . . . . . . . c30643_6pv2 1 . 2 . 614 . 1 1 6 THR HA H 0.578 -8.356 1.534 . . . 1.0 . . . . . . . . . . . . A . 6 THR HA . . . . . . . . . c30643_6pv2 1 . 2 . 615 . 1 1 6 THR HB H 0.004 -8.804 3.995 . . . 1.0 . . . . . . . . . . . . A . 6 THR HB . . . . . . . . . c30643_6pv2 1 . 2 . 616 . 1 1 6 THR HG1 H 0.075 -7.014 5.348 . . . 1.0 . . . . . . . . . . . . A . 6 THR HG1 . . . . . . . . . c30643_6pv2 1 . 2 . 617 . 1 1 6 THR HG21 H 2.288 -8.859 3.141 . . . 1.0 . . . . . . . . . . . . A . 6 THR HG21 . . . . . . . . . c30643_6pv2 1 . 2 . 618 . 1 1 6 THR HG22 H 2.247 -8.115 4.740 . . . 1.0 . . . . . . . . . . . . A . 6 THR HG22 . . . . . . . . . c30643_6pv2 1 . 2 . 619 . 1 1 6 THR HG23 H 2.404 -7.106 3.301 . . . 1.0 . . . . . . . . . . . . A . 6 THR HG23 . . . . . . . . . c30643_6pv2 1 . 2 . 620 . 1 1 6 THR N N 0.219 -6.339 1.718 . . . 1.0 . . . . . . . . . . . . A . 6 THR N . . . . . . . . . c30643_6pv2 1 . 2 . 621 . 1 1 6 THR O O -1.973 -8.974 2.705 . . . 1.0 . . . . . . . . . . . . A . 6 THR O . . . . . . . . . c30643_6pv2 1 . 2 . 622 . 1 1 6 THR OG1 O -0.017 -6.789 4.414 . . . 1.0 . . . . . . . . . . . . A . 6 THR OG1 . . . . . . . . . c30643_6pv2 1 . 2 . 623 . 1 1 7 TRP C C -3.732 -8.790 -0.114 . . . 1.0 . . . . . . . . . . . . A . 7 TRP C . . . . . . . . . c30643_6pv2 1 . 2 . 624 . 1 1 7 TRP CA C -3.585 -7.666 0.903 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CA . . . . . . . . . c30643_6pv2 1 . 2 . 625 . 1 1 7 TRP CB C -4.296 -6.406 0.417 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CB . . . . . . . . . c30643_6pv2 1 . 2 . 626 . 1 1 7 TRP CD1 C -6.772 -7.050 0.262 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CD1 . . . . . . . . . c30643_6pv2 1 . 2 . 627 . 1 1 7 TRP CD2 C -6.312 -5.504 1.810 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CD2 . . . . . . . . . c30643_6pv2 1 . 2 . 628 . 1 1 7 TRP CE2 C -7.694 -5.761 1.834 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CE2 . . . . . . . . . c30643_6pv2 1 . 2 . 629 . 1 1 7 TRP CE3 C -5.785 -4.563 2.696 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CE3 . . . . . . . . . c30643_6pv2 1 . 2 . 630 . 1 1 7 TRP CG C -5.741 -6.342 0.803 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CG . . . . . . . . . c30643_6pv2 1 . 2 . 631 . 1 1 7 TRP CH2 C -8.014 -4.192 3.568 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CH2 . . . . . . . . . c30643_6pv2 1 . 2 . 632 . 1 1 7 TRP CZ2 C -8.558 -5.109 2.710 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CZ2 . . . . . . . . . c30643_6pv2 1 . 2 . 633 . 1 1 7 TRP CZ3 C -6.640 -3.916 3.565 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CZ3 . . . . . . . . . c30643_6pv2 1 . 2 . 634 . 1 1 7 TRP H H -1.733 -6.706 0.587 . . . 1.0 . . . . . . . . . . . . A . 7 TRP H . . . . . . . . . c30643_6pv2 1 . 2 . 635 . 1 1 7 TRP HA H -4.017 -7.978 1.841 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HA . . . . . . . . . c30643_6pv2 1 . 2 . 636 . 1 1 7 TRP HB2 H -3.805 -5.541 0.833 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HB2 . . . . . . . . . c30643_6pv2 1 . 2 . 637 . 1 1 7 TRP HB3 H -4.235 -6.360 -0.659 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HB3 . . . . . . . . . c30643_6pv2 1 . 2 . 638 . 1 1 7 TRP HD1 H -6.661 -7.773 -0.532 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HD1 . . . . . . . . . c30643_6pv2 1 . 2 . 639 . 1 1 7 TRP HE1 H -8.835 -7.083 0.671 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HE1 . . . . . . . . . c30643_6pv2 1 . 2 . 640 . 1 1 7 TRP HE3 H -4.727 -4.340 2.706 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HE3 . . . . . . . . . c30643_6pv2 1 . 2 . 641 . 1 1 7 TRP HH2 H -8.646 -3.661 4.264 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HH2 . . . . . . . . . c30643_6pv2 1 . 2 . 642 . 1 1 7 TRP HZ2 H -9.619 -5.312 2.725 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HZ2 . . . . . . . . . c30643_6pv2 1 . 2 . 643 . 1 1 7 TRP HZ3 H -6.250 -3.185 4.258 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HZ3 . . . . . . . . . c30643_6pv2 1 . 2 . 644 . 1 1 7 TRP N N -2.178 -7.397 1.123 . . . 1.0 . . . . . . . . . . . . A . 7 TRP N . . . . . . . . . c30643_6pv2 1 . 2 . 645 . 1 1 7 TRP NE1 N -7.951 -6.709 0.880 . . . 1.0 . . . . . . . . . . . . A . 7 TRP NE1 . . . . . . . . . c30643_6pv2 1 . 2 . 646 . 1 1 7 TRP O O -4.009 -8.558 -1.295 . . . 1.0 . . . . . . . . . . . . A . 7 TRP O . . . . . . . . . c30643_6pv2 1 . 2 . 647 . 1 1 8 ORN C C -2.123 -10.897 -3.912 . . . 1.0 . . . . . . . . . . . . A . 8 ORN C . . . . . . . . . c30643_6pv2 1 . 2 . 648 . 1 1 8 ORN CA C -2.944 -12.070 -3.394 . . . 1.0 . . . . . . . . . . . . A . 8 ORN CA . . . . . . . . . c30643_6pv2 1 . 2 . 649 . 1 1 8 ORN CB C -2.311 -12.636 -2.119 . . . 1.0 . . . . . . . . . . . . A . 8 ORN CB . . . . . . . . . c30643_6pv2 1 . 2 . 650 . 1 1 8 ORN CD C -3.579 -11.199 -0.492 . . . 1.0 . . . . . . . . . . . . A . 8 ORN CD . . . . . . . . . c30643_6pv2 1 . 2 . 651 . 1 1 8 ORN CG C -2.206 -11.626 -0.990 . . . 1.0 . . . . . . . . . . . . A . 8 ORN CG . . . . . . . . . c30643_6pv2 1 . 2 . 652 . 1 1 8 ORN H H -2.086 -13.465 -4.668 . . . 1.0 . . . . . . . . . . . . A . 8 ORN H . . . . . . . . . c30643_6pv2 1 . 2 . 653 . 1 1 8 ORN HA H -3.942 -11.724 -3.174 . . . 1.0 . . . . . . . . . . . . A . 8 ORN HA . . . . . . . . . c30643_6pv2 1 . 2 . 654 . 1 1 8 ORN HB2 H -1.318 -12.991 -2.349 . . . 1.0 . . . . . . . . . . . . A . 8 ORN HB2 . . . . . . . . . c30643_6pv2 1 . 2 . 655 . 1 1 8 ORN HB3 H -2.909 -13.465 -1.772 . . . 1.0 . . . . . . . . . . . . A . 8 ORN HB3 . . . . . . . . . c30643_6pv2 1 . 2 . 656 . 1 1 8 ORN HD2 H -4.008 -12.004 0.086 . . . 1.0 . . . . . . . . . . . . A . 8 ORN HD2 . . . . . . . . . c30643_6pv2 1 . 2 . 657 . 1 1 8 ORN HD3 H -4.210 -10.991 -1.341 . . . 1.0 . . . . . . . . . . . . A . 8 ORN HD3 . . . . . . . . . c30643_6pv2 1 . 2 . 658 . 1 1 8 ORN HE1 H -3.243 -10.123 1.281 . . . 1.0 . . . . . . . . . . . . A . 8 ORN HE1 . . . . . . . . . c30643_6pv2 1 . 2 . 659 . 1 1 8 ORN HG2 H -1.676 -10.756 -1.349 . . . 1.0 . . . . . . . . . . . . A . 8 ORN HG2 . . . . . . . . . c30643_6pv2 1 . 2 . 660 . 1 1 8 ORN HG3 H -1.658 -12.071 -0.172 . . . 1.0 . . . . . . . . . . . . A . 8 ORN HG3 . . . . . . . . . c30643_6pv2 1 . 2 . 661 . 1 1 8 ORN N N -3.034 -13.119 -4.430 . . . 1.0 . . . . . . . . . . . . A . 8 ORN N . . . . . . . . . c30643_6pv2 1 . 2 . 662 . 1 1 8 ORN NE N -3.497 -10.009 0.339 . . . 1.0 . . . . . . . . . . . . A . 8 ORN NE . . . . . . . . . c30643_6pv2 1 . 2 . 663 . 1 1 8 ORN O O -1.150 -11.086 -4.640 . . . 1.0 . . . . . . . . . . . . A . 8 ORN O . . . . . . . . . c30643_6pv2 1 . 2 . 664 . 1 1 9 CYS C C -0.640 -8.183 -3.099 . . . 1.0 . . . . . . . . . . . . A . 9 CYS C . . . . . . . . . c30643_6pv2 1 . 2 . 665 . 1 1 9 CYS CA C -1.844 -8.485 -3.988 . . . 1.0 . . . . . . . . . . . . A . 9 CYS CA . . . . . . . . . c30643_6pv2 1 . 2 . 666 . 1 1 9 CYS CB C -2.830 -7.320 -3.979 . . . 1.0 . . . . . . . . . . . . A . 9 CYS CB . . . . . . . . . c30643_6pv2 1 . 2 . 667 . 1 1 9 CYS H H -3.278 -9.601 -2.914 . . . 1.0 . . . . . . . . . . . . A . 9 CYS H . . . . . . . . . c30643_6pv2 1 . 2 . 668 . 1 1 9 CYS HA H -1.504 -8.653 -4.998 . . . 1.0 . . . . . . . . . . . . A . 9 CYS HA . . . . . . . . . c30643_6pv2 1 . 2 . 669 . 1 1 9 CYS HB2 H -3.616 -7.517 -4.693 . . . 1.0 . . . . . . . . . . . . A . 9 CYS HB2 . . . . . . . . . c30643_6pv2 1 . 2 . 670 . 1 1 9 CYS HB3 H -3.263 -7.237 -2.992 . . . 1.0 . . . . . . . . . . . . A . 9 CYS HB3 . . . . . . . . . c30643_6pv2 1 . 2 . 671 . 1 1 9 CYS N N -2.517 -9.688 -3.534 . . . 1.0 . . . . . . . . . . . . A . 9 CYS N . . . . . . . . . c30643_6pv2 1 . 2 . 672 . 1 1 9 CYS O O -0.737 -8.245 -1.872 . . . 1.0 . . . . . . . . . . . . A . 9 CYS O . . . . . . . . . c30643_6pv2 1 . 2 . 673 . 1 1 9 CYS SG S -2.110 -5.723 -4.393 . . . 1.0 . . . . . . . . . . . . A . 9 CYS SG . . . . . . . . . c30643_6pv2 1 . 2 . 674 . 1 1 10 GLY C C 2.660 -6.689 -3.697 . . . 1.0 . . . . . . . . . . . . A . 10 GLY C . . . . . . . . . c30643_6pv2 1 . 2 . 675 . 1 1 10 GLY CA C 1.701 -7.606 -2.966 . . . 1.0 . . . . . . . . . . . . A . 10 GLY CA . . . . . . . . . c30643_6pv2 1 . 2 . 676 . 1 1 10 GLY H H 0.506 -7.813 -4.696 . . . 1.0 . . . . . . . . . . . . A . 10 GLY H . . . . . . . . . c30643_6pv2 1 . 2 . 677 . 1 1 10 GLY HA2 H 1.434 -7.153 -2.024 . . . 1.0 . . . . . . . . . . . . A . 10 GLY HA2 . . . . . . . . . c30643_6pv2 1 . 2 . 678 . 1 1 10 GLY HA3 H 2.195 -8.546 -2.775 . . . 1.0 . . . . . . . . . . . . A . 10 GLY HA3 . . . . . . . . . c30643_6pv2 1 . 2 . 679 . 1 1 10 GLY N N 0.491 -7.866 -3.718 . . . 1.0 . . . . . . . . . . . . A . 10 GLY N . . . . . . . . . c30643_6pv2 1 . 2 . 680 . 1 1 10 GLY O O 3.791 -7.071 -3.991 . . . 1.0 . . . . . . . . . . . . A . 10 GLY O . . . . . . . . . c30643_6pv2 1 . 2 . 681 . 1 1 11 LYS C C 3.931 -3.780 -3.639 . . . 1.0 . . . . . . . . . . . . A . 11 LYS C . . . . . . . . . c30643_6pv2 1 . 2 . 682 . 1 1 11 LYS CA C 3.051 -4.491 -4.661 . . . 1.0 . . . . . . . . . . . . A . 11 LYS CA . . . . . . . . . c30643_6pv2 1 . 2 . 683 . 1 1 11 LYS CB C 2.181 -3.482 -5.411 . . . 1.0 . . . . . . . . . . . . A . 11 LYS CB . . . . . . . . . c30643_6pv2 1 . 2 . 684 . 1 1 11 LYS CD C 0.494 -3.073 -7.221 . . . 1.0 . . . . . . . . . . . . A . 11 LYS CD . . . . . . . . . c30643_6pv2 1 . 2 . 685 . 1 1 11 LYS CE C -0.334 -3.691 -8.338 . . . 1.0 . . . . . . . . . . . . A . 11 LYS CE . . . . . . . . . c30643_6pv2 1 . 2 . 686 . 1 1 11 LYS CG C 1.361 -4.107 -6.527 . . . 1.0 . . . . . . . . . . . . A . 11 LYS CG . . . . . . . . . c30643_6pv2 1 . 2 . 687 . 1 1 11 LYS H H 1.283 -5.251 -3.781 . . . 1.0 . . . . . . . . . . . . A . 11 LYS H . . . . . . . . . c30643_6pv2 1 . 2 . 688 . 1 1 11 LYS HA H 3.684 -5.007 -5.367 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HA . . . . . . . . . c30643_6pv2 1 . 2 . 689 . 1 1 11 LYS HB2 H 1.501 -3.018 -4.710 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HB2 . . . . . . . . . c30643_6pv2 1 . 2 . 690 . 1 1 11 LYS HB3 H 2.816 -2.721 -5.841 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HB3 . . . . . . . . . c30643_6pv2 1 . 2 . 691 . 1 1 11 LYS HD2 H -0.169 -2.631 -6.496 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HD2 . . . . . . . . . c30643_6pv2 1 . 2 . 692 . 1 1 11 LYS HD3 H 1.132 -2.308 -7.639 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HD3 . . . . . . . . . c30643_6pv2 1 . 2 . 693 . 1 1 11 LYS HE2 H -0.924 -4.497 -7.928 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HE2 . . . . . . . . . c30643_6pv2 1 . 2 . 694 . 1 1 11 LYS HE3 H -0.991 -2.935 -8.743 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HE3 . . . . . . . . . c30643_6pv2 1 . 2 . 695 . 1 1 11 LYS HG2 H 2.031 -4.545 -7.251 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HG2 . . . . . . . . . c30643_6pv2 1 . 2 . 696 . 1 1 11 LYS HG3 H 0.726 -4.874 -6.109 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HG3 . . . . . . . . . c30643_6pv2 1 . 2 . 697 . 1 1 11 LYS HZ1 H -0.073 -4.559 -10.220 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HZ1 . . . . . . . . . c30643_6pv2 1 . 2 . 698 . 1 1 11 LYS HZ2 H 1.097 -5.018 -9.086 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HZ2 . . . . . . . . . c30643_6pv2 1 . 2 . 699 . 1 1 11 LYS HZ3 H 1.156 -3.478 -9.784 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HZ3 . . . . . . . . . c30643_6pv2 1 . 2 . 700 . 1 1 11 LYS N N 2.207 -5.483 -4.002 . . . 1.0 . . . . . . . . . . . . A . 11 LYS N . . . . . . . . . c30643_6pv2 1 . 2 . 701 . 1 1 11 LYS NZ N 0.520 -4.224 -9.432 . . . 1.0 . . . . . . . . . . . . A . 11 LYS NZ . . . . . . . . . c30643_6pv2 1 . 2 . 702 . 1 1 11 LYS O O 3.538 -3.616 -2.485 . . . 1.0 . . . . . . . . . . . . A . 11 LYS O . . . . . . . . . c30643_6pv2 1 . 2 . 703 . 1 1 12 ARG C C 6.214 -1.245 -3.514 . . . 1.0 . . . . . . . . . . . . A . 12 ARG C . . . . . . . . . c30643_6pv2 1 . 2 . 704 . 1 1 12 ARG CA C 6.056 -2.714 -3.155 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CA . . . . . . . . . c30643_6pv2 1 . 2 . 705 . 1 1 12 ARG CB C 7.418 -3.412 -3.188 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CB . . . . . . . . . c30643_6pv2 1 . 2 . 706 . 1 1 12 ARG CD C 8.725 -5.527 -2.803 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CD . . . . . . . . . c30643_6pv2 1 . 2 . 707 . 1 1 12 ARG CG C 7.363 -4.857 -2.730 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CG . . . . . . . . . c30643_6pv2 1 . 2 . 708 . 1 1 12 ARG CZ C 9.557 -7.499 -1.568 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CZ . . . . . . . . . c30643_6pv2 1 . 2 . 709 . 1 1 12 ARG H H 5.377 -3.512 -4.994 . . . 1.0 . . . . . . . . . . . . A . 12 ARG H . . . . . . . . . c30643_6pv2 1 . 2 . 710 . 1 1 12 ARG HA H 5.651 -2.783 -2.157 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HA . . . . . . . . . c30643_6pv2 1 . 2 . 711 . 1 1 12 ARG HB2 H 7.797 -3.389 -4.198 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HB2 . . . . . . . . . c30643_6pv2 1 . 2 . 712 . 1 1 12 ARG HB3 H 8.101 -2.878 -2.544 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HB3 . . . . . . . . . c30643_6pv2 1 . 2 . 713 . 1 1 12 ARG HD2 H 9.080 -5.489 -3.822 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HD2 . . . . . . . . . c30643_6pv2 1 . 2 . 714 . 1 1 12 ARG HD3 H 9.410 -4.992 -2.162 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HD3 . . . . . . . . . c30643_6pv2 1 . 2 . 715 . 1 1 12 ARG HE H 7.899 -7.456 -2.692 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HE . . . . . . . . . c30643_6pv2 1 . 2 . 716 . 1 1 12 ARG HG2 H 7.016 -4.886 -1.708 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HG2 . . . . . . . . . c30643_6pv2 1 . 2 . 717 . 1 1 12 ARG HG3 H 6.671 -5.396 -3.360 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HG3 . . . . . . . . . c30643_6pv2 1 . 2 . 718 . 1 1 12 ARG HH11 H 10.763 -5.873 -1.451 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH11 . . . . . . . . . c30643_6pv2 1 . 2 . 719 . 1 1 12 ARG HH12 H 11.299 -7.255 -0.552 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH12 . . . . . . . . . c30643_6pv2 1 . 2 . 720 . 1 1 12 ARG HH21 H 10.063 -9.197 -0.587 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH21 . . . . . . . . . c30643_6pv2 1 . 2 . 721 . 1 1 12 ARG HH22 H 8.602 -9.288 -1.516 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH22 . . . . . . . . . c30643_6pv2 1 . 2 . 722 . 1 1 12 ARG N N 5.122 -3.374 -4.057 . . . 1.0 . . . . . . . . . . . . A . 12 ARG N . . . . . . . . . c30643_6pv2 1 . 2 . 723 . 1 1 12 ARG NE N 8.662 -6.923 -2.372 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NE . . . . . . . . . c30643_6pv2 1 . 2 . 724 . 1 1 12 ARG NH1 N 10.623 -6.820 -1.159 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NH1 . . . . . . . . . c30643_6pv2 1 . 2 . 725 . 1 1 12 ARG NH2 N 9.395 -8.761 -1.193 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NH2 . . . . . . . . . c30643_6pv2 1 . 2 . 726 . 1 1 12 ARG O O 6.240 -0.882 -4.689 . . . 1.0 . . . . . . . . . . . . A . 12 ARG O . . . . . . . . . c30643_6pv2 1 . 2 . 727 . 1 1 13 PHE C C 7.626 1.538 -1.854 . . . 1.0 . . . . . . . . . . . . A . 13 PHE C . . . . . . . . . c30643_6pv2 1 . 2 . 728 . 1 1 13 PHE CA C 6.445 1.026 -2.668 . . . 1.0 . . . . . . . . . . . . A . 13 PHE CA . . . . . . . . . c30643_6pv2 1 . 2 . 729 . 1 1 13 PHE CB C 5.161 1.728 -2.218 . . . 1.0 . . . . . . . . . . . . A . 13 PHE CB . . . . . . . . . c30643_6pv2 1 . 2 . 730 . 1 1 13 PHE CD1 C 3.502 1.837 -4.094 . . . 1.0 . . . . . . . . . . . . A . 13 PHE CD1 . . . . . . . . . c30643_6pv2 1 . 2 . 731 . 1 1 13 PHE CD2 C 3.220 0.157 -2.426 . . . 1.0 . . . . . . . . . . . . A . 13 PHE CD2 . . . . . . . . . c30643_6pv2 1 . 2 . 732 . 1 1 13 PHE CE1 C 2.379 1.375 -4.750 . . . 1.0 . . . . . . . . . . . . A . 13 PHE CE1 . . . . . . . . . c30643_6pv2 1 . 2 . 733 . 1 1 13 PHE CE2 C 2.098 -0.308 -3.076 . . . 1.0 . . . . . . . . . . . . A . 13 PHE CE2 . . . . . . . . . c30643_6pv2 1 . 2 . 734 . 1 1 13 PHE CG C 3.934 1.234 -2.926 . . . 1.0 . . . . . . . . . . . . A . 13 PHE CG . . . . . . . . . c30643_6pv2 1 . 2 . 735 . 1 1 13 PHE CZ C 1.677 0.302 -4.241 . . . 1.0 . . . . . . . . . . . . A . 13 PHE CZ . . . . . . . . . c30643_6pv2 1 . 2 . 736 . 1 1 13 PHE H H 6.267 -0.769 -1.577 . . . 1.0 . . . . . . . . . . . . A . 13 PHE H . . . . . . . . . c30643_6pv2 1 . 2 . 737 . 1 1 13 PHE HA H 6.613 1.225 -3.714 . . . 1.0 . . . . . . . . . . . . A . 13 PHE HA . . . . . . . . . c30643_6pv2 1 . 2 . 738 . 1 1 13 PHE HB2 H 5.021 1.564 -1.159 . . . 1.0 . . . . . . . . . . . . A . 13 PHE HB2 . . . . . . . . . c30643_6pv2 1 . 2 . 739 . 1 1 13 PHE HB3 H 5.252 2.787 -2.407 . . . 1.0 . . . . . . . . . . . . A . 13 PHE HB3 . . . . . . . . . c30643_6pv2 1 . 2 . 740 . 1 1 13 PHE HD1 H 4.052 2.676 -4.492 . . . 1.0 . . . . . . . . . . . . A . 13 PHE HD1 . . . . . . . . . c30643_6pv2 1 . 2 . 741 . 1 1 13 PHE HD2 H 3.551 -0.321 -1.515 . . . 1.0 . . . . . . . . . . . . A . 13 PHE HD2 . . . . . . . . . c30643_6pv2 1 . 2 . 742 . 1 1 13 PHE HE1 H 2.052 1.852 -5.661 . . . 1.0 . . . . . . . . . . . . A . 13 PHE HE1 . . . . . . . . . c30643_6pv2 1 . 2 . 743 . 1 1 13 PHE HE2 H 1.550 -1.148 -2.674 . . . 1.0 . . . . . . . . . . . . A . 13 PHE HE2 . . . . . . . . . c30643_6pv2 1 . 2 . 744 . 1 1 13 PHE HZ H 0.799 -0.061 -4.753 . . . 1.0 . . . . . . . . . . . . A . 13 PHE HZ . . . . . . . . . c30643_6pv2 1 . 2 . 745 . 1 1 13 PHE N N 6.307 -0.410 -2.492 . . . 1.0 . . . . . . . . . . . . A . 13 PHE N . . . . . . . . . c30643_6pv2 1 . 2 . 746 . 1 1 13 PHE O O 7.998 0.938 -0.846 . . . 1.0 . . . . . . . . . . . . A . 13 PHE O . . . . . . . . . c30643_6pv2 1 . 2 . 747 . 1 1 14 THR C C 8.828 4.337 -0.624 . . . 1.0 . . . . . . . . . . . . A . 14 THR C . . . . . . . . . c30643_6pv2 1 . 2 . 748 . 1 1 14 THR CA C 9.323 3.240 -1.559 . . . 1.0 . . . . . . . . . . . . A . 14 THR CA . . . . . . . . . c30643_6pv2 1 . 2 . 749 . 1 1 14 THR CB C 10.367 3.824 -2.523 . . . 1.0 . . . . . . . . . . . . A . 14 THR CB . . . . . . . . . c30643_6pv2 1 . 2 . 750 . 1 1 14 THR CG2 C 11.406 2.777 -2.904 . . . 1.0 . . . . . . . . . . . . A . 14 THR CG2 . . . . . . . . . c30643_6pv2 1 . 2 . 751 . 1 1 14 THR H H 7.920 3.045 -3.134 . . . 1.0 . . . . . . . . . . . . A . 14 THR H . . . . . . . . . c30643_6pv2 1 . 2 . 752 . 1 1 14 THR HA H 9.796 2.469 -0.970 . . . 1.0 . . . . . . . . . . . . A . 14 THR HA . . . . . . . . . c30643_6pv2 1 . 2 . 753 . 1 1 14 THR HB H 10.867 4.644 -2.029 . . . 1.0 . . . . . . . . . . . . A . 14 THR HB . . . . . . . . . c30643_6pv2 1 . 2 . 754 . 1 1 14 THR HG1 H 9.656 3.614 -4.355 . . . 1.0 . . . . . . . . . . . . A . 14 THR HG1 . . . . . . . . . c30643_6pv2 1 . 2 . 755 . 1 1 14 THR HG21 H 10.914 1.933 -3.365 . . . 1.0 . . . . . . . . . . . . A . 14 THR HG21 . . . . . . . . . c30643_6pv2 1 . 2 . 756 . 1 1 14 THR HG22 H 11.930 2.449 -2.019 . . . 1.0 . . . . . . . . . . . . A . 14 THR HG22 . . . . . . . . . c30643_6pv2 1 . 2 . 757 . 1 1 14 THR HG23 H 12.111 3.205 -3.600 . . . 1.0 . . . . . . . . . . . . A . 14 THR HG23 . . . . . . . . . c30643_6pv2 1 . 2 . 758 . 1 1 14 THR N N 8.219 2.635 -2.291 . . . 1.0 . . . . . . . . . . . . A . 14 THR N . . . . . . . . . c30643_6pv2 1 . 2 . 759 . 1 1 14 THR O O 9.610 4.950 0.105 . . . 1.0 . . . . . . . . . . . . A . 14 THR O . . . . . . . . . c30643_6pv2 1 . 2 . 760 . 1 1 14 THR OG1 O 9.716 4.322 -3.700 . . . 1.0 . . . . . . . . . . . . A . 14 THR OG1 . . . . . . . . . c30643_6pv2 1 . 2 . 761 . 1 1 15 ARG C C 5.709 5.091 0.920 . . . 1.0 . . . . . . . . . . . . A . 15 ARG C . . . . . . . . . c30643_6pv2 1 . 2 . 762 . 1 1 15 ARG CA C 6.920 5.628 0.157 . . . 1.0 . . . . . . . . . . . . A . 15 ARG CA . . . . . . . . . c30643_6pv2 1 . 2 . 763 . 1 1 15 ARG CB C 6.502 6.792 -0.750 . . . 1.0 . . . . . . . . . . . . A . 15 ARG CB . . . . . . . . . c30643_6pv2 1 . 2 . 764 . 1 1 15 ARG CD C 7.153 8.428 -2.555 . . . 1.0 . . . . . . . . . . . . A . 15 ARG CD . . . . . . . . . c30643_6pv2 1 . 2 . 765 . 1 1 15 ARG CG C 7.632 7.332 -1.617 . . . 1.0 . . . . . . . . . . . . A . 15 ARG CG . . . . . . . . . c30643_6pv2 1 . 2 . 766 . 1 1 15 ARG CZ C 5.810 10.492 -2.354 . . . 1.0 . . . . . . . . . . . . A . 15 ARG CZ . . . . . . . . . c30643_6pv2 1 . 2 . 767 . 1 1 15 ARG H H 6.947 4.002 -1.194 . . . 1.0 . . . . . . . . . . . . A . 15 ARG H . . . . . . . . . c30643_6pv2 1 . 2 . 768 . 1 1 15 ARG HA H 7.659 5.974 0.864 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HA . . . . . . . . . c30643_6pv2 1 . 2 . 769 . 1 1 15 ARG HB2 H 5.708 6.459 -1.400 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HB2 . . . . . . . . . c30643_6pv2 1 . 2 . 770 . 1 1 15 ARG HB3 H 6.135 7.600 -0.135 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HB3 . . . . . . . . . c30643_6pv2 1 . 2 . 771 . 1 1 15 ARG HD2 H 7.982 8.745 -3.169 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HD2 . . . . . . . . . c30643_6pv2 1 . 2 . 772 . 1 1 15 ARG HD3 H 6.371 8.030 -3.185 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HD3 . . . . . . . . . c30643_6pv2 1 . 2 . 773 . 1 1 15 ARG HE H 6.928 9.696 -0.894 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HE . . . . . . . . . c30643_6pv2 1 . 2 . 774 . 1 1 15 ARG HG2 H 8.402 7.733 -0.977 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HG2 . . . . . . . . . c30643_6pv2 1 . 2 . 775 . 1 1 15 ARG HG3 H 8.039 6.522 -2.205 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HG3 . . . . . . . . . c30643_6pv2 1 . 2 . 776 . 1 1 15 ARG HH11 H 5.684 9.605 -4.177 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HH11 . . . . . . . . . c30643_6pv2 1 . 2 . 777 . 1 1 15 ARG HH12 H 4.761 11.062 -3.997 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HH12 . . . . . . . . . c30643_6pv2 1 . 2 . 778 . 1 1 15 ARG HH21 H 5.723 11.612 -0.669 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HH21 . . . . . . . . . c30643_6pv2 1 . 2 . 779 . 1 1 15 ARG HH22 H 4.788 12.204 -2.004 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HH22 . . . . . . . . . c30643_6pv2 1 . 2 . 780 . 1 1 15 ARG N N 7.522 4.569 -0.639 . . . 1.0 . . . . . . . . . . . . A . 15 ARG N . . . . . . . . . c30643_6pv2 1 . 2 . 781 . 1 1 15 ARG NE N 6.635 9.586 -1.829 . . . 1.0 . . . . . . . . . . . . A . 15 ARG NE . . . . . . . . . c30643_6pv2 1 . 2 . 782 . 1 1 15 ARG NH1 N 5.387 10.377 -3.610 . . . 1.0 . . . . . . . . . . . . A . 15 ARG NH1 . . . . . . . . . c30643_6pv2 1 . 2 . 783 . 1 1 15 ARG NH2 N 5.410 11.518 -1.618 . . . 1.0 . . . . . . . . . . . . A . 15 ARG NH2 . . . . . . . . . c30643_6pv2 1 . 2 . 784 . 1 1 15 ARG O O 4.850 4.404 0.353 . . . 1.0 . . . . . . . . . . . . A . 15 ARG O . . . . . . . . . c30643_6pv2 1 . 2 . 785 . 1 1 16 SER C C 3.240 5.464 2.719 . . . 1.0 . . . . . . . . . . . . A . 16 SER C . . . . . . . . . c30643_6pv2 1 . 2 . 786 . 1 1 16 SER CA C 4.609 4.901 3.089 . . . 1.0 . . . . . . . . . . . . A . 16 SER CA . . . . . . . . . c30643_6pv2 1 . 2 . 787 . 1 1 16 SER CB C 4.953 5.231 4.542 . . . 1.0 . . . . . . . . . . . . A . 16 SER CB . . . . . . . . . c30643_6pv2 1 . 2 . 788 . 1 1 16 SER H H 6.333 6.014 2.581 . . . 1.0 . . . . . . . . . . . . A . 16 SER H . . . . . . . . . c30643_6pv2 1 . 2 . 789 . 1 1 16 SER HA H 4.583 3.826 2.974 . . . 1.0 . . . . . . . . . . . . A . 16 SER HA . . . . . . . . . c30643_6pv2 1 . 2 . 790 . 1 1 16 SER HB2 H 4.081 5.081 5.160 . . . 1.0 . . . . . . . . . . . . A . 16 SER HB2 . . . . . . . . . c30643_6pv2 1 . 2 . 791 . 1 1 16 SER HB3 H 5.750 4.585 4.879 . . . 1.0 . . . . . . . . . . . . A . 16 SER HB3 . . . . . . . . . c30643_6pv2 1 . 2 . 792 . 1 1 16 SER HG H 6.336 6.621 4.605 . . . 1.0 . . . . . . . . . . . . A . 16 SER HG . . . . . . . . . c30643_6pv2 1 . 2 . 793 . 1 1 16 SER N N 5.652 5.410 2.208 . . . 1.0 . . . . . . . . . . . . A . 16 SER N . . . . . . . . . c30643_6pv2 1 . 2 . 794 . 1 1 16 SER O O 2.231 4.767 2.817 . . . 1.0 . . . . . . . . . . . . A . 16 SER O . . . . . . . . . c30643_6pv2 1 . 2 . 795 . 1 1 16 SER OG O 5.373 6.579 4.668 . . . 1.0 . . . . . . . . . . . . A . 16 SER OG . . . . . . . . . c30643_6pv2 1 . 2 . 796 . 1 1 17 ASP C C 1.456 6.643 0.587 . . . 1.0 . . . . . . . . . . . . A . 17 ASP C . . . . . . . . . c30643_6pv2 1 . 2 . 797 . 1 1 17 ASP CA C 1.960 7.341 1.839 . . . 1.0 . . . . . . . . . . . . A . 17 ASP CA . . . . . . . . . c30643_6pv2 1 . 2 . 798 . 1 1 17 ASP CB C 2.153 8.834 1.560 . . . 1.0 . . . . . . . . . . . . A . 17 ASP CB . . . . . . . . . c30643_6pv2 1 . 2 . 799 . 1 1 17 ASP CG C 0.872 9.514 1.115 . . . 1.0 . . . . . . . . . . . . A . 17 ASP CG . . . . . . . . . c30643_6pv2 1 . 2 . 800 . 1 1 17 ASP H H 4.037 7.250 2.284 . . . 1.0 . . . . . . . . . . . . A . 17 ASP H . . . . . . . . . c30643_6pv2 1 . 2 . 801 . 1 1 17 ASP HA H 1.228 7.218 2.622 . . . 1.0 . . . . . . . . . . . . A . 17 ASP HA . . . . . . . . . c30643_6pv2 1 . 2 . 802 . 1 1 17 ASP HB2 H 2.500 9.318 2.458 . . . 1.0 . . . . . . . . . . . . A . 17 ASP HB2 . . . . . . . . . c30643_6pv2 1 . 2 . 803 . 1 1 17 ASP HB3 H 2.891 8.955 0.784 . . . 1.0 . . . . . . . . . . . . A . 17 ASP HB3 . . . . . . . . . c30643_6pv2 1 . 2 . 804 . 1 1 17 ASP N N 3.207 6.723 2.288 . . . 1.0 . . . . . . . . . . . . A . 17 ASP N . . . . . . . . . c30643_6pv2 1 . 2 . 805 . 1 1 17 ASP O O 0.251 6.501 0.380 . . . 1.0 . . . . . . . . . . . . A . 17 ASP O . . . . . . . . . c30643_6pv2 1 . 2 . 806 . 1 1 17 ASP OD1 O 0.760 9.854 -0.084 . . . 1.0 . . . . . . . . . . . . A . 17 ASP OD1 . . . . . . . . . c30643_6pv2 1 . 2 . 807 . 1 1 17 ASP OD2 O -0.038 9.696 1.953 . . . 1.0 . . . . . . . . . . . . A . 17 ASP OD2 . . . . . . . . . c30643_6pv2 1 . 2 . 808 . 1 1 18 GLU C C 1.435 4.131 -1.115 . . . 1.0 . . . . . . . . . . . . A . 18 GLU C . . . . . . . . . c30643_6pv2 1 . 2 . 809 . 1 1 18 GLU CA C 2.072 5.466 -1.447 . . . 1.0 . . . . . . . . . . . . A . 18 GLU CA . . . . . . . . . c30643_6pv2 1 . 2 . 810 . 1 1 18 GLU CB C 3.327 5.255 -2.289 . . . 1.0 . . . . . . . . . . . . A . 18 GLU CB . . . . . . . . . c30643_6pv2 1 . 2 . 811 . 1 1 18 GLU CD C 2.958 6.975 -4.081 . . . 1.0 . . . . . . . . . . . . A . 18 GLU CD . . . . . . . . . c30643_6pv2 1 . 2 . 812 . 1 1 18 GLU CG C 3.836 6.526 -2.936 . . . 1.0 . . . . . . . . . . . . A . 18 GLU CG . . . . . . . . . c30643_6pv2 1 . 2 . 813 . 1 1 18 GLU H H 3.333 6.338 -0.002 . . . 1.0 . . . . . . . . . . . . A . 18 GLU H . . . . . . . . . c30643_6pv2 1 . 2 . 814 . 1 1 18 GLU HA H 1.368 6.059 -2.008 . . . 1.0 . . . . . . . . . . . . A . 18 GLU HA . . . . . . . . . c30643_6pv2 1 . 2 . 815 . 1 1 18 GLU HB2 H 4.109 4.860 -1.659 . . . 1.0 . . . . . . . . . . . . A . 18 GLU HB2 . . . . . . . . . c30643_6pv2 1 . 2 . 816 . 1 1 18 GLU HB3 H 3.108 4.543 -3.069 . . . 1.0 . . . . . . . . . . . . A . 18 GLU HB3 . . . . . . . . . c30643_6pv2 1 . 2 . 817 . 1 1 18 GLU HG2 H 3.863 7.311 -2.193 . . . 1.0 . . . . . . . . . . . . A . 18 GLU HG2 . . . . . . . . . c30643_6pv2 1 . 2 . 818 . 1 1 18 GLU HG3 H 4.832 6.345 -3.312 . . . 1.0 . . . . . . . . . . . . A . 18 GLU HG3 . . . . . . . . . c30643_6pv2 1 . 2 . 819 . 1 1 18 GLU N N 2.395 6.190 -0.231 . . . 1.0 . . . . . . . . . . . . A . 18 GLU N . . . . . . . . . c30643_6pv2 1 . 2 . 820 . 1 1 18 GLU O O 0.411 3.767 -1.692 . . . 1.0 . . . . . . . . . . . . A . 18 GLU O . . . . . . . . . c30643_6pv2 1 . 2 . 821 . 1 1 18 GLU OE1 O 3.390 6.844 -5.241 . . . 1.0 . . . . . . . . . . . . A . 18 GLU OE1 . . . . . . . . . c30643_6pv2 1 . 2 . 822 . 1 1 18 GLU OE2 O 1.830 7.446 -3.832 . . . 1.0 . . . . . . . . . . . . A . 18 GLU OE2 . . . . . . . . . c30643_6pv2 1 . 2 . 823 . 1 1 19 LEU C C 0.137 2.306 0.923 . . . 1.0 . . . . . . . . . . . . A . 19 LEU C . . . . . . . . . c30643_6pv2 1 . 2 . 824 . 1 1 19 LEU CA C 1.497 2.131 0.258 . . . 1.0 . . . . . . . . . . . . A . 19 LEU CA . . . . . . . . . c30643_6pv2 1 . 2 . 825 . 1 1 19 LEU CB C 2.452 1.433 1.223 . . . 1.0 . . . . . . . . . . . . A . 19 LEU CB . . . . . . . . . c30643_6pv2 1 . 2 . 826 . 1 1 19 LEU CD1 C 1.586 -0.896 0.851 . . . 1.0 . . . . . . . . . . . . A . 19 LEU CD1 . . . . . . . . . c30643_6pv2 1 . 2 . 827 . 1 1 19 LEU CD2 C 2.823 -0.344 2.954 . . . 1.0 . . . . . . . . . . . . A . 19 LEU CD2 . . . . . . . . . c30643_6pv2 1 . 2 . 828 . 1 1 19 LEU CG C 1.878 0.179 1.888 . . . 1.0 . . . . . . . . . . . . A . 19 LEU CG . . . . . . . . . c30643_6pv2 1 . 2 . 829 . 1 1 19 LEU H H 2.871 3.748 0.230 . . . 1.0 . . . . . . . . . . . . A . 19 LEU H . . . . . . . . . c30643_6pv2 1 . 2 . 830 . 1 1 19 LEU HA H 1.372 1.513 -0.619 . . . 1.0 . . . . . . . . . . . . A . 19 LEU HA . . . . . . . . . c30643_6pv2 1 . 2 . 831 . 1 1 19 LEU HB2 H 3.347 1.156 0.681 . . . 1.0 . . . . . . . . . . . . A . 19 LEU HB2 . . . . . . . . . c30643_6pv2 1 . 2 . 832 . 1 1 19 LEU HB3 H 2.723 2.131 1.998 . . . 1.0 . . . . . . . . . . . . A . 19 LEU HB3 . . . . . . . . . c30643_6pv2 1 . 2 . 833 . 1 1 19 LEU HD11 H 1.165 -1.760 1.341 . . . 1.0 . . . . . . . . . . . . A . 19 LEU HD11 . . . . . . . . . c30643_6pv2 1 . 2 . 834 . 1 1 19 LEU HD12 H 2.503 -1.175 0.354 . . . 1.0 . . . . . . . . . . . . A . 19 LEU HD12 . . . . . . . . . c30643_6pv2 1 . 2 . 835 . 1 1 19 LEU HD13 H 0.883 -0.515 0.125 . . . 1.0 . . . . . . . . . . . . A . 19 LEU HD13 . . . . . . . . . c30643_6pv2 1 . 2 . 836 . 1 1 19 LEU HD21 H 2.322 -1.103 3.536 . . . 1.0 . . . . . . . . . . . . A . 19 LEU HD21 . . . . . . . . . c30643_6pv2 1 . 2 . 837 . 1 1 19 LEU HD22 H 3.124 0.467 3.600 . . . 1.0 . . . . . . . . . . . . A . 19 LEU HD22 . . . . . . . . . c30643_6pv2 1 . 2 . 838 . 1 1 19 LEU HD23 H 3.693 -0.773 2.482 . . . 1.0 . . . . . . . . . . . . A . 19 LEU HD23 . . . . . . . . . c30643_6pv2 1 . 2 . 839 . 1 1 19 LEU HG H 0.944 0.437 2.368 . . . 1.0 . . . . . . . . . . . . A . 19 LEU HG . . . . . . . . . c30643_6pv2 1 . 2 . 840 . 1 1 19 LEU N N 2.038 3.411 -0.175 . . . 1.0 . . . . . . . . . . . . A . 19 LEU N . . . . . . . . . c30643_6pv2 1 . 2 . 841 . 1 1 19 LEU O O -0.802 1.568 0.637 . . . 1.0 . . . . . . . . . . . . A . 19 LEU O . . . . . . . . . c30643_6pv2 1 . 2 . 842 . 1 1 20 GLN C C -2.321 3.921 1.553 . . . 1.0 . . . . . . . . . . . . A . 20 GLN C . . . . . . . . . c30643_6pv2 1 . 2 . 843 . 1 1 20 GLN CA C -1.210 3.529 2.527 . . . 1.0 . . . . . . . . . . . . A . 20 GLN CA . . . . . . . . . c30643_6pv2 1 . 2 . 844 . 1 1 20 GLN CB C -1.004 4.618 3.585 . . . 1.0 . . . . . . . . . . . . A . 20 GLN CB . . . . . . . . . c30643_6pv2 1 . 2 . 845 . 1 1 20 GLN CD C -2.522 3.656 5.382 . . . 1.0 . . . . . . . . . . . . A . 20 GLN CD . . . . . . . . . c30643_6pv2 1 . 2 . 846 . 1 1 20 GLN CG C -2.209 4.843 4.484 . . . 1.0 . . . . . . . . . . . . A . 20 GLN CG . . . . . . . . . c30643_6pv2 1 . 2 . 847 . 1 1 20 GLN H H 0.816 3.854 1.996 . . . 1.0 . . . . . . . . . . . . A . 20 GLN H . . . . . . . . . c30643_6pv2 1 . 2 . 848 . 1 1 20 GLN HA H -1.490 2.611 3.020 . . . 1.0 . . . . . . . . . . . . A . 20 GLN HA . . . . . . . . . c30643_6pv2 1 . 2 . 849 . 1 1 20 GLN HB2 H -0.167 4.338 4.207 . . . 1.0 . . . . . . . . . . . . A . 20 GLN HB2 . . . . . . . . . c30643_6pv2 1 . 2 . 850 . 1 1 20 GLN HB3 H -0.773 5.548 3.087 . . . 1.0 . . . . . . . . . . . . A . 20 GLN HB3 . . . . . . . . . c30643_6pv2 1 . 2 . 851 . 1 1 20 GLN HE21 H -3.337 4.868 6.725 . . . 1.0 . . . . . . . . . . . . A . 20 GLN HE21 . . . . . . . . . c30643_6pv2 1 . 2 . 852 . 1 1 20 GLN HE22 H -3.342 3.187 7.129 . . . 1.0 . . . . . . . . . . . . A . 20 GLN HE22 . . . . . . . . . c30643_6pv2 1 . 2 . 853 . 1 1 20 GLN HG2 H -2.015 5.701 5.108 . . . 1.0 . . . . . . . . . . . . A . 20 GLN HG2 . . . . . . . . . c30643_6pv2 1 . 2 . 854 . 1 1 20 GLN HG3 H -3.067 5.041 3.862 . . . 1.0 . . . . . . . . . . . . A . 20 GLN HG3 . . . . . . . . . c30643_6pv2 1 . 2 . 855 . 1 1 20 GLN N N 0.034 3.285 1.811 . . . 1.0 . . . . . . . . . . . . A . 20 GLN N . . . . . . . . . c30643_6pv2 1 . 2 . 856 . 1 1 20 GLN NE2 N -3.127 3.931 6.526 . . . 1.0 . . . . . . . . . . . . A . 20 GLN NE2 . . . . . . . . . c30643_6pv2 1 . 2 . 857 . 1 1 20 GLN O O -3.465 3.465 1.673 . . . 1.0 . . . . . . . . . . . . A . 20 GLN O . . . . . . . . . c30643_6pv2 1 . 2 . 858 . 1 1 20 GLN OE1 O -2.237 2.504 5.052 . . . 1.0 . . . . . . . . . . . . A . 20 GLN OE1 . . . . . . . . . c30643_6pv2 1 . 2 . 859 . 1 1 21 ARG C C -3.333 3.919 -1.260 . . . 1.0 . . . . . . . . . . . . A . 21 ARG C . . . . . . . . . c30643_6pv2 1 . 2 . 860 . 1 1 21 ARG CA C -2.915 5.141 -0.462 . . . 1.0 . . . . . . . . . . . . A . 21 ARG CA . . . . . . . . . c30643_6pv2 1 . 2 . 861 . 1 1 21 ARG CB C -2.287 6.170 -1.394 . . . 1.0 . . . . . . . . . . . . A . 21 ARG CB . . . . . . . . . c30643_6pv2 1 . 2 . 862 . 1 1 21 ARG CD C -2.557 7.716 -3.342 . . . 1.0 . . . . . . . . . . . . A . 21 ARG CD . . . . . . . . . c30643_6pv2 1 . 2 . 863 . 1 1 21 ARG CG C -3.270 6.804 -2.361 . . . 1.0 . . . . . . . . . . . . A . 21 ARG CG . . . . . . . . . c30643_6pv2 1 . 2 . 864 . 1 1 21 ARG CZ C -1.092 9.691 -3.226 . . . 1.0 . . . . . . . . . . . . A . 21 ARG CZ . . . . . . . . . c30643_6pv2 1 . 2 . 865 . 1 1 21 ARG H H -1.055 5.109 0.557 . . . 1.0 . . . . . . . . . . . . A . 21 ARG H . . . . . . . . . c30643_6pv2 1 . 2 . 866 . 1 1 21 ARG HA H -3.785 5.571 0.011 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HA . . . . . . . . . c30643_6pv2 1 . 2 . 867 . 1 1 21 ARG HB2 H -1.846 6.954 -0.799 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HB2 . . . . . . . . . c30643_6pv2 1 . 2 . 868 . 1 1 21 ARG HB3 H -1.511 5.689 -1.968 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HB3 . . . . . . . . . c30643_6pv2 1 . 2 . 869 . 1 1 21 ARG HD2 H -2.006 7.110 -4.045 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HD2 . . . . . . . . . c30643_6pv2 1 . 2 . 870 . 1 1 21 ARG HD3 H -3.291 8.304 -3.870 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HD3 . . . . . . . . . c30643_6pv2 1 . 2 . 871 . 1 1 21 ARG HE H -1.380 8.394 -1.737 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HE . . . . . . . . . c30643_6pv2 1 . 2 . 872 . 1 1 21 ARG HG2 H -3.777 6.023 -2.909 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HG2 . . . . . . . . . c30643_6pv2 1 . 2 . 873 . 1 1 21 ARG HG3 H -3.991 7.382 -1.801 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HG3 . . . . . . . . . c30643_6pv2 1 . 2 . 874 . 1 1 21 ARG HH11 H -2.105 9.502 -4.971 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HH11 . . . . . . . . . c30643_6pv2 1 . 2 . 875 . 1 1 21 ARG HH12 H -1.031 10.861 -4.881 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HH12 . . . . . . . . . c30643_6pv2 1 . 2 . 876 . 1 1 21 ARG HH21 H 0.038 10.152 -1.606 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HH21 . . . . . . . . . c30643_6pv2 1 . 2 . 877 . 1 1 21 ARG HH22 H 0.191 11.229 -2.965 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HH22 . . . . . . . . . c30643_6pv2 1 . 2 . 878 . 1 1 21 ARG N N -1.973 4.749 0.577 . . . 1.0 . . . . . . . . . . . . A . 21 ARG N . . . . . . . . . c30643_6pv2 1 . 2 . 879 . 1 1 21 ARG NE N -1.629 8.617 -2.663 . . . 1.0 . . . . . . . . . . . . A . 21 ARG NE . . . . . . . . . c30643_6pv2 1 . 2 . 880 . 1 1 21 ARG NH1 N -1.437 10.046 -4.456 . . . 1.0 . . . . . . . . . . . . A . 21 ARG NH1 . . . . . . . . . c30643_6pv2 1 . 2 . 881 . 1 1 21 ARG NH2 N -0.220 10.417 -2.548 . . . 1.0 . . . . . . . . . . . . A . 21 ARG NH2 . . . . . . . . . c30643_6pv2 1 . 2 . 882 . 1 1 21 ARG O O -4.515 3.718 -1.539 . . . 1.0 . . . . . . . . . . . . A . 21 ARG O . . . . . . . . . c30643_6pv2 1 . 2 . 883 . 1 1 22 HIS C C -3.603 0.994 -1.515 . . . 1.0 . . . . . . . . . . . . A . 22 HIS C . . . . . . . . . c30643_6pv2 1 . 2 . 884 . 1 1 22 HIS CA C -2.608 1.849 -2.302 . . . 1.0 . . . . . . . . . . . . A . 22 HIS CA . . . . . . . . . c30643_6pv2 1 . 2 . 885 . 1 1 22 HIS CB C -1.290 1.092 -2.533 . . . 1.0 . . . . . . . . . . . . A . 22 HIS CB . . . . . . . . . c30643_6pv2 1 . 2 . 886 . 1 1 22 HIS CD2 C -1.807 -1.413 -2.297 . . . 1.0 . . . . . . . . . . . . A . 22 HIS CD2 . . . . . . . . . c30643_6pv2 1 . 2 . 887 . 1 1 22 HIS CE1 C -1.793 -2.001 -4.389 . . . 1.0 . . . . . . . . . . . . A . 22 HIS CE1 . . . . . . . . . c30643_6pv2 1 . 2 . 888 . 1 1 22 HIS CG C -1.491 -0.308 -3.009 . . . 1.0 . . . . . . . . . . . . A . 22 HIS CG . . . . . . . . . c30643_6pv2 1 . 2 . 889 . 1 1 22 HIS H H -1.424 3.332 -1.380 . . . 1.0 . . . . . . . . . . . . A . 22 HIS H . . . . . . . . . c30643_6pv2 1 . 2 . 890 . 1 1 22 HIS HA H -3.043 2.095 -3.258 . . . 1.0 . . . . . . . . . . . . A . 22 HIS HA . . . . . . . . . c30643_6pv2 1 . 2 . 891 . 1 1 22 HIS HB2 H -0.704 1.616 -3.274 . . . 1.0 . . . . . . . . . . . . A . 22 HIS HB2 . . . . . . . . . c30643_6pv2 1 . 2 . 892 . 1 1 22 HIS HB3 H -0.737 1.054 -1.606 . . . 1.0 . . . . . . . . . . . . A . 22 HIS HB3 . . . . . . . . . c30643_6pv2 1 . 2 . 893 . 1 1 22 HIS HD1 H -1.258 -0.123 -5.113 . . . 1.0 . . . . . . . . . . . . A . 22 HIS HD1 . . . . . . . . . c30643_6pv2 1 . 2 . 894 . 1 1 22 HIS HD2 H -1.875 -1.486 -1.220 . . . 1.0 . . . . . . . . . . . . A . 22 HIS HD2 . . . . . . . . . c30643_6pv2 1 . 2 . 895 . 1 1 22 HIS HE1 H -1.877 -2.591 -5.287 . . . 1.0 . . . . . . . . . . . . A . 22 HIS HE1 . . . . . . . . . c30643_6pv2 1 . 2 . 896 . 1 1 22 HIS N N -2.352 3.093 -1.603 . . . 1.0 . . . . . . . . . . . . A . 22 HIS N . . . . . . . . . c30643_6pv2 1 . 2 . 897 . 1 1 22 HIS ND1 N -1.470 -0.698 -4.343 . . . 1.0 . . . . . . . . . . . . A . 22 HIS ND1 . . . . . . . . . c30643_6pv2 1 . 2 . 898 . 1 1 22 HIS NE2 N -1.998 -2.442 -3.178 . . . 1.0 . . . . . . . . . . . . A . 22 HIS NE2 . . . . . . . . . c30643_6pv2 1 . 2 . 899 . 1 1 22 HIS O O -4.540 0.431 -2.084 . . . 1.0 . . . . . . . . . . . . A . 22 HIS O . . . . . . . . . c30643_6pv2 1 . 2 . 900 . 1 1 23 LYS C C -5.707 0.768 0.625 . . . 1.0 . . . . . . . . . . . . A . 23 LYS C . . . . . . . . . c30643_6pv2 1 . 2 . 901 . 1 1 23 LYS CA C -4.306 0.168 0.663 . . . 1.0 . . . . . . . . . . . . A . 23 LYS CA . . . . . . . . . c30643_6pv2 1 . 2 . 902 . 1 1 23 LYS CB C -3.785 0.147 2.100 . . . 1.0 . . . . . . . . . . . . A . 23 LYS CB . . . . . . . . . c30643_6pv2 1 . 2 . 903 . 1 1 23 LYS CD C -2.070 -0.684 3.731 . . . 1.0 . . . . . . . . . . . . A . 23 LYS CD . . . . . . . . . c30643_6pv2 1 . 2 . 904 . 1 1 23 LYS CE C -0.827 -1.537 3.924 . . . 1.0 . . . . . . . . . . . . A . 23 LYS CE . . . . . . . . . c30643_6pv2 1 . 2 . 905 . 1 1 23 LYS CG C -2.507 -0.657 2.278 . . . 1.0 . . . . . . . . . . . . A . 23 LYS CG . . . . . . . . . c30643_6pv2 1 . 2 . 906 . 1 1 23 LYS H H -2.617 1.358 0.187 . . . 1.0 . . . . . . . . . . . . A . 23 LYS H . . . . . . . . . c30643_6pv2 1 . 2 . 907 . 1 1 23 LYS HA H -4.355 -0.843 0.296 . . . 1.0 . . . . . . . . . . . . A . 23 LYS HA . . . . . . . . . c30643_6pv2 1 . 2 . 908 . 1 1 23 LYS HB2 H -3.593 1.163 2.413 . . . 1.0 . . . . . . . . . . . . A . 23 LYS HB2 . . . . . . . . . c30643_6pv2 1 . 2 . 909 . 1 1 23 LYS HB3 H -4.543 -0.280 2.738 . . . 1.0 . . . . . . . . . . . . A . 23 LYS HB3 . . . . . . . . . c30643_6pv2 1 . 2 . 910 . 1 1 23 LYS HD2 H -1.857 0.325 4.050 . . . 1.0 . . . . . . . . . . . . A . 23 LYS HD2 . . . . . . . . . c30643_6pv2 1 . 2 . 911 . 1 1 23 LYS HD3 H -2.873 -1.091 4.327 . . . 1.0 . . . . . . . . . . . . A . 23 LYS HD3 . . . . . . . . . c30643_6pv2 1 . 2 . 912 . 1 1 23 LYS HE2 H -1.027 -2.530 3.551 . . . 1.0 . . . . . . . . . . . . A . 23 LYS HE2 . . . . . . . . . c30643_6pv2 1 . 2 . 913 . 1 1 23 LYS HE3 H -0.015 -1.099 3.363 . . . 1.0 . . . . . . . . . . . . A . 23 LYS HE3 . . . . . . . . . c30643_6pv2 1 . 2 . 914 . 1 1 23 LYS HG2 H -2.680 -1.670 1.947 . . . 1.0 . . . . . . . . . . . . A . 23 LYS HG2 . . . . . . . . . c30643_6pv2 1 . 2 . 915 . 1 1 23 LYS HG3 H -1.723 -0.210 1.684 . . . 1.0 . . . . . . . . . . . . A . 23 LYS HG3 . . . . . . . . . c30643_6pv2 1 . 2 . 916 . 1 1 23 LYS HZ1 H 0.391 -2.257 5.459 . . . 1.0 . . . . . . . . . . . . A . 23 LYS HZ1 . . . . . . . . . c30643_6pv2 1 . 2 . 917 . 1 1 23 LYS HZ2 H -1.216 -2.011 5.918 . . . 1.0 . . . . . . . . . . . . A . 23 LYS HZ2 . . . . . . . . . c30643_6pv2 1 . 2 . 918 . 1 1 23 LYS HZ3 H -0.185 -0.688 5.721 . . . 1.0 . . . . . . . . . . . . A . 23 LYS HZ3 . . . . . . . . . c30643_6pv2 1 . 2 . 919 . 1 1 23 LYS N N -3.402 0.912 -0.205 . . . 1.0 . . . . . . . . . . . . A . 23 LYS N . . . . . . . . . c30643_6pv2 1 . 2 . 920 . 1 1 23 LYS NZ N -0.433 -1.630 5.354 . . . 1.0 . . . . . . . . . . . . A . 23 LYS NZ . . . . . . . . . c30643_6pv2 1 . 2 . 921 . 1 1 23 LYS O O -6.706 0.049 0.730 . . . 1.0 . . . . . . . . . . . . A . 23 LYS O . . . . . . . . . c30643_6pv2 1 . 2 . 922 . 1 1 24 ARG C C -7.797 2.330 -0.938 . . . 1.0 . . . . . . . . . . . . A . 24 ARG C . . . . . . . . . c30643_6pv2 1 . 2 . 923 . 1 1 24 ARG CA C -7.064 2.768 0.329 . . . 1.0 . . . . . . . . . . . . A . 24 ARG CA . . . . . . . . . c30643_6pv2 1 . 2 . 924 . 1 1 24 ARG CB C -6.869 4.287 0.326 . . . 1.0 . . . . . . . . . . . . A . 24 ARG CB . . . . . . . . . c30643_6pv2 1 . 2 . 925 . 1 1 24 ARG CD C -7.934 6.562 0.282 . . . 1.0 . . . . . . . . . . . . A . 24 ARG CD . . . . . . . . . c30643_6pv2 1 . 2 . 926 . 1 1 24 ARG CG C -8.174 5.066 0.352 . . . 1.0 . . . . . . . . . . . . A . 24 ARG CG . . . . . . . . . c30643_6pv2 1 . 2 . 927 . 1 1 24 ARG CZ C -9.266 8.630 0.102 . . . 1.0 . . . . . . . . . . . . A . 24 ARG CZ . . . . . . . . . c30643_6pv2 1 . 2 . 928 . 1 1 24 ARG H H -4.946 2.609 0.354 . . . 1.0 . . . . . . . . . . . . A . 24 ARG H . . . . . . . . . c30643_6pv2 1 . 2 . 929 . 1 1 24 ARG HA H -7.656 2.491 1.188 . . . 1.0 . . . . . . . . . . . . A . 24 ARG HA . . . . . . . . . c30643_6pv2 1 . 2 . 930 . 1 1 24 ARG HB2 H -6.290 4.566 1.191 . . . 1.0 . . . . . . . . . . . . A . 24 ARG HB2 . . . . . . . . . c30643_6pv2 1 . 2 . 931 . 1 1 24 ARG HB3 H -6.326 4.567 -0.565 . . . 1.0 . . . . . . . . . . . . A . 24 ARG HB3 . . . . . . . . . c30643_6pv2 1 . 2 . 932 . 1 1 24 ARG HD2 H -7.339 6.860 1.133 . . . 1.0 . . . . . . . . . . . . A . 24 ARG HD2 . . . . . . . . . c30643_6pv2 1 . 2 . 933 . 1 1 24 ARG HD3 H -7.395 6.786 -0.628 . . . 1.0 . . . . . . . . . . . . A . 24 ARG HD3 . . . . . . . . . c30643_6pv2 1 . 2 . 934 . 1 1 24 ARG HE H -10.015 6.809 0.455 . . . 1.0 . . . . . . . . . . . . A . 24 ARG HE . . . . . . . . . c30643_6pv2 1 . 2 . 935 . 1 1 24 ARG HG2 H -8.775 4.768 -0.493 . . . 1.0 . . . . . . . . . . . . A . 24 ARG HG2 . . . . . . . . . c30643_6pv2 1 . 2 . 936 . 1 1 24 ARG HG3 H -8.700 4.837 1.268 . . . 1.0 . . . . . . . . . . . . A . 24 ARG HG3 . . . . . . . . . c30643_6pv2 1 . 2 . 937 . 1 1 24 ARG HH11 H -8.229 10.331 -0.275 . . . 1.0 . . . . . . . . . . . . A . 24 ARG HH11 . . . . . . . . . c30643_6pv2 1 . 2 . 938 . 1 1 24 ARG HH12 H -7.272 8.889 -0.166 . . . 1.0 . . . . . . . . . . . . A . 24 ARG HH12 . . . . . . . . . c30643_6pv2 1 . 2 . 939 . 1 1 24 ARG HH21 H -10.515 10.222 0.000 . . . 1.0 . . . . . . . . . . . . A . 24 ARG HH21 . . . . . . . . . c30643_6pv2 1 . 2 . 940 . 1 1 24 ARG HH22 H -11.278 8.696 0.310 . . . 1.0 . . . . . . . . . . . . A . 24 ARG HH22 . . . . . . . . . c30643_6pv2 1 . 2 . 941 . 1 1 24 ARG N N -5.780 2.083 0.433 . . . 1.0 . . . . . . . . . . . . A . 24 ARG N . . . . . . . . . c30643_6pv2 1 . 2 . 942 . 1 1 24 ARG NE N -9.185 7.316 0.292 . . . 1.0 . . . . . . . . . . . . A . 24 ARG NE . . . . . . . . . c30643_6pv2 1 . 2 . 943 . 1 1 24 ARG NH1 N -8.168 9.341 -0.133 . . . 1.0 . . . . . . . . . . . . A . 24 ARG NH1 . . . . . . . . . c30643_6pv2 1 . 2 . 944 . 1 1 24 ARG NH2 N -10.446 9.231 0.142 . . . 1.0 . . . . . . . . . . . . A . 24 ARG NH2 . . . . . . . . . c30643_6pv2 1 . 2 . 945 . 1 1 24 ARG O O -8.988 2.583 -1.101 . . . 1.0 . . . . . . . . . . . . A . 24 ARG O . . . . . . . . . c30643_6pv2 1 . 2 . 946 . 1 1 25 THR C C -8.316 -0.216 -2.777 . . . 1.0 . . . . . . . . . . . . A . 25 THR C . . . . . . . . . c30643_6pv2 1 . 2 . 947 . 1 1 25 THR CA C -7.681 1.150 -3.047 . . . 1.0 . . . . . . . . . . . . A . 25 THR CA . . . . . . . . . c30643_6pv2 1 . 2 . 948 . 1 1 25 THR CB C -6.641 1.057 -4.180 . . . 1.0 . . . . . . . . . . . . A . 25 THR CB . . . . . . . . . c30643_6pv2 1 . 2 . 949 . 1 1 25 THR CG2 C -7.306 0.730 -5.509 . . . 1.0 . . . . . . . . . . . . A . 25 THR CG2 . . . . . . . . . c30643_6pv2 1 . 2 . 950 . 1 1 25 THR H H -6.121 1.522 -1.670 . . . 1.0 . . . . . . . . . . . . A . 25 THR H . . . . . . . . . c30643_6pv2 1 . 2 . 951 . 1 1 25 THR HA H -8.457 1.838 -3.352 . . . 1.0 . . . . . . . . . . . . A . 25 THR HA . . . . . . . . . c30643_6pv2 1 . 2 . 952 . 1 1 25 THR HB H -5.935 0.275 -3.940 . . . 1.0 . . . . . . . . . . . . A . 25 THR HB . . . . . . . . . c30643_6pv2 1 . 2 . 953 . 1 1 25 THR HG1 H -5.799 2.670 -3.406 . . . 1.0 . . . . . . . . . . . . A . 25 THR HG1 . . . . . . . . . c30643_6pv2 1 . 2 . 954 . 1 1 25 THR HG21 H -8.014 1.505 -5.758 . . . 1.0 . . . . . . . . . . . . A . 25 THR HG21 . . . . . . . . . c30643_6pv2 1 . 2 . 955 . 1 1 25 THR HG22 H -7.820 -0.216 -5.432 . . . 1.0 . . . . . . . . . . . . A . 25 THR HG22 . . . . . . . . . c30643_6pv2 1 . 2 . 956 . 1 1 25 THR HG23 H -6.553 0.669 -6.281 . . . 1.0 . . . . . . . . . . . . A . 25 THR HG23 . . . . . . . . . c30643_6pv2 1 . 2 . 957 . 1 1 25 THR N N -7.080 1.671 -1.834 . . . 1.0 . . . . . . . . . . . . A . 25 THR N . . . . . . . . . c30643_6pv2 1 . 2 . 958 . 1 1 25 THR O O -9.197 -0.659 -3.510 . . . 1.0 . . . . . . . . . . . . A . 25 THR O . . . . . . . . . c30643_6pv2 1 . 2 . 959 . 1 1 25 THR OG1 O -5.943 2.308 -4.289 . . . 1.0 . . . . . . . . . . . . A . 25 THR OG1 . . . . . . . . . c30643_6pv2 1 . 2 . 960 . 1 1 26 HIS C C -9.696 -1.824 -0.388 . . . 1.0 . . . . . . . . . . . . A . 26 HIS C . . . . . . . . . c30643_6pv2 1 . 2 . 961 . 1 1 26 HIS CA C -8.497 -2.120 -1.276 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CA . . . . . . . . . c30643_6pv2 1 . 2 . 962 . 1 1 26 HIS CB C -7.511 -3.010 -0.512 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CB . . . . . . . . . c30643_6pv2 1 . 2 . 963 . 1 1 26 HIS CD2 C -5.094 -3.375 -1.344 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CD2 . . . . . . . . . c30643_6pv2 1 . 2 . 964 . 1 1 26 HIS CE1 C -5.442 -4.940 -2.823 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CE1 . . . . . . . . . c30643_6pv2 1 . 2 . 965 . 1 1 26 HIS CG C -6.428 -3.614 -1.350 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CG . . . . . . . . . c30643_6pv2 1 . 2 . 966 . 1 1 26 HIS H H -7.141 -0.498 -1.175 . . . 1.0 . . . . . . . . . . . . A . 26 HIS H . . . . . . . . . c30643_6pv2 1 . 2 . 967 . 1 1 26 HIS HA H -8.834 -2.642 -2.158 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HA . . . . . . . . . c30643_6pv2 1 . 2 . 968 . 1 1 26 HIS HB2 H -7.033 -2.422 0.257 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HB2 . . . . . . . . . c30643_6pv2 1 . 2 . 969 . 1 1 26 HIS HB3 H -8.058 -3.817 -0.046 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HB3 . . . . . . . . . c30643_6pv2 1 . 2 . 970 . 1 1 26 HIS HD1 H -7.507 -5.007 -2.541 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HD1 . . . . . . . . . c30643_6pv2 1 . 2 . 971 . 1 1 26 HIS HD2 H -4.571 -2.669 -0.718 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HD2 . . . . . . . . . c30643_6pv2 1 . 2 . 972 . 1 1 26 HIS HE1 H -5.280 -5.692 -3.579 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HE1 . . . . . . . . . c30643_6pv2 1 . 2 . 973 . 1 1 26 HIS N N -7.881 -0.870 -1.702 . . . 1.0 . . . . . . . . . . . . A . 26 HIS N . . . . . . . . . c30643_6pv2 1 . 2 . 974 . 1 1 26 HIS ND1 N -6.638 -4.611 -2.300 . . . 1.0 . . . . . . . . . . . . A . 26 HIS ND1 . . . . . . . . . c30643_6pv2 1 . 2 . 975 . 1 1 26 HIS NE2 N -4.505 -4.213 -2.268 . . . 1.0 . . . . . . . . . . . . A . 26 HIS NE2 . . . . . . . . . c30643_6pv2 1 . 2 . 976 . 1 1 26 HIS O O -10.729 -2.484 -0.480 . . . 1.0 . . . . . . . . . . . . A . 26 HIS O . . . . . . . . . c30643_6pv2 1 . 2 . 977 . 1 1 27 THR C C -11.557 0.595 0.631 . . . 1.0 . . . . . . . . . . . . A . 27 THR C . . . . . . . . . c30643_6pv2 1 . 2 . 978 . 1 1 27 THR CA C -10.632 -0.387 1.341 . . . 1.0 . . . . . . . . . . . . A . 27 THR CA . . . . . . . . . c30643_6pv2 1 . 2 . 979 . 1 1 27 THR CB C -10.079 0.266 2.620 . . . 1.0 . . . . . . . . . . . . A . 27 THR CB . . . . . . . . . c30643_6pv2 1 . 2 . 980 . 1 1 27 THR CG2 C -9.505 -0.784 3.556 . . . 1.0 . . . . . . . . . . . . A . 27 THR CG2 . . . . . . . . . c30643_6pv2 1 . 2 . 981 . 1 1 27 THR H H -8.679 -0.356 0.525 . . . 1.0 . . . . . . . . . . . . A . 27 THR H . . . . . . . . . c30643_6pv2 1 . 2 . 982 . 1 1 27 THR HA H -11.200 -1.261 1.624 . . . 1.0 . . . . . . . . . . . . A . 27 THR HA . . . . . . . . . c30643_6pv2 1 . 2 . 983 . 1 1 27 THR HB H -10.886 0.777 3.123 . . . 1.0 . . . . . . . . . . . . A . 27 THR HB . . . . . . . . . c30643_6pv2 1 . 2 . 984 . 1 1 27 THR HG1 H -9.265 2.066 2.699 . . . 1.0 . . . . . . . . . . . . A . 27 THR HG1 . . . . . . . . . c30643_6pv2 1 . 2 . 985 . 1 1 27 THR HG21 H -8.717 -1.323 3.052 . . . 1.0 . . . . . . . . . . . . A . 27 THR HG21 . . . . . . . . . c30643_6pv2 1 . 2 . 986 . 1 1 27 THR HG22 H -10.284 -1.473 3.847 . . . 1.0 . . . . . . . . . . . . A . 27 THR HG22 . . . . . . . . . c30643_6pv2 1 . 2 . 987 . 1 1 27 THR HG23 H -9.104 -0.301 4.434 . . . 1.0 . . . . . . . . . . . . A . 27 THR HG23 . . . . . . . . . c30643_6pv2 1 . 2 . 988 . 1 1 27 THR N N -9.548 -0.816 0.467 . . . 1.0 . . . . . . . . . . . . A . 27 THR N . . . . . . . . . c30643_6pv2 1 . 2 . 989 . 1 1 27 THR O O -12.518 1.106 1.214 . . . 1.0 . . . . . . . . . . . . A . 27 THR O . . . . . . . . . c30643_6pv2 1 . 2 . 990 . 1 1 27 THR OG1 O -9.061 1.221 2.283 . . . 1.0 . . . . . . . . . . . . A . 27 THR OG1 . . . . . . . . . c30643_6pv2 1 . 2 . 991 . 1 1 28 GLY C C -13.190 1.019 -2.109 . . . 1.0 . . . . . . . . . . . . A . 28 GLY C . . . . . . . . . c30643_6pv2 1 . 2 . 992 . 1 1 28 GLY CA C -12.068 1.755 -1.416 . . . 1.0 . . . . . . . . . . . . A . 28 GLY CA . . . . . . . . . c30643_6pv2 1 . 2 . 993 . 1 1 28 GLY H H -10.475 0.432 -1.029 . . . 1.0 . . . . . . . . . . . . A . 28 GLY H . . . . . . . . . c30643_6pv2 1 . 2 . 994 . 1 1 28 GLY HA2 H -12.484 2.511 -0.768 . . . 1.0 . . . . . . . . . . . . A . 28 GLY HA2 . . . . . . . . . c30643_6pv2 1 . 2 . 995 . 1 1 28 GLY HA3 H -11.448 2.230 -2.161 . . . 1.0 . . . . . . . . . . . . A . 28 GLY HA3 . . . . . . . . . c30643_6pv2 1 . 2 . 996 . 1 1 28 GLY N N -11.257 0.858 -0.628 . . . 1.0 . . . . . . . . . . . . A . 28 GLY N . . . . . . . . . c30643_6pv2 1 . 2 . 997 . 1 1 28 GLY O O -12.977 -0.067 -2.652 . . . 1.0 . . . . . . . . . . . . A . 28 GLY O . . . . . . . . . c30643_6pv2 1 . 2 . 998 . 1 1 29 GLU C C -15.522 1.129 -4.205 . . . 1.0 . . . . . . . . . . . . A . 29 GLU C . . . . . . . . . c30643_6pv2 1 . 2 . 999 . 1 1 29 GLU CA C -15.534 0.945 -2.692 . . . 1.0 . . . . . . . . . . . . A . 29 GLU CA . . . . . . . . . c30643_6pv2 1 . 2 . 1000 . 1 1 29 GLU CB C -16.835 1.495 -2.101 . . . 1.0 . . . . . . . . . . . . A . 29 GLU CB . . . . . . . . . c30643_6pv2 1 . 2 . 1001 . 1 1 29 GLU CD C -18.331 3.490 -1.742 . . . 1.0 . . . . . . . . . . . . A . 29 GLU CD . . . . . . . . . c30643_6pv2 1 . 2 . 1002 . 1 1 29 GLU CG C -17.004 2.998 -2.269 . . . 1.0 . . . . . . . . . . . . A . 29 GLU CG . . . . . . . . . c30643_6pv2 1 . 2 . 1003 . 1 1 29 GLU H H -14.489 2.465 -1.664 . . . 1.0 . . . . . . . . . . . . A . 29 GLU H . . . . . . . . . c30643_6pv2 1 . 2 . 1004 . 1 1 29 GLU HA H -15.467 -0.111 -2.473 . . . 1.0 . . . . . . . . . . . . A . 29 GLU HA . . . . . . . . . c30643_6pv2 1 . 2 . 1005 . 1 1 29 GLU HB2 H -17.669 1.010 -2.583 . . . 1.0 . . . . . . . . . . . . A . 29 GLU HB2 . . . . . . . . . c30643_6pv2 1 . 2 . 1006 . 1 1 29 GLU HB3 H -16.861 1.269 -1.045 . . . 1.0 . . . . . . . . . . . . A . 29 GLU HB3 . . . . . . . . . c30643_6pv2 1 . 2 . 1007 . 1 1 29 GLU HG2 H -16.213 3.501 -1.734 . . . 1.0 . . . . . . . . . . . . A . 29 GLU HG2 . . . . . . . . . c30643_6pv2 1 . 2 . 1008 . 1 1 29 GLU HG3 H -16.936 3.240 -3.318 . . . 1.0 . . . . . . . . . . . . A . 29 GLU HG3 . . . . . . . . . c30643_6pv2 1 . 2 . 1009 . 1 1 29 GLU N N -14.382 1.589 -2.088 . . . 1.0 . . . . . . . . . . . . A . 29 GLU N . . . . . . . . . c30643_6pv2 1 . 2 . 1010 . 1 1 29 GLU O O -15.137 2.184 -4.711 . . . 1.0 . . . . . . . . . . . . A . 29 GLU O . . . . . . . . . c30643_6pv2 1 . 2 . 1011 . 1 1 29 GLU OE1 O -18.430 3.754 -0.526 . . . 1.0 . . . . . . . . . . . . A . 29 GLU OE1 . . . . . . . . . c30643_6pv2 1 . 2 . 1012 . 1 1 29 GLU OE2 O -19.284 3.605 -2.537 . . . 1.0 . . . . . . . . . . . . A . 29 GLU OE2 . . . . . . . . . c30643_6pv2 1 . 2 . 1013 . 1 1 30 LYS C C -17.400 -0.104 -6.858 . . . 1.0 . . . . . . . . . . . . A . 30 LYS C . . . . . . . . . c30643_6pv2 1 . 2 . 1014 . 1 1 30 LYS CA C -15.983 0.154 -6.372 . . . 1.0 . . . . . . . . . . . . A . 30 LYS CA . . . . . . . . . c30643_6pv2 1 . 2 . 1015 . 1 1 30 LYS CB C -15.015 -0.860 -6.994 . . . 1.0 . . . . . . . . . . . . A . 30 LYS CB . . . . . . . . . c30643_6pv2 1 . 2 . 1016 . 1 1 30 LYS CD C -12.618 -1.567 -7.340 . . . 1.0 . . . . . . . . . . . . A . 30 LYS CD . . . . . . . . . c30643_6pv2 1 . 2 . 1017 . 1 1 30 LYS CE C -12.934 -3.045 -7.168 . . . 1.0 . . . . . . . . . . . . A . 30 LYS CE . . . . . . . . . c30643_6pv2 1 . 2 . 1018 . 1 1 30 LYS CG C -13.571 -0.680 -6.548 . . . 1.0 . . . . . . . . . . . . A . 30 LYS CG . . . . . . . . . c30643_6pv2 1 . 2 . 1019 . 1 1 30 LYS H H -16.225 -0.722 -4.464 . . . 1.0 . . . . . . . . . . . . A . 30 LYS H . . . . . . . . . c30643_6pv2 1 . 2 . 1020 . 1 1 30 LYS HA H -15.690 1.150 -6.671 . . . 1.0 . . . . . . . . . . . . A . 30 LYS HA . . . . . . . . . c30643_6pv2 1 . 2 . 1021 . 1 1 30 LYS HB2 H -15.332 -1.856 -6.721 . . . 1.0 . . . . . . . . . . . . A . 30 LYS HB2 . . . . . . . . . c30643_6pv2 1 . 2 . 1022 . 1 1 30 LYS HB3 H -15.052 -0.762 -8.069 . . . 1.0 . . . . . . . . . . . . A . 30 LYS HB3 . . . . . . . . . c30643_6pv2 1 . 2 . 1023 . 1 1 30 LYS HD2 H -12.696 -1.315 -8.386 . . . 1.0 . . . . . . . . . . . . A . 30 LYS HD2 . . . . . . . . . c30643_6pv2 1 . 2 . 1024 . 1 1 30 LYS HD3 H -11.608 -1.382 -7.001 . . . 1.0 . . . . . . . . . . . . A . 30 LYS HD3 . . . . . . . . . c30643_6pv2 1 . 2 . 1025 . 1 1 30 LYS HE2 H -13.951 -3.222 -7.485 . . . 1.0 . . . . . . . . . . . . A . 30 LYS HE2 . . . . . . . . . c30643_6pv2 1 . 2 . 1026 . 1 1 30 LYS HE3 H -12.261 -3.619 -7.788 . . . 1.0 . . . . . . . . . . . . A . 30 LYS HE3 . . . . . . . . . c30643_6pv2 1 . 2 . 1027 . 1 1 30 LYS HG2 H -13.286 0.351 -6.689 . . . 1.0 . . . . . . . . . . . . A . 30 LYS HG2 . . . . . . . . . c30643_6pv2 1 . 2 . 1028 . 1 1 30 LYS HG3 H -13.495 -0.935 -5.500 . . . 1.0 . . . . . . . . . . . . A . 30 LYS HG3 . . . . . . . . . c30643_6pv2 1 . 2 . 1029 . 1 1 30 LYS HZ1 H -11.817 -3.316 -5.425 . . . 1.0 . . . . . . . . . . . . A . 30 LYS HZ1 . . . . . . . . . c30643_6pv2 1 . 2 . 1030 . 1 1 30 LYS HZ2 H -12.998 -4.502 -5.674 . . . 1.0 . . . . . . . . . . . . A . 30 LYS HZ2 . . . . . . . . . c30643_6pv2 1 . 2 . 1031 . 1 1 30 LYS HZ3 H -13.445 -2.963 -5.145 . . . 1.0 . . . . . . . . . . . . A . 30 LYS HZ3 . . . . . . . . . c30643_6pv2 1 . 2 . 1032 . 1 1 30 LYS N N -15.936 0.097 -4.922 . . . 1.0 . . . . . . . . . . . . A . 30 LYS N . . . . . . . . . c30643_6pv2 1 . 2 . 1033 . 1 1 30 LYS NZ N -12.788 -3.488 -5.756 . . . 1.0 . . . . . . . . . . . . A . 30 LYS NZ . . . . . . . . . c30643_6pv2 1 . 2 . 1034 . 1 1 30 LYS O O -17.788 -1.243 -7.107 . . . 1.0 . . . . . . . . . . . . A . 30 LYS O . . . . . . . . . c30643_6pv2 1 . 2 . 1035 . 1 1 31 NH2 HN1 H -17.797 1.836 -6.757 . . . 1.0 . . . . . . . . . . . . A . 31 NH2 HN1 . . . . . . . . . c30643_6pv2 1 . 2 . 1036 . 1 1 31 NH2 HN2 H -19.103 0.824 -7.273 . . . 1.0 . . . . . . . . . . . . A . 31 NH2 HN2 . . . . . . . . . c30643_6pv2 1 . 2 . 1037 . 1 1 31 NH2 N N -18.177 0.956 -6.976 . . . 1.0 . . . . . . . . . . . . A . 31 NH2 N . . . . . . . . . c30643_6pv2 1 . 2 . 1038 . 2 2 1 ZN ZN Zn -2.546 -4.277 -2.670 . . . 1.0 . . . . . . . . . . . . A . 101 ZN ZN . . . . . . . . . c30643_6pv2 1 . 3 . 1039 . 1 1 1 ARG C C 11.862 -1.195 2.903 . . . 1.0 . . . . . . . . . . . . A . 1 ARG C . . . . . . . . . c30643_6pv2 1 . 3 . 1040 . 1 1 1 ARG CA C 13.060 -1.748 3.668 . . . 1.0 . . . . . . . . . . . . A . 1 ARG CA . . . . . . . . . c30643_6pv2 1 . 3 . 1041 . 1 1 1 ARG CB C 13.001 -1.274 5.122 . . . 1.0 . . . . . . . . . . . . A . 1 ARG CB . . . . . . . . . c30643_6pv2 1 . 3 . 1042 . 1 1 1 ARG CD C 14.183 -1.000 7.325 . . . 1.0 . . . . . . . . . . . . A . 1 ARG CD . . . . . . . . . c30643_6pv2 1 . 3 . 1043 . 1 1 1 ARG CG C 14.244 -1.608 5.931 . . . 1.0 . . . . . . . . . . . . A . 1 ARG CG . . . . . . . . . c30643_6pv2 1 . 3 . 1044 . 1 1 1 ARG CZ C 12.408 -0.932 9.042 . . . 1.0 . . . . . . . . . . . . A . 1 ARG CZ . . . . . . . . . c30643_6pv2 1 . 3 . 1045 . 1 1 1 ARG H1 H 14.371 -0.248 3.060 . . . 1.0 . . . . . . . . . . . . A . 1 ARG H1 . . . . . . . . . c30643_6pv2 1 . 3 . 1046 . 1 1 1 ARG H2 H 14.338 -1.588 2.034 . . . 1.0 . . . . . . . . . . . . A . 1 ARG H2 . . . . . . . . . c30643_6pv2 1 . 3 . 1047 . 1 1 1 ARG H3 H 15.139 -1.685 3.517 . . . 1.0 . . . . . . . . . . . . A . 1 ARG H3 . . . . . . . . . c30643_6pv2 1 . 3 . 1048 . 1 1 1 ARG HA H 13.034 -2.827 3.639 . . . 1.0 . . . . . . . . . . . . A . 1 ARG HA . . . . . . . . . c30643_6pv2 1 . 3 . 1049 . 1 1 1 ARG HB2 H 12.869 -0.202 5.131 . . . 1.0 . . . . . . . . . . . . A . 1 ARG HB2 . . . . . . . . . c30643_6pv2 1 . 3 . 1050 . 1 1 1 ARG HB3 H 12.150 -1.734 5.601 . . . 1.0 . . . . . . . . . . . . A . 1 ARG HB3 . . . . . . . . . c30643_6pv2 1 . 3 . 1051 . 1 1 1 ARG HD2 H 15.137 -1.148 7.811 . . . 1.0 . . . . . . . . . . . . A . 1 ARG HD2 . . . . . . . . . c30643_6pv2 1 . 3 . 1052 . 1 1 1 ARG HD3 H 13.992 0.059 7.231 . . . 1.0 . . . . . . . . . . . . A . 1 ARG HD3 . . . . . . . . . c30643_6pv2 1 . 3 . 1053 . 1 1 1 ARG HE H 12.973 -2.566 8.032 . . . 1.0 . . . . . . . . . . . . A . 1 ARG HE . . . . . . . . . c30643_6pv2 1 . 3 . 1054 . 1 1 1 ARG HG2 H 14.326 -2.682 6.020 . . . 1.0 . . . . . . . . . . . . A . 1 ARG HG2 . . . . . . . . . c30643_6pv2 1 . 3 . 1055 . 1 1 1 ARG HG3 H 15.112 -1.221 5.416 . . . 1.0 . . . . . . . . . . . . A . 1 ARG HG3 . . . . . . . . . c30643_6pv2 1 . 3 . 1056 . 1 1 1 ARG HH11 H 12.032 0.876 9.886 . . . 1.0 . . . . . . . . . . . . A . 1 ARG HH11 . . . . . . . . . c30643_6pv2 1 . 3 . 1057 . 1 1 1 ARG HH12 H 13.263 0.869 8.665 . . . 1.0 . . . . . . . . . . . . A . 1 ARG HH12 . . . . . . . . . c30643_6pv2 1 . 3 . 1058 . 1 1 1 ARG HH21 H 11.366 -2.561 9.643 . . . 1.0 . . . . . . . . . . . . A . 1 ARG HH21 . . . . . . . . . c30643_6pv2 1 . 3 . 1059 . 1 1 1 ARG HH22 H 10.957 -1.080 10.448 . . . 1.0 . . . . . . . . . . . . A . 1 ARG HH22 . . . . . . . . . c30643_6pv2 1 . 3 . 1060 . 1 1 1 ARG N N 14.313 -1.288 3.027 . . . 1.0 . . . . . . . . . . . . A . 1 ARG N . . . . . . . . . c30643_6pv2 1 . 3 . 1061 . 1 1 1 ARG NE N 13.134 -1.600 8.145 . . . 1.0 . . . . . . . . . . . . A . 1 ARG NE . . . . . . . . . c30643_6pv2 1 . 3 . 1062 . 1 1 1 ARG NH1 N 12.581 0.376 9.210 . . . 1.0 . . . . . . . . . . . . A . 1 ARG NH1 . . . . . . . . . c30643_6pv2 1 . 3 . 1063 . 1 1 1 ARG NH2 N 11.504 -1.574 9.767 . . . 1.0 . . . . . . . . . . . . A . 1 ARG NH2 . . . . . . . . . c30643_6pv2 1 . 3 . 1064 . 1 1 1 ARG O O 11.512 -0.025 3.055 . . . 1.0 . . . . . . . . . . . . A . 1 ARG O . . . . . . . . . c30643_6pv2 1 . 3 . 1065 . 1 1 2 PRO C C 8.777 -1.578 1.946 . . . 1.0 . . . . . . . . . . . . A . 2 PRO C . . . . . . . . . c30643_6pv2 1 . 3 . 1066 . 1 1 2 PRO CA C 10.119 -1.568 1.224 . . . 1.0 . . . . . . . . . . . . A . 2 PRO CA . . . . . . . . . c30643_6pv2 1 . 3 . 1067 . 1 1 2 PRO CB C 10.122 -2.587 0.090 . . . 1.0 . . . . . . . . . . . . A . 2 PRO CB . . . . . . . . . c30643_6pv2 1 . 3 . 1068 . 1 1 2 PRO CD C 11.502 -3.454 1.872 . . . 1.0 . . . . . . . . . . . . A . 2 PRO CD . . . . . . . . . c30643_6pv2 1 . 3 . 1069 . 1 1 2 PRO CG C 10.602 -3.852 0.720 . . . 1.0 . . . . . . . . . . . . A . 2 PRO CG . . . . . . . . . c30643_6pv2 1 . 3 . 1070 . 1 1 2 PRO HA H 10.303 -0.581 0.826 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HA . . . . . . . . . c30643_6pv2 1 . 3 . 1071 . 1 1 2 PRO HB2 H 9.120 -2.691 -0.304 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HB2 . . . . . . . . . c30643_6pv2 1 . 3 . 1072 . 1 1 2 PRO HB3 H 10.791 -2.256 -0.692 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HB3 . . . . . . . . . c30643_6pv2 1 . 3 . 1073 . 1 1 2 PRO HD2 H 11.249 -4.017 2.759 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HD2 . . . . . . . . . c30643_6pv2 1 . 3 . 1074 . 1 1 2 PRO HD3 H 12.539 -3.609 1.611 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HD3 . . . . . . . . . c30643_6pv2 1 . 3 . 1075 . 1 1 2 PRO HG2 H 9.759 -4.418 1.084 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HG2 . . . . . . . . . c30643_6pv2 1 . 3 . 1076 . 1 1 2 PRO HG3 H 11.155 -4.432 -0.005 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HG3 . . . . . . . . . c30643_6pv2 1 . 3 . 1077 . 1 1 2 PRO N N 11.219 -2.018 2.064 . . . 1.0 . . . . . . . . . . . . A . 2 PRO N . . . . . . . . . c30643_6pv2 1 . 3 . 1078 . 1 1 2 PRO O O 8.590 -2.276 2.947 . . . 1.0 . . . . . . . . . . . . A . 2 PRO O . . . . . . . . . c30643_6pv2 1 . 3 . 1079 . 1 1 3 PHE C C 5.610 -1.605 1.061 . . . 1.0 . . . . . . . . . . . . A . 3 PHE C . . . . . . . . . c30643_6pv2 1 . 3 . 1080 . 1 1 3 PHE CA C 6.500 -0.746 1.945 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CA . . . . . . . . . c30643_6pv2 1 . 3 . 1081 . 1 1 3 PHE CB C 5.999 0.697 1.972 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CB . . . . . . . . . c30643_6pv2 1 . 3 . 1082 . 1 1 3 PHE CD1 C 7.833 2.363 2.330 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CD1 . . . . . . . . . c30643_6pv2 1 . 3 . 1083 . 1 1 3 PHE CD2 C 6.545 1.681 4.215 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CD2 . . . . . . . . . c30643_6pv2 1 . 3 . 1084 . 1 1 3 PHE CE1 C 8.584 3.193 3.141 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CE1 . . . . . . . . . c30643_6pv2 1 . 3 . 1085 . 1 1 3 PHE CE2 C 7.290 2.508 5.030 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CE2 . . . . . . . . . c30643_6pv2 1 . 3 . 1086 . 1 1 3 PHE CG C 6.808 1.600 2.858 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CG . . . . . . . . . c30643_6pv2 1 . 3 . 1087 . 1 1 3 PHE CZ C 8.295 3.274 4.499 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CZ . . . . . . . . . c30643_6pv2 1 . 3 . 1088 . 1 1 3 PHE H H 8.087 -0.221 0.667 . . . 1.0 . . . . . . . . . . . . A . 3 PHE H . . . . . . . . . c30643_6pv2 1 . 3 . 1089 . 1 1 3 PHE HA H 6.503 -1.148 2.947 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HA . . . . . . . . . c30643_6pv2 1 . 3 . 1090 . 1 1 3 PHE HB2 H 6.032 1.099 0.971 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HB2 . . . . . . . . . c30643_6pv2 1 . 3 . 1091 . 1 1 3 PHE HB3 H 4.982 0.711 2.325 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HB3 . . . . . . . . . c30643_6pv2 1 . 3 . 1092 . 1 1 3 PHE HD1 H 8.046 2.305 1.274 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HD1 . . . . . . . . . c30643_6pv2 1 . 3 . 1093 . 1 1 3 PHE HD2 H 5.744 1.089 4.638 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HD2 . . . . . . . . . c30643_6pv2 1 . 3 . 1094 . 1 1 3 PHE HE1 H 9.382 3.783 2.717 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HE1 . . . . . . . . . c30643_6pv2 1 . 3 . 1095 . 1 1 3 PHE HE2 H 7.077 2.562 6.088 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HE2 . . . . . . . . . c30643_6pv2 1 . 3 . 1096 . 1 1 3 PHE HZ H 8.873 3.924 5.138 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HZ . . . . . . . . . c30643_6pv2 1 . 3 . 1097 . 1 1 3 PHE N N 7.852 -0.792 1.431 . . . 1.0 . . . . . . . . . . . . A . 3 PHE N . . . . . . . . . c30643_6pv2 1 . 3 . 1098 . 1 1 3 PHE O O 5.077 -1.135 0.058 . . . 1.0 . . . . . . . . . . . . A . 3 PHE O . . . . . . . . . c30643_6pv2 1 . 3 . 1099 . 1 1 4 NLE C C 3.347 -4.022 0.992 . . . 1.0 . . . . . . . . . . . . A . 4 NLE C . . . . . . . . . c30643_6pv2 1 . 3 . 1100 . 1 1 4 NLE CA C 4.797 -3.831 0.567 . . . 1.0 . . . . . . . . . . . . A . 4 NLE CA . . . . . . . . . c30643_6pv2 1 . 3 . 1101 . 1 1 4 NLE CB C 5.540 -5.170 0.598 . . . 1.0 . . . . . . . . . . . . A . 4 NLE CB . . . . . . . . . c30643_6pv2 1 . 3 . 1102 . 1 1 4 NLE CD C 5.840 -7.468 -0.372 . . . 1.0 . . . . . . . . . . . . A . 4 NLE CD . . . . . . . . . c30643_6pv2 1 . 3 . 1103 . 1 1 4 NLE CE C 5.314 -8.451 -1.394 . . . 1.0 . . . . . . . . . . . . A . 4 NLE CE . . . . . . . . . c30643_6pv2 1 . 3 . 1104 . 1 1 4 NLE CG C 5.021 -6.188 -0.405 . . . 1.0 . . . . . . . . . . . . A . 4 NLE CG . . . . . . . . . c30643_6pv2 1 . 3 . 1105 . 1 1 4 NLE H H 5.844 -3.161 2.278 . . . 1.0 . . . . . . . . . . . . A . 4 NLE H . . . . . . . . . c30643_6pv2 1 . 3 . 1106 . 1 1 4 NLE HA H 4.811 -3.447 -0.439 . . . 1.0 . . . . . . . . . . . . A . 4 NLE HA . . . . . . . . . c30643_6pv2 1 . 3 . 1107 . 1 1 4 NLE HB2 H 5.446 -5.593 1.586 . . . 1.0 . . . . . . . . . . . . A . 4 NLE HB2 . . . . . . . . . c30643_6pv2 1 . 3 . 1108 . 1 1 4 NLE HB3 H 6.585 -4.995 0.390 . . . 1.0 . . . . . . . . . . . . A . 4 NLE HB3 . . . . . . . . . c30643_6pv2 1 . 3 . 1109 . 1 1 4 NLE HD2 H 5.768 -7.914 0.610 . . . 1.0 . . . . . . . . . . . . A . 4 NLE HD2 . . . . . . . . . c30643_6pv2 1 . 3 . 1110 . 1 1 4 NLE HD3 H 6.869 -7.242 -0.604 . . . 1.0 . . . . . . . . . . . . A . 4 NLE HD3 . . . . . . . . . c30643_6pv2 1 . 3 . 1111 . 1 1 4 NLE HE1 H 5.359 -8.006 -2.377 . . . 1.0 . . . . . . . . . . . . A . 4 NLE HE1 . . . . . . . . . c30643_6pv2 1 . 3 . 1112 . 1 1 4 NLE HE2 H 4.291 -8.704 -1.158 . . . 1.0 . . . . . . . . . . . . A . 4 NLE HE2 . . . . . . . . . c30643_6pv2 1 . 3 . 1113 . 1 1 4 NLE HE3 H 5.919 -9.346 -1.376 . . . 1.0 . . . . . . . . . . . . A . 4 NLE HE3 . . . . . . . . . c30643_6pv2 1 . 3 . 1114 . 1 1 4 NLE HG2 H 5.073 -5.764 -1.398 . . . 1.0 . . . . . . . . . . . . A . 4 NLE HG2 . . . . . . . . . c30643_6pv2 1 . 3 . 1115 . 1 1 4 NLE HG3 H 3.994 -6.425 -0.167 . . . 1.0 . . . . . . . . . . . . A . 4 NLE HG3 . . . . . . . . . c30643_6pv2 1 . 3 . 1116 . 1 1 4 NLE N N 5.480 -2.868 1.418 . . . 1.0 . . . . . . . . . . . . A . 4 NLE N . . . . . . . . . c30643_6pv2 1 . 3 . 1117 . 1 1 4 NLE O O 3.034 -4.073 2.183 . . . 1.0 . . . . . . . . . . . . A . 4 NLE O . . . . . . . . . c30643_6pv2 1 . 3 . 1118 . 1 1 5 CYS C C 0.882 -5.790 0.799 . . . 1.0 . . . . . . . . . . . . A . 5 CYS C . . . . . . . . . c30643_6pv2 1 . 3 . 1119 . 1 1 5 CYS CA C 1.064 -4.382 0.231 . . . 1.0 . . . . . . . . . . . . A . 5 CYS CA . . . . . . . . . c30643_6pv2 1 . 3 . 1120 . 1 1 5 CYS CB C 0.280 -4.230 -1.074 . . . 1.0 . . . . . . . . . . . . A . 5 CYS CB . . . . . . . . . c30643_6pv2 1 . 3 . 1121 . 1 1 5 CYS H H 2.778 -3.946 -0.920 . . . 1.0 . . . . . . . . . . . . A . 5 CYS H . . . . . . . . . c30643_6pv2 1 . 3 . 1122 . 1 1 5 CYS HA H 0.694 -3.667 0.947 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HA . . . . . . . . . c30643_6pv2 1 . 3 . 1123 . 1 1 5 CYS HB2 H 0.212 -3.180 -1.326 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HB2 . . . . . . . . . c30643_6pv2 1 . 3 . 1124 . 1 1 5 CYS HB3 H 0.799 -4.751 -1.862 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HB3 . . . . . . . . . c30643_6pv2 1 . 3 . 1125 . 1 1 5 CYS N N 2.469 -4.098 0.001 . . . 1.0 . . . . . . . . . . . . A . 5 CYS N . . . . . . . . . c30643_6pv2 1 . 3 . 1126 . 1 1 5 CYS O O 1.495 -6.747 0.319 . . . 1.0 . . . . . . . . . . . . A . 5 CYS O . . . . . . . . . c30643_6pv2 1 . 3 . 1127 . 1 1 5 CYS SG S -1.398 -4.883 -0.988 . . . 1.0 . . . . . . . . . . . . A . 5 CYS SG . . . . . . . . . c30643_6pv2 1 . 3 . 1128 . 1 1 6 THR C C -1.548 -7.762 2.249 . . . 1.0 . . . . . . . . . . . . A . 6 THR C . . . . . . . . . c30643_6pv2 1 . 3 . 1129 . 1 1 6 THR CA C -0.158 -7.179 2.506 . . . 1.0 . . . . . . . . . . . . A . 6 THR CA . . . . . . . . . c30643_6pv2 1 . 3 . 1130 . 1 1 6 THR CB C 0.044 -7.007 4.023 . . . 1.0 . . . . . . . . . . . . A . 6 THR CB . . . . . . . . . c30643_6pv2 1 . 3 . 1131 . 1 1 6 THR CG2 C 1.516 -6.808 4.357 . . . 1.0 . . . . . . . . . . . . A . 6 THR CG2 . . . . . . . . . c30643_6pv2 1 . 3 . 1132 . 1 1 6 THR H H -0.448 -5.119 2.131 . . . 1.0 . . . . . . . . . . . . A . 6 THR H . . . . . . . . . c30643_6pv2 1 . 3 . 1133 . 1 1 6 THR HA H 0.585 -7.874 2.144 . . . 1.0 . . . . . . . . . . . . A . 6 THR HA . . . . . . . . . c30643_6pv2 1 . 3 . 1134 . 1 1 6 THR HB H -0.305 -7.900 4.520 . . . 1.0 . . . . . . . . . . . . A . 6 THR HB . . . . . . . . . c30643_6pv2 1 . 3 . 1135 . 1 1 6 THR HG1 H -1.653 -6.117 4.528 . . . 1.0 . . . . . . . . . . . . A . 6 THR HG1 . . . . . . . . . c30643_6pv2 1 . 3 . 1136 . 1 1 6 THR HG21 H 1.882 -5.925 3.854 . . . 1.0 . . . . . . . . . . . . A . 6 THR HG21 . . . . . . . . . c30643_6pv2 1 . 3 . 1137 . 1 1 6 THR HG22 H 2.079 -7.669 4.031 . . . 1.0 . . . . . . . . . . . . A . 6 THR HG22 . . . . . . . . . c30643_6pv2 1 . 3 . 1138 . 1 1 6 THR HG23 H 1.630 -6.688 5.426 . . . 1.0 . . . . . . . . . . . . A . 6 THR HG23 . . . . . . . . . c30643_6pv2 1 . 3 . 1139 . 1 1 6 THR N N 0.043 -5.910 1.821 . . . 1.0 . . . . . . . . . . . . A . 6 THR N . . . . . . . . . c30643_6pv2 1 . 3 . 1140 . 1 1 6 THR O O -2.056 -8.553 3.049 . . . 1.0 . . . . . . . . . . . . A . 6 THR O . . . . . . . . . c30643_6pv2 1 . 3 . 1141 . 1 1 6 THR OG1 O -0.717 -5.881 4.491 . . . 1.0 . . . . . . . . . . . . A . 6 THR OG1 . . . . . . . . . c30643_6pv2 1 . 3 . 1142 . 1 1 7 TRP C C -3.426 -8.923 -0.285 . . . 1.0 . . . . . . . . . . . . A . 7 TRP C . . . . . . . . . c30643_6pv2 1 . 3 . 1143 . 1 1 7 TRP CA C -3.494 -7.872 0.818 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CA . . . . . . . . . c30643_6pv2 1 . 3 . 1144 . 1 1 7 TRP CB C -4.401 -6.723 0.394 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CB . . . . . . . . . c30643_6pv2 1 . 3 . 1145 . 1 1 7 TRP CD1 C -6.472 -7.723 -0.727 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CD1 . . . . . . . . . c30643_6pv2 1 . 3 . 1146 . 1 1 7 TRP CD2 C -6.842 -6.904 1.319 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CD2 . . . . . . . . . c30643_6pv2 1 . 3 . 1147 . 1 1 7 TRP CE2 C -8.051 -7.418 0.818 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CE2 . . . . . . . . . c30643_6pv2 1 . 3 . 1148 . 1 1 7 TRP CE3 C -6.829 -6.335 2.593 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CE3 . . . . . . . . . c30643_6pv2 1 . 3 . 1149 . 1 1 7 TRP CG C -5.845 -7.111 0.315 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CG . . . . . . . . . c30643_6pv2 1 . 3 . 1150 . 1 1 7 TRP CH2 C -9.193 -6.816 2.791 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CH2 . . . . . . . . . c30643_6pv2 1 . 3 . 1151 . 1 1 7 TRP CZ2 C -9.234 -7.380 1.546 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CZ2 . . . . . . . . . c30643_6pv2 1 . 3 . 1152 . 1 1 7 TRP CZ3 C -8.004 -6.296 3.316 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CZ3 . . . . . . . . . c30643_6pv2 1 . 3 . 1153 . 1 1 7 TRP H H -1.721 -6.758 0.524 . . . 1.0 . . . . . . . . . . . . A . 7 TRP H . . . . . . . . . c30643_6pv2 1 . 3 . 1154 . 1 1 7 TRP HA H -3.902 -8.328 1.707 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HA . . . . . . . . . c30643_6pv2 1 . 3 . 1155 . 1 1 7 TRP HB2 H -4.310 -5.917 1.104 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HB2 . . . . . . . . . c30643_6pv2 1 . 3 . 1156 . 1 1 7 TRP HB3 H -4.095 -6.373 -0.580 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HB3 . . . . . . . . . c30643_6pv2 1 . 3 . 1157 . 1 1 7 TRP HD1 H -5.981 -8.011 -1.643 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HD1 . . . . . . . . . c30643_6pv2 1 . 3 . 1158 . 1 1 7 TRP HE1 H -8.457 -8.338 -1.025 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HE1 . . . . . . . . . c30643_6pv2 1 . 3 . 1159 . 1 1 7 TRP HE3 H -5.920 -5.931 3.013 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HE3 . . . . . . . . . c30643_6pv2 1 . 3 . 1160 . 1 1 7 TRP HH2 H -10.088 -6.763 3.390 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HH2 . . . . . . . . . c30643_6pv2 1 . 3 . 1161 . 1 1 7 TRP HZ2 H -10.159 -7.777 1.156 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HZ2 . . . . . . . . . c30643_6pv2 1 . 3 . 1162 . 1 1 7 TRP HZ3 H -8.013 -5.859 4.303 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HZ3 . . . . . . . . . c30643_6pv2 1 . 3 . 1163 . 1 1 7 TRP N N -2.165 -7.380 1.139 . . . 1.0 . . . . . . . . . . . . A . 7 TRP N . . . . . . . . . c30643_6pv2 1 . 3 . 1164 . 1 1 7 TRP NE1 N -7.798 -7.915 -0.433 . . . 1.0 . . . . . . . . . . . . A . 7 TRP NE1 . . . . . . . . . c30643_6pv2 1 . 3 . 1165 . 1 1 7 TRP O O -3.456 -8.600 -1.473 . . . 1.0 . . . . . . . . . . . . A . 7 TRP O . . . . . . . . . c30643_6pv2 1 . 3 . 1166 . 1 1 8 ORN C C -1.750 -10.796 -4.188 . . . 1.0 . . . . . . . . . . . . A . 8 ORN C . . . . . . . . . c30643_6pv2 1 . 3 . 1167 . 1 1 8 ORN CA C -2.460 -12.053 -3.707 . . . 1.0 . . . . . . . . . . . . A . 8 ORN CA . . . . . . . . . c30643_6pv2 1 . 3 . 1168 . 1 1 8 ORN CB C -1.794 -12.575 -2.429 . . . 1.0 . . . . . . . . . . . . A . 8 ORN CB . . . . . . . . . c30643_6pv2 1 . 3 . 1169 . 1 1 8 ORN CD C -3.241 -11.310 -0.807 . . . 1.0 . . . . . . . . . . . . A . 8 ORN CD . . . . . . . . . c30643_6pv2 1 . 3 . 1170 . 1 1 8 ORN CG C -1.820 -11.580 -1.279 . . . 1.0 . . . . . . . . . . . . A . 8 ORN CG . . . . . . . . . c30643_6pv2 1 . 3 . 1171 . 1 1 8 ORN H H -2.924 -13.944 -4.438 . . . 1.0 . . . . . . . . . . . . A . 8 ORN H . . . . . . . . . c30643_6pv2 1 . 3 . 1172 . 1 1 8 ORN HA H -3.490 -11.813 -3.498 . . . 1.0 . . . . . . . . . . . . A . 8 ORN HA . . . . . . . . . c30643_6pv2 1 . 3 . 1173 . 1 1 8 ORN HB2 H -0.764 -12.816 -2.645 . . . 1.0 . . . . . . . . . . . . A . 8 ORN HB2 . . . . . . . . . c30643_6pv2 1 . 3 . 1174 . 1 1 8 ORN HB3 H -2.305 -13.470 -2.110 . . . 1.0 . . . . . . . . . . . . A . 8 ORN HB3 . . . . . . . . . c30643_6pv2 1 . 3 . 1175 . 1 1 8 ORN HD2 H -3.613 -12.190 -0.308 . . . 1.0 . . . . . . . . . . . . A . 8 ORN HD2 . . . . . . . . . c30643_6pv2 1 . 3 . 1176 . 1 1 8 ORN HD3 H -3.859 -11.096 -1.665 . . . 1.0 . . . . . . . . . . . . A . 8 ORN HD3 . . . . . . . . . c30643_6pv2 1 . 3 . 1177 . 1 1 8 ORN HE1 H -3.267 -10.368 1.072 . . . 1.0 . . . . . . . . . . . . A . 8 ORN HE1 . . . . . . . . . c30643_6pv2 1 . 3 . 1178 . 1 1 8 ORN HG2 H -1.376 -10.652 -1.608 . . . 1.0 . . . . . . . . . . . . A . 8 ORN HG2 . . . . . . . . . c30643_6pv2 1 . 3 . 1179 . 1 1 8 ORN HG3 H -1.249 -11.983 -0.455 . . . 1.0 . . . . . . . . . . . . A . 8 ORN HG3 . . . . . . . . . c30643_6pv2 1 . 3 . 1180 . 1 1 8 ORN N N -2.430 -13.089 -4.760 . . . 1.0 . . . . . . . . . . . . A . 8 ORN N . . . . . . . . . c30643_6pv2 1 . 3 . 1181 . 1 1 8 ORN NE N -3.311 -10.180 0.112 . . . 1.0 . . . . . . . . . . . . A . 8 ORN NE . . . . . . . . . c30643_6pv2 1 . 3 . 1182 . 1 1 8 ORN O O -0.685 -10.870 -4.806 . . . 1.0 . . . . . . . . . . . . A . 8 ORN O . . . . . . . . . c30643_6pv2 1 . 3 . 1183 . 1 1 9 CYS C C -0.542 -8.104 -3.375 . . . 1.0 . . . . . . . . . . . . A . 9 CYS C . . . . . . . . . c30643_6pv2 1 . 3 . 1184 . 1 1 9 CYS CA C -1.743 -8.382 -4.277 . . . 1.0 . . . . . . . . . . . . A . 9 CYS CA . . . . . . . . . c30643_6pv2 1 . 3 . 1185 . 1 1 9 CYS CB C -2.782 -7.270 -4.160 . . . 1.0 . . . . . . . . . . . . A . 9 CYS CB . . . . . . . . . c30643_6pv2 1 . 3 . 1186 . 1 1 9 CYS H H -3.196 -9.648 -3.423 . . . 1.0 . . . . . . . . . . . . A . 9 CYS H . . . . . . . . . c30643_6pv2 1 . 3 . 1187 . 1 1 9 CYS HA H -1.410 -8.454 -5.300 . . . 1.0 . . . . . . . . . . . . A . 9 CYS HA . . . . . . . . . c30643_6pv2 1 . 3 . 1188 . 1 1 9 CYS HB2 H -3.612 -7.489 -4.816 . . . 1.0 . . . . . . . . . . . . A . 9 CYS HB2 . . . . . . . . . c30643_6pv2 1 . 3 . 1189 . 1 1 9 CYS HB3 H -3.137 -7.232 -3.142 . . . 1.0 . . . . . . . . . . . . A . 9 CYS HB3 . . . . . . . . . c30643_6pv2 1 . 3 . 1190 . 1 1 9 CYS N N -2.340 -9.648 -3.910 . . . 1.0 . . . . . . . . . . . . A . 9 CYS N . . . . . . . . . c30643_6pv2 1 . 3 . 1191 . 1 1 9 CYS O O -0.609 -8.310 -2.163 . . . 1.0 . . . . . . . . . . . . A . 9 CYS O . . . . . . . . . c30643_6pv2 1 . 3 . 1192 . 1 1 9 CYS SG S -2.166 -5.634 -4.586 . . . 1.0 . . . . . . . . . . . . A . 9 CYS SG . . . . . . . . . c30643_6pv2 1 . 3 . 1193 . 1 1 10 GLY C C 2.656 -6.397 -3.817 . . . 1.0 . . . . . . . . . . . . A . 10 GLY C . . . . . . . . . c30643_6pv2 1 . 3 . 1194 . 1 1 10 GLY CA C 1.762 -7.444 -3.199 . . . 1.0 . . . . . . . . . . . . A . 10 GLY CA . . . . . . . . . c30643_6pv2 1 . 3 . 1195 . 1 1 10 GLY H H 0.546 -7.468 -4.926 . . . 1.0 . . . . . . . . . . . . A . 10 GLY H . . . . . . . . . c30643_6pv2 1 . 3 . 1196 . 1 1 10 GLY HA2 H 1.493 -7.130 -2.202 . . . 1.0 . . . . . . . . . . . . A . 10 GLY HA2 . . . . . . . . . c30643_6pv2 1 . 3 . 1197 . 1 1 10 GLY HA3 H 2.304 -8.375 -3.139 . . . 1.0 . . . . . . . . . . . . A . 10 GLY HA3 . . . . . . . . . c30643_6pv2 1 . 3 . 1198 . 1 1 10 GLY N N 0.556 -7.659 -3.964 . . . 1.0 . . . . . . . . . . . . A . 10 GLY N . . . . . . . . . c30643_6pv2 1 . 3 . 1199 . 1 1 10 GLY O O 3.864 -6.596 -3.941 . . . 1.0 . . . . . . . . . . . . A . 10 GLY O . . . . . . . . . c30643_6pv2 1 . 3 . 1200 . 1 1 11 LYS C C 3.686 -3.540 -3.706 . . . 1.0 . . . . . . . . . . . . A . 11 LYS C . . . . . . . . . c30643_6pv2 1 . 3 . 1201 . 1 1 11 LYS CA C 2.829 -4.185 -4.786 . . . 1.0 . . . . . . . . . . . . A . 11 LYS CA . . . . . . . . . c30643_6pv2 1 . 3 . 1202 . 1 1 11 LYS CB C 1.902 -3.146 -5.423 . . . 1.0 . . . . . . . . . . . . A . 11 LYS CB . . . . . . . . . c30643_6pv2 1 . 3 . 1203 . 1 1 11 LYS CD C 0.429 -2.568 -7.372 . . . 1.0 . . . . . . . . . . . . A . 11 LYS CD . . . . . . . . . c30643_6pv2 1 . 3 . 1204 . 1 1 11 LYS CE C -0.380 -3.112 -8.537 . . . 1.0 . . . . . . . . . . . . A . 11 LYS CE . . . . . . . . . c30643_6pv2 1 . 3 . 1205 . 1 1 11 LYS CG C 1.095 -3.686 -6.590 . . . 1.0 . . . . . . . . . . . . A . 11 LYS CG . . . . . . . . . c30643_6pv2 1 . 3 . 1206 . 1 1 11 LYS H H 1.094 -5.197 -4.124 . . . 1.0 . . . . . . . . . . . . A . 11 LYS H . . . . . . . . . c30643_6pv2 1 . 3 . 1207 . 1 1 11 LYS HA H 3.477 -4.593 -5.547 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HA . . . . . . . . . c30643_6pv2 1 . 3 . 1208 . 1 1 11 LYS HB2 H 1.212 -2.788 -4.673 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HB2 . . . . . . . . . c30643_6pv2 1 . 3 . 1209 . 1 1 11 LYS HB3 H 2.497 -2.317 -5.777 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HB3 . . . . . . . . . c30643_6pv2 1 . 3 . 1210 . 1 1 11 LYS HD2 H -0.228 -2.023 -6.712 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HD2 . . . . . . . . . c30643_6pv2 1 . 3 . 1211 . 1 1 11 LYS HD3 H 1.191 -1.904 -7.752 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HD3 . . . . . . . . . c30643_6pv2 1 . 3 . 1212 . 1 1 11 LYS HE2 H 0.266 -3.719 -9.154 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HE2 . . . . . . . . . c30643_6pv2 1 . 3 . 1213 . 1 1 11 LYS HE3 H -1.179 -3.723 -8.147 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HE3 . . . . . . . . . c30643_6pv2 1 . 3 . 1214 . 1 1 11 LYS HG2 H 1.753 -4.229 -7.248 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HG2 . . . . . . . . . c30643_6pv2 1 . 3 . 1215 . 1 1 11 LYS HG3 H 0.331 -4.350 -6.210 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HG3 . . . . . . . . . c30643_6pv2 1 . 3 . 1216 . 1 1 11 LYS HZ1 H -1.532 -1.389 -8.771 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HZ1 . . . . . . . . . c30643_6pv2 1 . 3 . 1217 . 1 1 11 LYS HZ2 H -1.564 -2.420 -10.109 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HZ2 . . . . . . . . . c30643_6pv2 1 . 3 . 1218 . 1 1 11 LYS HZ3 H -0.201 -1.469 -9.809 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HZ3 . . . . . . . . . c30643_6pv2 1 . 3 . 1219 . 1 1 11 LYS N N 2.064 -5.283 -4.218 . . . 1.0 . . . . . . . . . . . . A . 11 LYS N . . . . . . . . . c30643_6pv2 1 . 3 . 1220 . 1 1 11 LYS NZ N -0.959 -2.023 -9.364 . . . 1.0 . . . . . . . . . . . . A . 11 LYS NZ . . . . . . . . . c30643_6pv2 1 . 3 . 1221 . 1 1 11 LYS O O 3.205 -3.265 -2.606 . . . 1.0 . . . . . . . . . . . . A . 11 LYS O . . . . . . . . . c30643_6pv2 1 . 3 . 1222 . 1 1 12 ARG C C 6.133 -1.276 -3.398 . . . 1.0 . . . . . . . . . . . . A . 12 ARG C . . . . . . . . . c30643_6pv2 1 . 3 . 1223 . 1 1 12 ARG CA C 5.874 -2.734 -3.051 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CA . . . . . . . . . c30643_6pv2 1 . 3 . 1224 . 1 1 12 ARG CB C 7.197 -3.512 -3.001 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CB . . . . . . . . . c30643_6pv2 1 . 3 . 1225 . 1 1 12 ARG CD C 9.365 -4.090 -4.140 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CD . . . . . . . . . c30643_6pv2 1 . 3 . 1226 . 1 1 12 ARG CG C 7.994 -3.453 -4.293 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CG . . . . . . . . . c30643_6pv2 1 . 3 . 1227 . 1 1 12 ARG CZ C 11.507 -4.098 -5.369 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CZ . . . . . . . . . c30643_6pv2 1 . 3 . 1228 . 1 1 12 ARG H H 5.280 -3.565 -4.904 . . . 1.0 . . . . . . . . . . . . A . 12 ARG H . . . . . . . . . c30643_6pv2 1 . 3 . 1229 . 1 1 12 ARG HA H 5.405 -2.775 -2.082 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HA . . . . . . . . . c30643_6pv2 1 . 3 . 1230 . 1 1 12 ARG HB2 H 7.809 -3.108 -2.209 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HB2 . . . . . . . . . c30643_6pv2 1 . 3 . 1231 . 1 1 12 ARG HB3 H 6.982 -4.549 -2.785 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HB3 . . . . . . . . . c30643_6pv2 1 . 3 . 1232 . 1 1 12 ARG HD2 H 9.856 -3.660 -3.278 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HD2 . . . . . . . . . c30643_6pv2 1 . 3 . 1233 . 1 1 12 ARG HD3 H 9.242 -5.153 -3.992 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HD3 . . . . . . . . . c30643_6pv2 1 . 3 . 1234 . 1 1 12 ARG HE H 9.748 -3.507 -6.123 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HE . . . . . . . . . c30643_6pv2 1 . 3 . 1235 . 1 1 12 ARG HG2 H 7.451 -3.980 -5.062 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HG2 . . . . . . . . . c30643_6pv2 1 . 3 . 1236 . 1 1 12 ARG HG3 H 8.116 -2.418 -4.581 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HG3 . . . . . . . . . c30643_6pv2 1 . 3 . 1237 . 1 1 12 ARG HH11 H 11.627 -4.841 -3.487 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH11 . . . . . . . . . c30643_6pv2 1 . 3 . 1238 . 1 1 12 ARG HH12 H 13.122 -4.790 -4.361 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH12 . . . . . . . . . c30643_6pv2 1 . 3 . 1239 . 1 1 12 ARG HH21 H 13.178 -3.989 -6.508 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH21 . . . . . . . . . c30643_6pv2 1 . 3 . 1240 . 1 1 12 ARG HH22 H 11.727 -3.412 -7.263 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH22 . . . . . . . . . c30643_6pv2 1 . 3 . 1241 . 1 1 12 ARG N N 4.956 -3.327 -4.011 . . . 1.0 . . . . . . . . . . . . A . 12 ARG N . . . . . . . . . c30643_6pv2 1 . 3 . 1242 . 1 1 12 ARG NE N 10.195 -3.867 -5.321 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NE . . . . . . . . . c30643_6pv2 1 . 3 . 1243 . 1 1 12 ARG NH1 N 12.135 -4.619 -4.321 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NH1 . . . . . . . . . c30643_6pv2 1 . 3 . 1244 . 1 1 12 ARG NH2 N 12.190 -3.814 -6.469 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NH2 . . . . . . . . . c30643_6pv2 1 . 3 . 1245 . 1 1 12 ARG O O 6.247 -0.914 -4.570 . . . 1.0 . . . . . . . . . . . . A . 12 ARG O . . . . . . . . . c30643_6pv2 1 . 3 . 1246 . 1 1 13 PHE C C 7.604 1.455 -1.756 . . . 1.0 . . . . . . . . . . . . A . 13 PHE C . . . . . . . . . c30643_6pv2 1 . 3 . 1247 . 1 1 13 PHE CA C 6.398 0.983 -2.555 . . . 1.0 . . . . . . . . . . . . A . 13 PHE CA . . . . . . . . . c30643_6pv2 1 . 3 . 1248 . 1 1 13 PHE CB C 5.140 1.727 -2.106 . . . 1.0 . . . . . . . . . . . . A . 13 PHE CB . . . . . . . . . c30643_6pv2 1 . 3 . 1249 . 1 1 13 PHE CD1 C 3.517 1.912 -4.007 . . . 1.0 . . . . . . . . . . . . A . 13 PHE CD1 . . . . . . . . . c30643_6pv2 1 . 3 . 1250 . 1 1 13 PHE CD2 C 3.145 0.232 -2.360 . . . 1.0 . . . . . . . . . . . . A . 13 PHE CD2 . . . . . . . . . c30643_6pv2 1 . 3 . 1251 . 1 1 13 PHE CE1 C 2.389 1.500 -4.686 . . . 1.0 . . . . . . . . . . . . A . 13 PHE CE1 . . . . . . . . . c30643_6pv2 1 . 3 . 1252 . 1 1 13 PHE CE2 C 2.017 -0.186 -3.032 . . . 1.0 . . . . . . . . . . . . A . 13 PHE CE2 . . . . . . . . . c30643_6pv2 1 . 3 . 1253 . 1 1 13 PHE CG C 3.906 1.284 -2.838 . . . 1.0 . . . . . . . . . . . . A . 13 PHE CG . . . . . . . . . c30643_6pv2 1 . 3 . 1254 . 1 1 13 PHE CZ C 1.637 0.449 -4.197 . . . 1.0 . . . . . . . . . . . . A . 13 PHE CZ . . . . . . . . . c30643_6pv2 1 . 3 . 1255 . 1 1 13 PHE H H 6.126 -0.798 -1.461 . . . 1.0 . . . . . . . . . . . . A . 13 PHE H . . . . . . . . . c30643_6pv2 1 . 3 . 1256 . 1 1 13 PHE HA H 6.566 1.173 -3.604 . . . 1.0 . . . . . . . . . . . . A . 13 PHE HA . . . . . . . . . c30643_6pv2 1 . 3 . 1257 . 1 1 13 PHE HB2 H 4.981 1.554 -1.052 . . . 1.0 . . . . . . . . . . . . A . 13 PHE HB2 . . . . . . . . . c30643_6pv2 1 . 3 . 1258 . 1 1 13 PHE HB3 H 5.269 2.785 -2.280 . . . 1.0 . . . . . . . . . . . . A . 13 PHE HB3 . . . . . . . . . c30643_6pv2 1 . 3 . 1259 . 1 1 13 PHE HD1 H 4.105 2.732 -4.389 . . . 1.0 . . . . . . . . . . . . A . 13 PHE HD1 . . . . . . . . . c30643_6pv2 1 . 3 . 1260 . 1 1 13 PHE HD2 H 3.445 -0.266 -1.449 . . . 1.0 . . . . . . . . . . . . A . 13 PHE HD2 . . . . . . . . . c30643_6pv2 1 . 3 . 1261 . 1 1 13 PHE HE1 H 2.095 1.997 -5.598 . . . 1.0 . . . . . . . . . . . . A . 13 PHE HE1 . . . . . . . . . c30643_6pv2 1 . 3 . 1262 . 1 1 13 PHE HE2 H 1.430 -1.008 -2.647 . . . 1.0 . . . . . . . . . . . . A . 13 PHE HE2 . . . . . . . . . c30643_6pv2 1 . 3 . 1263 . 1 1 13 PHE HZ H 0.754 0.124 -4.725 . . . 1.0 . . . . . . . . . . . . A . 13 PHE HZ . . . . . . . . . c30643_6pv2 1 . 3 . 1264 . 1 1 13 PHE N N 6.210 -0.444 -2.375 . . . 1.0 . . . . . . . . . . . . A . 13 PHE N . . . . . . . . . c30643_6pv2 1 . 3 . 1265 . 1 1 13 PHE O O 7.976 0.840 -0.760 . . . 1.0 . . . . . . . . . . . . A . 13 PHE O . . . . . . . . . c30643_6pv2 1 . 3 . 1266 . 1 1 14 THR C C 8.937 4.185 -0.539 . . . 1.0 . . . . . . . . . . . . A . 14 THR C . . . . . . . . . c30643_6pv2 1 . 3 . 1267 . 1 1 14 THR CA C 9.371 3.095 -1.515 . . . 1.0 . . . . . . . . . . . . A . 14 THR CA . . . . . . . . . c30643_6pv2 1 . 3 . 1268 . 1 1 14 THR CB C 10.392 3.672 -2.515 . . . 1.0 . . . . . . . . . . . . A . 14 THR CB . . . . . . . . . c30643_6pv2 1 . 3 . 1269 . 1 1 14 THR CG2 C 11.185 2.564 -3.191 . . . 1.0 . . . . . . . . . . . . A . 14 THR CG2 . . . . . . . . . c30643_6pv2 1 . 3 . 1270 . 1 1 14 THR H H 7.912 2.958 -3.035 . . . 1.0 . . . . . . . . . . . . A . 14 THR H . . . . . . . . . c30643_6pv2 1 . 3 . 1271 . 1 1 14 THR HA H 9.850 2.301 -0.960 . . . 1.0 . . . . . . . . . . . . A . 14 THR HA . . . . . . . . . c30643_6pv2 1 . 3 . 1272 . 1 1 14 THR HB H 11.077 4.311 -1.978 . . . 1.0 . . . . . . . . . . . . A . 14 THR HB . . . . . . . . . c30643_6pv2 1 . 3 . 1273 . 1 1 14 THR HG1 H 10.360 4.846 -4.106 . . . 1.0 . . . . . . . . . . . . A . 14 THR HG1 . . . . . . . . . c30643_6pv2 1 . 3 . 1274 . 1 1 14 THR HG21 H 11.892 2.998 -3.882 . . . 1.0 . . . . . . . . . . . . A . 14 THR HG21 . . . . . . . . . c30643_6pv2 1 . 3 . 1275 . 1 1 14 THR HG22 H 10.510 1.915 -3.728 . . . 1.0 . . . . . . . . . . . . A . 14 THR HG22 . . . . . . . . . c30643_6pv2 1 . 3 . 1276 . 1 1 14 THR HG23 H 11.716 1.991 -2.444 . . . 1.0 . . . . . . . . . . . . A . 14 THR HG23 . . . . . . . . . c30643_6pv2 1 . 3 . 1277 . 1 1 14 THR N N 8.225 2.531 -2.207 . . . 1.0 . . . . . . . . . . . . A . 14 THR N . . . . . . . . . c30643_6pv2 1 . 3 . 1278 . 1 1 14 THR O O 9.762 4.778 0.155 . . . 1.0 . . . . . . . . . . . . A . 14 THR O . . . . . . . . . c30643_6pv2 1 . 3 . 1279 . 1 1 14 THR OG1 O 9.711 4.451 -3.509 . . . 1.0 . . . . . . . . . . . . A . 14 THR OG1 . . . . . . . . . c30643_6pv2 1 . 3 . 1280 . 1 1 15 ARG C C 5.817 4.951 1.060 . . . 1.0 . . . . . . . . . . . . A . 15 ARG C . . . . . . . . . c30643_6pv2 1 . 3 . 1281 . 1 1 15 ARG CA C 7.083 5.467 0.385 . . . 1.0 . . . . . . . . . . . . A . 15 ARG CA . . . . . . . . . c30643_6pv2 1 . 3 . 1282 . 1 1 15 ARG CB C 6.770 6.735 -0.416 . . . 1.0 . . . . . . . . . . . . A . 15 ARG CB . . . . . . . . . c30643_6pv2 1 . 3 . 1283 . 1 1 15 ARG CD C 8.982 7.874 -0.029 . . . 1.0 . . . . . . . . . . . . A . 15 ARG CD . . . . . . . . . c30643_6pv2 1 . 3 . 1284 . 1 1 15 ARG CG C 7.988 7.373 -1.062 . . . 1.0 . . . . . . . . . . . . A . 15 ARG CG . . . . . . . . . c30643_6pv2 1 . 3 . 1285 . 1 1 15 ARG CZ C 10.693 9.608 -0.422 . . . 1.0 . . . . . . . . . . . . A . 15 ARG CZ . . . . . . . . . c30643_6pv2 1 . 3 . 1286 . 1 1 15 ARG H H 7.024 3.909 -1.041 . . . 1.0 . . . . . . . . . . . . A . 15 ARG H . . . . . . . . . c30643_6pv2 1 . 3 . 1287 . 1 1 15 ARG HA H 7.820 5.694 1.141 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HA . . . . . . . . . c30643_6pv2 1 . 3 . 1288 . 1 1 15 ARG HB2 H 6.068 6.486 -1.197 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HB2 . . . . . . . . . c30643_6pv2 1 . 3 . 1289 . 1 1 15 ARG HB3 H 6.317 7.460 0.243 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HB3 . . . . . . . . . c30643_6pv2 1 . 3 . 1290 . 1 1 15 ARG HD2 H 8.520 8.655 0.548 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HD2 . . . . . . . . . c30643_6pv2 1 . 3 . 1291 . 1 1 15 ARG HD3 H 9.248 7.056 0.624 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HD3 . . . . . . . . . c30643_6pv2 1 . 3 . 1292 . 1 1 15 ARG HE H 10.673 7.798 -1.268 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HE . . . . . . . . . c30643_6pv2 1 . 3 . 1293 . 1 1 15 ARG HG2 H 8.474 6.639 -1.685 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HG2 . . . . . . . . . c30643_6pv2 1 . 3 . 1294 . 1 1 15 ARG HG3 H 7.663 8.204 -1.670 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HG3 . . . . . . . . . c30643_6pv2 1 . 3 . 1295 . 1 1 15 ARG HH11 H 9.219 10.172 0.853 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HH11 . . . . . . . . . c30643_6pv2 1 . 3 . 1296 . 1 1 15 ARG HH12 H 10.450 11.358 0.570 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HH12 . . . . . . . . . c30643_6pv2 1 . 3 . 1297 . 1 1 15 ARG HH21 H 12.290 9.356 -1.641 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HH21 . . . . . . . . . c30643_6pv2 1 . 3 . 1298 . 1 1 15 ARG HH22 H 12.194 10.895 -0.851 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HH22 . . . . . . . . . c30643_6pv2 1 . 3 . 1299 . 1 1 15 ARG N N 7.635 4.438 -0.487 . . . 1.0 . . . . . . . . . . . . A . 15 ARG N . . . . . . . . . c30643_6pv2 1 . 3 . 1300 . 1 1 15 ARG NE N 10.196 8.395 -0.650 . . . 1.0 . . . . . . . . . . . . A . 15 ARG NE . . . . . . . . . c30643_6pv2 1 . 3 . 1301 . 1 1 15 ARG NH1 N 10.071 10.446 0.398 . . . 1.0 . . . . . . . . . . . . A . 15 ARG NH1 . . . . . . . . . c30643_6pv2 1 . 3 . 1302 . 1 1 15 ARG NH2 N 11.815 9.983 -1.018 . . . 1.0 . . . . . . . . . . . . A . 15 ARG NH2 . . . . . . . . . c30643_6pv2 1 . 3 . 1303 . 1 1 15 ARG O O 4.954 4.347 0.414 . . . 1.0 . . . . . . . . . . . . A . 15 ARG O . . . . . . . . . c30643_6pv2 1 . 3 . 1304 . 1 1 16 SER C C 3.298 5.343 2.699 . . . 1.0 . . . . . . . . . . . . A . 16 SER C . . . . . . . . . c30643_6pv2 1 . 3 . 1305 . 1 1 16 SER CA C 4.603 4.709 3.160 . . . 1.0 . . . . . . . . . . . . A . 16 SER CA . . . . . . . . . c30643_6pv2 1 . 3 . 1306 . 1 1 16 SER CB C 4.829 5.000 4.649 . . . 1.0 . . . . . . . . . . . . A . 16 SER CB . . . . . . . . . c30643_6pv2 1 . 3 . 1307 . 1 1 16 SER H H 6.432 5.711 2.804 . . . 1.0 . . . . . . . . . . . . A . 16 SER H . . . . . . . . . c30643_6pv2 1 . 3 . 1308 . 1 1 16 SER HA H 4.537 3.640 3.021 . . . 1.0 . . . . . . . . . . . . A . 16 SER HA . . . . . . . . . c30643_6pv2 1 . 3 . 1309 . 1 1 16 SER HB2 H 5.766 4.564 4.961 . . . 1.0 . . . . . . . . . . . . A . 16 SER HB2 . . . . . . . . . c30643_6pv2 1 . 3 . 1310 . 1 1 16 SER HB3 H 4.863 6.068 4.805 . . . 1.0 . . . . . . . . . . . . A . 16 SER HB3 . . . . . . . . . c30643_6pv2 1 . 3 . 1311 . 1 1 16 SER HG H 4.133 4.256 6.326 . . . 1.0 . . . . . . . . . . . . A . 16 SER HG . . . . . . . . . c30643_6pv2 1 . 3 . 1312 . 1 1 16 SER N N 5.723 5.192 2.364 . . . 1.0 . . . . . . . . . . . . A . 16 SER N . . . . . . . . . c30643_6pv2 1 . 3 . 1313 . 1 1 16 SER O O 2.264 4.689 2.681 . . . 1.0 . . . . . . . . . . . . A . 16 SER O . . . . . . . . . c30643_6pv2 1 . 3 . 1314 . 1 1 16 SER OG O 3.789 4.455 5.447 . . . 1.0 . . . . . . . . . . . . A . 16 SER OG . . . . . . . . . c30643_6pv2 1 . 3 . 1315 . 1 1 17 ASP C C 1.668 6.745 0.538 . . . 1.0 . . . . . . . . . . . . A . 17 ASP C . . . . . . . . . c30643_6pv2 1 . 3 . 1316 . 1 1 17 ASP CA C 2.185 7.333 1.847 . . . 1.0 . . . . . . . . . . . . A . 17 ASP CA . . . . . . . . . c30643_6pv2 1 . 3 . 1317 . 1 1 17 ASP CB C 2.500 8.826 1.693 . . . 1.0 . . . . . . . . . . . . A . 17 ASP CB . . . . . . . . . c30643_6pv2 1 . 3 . 1318 . 1 1 17 ASP CG C 3.769 9.097 0.907 . . . 1.0 . . . . . . . . . . . . A . 17 ASP CG . . . . . . . . . c30643_6pv2 1 . 3 . 1319 . 1 1 17 ASP H H 4.224 7.078 2.344 . . . 1.0 . . . . . . . . . . . . A . 17 ASP H . . . . . . . . . c30643_6pv2 1 . 3 . 1320 . 1 1 17 ASP HA H 1.416 7.218 2.595 . . . 1.0 . . . . . . . . . . . . A . 17 ASP HA . . . . . . . . . c30643_6pv2 1 . 3 . 1321 . 1 1 17 ASP HB2 H 1.681 9.303 1.181 . . . 1.0 . . . . . . . . . . . . A . 17 ASP HB2 . . . . . . . . . c30643_6pv2 1 . 3 . 1322 . 1 1 17 ASP HB3 H 2.606 9.265 2.673 . . . 1.0 . . . . . . . . . . . . A . 17 ASP HB3 . . . . . . . . . c30643_6pv2 1 . 3 . 1323 . 1 1 17 ASP N N 3.361 6.610 2.315 . . . 1.0 . . . . . . . . . . . . A . 17 ASP N . . . . . . . . . c30643_6pv2 1 . 3 . 1324 . 1 1 17 ASP O O 0.459 6.699 0.304 . . . 1.0 . . . . . . . . . . . . A . 17 ASP O . . . . . . . . . c30643_6pv2 1 . 3 . 1325 . 1 1 17 ASP OD1 O 3.676 9.668 -0.203 . . . 1.0 . . . . . . . . . . . . A . 17 ASP OD1 . . . . . . . . . c30643_6pv2 1 . 3 . 1326 . 1 1 17 ASP OD2 O 4.860 8.718 1.378 . . . 1.0 . . . . . . . . . . . . A . 17 ASP OD2 . . . . . . . . . c30643_6pv2 1 . 3 . 1327 . 1 1 18 GLU C C 1.473 4.284 -1.174 . . . 1.0 . . . . . . . . . . . . A . 18 GLU C . . . . . . . . . c30643_6pv2 1 . 3 . 1328 . 1 1 18 GLU CA C 2.212 5.569 -1.519 . . . 1.0 . . . . . . . . . . . . A . 18 GLU CA . . . . . . . . . c30643_6pv2 1 . 3 . 1329 . 1 1 18 GLU CB C 3.450 5.239 -2.355 . . . 1.0 . . . . . . . . . . . . A . 18 GLU CB . . . . . . . . . c30643_6pv2 1 . 3 . 1330 . 1 1 18 GLU CD C 3.315 7.199 -3.940 . . . 1.0 . . . . . . . . . . . . A . 18 GLU CD . . . . . . . . . c30643_6pv2 1 . 3 . 1331 . 1 1 18 GLU CG C 4.157 6.452 -2.928 . . . 1.0 . . . . . . . . . . . . A . 18 GLU CG . . . . . . . . . c30643_6pv2 1 . 3 . 1332 . 1 1 18 GLU H H 3.531 6.389 -0.084 . . . 1.0 . . . . . . . . . . . . A . 18 GLU H . . . . . . . . . c30643_6pv2 1 . 3 . 1333 . 1 1 18 GLU HA H 1.557 6.210 -2.088 . . . 1.0 . . . . . . . . . . . . A . 18 GLU HA . . . . . . . . . c30643_6pv2 1 . 3 . 1334 . 1 1 18 GLU HB2 H 4.154 4.706 -1.735 . . . 1.0 . . . . . . . . . . . . A . 18 GLU HB2 . . . . . . . . . c30643_6pv2 1 . 3 . 1335 . 1 1 18 GLU HB3 H 3.153 4.603 -3.174 . . . 1.0 . . . . . . . . . . . . A . 18 GLU HB3 . . . . . . . . . c30643_6pv2 1 . 3 . 1336 . 1 1 18 GLU HG2 H 4.397 7.128 -2.119 . . . 1.0 . . . . . . . . . . . . A . 18 GLU HG2 . . . . . . . . . c30643_6pv2 1 . 3 . 1337 . 1 1 18 GLU HG3 H 5.068 6.125 -3.407 . . . 1.0 . . . . . . . . . . . . A . 18 GLU HG3 . . . . . . . . . c30643_6pv2 1 . 3 . 1338 . 1 1 18 GLU N N 2.584 6.269 -0.297 . . . 1.0 . . . . . . . . . . . . A . 18 GLU N . . . . . . . . . c30643_6pv2 1 . 3 . 1339 . 1 1 18 GLU O O 0.406 3.998 -1.724 . . . 1.0 . . . . . . . . . . . . A . 18 GLU O . . . . . . . . . c30643_6pv2 1 . 3 . 1340 . 1 1 18 GLU OE1 O 2.928 8.350 -3.667 . . . 1.0 . . . . . . . . . . . . A . 18 GLU OE1 . . . . . . . . . c30643_6pv2 1 . 3 . 1341 . 1 1 18 GLU OE2 O 3.031 6.633 -5.015 . . . 1.0 . . . . . . . . . . . . A . 18 GLU OE2 . . . . . . . . . c30643_6pv2 1 . 3 . 1342 . 1 1 19 LEU C C 0.087 2.508 0.851 . . . 1.0 . . . . . . . . . . . . A . 19 LEU C . . . . . . . . . c30643_6pv2 1 . 3 . 1343 . 1 1 19 LEU CA C 1.436 2.270 0.188 . . . 1.0 . . . . . . . . . . . . A . 19 LEU CA . . . . . . . . . c30643_6pv2 1 . 3 . 1344 . 1 1 19 LEU CB C 2.358 1.520 1.151 . . . 1.0 . . . . . . . . . . . . A . 19 LEU CB . . . . . . . . . c30643_6pv2 1 . 3 . 1345 . 1 1 19 LEU CD1 C 1.337 -0.741 0.734 . . . 1.0 . . . . . . . . . . . . A . 19 LEU CD1 . . . . . . . . . c30643_6pv2 1 . 3 . 1346 . 1 1 19 LEU CD2 C 2.692 -0.350 2.797 . . . 1.0 . . . . . . . . . . . . A . 19 LEU CD2 . . . . . . . . . c30643_6pv2 1 . 3 . 1347 . 1 1 19 LEU CG C 1.735 0.275 1.795 . . . 1.0 . . . . . . . . . . . . A . 19 LEU CG . . . . . . . . . c30643_6pv2 1 . 3 . 1348 . 1 1 19 LEU H H 2.884 3.816 0.168 . . . 1.0 . . . . . . . . . . . . A . 19 LEU H . . . . . . . . . c30643_6pv2 1 . 3 . 1349 . 1 1 19 LEU HA H 1.283 1.664 -0.692 . . . 1.0 . . . . . . . . . . . . A . 19 LEU HA . . . . . . . . . c30643_6pv2 1 . 3 . 1350 . 1 1 19 LEU HB2 H 3.245 1.221 0.611 . . . 1.0 . . . . . . . . . . . . A . 19 LEU HB2 . . . . . . . . . c30643_6pv2 1 . 3 . 1351 . 1 1 19 LEU HB3 H 2.647 2.197 1.938 . . . 1.0 . . . . . . . . . . . . A . 19 LEU HB3 . . . . . . . . . c30643_6pv2 1 . 3 . 1352 . 1 1 19 LEU HD11 H 2.218 -1.069 0.200 . . . 1.0 . . . . . . . . . . . . A . 19 LEU HD11 . . . . . . . . . c30643_6pv2 1 . 3 . 1353 . 1 1 19 LEU HD12 H 0.645 -0.288 0.041 . . . 1.0 . . . . . . . . . . . . A . 19 LEU HD12 . . . . . . . . . c30643_6pv2 1 . 3 . 1354 . 1 1 19 LEU HD13 H 0.866 -1.589 1.207 . . . 1.0 . . . . . . . . . . . . A . 19 LEU HD13 . . . . . . . . . c30643_6pv2 1 . 3 . 1355 . 1 1 19 LEU HD21 H 3.034 0.407 3.489 . . . 1.0 . . . . . . . . . . . . A . 19 LEU HD21 . . . . . . . . . c30643_6pv2 1 . 3 . 1356 . 1 1 19 LEU HD22 H 3.539 -0.770 2.273 . . . 1.0 . . . . . . . . . . . . A . 19 LEU HD22 . . . . . . . . . c30643_6pv2 1 . 3 . 1357 . 1 1 19 LEU HD23 H 2.183 -1.131 3.340 . . . 1.0 . . . . . . . . . . . . A . 19 LEU HD23 . . . . . . . . . c30643_6pv2 1 . 3 . 1358 . 1 1 19 LEU HG H 0.838 0.567 2.327 . . . 1.0 . . . . . . . . . . . . A . 19 LEU HG . . . . . . . . . c30643_6pv2 1 . 3 . 1359 . 1 1 19 LEU N N 2.038 3.524 -0.241 . . . 1.0 . . . . . . . . . . . . A . 19 LEU N . . . . . . . . . c30643_6pv2 1 . 3 . 1360 . 1 1 19 LEU O O -0.844 1.742 0.650 . . . 1.0 . . . . . . . . . . . . A . 19 LEU O . . . . . . . . . c30643_6pv2 1 . 3 . 1361 . 1 1 20 GLN C C -2.352 4.209 1.307 . . . 1.0 . . . . . . . . . . . . A . 20 GLN C . . . . . . . . . c30643_6pv2 1 . 3 . 1362 . 1 1 20 GLN CA C -1.260 3.897 2.320 . . . 1.0 . . . . . . . . . . . . A . 20 GLN CA . . . . . . . . . c30643_6pv2 1 . 3 . 1363 . 1 1 20 GLN CB C -1.063 5.080 3.267 . . . 1.0 . . . . . . . . . . . . A . 20 GLN CB . . . . . . . . . c30643_6pv2 1 . 3 . 1364 . 1 1 20 GLN CD C 0.119 5.981 5.313 . . . 1.0 . . . . . . . . . . . . A . 20 GLN CD . . . . . . . . . c30643_6pv2 1 . 3 . 1365 . 1 1 20 GLN CG C -0.143 4.773 4.440 . . . 1.0 . . . . . . . . . . . . A . 20 GLN CG . . . . . . . . . c30643_6pv2 1 . 3 . 1366 . 1 1 20 GLN H H 0.775 4.137 1.779 . . . 1.0 . . . . . . . . . . . . A . 20 GLN H . . . . . . . . . c30643_6pv2 1 . 3 . 1367 . 1 1 20 GLN HA H -1.559 3.034 2.895 . . . 1.0 . . . . . . . . . . . . A . 20 GLN HA . . . . . . . . . c30643_6pv2 1 . 3 . 1368 . 1 1 20 GLN HB2 H -0.640 5.904 2.713 . . . 1.0 . . . . . . . . . . . . A . 20 GLN HB2 . . . . . . . . . c30643_6pv2 1 . 3 . 1369 . 1 1 20 GLN HB3 H -2.023 5.376 3.659 . . . 1.0 . . . . . . . . . . . . A . 20 GLN HB3 . . . . . . . . . c30643_6pv2 1 . 3 . 1370 . 1 1 20 GLN HE21 H 1.948 5.321 5.713 . . . 1.0 . . . . . . . . . . . . A . 20 GLN HE21 . . . . . . . . . c30643_6pv2 1 . 3 . 1371 . 1 1 20 GLN HE22 H 1.505 6.815 6.462 . . . 1.0 . . . . . . . . . . . . A . 20 GLN HE22 . . . . . . . . . c30643_6pv2 1 . 3 . 1372 . 1 1 20 GLN HG2 H -0.598 4.006 5.045 . . . 1.0 . . . . . . . . . . . . A . 20 GLN HG2 . . . . . . . . . c30643_6pv2 1 . 3 . 1373 . 1 1 20 GLN HG3 H 0.801 4.414 4.056 . . . 1.0 . . . . . . . . . . . . A . 20 GLN HG3 . . . . . . . . . c30643_6pv2 1 . 3 . 1374 . 1 1 20 GLN N N -0.013 3.566 1.642 . . . 1.0 . . . . . . . . . . . . A . 20 GLN N . . . . . . . . . c30643_6pv2 1 . 3 . 1375 . 1 1 20 GLN NE2 N 1.308 6.047 5.886 . . . 1.0 . . . . . . . . . . . . A . 20 GLN NE2 . . . . . . . . . c30643_6pv2 1 . 3 . 1376 . 1 1 20 GLN O O -3.485 3.733 1.429 . . . 1.0 . . . . . . . . . . . . A . 20 GLN O . . . . . . . . . c30643_6pv2 1 . 3 . 1377 . 1 1 20 GLN OE1 O -0.736 6.857 5.459 . . . 1.0 . . . . . . . . . . . . A . 20 GLN OE1 . . . . . . . . . c30643_6pv2 1 . 3 . 1378 . 1 1 21 ARG C C -3.380 4.031 -1.470 . . . 1.0 . . . . . . . . . . . . A . 21 ARG C . . . . . . . . . c30643_6pv2 1 . 3 . 1379 . 1 1 21 ARG CA C -2.940 5.312 -0.773 . . . 1.0 . . . . . . . . . . . . A . 21 ARG CA . . . . . . . . . c30643_6pv2 1 . 3 . 1380 . 1 1 21 ARG CB C -2.304 6.263 -1.786 . . . 1.0 . . . . . . . . . . . . A . 21 ARG CB . . . . . . . . . c30643_6pv2 1 . 3 . 1381 . 1 1 21 ARG CD C -2.588 7.684 -3.836 . . . 1.0 . . . . . . . . . . . . A . 21 ARG CD . . . . . . . . . c30643_6pv2 1 . 3 . 1382 . 1 1 21 ARG CG C -3.290 6.816 -2.803 . . . 1.0 . . . . . . . . . . . . A . 21 ARG CG . . . . . . . . . c30643_6pv2 1 . 3 . 1383 . 1 1 21 ARG CZ C -0.342 7.056 -4.654 . . . 1.0 . . . . . . . . . . . . A . 21 ARG CZ . . . . . . . . . c30643_6pv2 1 . 3 . 1384 . 1 1 21 ARG H H -1.093 5.378 0.271 . . . 1.0 . . . . . . . . . . . . A . 21 ARG H . . . . . . . . . c30643_6pv2 1 . 3 . 1385 . 1 1 21 ARG HA H -3.802 5.788 -0.334 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HA . . . . . . . . . c30643_6pv2 1 . 3 . 1386 . 1 1 21 ARG HB2 H -1.858 7.090 -1.258 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HB2 . . . . . . . . . c30643_6pv2 1 . 3 . 1387 . 1 1 21 ARG HB3 H -1.531 5.733 -2.321 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HB3 . . . . . . . . . c30643_6pv2 1 . 3 . 1388 . 1 1 21 ARG HD2 H -3.332 8.139 -4.472 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HD2 . . . . . . . . . c30643_6pv2 1 . 3 . 1389 . 1 1 21 ARG HD3 H -2.034 8.456 -3.325 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HD3 . . . . . . . . . c30643_6pv2 1 . 3 . 1390 . 1 1 21 ARG HE H -2.065 6.236 -5.269 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HE . . . . . . . . . c30643_6pv2 1 . 3 . 1391 . 1 1 21 ARG HG2 H -3.774 5.992 -3.306 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HG2 . . . . . . . . . c30643_6pv2 1 . 3 . 1392 . 1 1 21 ARG HG3 H -4.028 7.411 -2.287 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HG3 . . . . . . . . . c30643_6pv2 1 . 3 . 1393 . 1 1 21 ARG HH11 H -0.338 8.495 -3.227 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HH11 . . . . . . . . . c30643_6pv2 1 . 3 . 1394 . 1 1 21 ARG HH12 H 1.228 8.050 -3.835 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HH12 . . . . . . . . . c30643_6pv2 1 . 3 . 1395 . 1 1 21 ARG HH21 H -0.002 5.640 -6.063 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HH21 . . . . . . . . . c30643_6pv2 1 . 3 . 1396 . 1 1 21 ARG HH22 H 1.422 6.426 -5.438 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HH22 . . . . . . . . . c30643_6pv2 1 . 3 . 1397 . 1 1 21 ARG N N -2.003 4.996 0.295 . . . 1.0 . . . . . . . . . . . . A . 21 ARG N . . . . . . . . . c30643_6pv2 1 . 3 . 1398 . 1 1 21 ARG NE N -1.667 6.905 -4.664 . . . 1.0 . . . . . . . . . . . . A . 21 ARG NE . . . . . . . . . c30643_6pv2 1 . 3 . 1399 . 1 1 21 ARG NH1 N 0.225 7.937 -3.841 . . . 1.0 . . . . . . . . . . . . A . 21 ARG NH1 . . . . . . . . . c30643_6pv2 1 . 3 . 1400 . 1 1 21 ARG NH2 N 0.416 6.317 -5.449 . . . 1.0 . . . . . . . . . . . . A . 21 ARG NH2 . . . . . . . . . c30643_6pv2 1 . 3 . 1401 . 1 1 21 ARG O O -4.574 3.796 -1.672 . . . 1.0 . . . . . . . . . . . . A . 21 ARG O . . . . . . . . . c30643_6pv2 1 . 3 . 1402 . 1 1 22 HIS C C -3.554 1.046 -1.549 . . . 1.0 . . . . . . . . . . . . A . 22 HIS C . . . . . . . . . c30643_6pv2 1 . 3 . 1403 . 1 1 22 HIS CA C -2.674 1.915 -2.445 . . . 1.0 . . . . . . . . . . . . A . 22 HIS CA . . . . . . . . . c30643_6pv2 1 . 3 . 1404 . 1 1 22 HIS CB C -1.366 1.176 -2.756 . . . 1.0 . . . . . . . . . . . . A . 22 HIS CB . . . . . . . . . c30643_6pv2 1 . 3 . 1405 . 1 1 22 HIS CD2 C -1.818 -1.350 -2.475 . . . 1.0 . . . . . . . . . . . . A . 22 HIS CD2 . . . . . . . . . c30643_6pv2 1 . 3 . 1406 . 1 1 22 HIS CE1 C -2.076 -1.900 -4.563 . . . 1.0 . . . . . . . . . . . . A . 22 HIS CE1 . . . . . . . . . c30643_6pv2 1 . 3 . 1407 . 1 1 22 HIS CG C -1.599 -0.229 -3.210 . . . 1.0 . . . . . . . . . . . . A . 22 HIS CG . . . . . . . . . c30643_6pv2 1 . 3 . 1408 . 1 1 22 HIS H H -1.469 3.447 -1.633 . . . 1.0 . . . . . . . . . . . . A . 22 HIS H . . . . . . . . . c30643_6pv2 1 . 3 . 1409 . 1 1 22 HIS HA H -3.198 2.108 -3.369 . . . 1.0 . . . . . . . . . . . . A . 22 HIS HA . . . . . . . . . c30643_6pv2 1 . 3 . 1410 . 1 1 22 HIS HB2 H -0.836 1.700 -3.537 . . . 1.0 . . . . . . . . . . . . A . 22 HIS HB2 . . . . . . . . . c30643_6pv2 1 . 3 . 1411 . 1 1 22 HIS HB3 H -0.754 1.144 -1.866 . . . 1.0 . . . . . . . . . . . . A . 22 HIS HB3 . . . . . . . . . c30643_6pv2 1 . 3 . 1412 . 1 1 22 HIS HD1 H -1.651 -0.008 -5.319 . . . 1.0 . . . . . . . . . . . . A . 22 HIS HD1 . . . . . . . . . c30643_6pv2 1 . 3 . 1413 . 1 1 22 HIS HD2 H -1.744 -1.443 -1.400 . . . 1.0 . . . . . . . . . . . . A . 22 HIS HD2 . . . . . . . . . c30643_6pv2 1 . 3 . 1414 . 1 1 22 HIS HE1 H -2.266 -2.475 -5.456 . . . 1.0 . . . . . . . . . . . . A . 22 HIS HE1 . . . . . . . . . c30643_6pv2 1 . 3 . 1415 . 1 1 22 HIS N N -2.403 3.194 -1.812 . . . 1.0 . . . . . . . . . . . . A . 22 HIS N . . . . . . . . . c30643_6pv2 1 . 3 . 1416 . 1 1 22 HIS ND1 N -1.751 -0.599 -4.539 . . . 1.0 . . . . . . . . . . . . A . 22 HIS ND1 . . . . . . . . . c30643_6pv2 1 . 3 . 1417 . 1 1 22 HIS NE2 N -2.124 -2.368 -3.344 . . . 1.0 . . . . . . . . . . . . A . 22 HIS NE2 . . . . . . . . . c30643_6pv2 1 . 3 . 1418 . 1 1 22 HIS O O -4.511 0.433 -2.008 . . . 1.0 . . . . . . . . . . . . A . 22 HIS O . . . . . . . . . c30643_6pv2 1 . 3 . 1419 . 1 1 23 LYS C C -5.396 0.537 0.717 . . . 1.0 . . . . . . . . . . . . A . 23 LYS C . . . . . . . . . c30643_6pv2 1 . 3 . 1420 . 1 1 23 LYS CA C -3.913 0.194 0.709 . . . 1.0 . . . . . . . . . . . . A . 23 LYS CA . . . . . . . . . c30643_6pv2 1 . 3 . 1421 . 1 1 23 LYS CB C -3.297 0.439 2.089 . . . 1.0 . . . . . . . . . . . . A . 23 LYS CB . . . . . . . . . c30643_6pv2 1 . 3 . 1422 . 1 1 23 LYS CD C -3.668 -1.867 3.030 . . . 1.0 . . . . . . . . . . . . A . 23 LYS CD . . . . . . . . . c30643_6pv2 1 . 3 . 1423 . 1 1 23 LYS CE C -3.767 -2.613 4.350 . . . 1.0 . . . . . . . . . . . . A . 23 LYS CE . . . . . . . . . c30643_6pv2 1 . 3 . 1424 . 1 1 23 LYS CG C -3.896 -0.378 3.220 . . . 1.0 . . . . . . . . . . . . A . 23 LYS CG . . . . . . . . . c30643_6pv2 1 . 3 . 1425 . 1 1 23 LYS H H -2.426 1.520 0.016 . . . 1.0 . . . . . . . . . . . . A . 23 LYS H . . . . . . . . . c30643_6pv2 1 . 3 . 1426 . 1 1 23 LYS HA H -3.794 -0.845 0.444 . . . 1.0 . . . . . . . . . . . . A . 23 LYS HA . . . . . . . . . c30643_6pv2 1 . 3 . 1427 . 1 1 23 LYS HB2 H -2.243 0.212 2.038 . . . 1.0 . . . . . . . . . . . . A . 23 LYS HB2 . . . . . . . . . c30643_6pv2 1 . 3 . 1428 . 1 1 23 LYS HB3 H -3.414 1.486 2.334 . . . 1.0 . . . . . . . . . . . . A . 23 LYS HB3 . . . . . . . . . c30643_6pv2 1 . 3 . 1429 . 1 1 23 LYS HD2 H -4.415 -2.253 2.353 . . . 1.0 . . . . . . . . . . . . A . 23 LYS HD2 . . . . . . . . . c30643_6pv2 1 . 3 . 1430 . 1 1 23 LYS HD3 H -2.684 -2.022 2.611 . . . 1.0 . . . . . . . . . . . . A . 23 LYS HD3 . . . . . . . . . c30643_6pv2 1 . 3 . 1431 . 1 1 23 LYS HE2 H -3.746 -3.672 4.150 . . . 1.0 . . . . . . . . . . . . A . 23 LYS HE2 . . . . . . . . . c30643_6pv2 1 . 3 . 1432 . 1 1 23 LYS HE3 H -2.915 -2.347 4.962 . . . 1.0 . . . . . . . . . . . . A . 23 LYS HE3 . . . . . . . . . c30643_6pv2 1 . 3 . 1433 . 1 1 23 LYS HG2 H -3.443 -0.074 4.150 . . . 1.0 . . . . . . . . . . . . A . 23 LYS HG2 . . . . . . . . . c30643_6pv2 1 . 3 . 1434 . 1 1 23 LYS HG3 H -4.959 -0.191 3.256 . . . 1.0 . . . . . . . . . . . . A . 23 LYS HG3 . . . . . . . . . c30643_6pv2 1 . 3 . 1435 . 1 1 23 LYS HZ1 H -5.852 -2.501 4.510 . . . 1.0 . . . . . . . . . . . . A . 23 LYS HZ1 . . . . . . . . . c30643_6pv2 1 . 3 . 1436 . 1 1 23 LYS HZ2 H -5.033 -1.280 5.346 . . . 1.0 . . . . . . . . . . . . A . 23 LYS HZ2 . . . . . . . . . c30643_6pv2 1 . 3 . 1437 . 1 1 23 LYS HZ3 H -5.065 -2.853 5.968 . . . 1.0 . . . . . . . . . . . . A . 23 LYS HZ3 . . . . . . . . . c30643_6pv2 1 . 3 . 1438 . 1 1 23 LYS N N -3.205 0.997 -0.276 . . . 1.0 . . . . . . . . . . . . A . 23 LYS N . . . . . . . . . c30643_6pv2 1 . 3 . 1439 . 1 1 23 LYS NZ N -5.015 -2.288 5.094 . . . 1.0 . . . . . . . . . . . . A . 23 LYS NZ . . . . . . . . . c30643_6pv2 1 . 3 . 1440 . 1 1 23 LYS O O -6.247 -0.331 0.921 . . . 1.0 . . . . . . . . . . . . A . 23 LYS O . . . . . . . . . c30643_6pv2 1 . 3 . 1441 . 1 1 24 ARG C C -7.868 1.782 -0.756 . . . 1.0 . . . . . . . . . . . . A . 24 ARG C . . . . . . . . . c30643_6pv2 1 . 3 . 1442 . 1 1 24 ARG CA C -7.074 2.276 0.459 . . . 1.0 . . . . . . . . . . . . A . 24 ARG CA . . . . . . . . . c30643_6pv2 1 . 3 . 1443 . 1 1 24 ARG CB C -7.101 3.802 0.549 . . . 1.0 . . . . . . . . . . . . A . 24 ARG CB . . . . . . . . . c30643_6pv2 1 . 3 . 1444 . 1 1 24 ARG CD C -6.578 5.840 1.935 . . . 1.0 . . . . . . . . . . . . A . 24 ARG CD . . . . . . . . . c30643_6pv2 1 . 3 . 1445 . 1 1 24 ARG CG C -6.624 4.322 1.896 . . . 1.0 . . . . . . . . . . . . A . 24 ARG CG . . . . . . . . . c30643_6pv2 1 . 3 . 1446 . 1 1 24 ARG CZ C -5.756 7.566 3.501 . . . 1.0 . . . . . . . . . . . . A . 24 ARG CZ . . . . . . . . . c30643_6pv2 1 . 3 . 1447 . 1 1 24 ARG H H -4.975 2.433 0.218 . . . 1.0 . . . . . . . . . . . . A . 24 ARG H . . . . . . . . . c30643_6pv2 1 . 3 . 1448 . 1 1 24 ARG HA H -7.537 1.874 1.347 . . . 1.0 . . . . . . . . . . . . A . 24 ARG HA . . . . . . . . . c30643_6pv2 1 . 3 . 1449 . 1 1 24 ARG HB2 H -6.462 4.211 -0.220 . . . 1.0 . . . . . . . . . . . . A . 24 ARG HB2 . . . . . . . . . c30643_6pv2 1 . 3 . 1450 . 1 1 24 ARG HB3 H -8.111 4.147 0.390 . . . 1.0 . . . . . . . . . . . . A . 24 ARG HB3 . . . . . . . . . c30643_6pv2 1 . 3 . 1451 . 1 1 24 ARG HD2 H -5.856 6.187 1.211 . . . 1.0 . . . . . . . . . . . . A . 24 ARG HD2 . . . . . . . . . c30643_6pv2 1 . 3 . 1452 . 1 1 24 ARG HD3 H -7.554 6.224 1.682 . . . 1.0 . . . . . . . . . . . . A . 24 ARG HD3 . . . . . . . . . c30643_6pv2 1 . 3 . 1453 . 1 1 24 ARG HE H -6.299 5.710 4.015 . . . 1.0 . . . . . . . . . . . . A . 24 ARG HE . . . . . . . . . c30643_6pv2 1 . 3 . 1454 . 1 1 24 ARG HG2 H -7.299 3.973 2.664 . . . 1.0 . . . . . . . . . . . . A . 24 ARG HG2 . . . . . . . . . c30643_6pv2 1 . 3 . 1455 . 1 1 24 ARG HG3 H -5.633 3.937 2.087 . . . 1.0 . . . . . . . . . . . . A . 24 ARG HG3 . . . . . . . . . c30643_6pv2 1 . 3 . 1456 . 1 1 24 ARG HH11 H -5.263 9.355 2.690 . . . 1.0 . . . . . . . . . . . . A . 24 ARG HH11 . . . . . . . . . c30643_6pv2 1 . 3 . 1457 . 1 1 24 ARG HH12 H -5.819 8.158 1.565 . . . 1.0 . . . . . . . . . . . . A . 24 ARG HH12 . . . . . . . . . c30643_6pv2 1 . 3 . 1458 . 1 1 24 ARG HH21 H -5.132 8.865 4.924 . . . 1.0 . . . . . . . . . . . . A . 24 ARG HH21 . . . . . . . . . c30643_6pv2 1 . 3 . 1459 . 1 1 24 ARG HH22 H -5.592 7.295 5.506 . . . 1.0 . . . . . . . . . . . . A . 24 ARG HH22 . . . . . . . . . c30643_6pv2 1 . 3 . 1460 . 1 1 24 ARG N N -5.700 1.800 0.441 . . . 1.0 . . . . . . . . . . . . A . 24 ARG N . . . . . . . . . c30643_6pv2 1 . 3 . 1461 . 1 1 24 ARG NE N -6.200 6.335 3.260 . . . 1.0 . . . . . . . . . . . . A . 24 ARG NE . . . . . . . . . c30643_6pv2 1 . 3 . 1462 . 1 1 24 ARG NH1 N -5.599 8.428 2.505 . . . 1.0 . . . . . . . . . . . . A . 24 ARG NH1 . . . . . . . . . c30643_6pv2 1 . 3 . 1463 . 1 1 24 ARG NH2 N -5.468 7.938 4.743 . . . 1.0 . . . . . . . . . . . . A . 24 ARG NH2 . . . . . . . . . c30643_6pv2 1 . 3 . 1464 . 1 1 24 ARG O O -9.049 2.104 -0.899 . . . 1.0 . . . . . . . . . . . . A . 24 ARG O . . . . . . . . . c30643_6pv2 1 . 3 . 1465 . 1 1 25 THR C C -8.629 -0.905 -2.181 . . . 1.0 . . . . . . . . . . . . A . 25 THR C . . . . . . . . . c30643_6pv2 1 . 3 . 1466 . 1 1 25 THR CA C -7.948 0.347 -2.714 . . . 1.0 . . . . . . . . . . . . A . 25 THR CA . . . . . . . . . c30643_6pv2 1 . 3 . 1467 . 1 1 25 THR CB C -7.034 -0.053 -3.895 . . . 1.0 . . . . . . . . . . . . A . 25 THR CB . . . . . . . . . c30643_6pv2 1 . 3 . 1468 . 1 1 25 THR CG2 C -6.298 1.151 -4.459 . . . 1.0 . . . . . . . . . . . . A . 25 THR CG2 . . . . . . . . . c30643_6pv2 1 . 3 . 1469 . 1 1 25 THR H H -6.258 0.874 -1.545 . . . 1.0 . . . . . . . . . . . . A . 25 THR H . . . . . . . . . c30643_6pv2 1 . 3 . 1470 . 1 1 25 THR HA H -8.701 1.030 -3.077 . . . 1.0 . . . . . . . . . . . . A . 25 THR HA . . . . . . . . . c30643_6pv2 1 . 3 . 1471 . 1 1 25 THR HB H -7.652 -0.472 -4.676 . . . 1.0 . . . . . . . . . . . . A . 25 THR HB . . . . . . . . . c30643_6pv2 1 . 3 . 1472 . 1 1 25 THR HG1 H -5.307 -0.604 -3.099 . . . 1.0 . . . . . . . . . . . . A . 25 THR HG1 . . . . . . . . . c30643_6pv2 1 . 3 . 1473 . 1 1 25 THR HG21 H -7.014 1.862 -4.841 . . . 1.0 . . . . . . . . . . . . A . 25 THR HG21 . . . . . . . . . c30643_6pv2 1 . 3 . 1474 . 1 1 25 THR HG22 H -5.645 0.831 -5.258 . . . 1.0 . . . . . . . . . . . . A . 25 THR HG22 . . . . . . . . . c30643_6pv2 1 . 3 . 1475 . 1 1 25 THR HG23 H -5.712 1.611 -3.678 . . . 1.0 . . . . . . . . . . . . A . 25 THR HG23 . . . . . . . . . c30643_6pv2 1 . 3 . 1476 . 1 1 25 THR N N -7.229 1.003 -1.630 . . . 1.0 . . . . . . . . . . . . A . 25 THR N . . . . . . . . . c30643_6pv2 1 . 3 . 1477 . 1 1 25 THR O O -9.693 -1.305 -2.658 . . . 1.0 . . . . . . . . . . . . A . 25 THR O . . . . . . . . . c30643_6pv2 1 . 3 . 1478 . 1 1 25 THR OG1 O -6.083 -1.042 -3.481 . . . 1.0 . . . . . . . . . . . . A . 25 THR OG1 . . . . . . . . . c30643_6pv2 1 . 3 . 1479 . 1 1 26 HIS C C -9.333 -2.334 0.679 . . . 1.0 . . . . . . . . . . . . A . 26 HIS C . . . . . . . . . c30643_6pv2 1 . 3 . 1480 . 1 1 26 HIS CA C -8.545 -2.717 -0.562 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CA . . . . . . . . . c30643_6pv2 1 . 3 . 1481 . 1 1 26 HIS CB C -7.434 -3.688 -0.146 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CB . . . . . . . . . c30643_6pv2 1 . 3 . 1482 . 1 1 26 HIS CD2 C -5.082 -3.714 -1.210 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CD2 . . . . . . . . . c30643_6pv2 1 . 3 . 1483 . 1 1 26 HIS CE1 C -5.484 -4.908 -2.987 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CE1 . . . . . . . . . c30643_6pv2 1 . 3 . 1484 . 1 1 26 HIS CG C -6.410 -3.997 -1.195 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CG . . . . . . . . . c30643_6pv2 1 . 3 . 1485 . 1 1 26 HIS H H -7.149 -1.159 -0.860 . . . 1.0 . . . . . . . . . . . . A . 26 HIS H . . . . . . . . . c30643_6pv2 1 . 3 . 1486 . 1 1 26 HIS HA H -9.200 -3.199 -1.268 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HA . . . . . . . . . c30643_6pv2 1 . 3 . 1487 . 1 1 26 HIS HB2 H -6.908 -3.270 0.699 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HB2 . . . . . . . . . c30643_6pv2 1 . 3 . 1488 . 1 1 26 HIS HB3 H -7.886 -4.622 0.155 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HB3 . . . . . . . . . c30643_6pv2 1 . 3 . 1489 . 1 1 26 HIS HD1 H -7.529 -5.108 -2.622 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HD1 . . . . . . . . . c30643_6pv2 1 . 3 . 1490 . 1 1 26 HIS HD2 H -4.541 -3.132 -0.477 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HD2 . . . . . . . . . c30643_6pv2 1 . 3 . 1491 . 1 1 26 HIS HE1 H -5.350 -5.459 -3.906 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HE1 . . . . . . . . . c30643_6pv2 1 . 3 . 1492 . 1 1 26 HIS N N -8.001 -1.521 -1.184 . . . 1.0 . . . . . . . . . . . . A . 26 HIS N . . . . . . . . . c30643_6pv2 1 . 3 . 1493 . 1 1 26 HIS ND1 N -6.657 -4.751 -2.339 . . . 1.0 . . . . . . . . . . . . A . 26 HIS ND1 . . . . . . . . . c30643_6pv2 1 . 3 . 1494 . 1 1 26 HIS NE2 N -4.534 -4.298 -2.331 . . . 1.0 . . . . . . . . . . . . A . 26 HIS NE2 . . . . . . . . . c30643_6pv2 1 . 3 . 1495 . 1 1 26 HIS O O -10.478 -2.741 0.861 . . . 1.0 . . . . . . . . . . . . A . 26 HIS O . . . . . . . . . c30643_6pv2 1 . 3 . 1496 . 1 1 27 THR C C -9.944 0.210 2.708 . . . 1.0 . . . . . . . . . . . . A . 27 THR C . . . . . . . . . c30643_6pv2 1 . 3 . 1497 . 1 1 27 THR CA C -9.280 -1.161 2.800 . . . 1.0 . . . . . . . . . . . . A . 27 THR CA . . . . . . . . . c30643_6pv2 1 . 3 . 1498 . 1 1 27 THR CB C -8.201 -1.150 3.898 . . . 1.0 . . . . . . . . . . . . A . 27 THR CB . . . . . . . . . c30643_6pv2 1 . 3 . 1499 . 1 1 27 THR CG2 C -8.827 -1.007 5.278 . . . 1.0 . . . . . . . . . . . . A . 27 THR CG2 . . . . . . . . . c30643_6pv2 1 . 3 . 1500 . 1 1 27 THR H H -7.819 -1.188 1.288 . . . 1.0 . . . . . . . . . . . . A . 27 THR H . . . . . . . . . c30643_6pv2 1 . 3 . 1501 . 1 1 27 THR HA H -10.025 -1.899 3.062 . . . 1.0 . . . . . . . . . . . . A . 27 THR HA . . . . . . . . . c30643_6pv2 1 . 3 . 1502 . 1 1 27 THR HB H -7.541 -0.313 3.728 . . . 1.0 . . . . . . . . . . . . A . 27 THR HB . . . . . . . . . c30643_6pv2 1 . 3 . 1503 . 1 1 27 THR HG1 H -8.028 -3.094 3.588 . . . 1.0 . . . . . . . . . . . . A . 27 THR HG1 . . . . . . . . . c30643_6pv2 1 . 3 . 1504 . 1 1 27 THR HG21 H -8.047 -0.952 6.023 . . . 1.0 . . . . . . . . . . . . A . 27 THR HG21 . . . . . . . . . c30643_6pv2 1 . 3 . 1505 . 1 1 27 THR HG22 H -9.453 -1.863 5.478 . . . 1.0 . . . . . . . . . . . . A . 27 THR HG22 . . . . . . . . . c30643_6pv2 1 . 3 . 1506 . 1 1 27 THR HG23 H -9.424 -0.108 5.313 . . . 1.0 . . . . . . . . . . . . A . 27 THR HG23 . . . . . . . . . c30643_6pv2 1 . 3 . 1507 . 1 1 27 THR N N -8.703 -1.540 1.530 . . . 1.0 . . . . . . . . . . . . A . 27 THR N . . . . . . . . . c30643_6pv2 1 . 3 . 1508 . 1 1 27 THR O O -9.332 1.240 3.006 . . . 1.0 . . . . . . . . . . . . A . 27 THR O . . . . . . . . . c30643_6pv2 1 . 3 . 1509 . 1 1 27 THR OG1 O -7.444 -2.370 3.842 . . . 1.0 . . . . . . . . . . . . A . 27 THR OG1 . . . . . . . . . c30643_6pv2 1 . 3 . 1510 . 1 1 28 GLY C C -13.388 1.198 2.628 . . . 1.0 . . . . . . . . . . . . A . 28 GLY C . . . . . . . . . c30643_6pv2 1 . 3 . 1511 . 1 1 28 GLY CA C -11.958 1.433 2.205 . . . 1.0 . . . . . . . . . . . . A . 28 GLY CA . . . . . . . . . c30643_6pv2 1 . 3 . 1512 . 1 1 28 GLY H H -11.598 -0.636 1.996 . . . 1.0 . . . . . . . . . . . . A . 28 GLY H . . . . . . . . . c30643_6pv2 1 . 3 . 1513 . 1 1 28 GLY HA2 H -11.511 2.167 2.859 . . . 1.0 . . . . . . . . . . . . A . 28 GLY HA2 . . . . . . . . . c30643_6pv2 1 . 3 . 1514 . 1 1 28 GLY HA3 H -11.945 1.806 1.192 . . . 1.0 . . . . . . . . . . . . A . 28 GLY HA3 . . . . . . . . . c30643_6pv2 1 . 3 . 1515 . 1 1 28 GLY N N -11.189 0.211 2.272 . . . 1.0 . . . . . . . . . . . . A . 28 GLY N . . . . . . . . . c30643_6pv2 1 . 3 . 1516 . 1 1 28 GLY O O -13.757 1.461 3.774 . . . 1.0 . . . . . . . . . . . . A . 28 GLY O . . . . . . . . . c30643_6pv2 1 . 3 . 1517 . 1 1 29 GLU C C -15.769 -1.164 1.744 . . . 1.0 . . . . . . . . . . . . A . 29 GLU C . . . . . . . . . c30643_6pv2 1 . 3 . 1518 . 1 1 29 GLU CA C -15.562 0.321 2.010 . . . 1.0 . . . . . . . . . . . . A . 29 GLU CA . . . . . . . . . c30643_6pv2 1 . 3 . 1519 . 1 1 29 GLU CB C -16.535 1.144 1.161 . . . 1.0 . . . . . . . . . . . . A . 29 GLU CB . . . . . . . . . c30643_6pv2 1 . 3 . 1520 . 1 1 29 GLU CD C -18.946 1.696 0.643 . . . 1.0 . . . . . . . . . . . . A . 29 GLU CD . . . . . . . . . c30643_6pv2 1 . 3 . 1521 . 1 1 29 GLU CG C -17.993 0.921 1.527 . . . 1.0 . . . . . . . . . . . . A . 29 GLU CG . . . . . . . . . c30643_6pv2 1 . 3 . 1522 . 1 1 29 GLU H H -13.845 0.540 0.805 . . . 1.0 . . . . . . . . . . . . A . 29 GLU H . . . . . . . . . c30643_6pv2 1 . 3 . 1523 . 1 1 29 GLU HA H -15.741 0.521 3.056 . . . 1.0 . . . . . . . . . . . . A . 29 GLU HA . . . . . . . . . c30643_6pv2 1 . 3 . 1524 . 1 1 29 GLU HB2 H -16.307 2.193 1.283 . . . 1.0 . . . . . . . . . . . . A . 29 GLU HB2 . . . . . . . . . c30643_6pv2 1 . 3 . 1525 . 1 1 29 GLU HB3 H -16.404 0.875 0.123 . . . 1.0 . . . . . . . . . . . . A . 29 GLU HB3 . . . . . . . . . c30643_6pv2 1 . 3 . 1526 . 1 1 29 GLU HG2 H -18.216 -0.131 1.432 . . . 1.0 . . . . . . . . . . . . A . 29 GLU HG2 . . . . . . . . . c30643_6pv2 1 . 3 . 1527 . 1 1 29 GLU HG3 H -18.144 1.228 2.552 . . . 1.0 . . . . . . . . . . . . A . 29 GLU HG3 . . . . . . . . . c30643_6pv2 1 . 3 . 1528 . 1 1 29 GLU N N -14.188 0.683 1.711 . . . 1.0 . . . . . . . . . . . . A . 29 GLU N . . . . . . . . . c30643_6pv2 1 . 3 . 1529 . 1 1 29 GLU O O -16.364 -1.878 2.553 . . . 1.0 . . . . . . . . . . . . A . 29 GLU O . . . . . . . . . c30643_6pv2 1 . 3 . 1530 . 1 1 29 GLU OE1 O -19.077 2.922 0.835 . . . 1.0 . . . . . . . . . . . . A . 29 GLU OE1 . . . . . . . . . c30643_6pv2 1 . 3 . 1531 . 1 1 29 GLU OE2 O -19.581 1.078 -0.235 . . . 1.0 . . . . . . . . . . . . A . 29 GLU OE2 . . . . . . . . . c30643_6pv2 1 . 3 . 1532 . 1 1 30 LYS C C -14.214 -3.815 0.746 . . . 1.0 . . . . . . . . . . . . A . 30 LYS C . . . . . . . . . c30643_6pv2 1 . 3 . 1533 . 1 1 30 LYS CA C -15.397 -3.016 0.219 . . . 1.0 . . . . . . . . . . . . A . 30 LYS CA . . . . . . . . . c30643_6pv2 1 . 3 . 1534 . 1 1 30 LYS CB C -15.480 -3.140 -1.307 . . . 1.0 . . . . . . . . . . . . A . 30 LYS CB . . . . . . . . . c30643_6pv2 1 . 3 . 1535 . 1 1 30 LYS CD C -17.912 -2.497 -1.401 . . . 1.0 . . . . . . . . . . . . A . 30 LYS CD . . . . . . . . . c30643_6pv2 1 . 3 . 1536 . 1 1 30 LYS CE C -18.938 -1.561 -2.020 . . . 1.0 . . . . . . . . . . . . A . 30 LYS CE . . . . . . . . . c30643_6pv2 1 . 3 . 1537 . 1 1 30 LYS CG C -16.519 -2.227 -1.943 . . . 1.0 . . . . . . . . . . . . A . 30 LYS CG . . . . . . . . . c30643_6pv2 1 . 3 . 1538 . 1 1 30 LYS H H -14.787 -1.007 0.013 . . . 1.0 . . . . . . . . . . . . A . 30 LYS H . . . . . . . . . c30643_6pv2 1 . 3 . 1539 . 1 1 30 LYS HA H -16.306 -3.400 0.660 . . . 1.0 . . . . . . . . . . . . A . 30 LYS HA . . . . . . . . . c30643_6pv2 1 . 3 . 1540 . 1 1 30 LYS HB2 H -14.516 -2.898 -1.727 . . . 1.0 . . . . . . . . . . . . A . 30 LYS HB2 . . . . . . . . . c30643_6pv2 1 . 3 . 1541 . 1 1 30 LYS HB3 H -15.726 -4.161 -1.560 . . . 1.0 . . . . . . . . . . . . A . 30 LYS HB3 . . . . . . . . . c30643_6pv2 1 . 3 . 1542 . 1 1 30 LYS HD2 H -18.186 -3.517 -1.626 . . . 1.0 . . . . . . . . . . . . A . 30 LYS HD2 . . . . . . . . . c30643_6pv2 1 . 3 . 1543 . 1 1 30 LYS HD3 H -17.906 -2.351 -0.331 . . . 1.0 . . . . . . . . . . . . A . 30 LYS HD3 . . . . . . . . . c30643_6pv2 1 . 3 . 1544 . 1 1 30 LYS HE2 H -19.908 -1.789 -1.607 . . . 1.0 . . . . . . . . . . . . A . 30 LYS HE2 . . . . . . . . . c30643_6pv2 1 . 3 . 1545 . 1 1 30 LYS HE3 H -18.672 -0.544 -1.774 . . . 1.0 . . . . . . . . . . . . A . 30 LYS HE3 . . . . . . . . . c30643_6pv2 1 . 3 . 1546 . 1 1 30 LYS HG2 H -16.257 -1.201 -1.737 . . . 1.0 . . . . . . . . . . . . A . 30 LYS HG2 . . . . . . . . . c30643_6pv2 1 . 3 . 1547 . 1 1 30 LYS HG3 H -16.520 -2.392 -3.011 . . . 1.0 . . . . . . . . . . . . A . 30 LYS HG3 . . . . . . . . . c30643_6pv2 1 . 3 . 1548 . 1 1 30 LYS HZ1 H -18.089 -1.425 -3.923 . . . 1.0 . . . . . . . . . . . . A . 30 LYS HZ1 . . . . . . . . . c30643_6pv2 1 . 3 . 1549 . 1 1 30 LYS HZ2 H -19.747 -1.096 -3.885 . . . 1.0 . . . . . . . . . . . . A . 30 LYS HZ2 . . . . . . . . . c30643_6pv2 1 . 3 . 1550 . 1 1 30 LYS HZ3 H -19.200 -2.689 -3.758 . . . 1.0 . . . . . . . . . . . . A . 30 LYS HZ3 . . . . . . . . . c30643_6pv2 1 . 3 . 1551 . 1 1 30 LYS N N -15.265 -1.623 0.608 . . . 1.0 . . . . . . . . . . . . A . 30 LYS N . . . . . . . . . c30643_6pv2 1 . 3 . 1552 . 1 1 30 LYS NZ N -18.997 -1.702 -3.498 . . . 1.0 . . . . . . . . . . . . A . 30 LYS NZ . . . . . . . . . c30643_6pv2 1 . 3 . 1553 . 1 1 30 LYS O O -14.329 -4.557 1.720 . . . 1.0 . . . . . . . . . . . . A . 30 LYS O . . . . . . . . . c30643_6pv2 1 . 3 . 1554 . 1 1 31 NH2 HN1 H -13.042 -3.033 -0.652 . . . 1.0 . . . . . . . . . . . . A . 31 NH2 HN1 . . . . . . . . . c30643_6pv2 1 . 3 . 1555 . 1 1 31 NH2 HN2 H -12.275 -4.112 0.456 . . . 1.0 . . . . . . . . . . . . A . 31 NH2 HN2 . . . . . . . . . c30643_6pv2 1 . 3 . 1556 . 1 1 31 NH2 N N -13.063 -3.639 0.120 . . . 1.0 . . . . . . . . . . . . A . 31 NH2 N . . . . . . . . . c30643_6pv2 1 . 3 . 1557 . 2 2 1 ZN ZN Zn -2.602 -4.229 -2.827 . . . 1.0 . . . . . . . . . . . . A . 101 ZN ZN . . . . . . . . . c30643_6pv2 1 . 4 . 1558 . 1 1 1 ARG C C 11.797 -1.022 2.556 . . . 1.0 . . . . . . . . . . . . A . 1 ARG C . . . . . . . . . c30643_6pv2 1 . 4 . 1559 . 1 1 1 ARG CA C 13.041 -1.503 3.295 . . . 1.0 . . . . . . . . . . . . A . 1 ARG CA . . . . . . . . . c30643_6pv2 1 . 4 . 1560 . 1 1 1 ARG CB C 12.644 -2.360 4.507 . . . 1.0 . . . . . . . . . . . . A . 1 ARG CB . . . . . . . . . c30643_6pv2 1 . 4 . 1561 . 1 1 1 ARG CD C 11.381 -2.562 6.669 . . . 1.0 . . . . . . . . . . . . A . 1 ARG CD . . . . . . . . . c30643_6pv2 1 . 4 . 1562 . 1 1 1 ARG CG C 11.724 -1.660 5.494 . . . 1.0 . . . . . . . . . . . . A . 1 ARG CG . . . . . . . . . c30643_6pv2 1 . 4 . 1563 . 1 1 1 ARG CZ C 9.902 -2.544 8.643 . . . 1.0 . . . . . . . . . . . . A . 1 ARG CZ . . . . . . . . . c30643_6pv2 1 . 4 . 1564 . 1 1 1 ARG H1 H 14.187 0.183 2.884 . . . 1.0 . . . . . . . . . . . . A . 1 ARG H1 . . . . . . . . . c30643_6pv2 1 . 4 . 1565 . 1 1 1 ARG H2 H 14.677 -0.658 4.267 . . . 1.0 . . . . . . . . . . . . A . 1 ARG H2 . . . . . . . . . c30643_6pv2 1 . 4 . 1566 . 1 1 1 ARG H3 H 13.284 0.298 4.309 . . . 1.0 . . . . . . . . . . . . A . 1 ARG H3 . . . . . . . . . c30643_6pv2 1 . 4 . 1567 . 1 1 1 ARG HA H 13.636 -2.099 2.619 . . . 1.0 . . . . . . . . . . . . A . 1 ARG HA . . . . . . . . . c30643_6pv2 1 . 4 . 1568 . 1 1 1 ARG HB2 H 12.143 -3.248 4.155 . . . 1.0 . . . . . . . . . . . . A . 1 ARG HB2 . . . . . . . . . c30643_6pv2 1 . 4 . 1569 . 1 1 1 ARG HB3 H 13.542 -2.653 5.032 . . . 1.0 . . . . . . . . . . . . A . 1 ARG HB3 . . . . . . . . . c30643_6pv2 1 . 4 . 1570 . 1 1 1 ARG HD2 H 10.959 -3.483 6.293 . . . 1.0 . . . . . . . . . . . . A . 1 ARG HD2 . . . . . . . . . c30643_6pv2 1 . 4 . 1571 . 1 1 1 ARG HD3 H 12.289 -2.779 7.214 . . . 1.0 . . . . . . . . . . . . A . 1 ARG HD3 . . . . . . . . . c30643_6pv2 1 . 4 . 1572 . 1 1 1 ARG HE H 10.151 -1.012 7.380 . . . 1.0 . . . . . . . . . . . . A . 1 ARG HE . . . . . . . . . c30643_6pv2 1 . 4 . 1573 . 1 1 1 ARG HG2 H 12.219 -0.775 5.865 . . . 1.0 . . . . . . . . . . . . A . 1 ARG HG2 . . . . . . . . . c30643_6pv2 1 . 4 . 1574 . 1 1 1 ARG HG3 H 10.813 -1.379 4.986 . . . 1.0 . . . . . . . . . . . . A . 1 ARG HG3 . . . . . . . . . c30643_6pv2 1 . 4 . 1575 . 1 1 1 ARG HH11 H 9.865 -4.249 9.741 . . . 1.0 . . . . . . . . . . . . A . 1 ARG HH11 . . . . . . . . . c30643_6pv2 1 . 4 . 1576 . 1 1 1 ARG HH12 H 10.923 -4.274 8.368 . . . 1.0 . . . . . . . . . . . . A . 1 ARG HH12 . . . . . . . . . c30643_6pv2 1 . 4 . 1577 . 1 1 1 ARG HH21 H 8.768 -0.958 9.199 . . . 1.0 . . . . . . . . . . . . A . 1 ARG HH21 . . . . . . . . . c30643_6pv2 1 . 4 . 1578 . 1 1 1 ARG HH22 H 8.635 -2.356 10.216 . . . 1.0 . . . . . . . . . . . . A . 1 ARG HH22 . . . . . . . . . c30643_6pv2 1 . 4 . 1579 . 1 1 1 ARG N N 13.853 -0.342 3.721 . . . 1.0 . . . . . . . . . . . . A . 1 ARG N . . . . . . . . . c30643_6pv2 1 . 4 . 1580 . 1 1 1 ARG NE N 10.423 -1.937 7.579 . . . 1.0 . . . . . . . . . . . . A . 1 ARG NE . . . . . . . . . c30643_6pv2 1 . 4 . 1581 . 1 1 1 ARG NH1 N 10.256 -3.789 8.940 . . . 1.0 . . . . . . . . . . . . A . 1 ARG NH1 . . . . . . . . . c30643_6pv2 1 . 4 . 1582 . 1 1 1 ARG NH2 N 9.034 -1.901 9.415 . . . 1.0 . . . . . . . . . . . . A . 1 ARG NH2 . . . . . . . . . c30643_6pv2 1 . 4 . 1583 . 1 1 1 ARG O O 11.243 0.030 2.884 . . . 1.0 . . . . . . . . . . . . A . 1 ARG O . . . . . . . . . c30643_6pv2 1 . 4 . 1584 . 1 1 2 PRO C C 8.877 -1.601 1.477 . . . 1.0 . . . . . . . . . . . . A . 2 PRO C . . . . . . . . . c30643_6pv2 1 . 4 . 1585 . 1 1 2 PRO CA C 10.190 -1.387 0.734 . . . 1.0 . . . . . . . . . . . . A . 2 PRO CA . . . . . . . . . c30643_6pv2 1 . 4 . 1586 . 1 1 2 PRO CB C 10.271 -2.309 -0.481 . . . 1.0 . . . . . . . . . . . . A . 2 PRO CB . . . . . . . . . c30643_6pv2 1 . 4 . 1587 . 1 1 2 PRO CD C 11.959 -3.030 1.056 . . . 1.0 . . . . . . . . . . . . A . 2 PRO CD . . . . . . . . . c30643_6pv2 1 . 4 . 1588 . 1 1 2 PRO CG C 10.995 -3.515 0.005 . . . 1.0 . . . . . . . . . . . . A . 2 PRO CG . . . . . . . . . c30643_6pv2 1 . 4 . 1589 . 1 1 2 PRO HA H 10.253 -0.357 0.412 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HA . . . . . . . . . c30643_6pv2 1 . 4 . 1590 . 1 1 2 PRO HB2 H 9.272 -2.555 -0.816 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HB2 . . . . . . . . . c30643_6pv2 1 . 4 . 1591 . 1 1 2 PRO HB3 H 10.813 -1.816 -1.275 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HB3 . . . . . . . . . c30643_6pv2 1 . 4 . 1592 . 1 1 2 PRO HD2 H 12.033 -3.749 1.859 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HD2 . . . . . . . . . c30643_6pv2 1 . 4 . 1593 . 1 1 2 PRO HD3 H 12.932 -2.851 0.621 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HD3 . . . . . . . . . c30643_6pv2 1 . 4 . 1594 . 1 1 2 PRO HG2 H 10.292 -4.215 0.435 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HG2 . . . . . . . . . c30643_6pv2 1 . 4 . 1595 . 1 1 2 PRO HG3 H 11.531 -3.976 -0.812 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HG3 . . . . . . . . . c30643_6pv2 1 . 4 . 1596 . 1 1 2 PRO N N 11.354 -1.768 1.530 . . . 1.0 . . . . . . . . . . . . A . 2 PRO N . . . . . . . . . c30643_6pv2 1 . 4 . 1597 . 1 1 2 PRO O O 8.726 -2.553 2.244 . . . 1.0 . . . . . . . . . . . . A . 2 PRO O . . . . . . . . . c30643_6pv2 1 . 4 . 1598 . 1 1 3 PHE C C 5.728 -1.676 0.965 . . . 1.0 . . . . . . . . . . . . A . 3 PHE C . . . . . . . . . c30643_6pv2 1 . 4 . 1599 . 1 1 3 PHE CA C 6.615 -0.797 1.832 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CA . . . . . . . . . c30643_6pv2 1 . 4 . 1600 . 1 1 3 PHE CB C 6.006 0.600 1.975 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CB . . . . . . . . . c30643_6pv2 1 . 4 . 1601 . 1 1 3 PHE CD1 C 7.814 2.278 2.452 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CD1 . . . . . . . . . c30643_6pv2 1 . 4 . 1602 . 1 1 3 PHE CD2 C 6.423 1.559 4.249 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CD2 . . . . . . . . . c30643_6pv2 1 . 4 . 1603 . 1 1 3 PHE CE1 C 8.507 3.105 3.314 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CE1 . . . . . . . . . c30643_6pv2 1 . 4 . 1604 . 1 1 3 PHE CE2 C 7.112 2.383 5.116 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CE2 . . . . . . . . . c30643_6pv2 1 . 4 . 1605 . 1 1 3 PHE CG C 6.765 1.497 2.910 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CG . . . . . . . . . c30643_6pv2 1 . 4 . 1606 . 1 1 3 PHE CZ C 8.157 3.157 4.649 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CZ . . . . . . . . . c30643_6pv2 1 . 4 . 1607 . 1 1 3 PHE H H 8.125 0.023 0.610 . . . 1.0 . . . . . . . . . . . . A . 3 PHE H . . . . . . . . . c30643_6pv2 1 . 4 . 1608 . 1 1 3 PHE HA H 6.716 -1.246 2.808 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HA . . . . . . . . . c30643_6pv2 1 . 4 . 1609 . 1 1 3 PHE HB2 H 5.979 1.076 1.009 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HB2 . . . . . . . . . c30643_6pv2 1 . 4 . 1610 . 1 1 3 PHE HB3 H 5.001 0.508 2.351 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HB3 . . . . . . . . . c30643_6pv2 1 . 4 . 1611 . 1 1 3 PHE HD1 H 8.088 2.238 1.407 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HD1 . . . . . . . . . c30643_6pv2 1 . 4 . 1612 . 1 1 3 PHE HD2 H 5.607 0.954 4.615 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HD2 . . . . . . . . . c30643_6pv2 1 . 4 . 1613 . 1 1 3 PHE HE1 H 9.322 3.710 2.946 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HE1 . . . . . . . . . c30643_6pv2 1 . 4 . 1614 . 1 1 3 PHE HE2 H 6.833 2.422 6.158 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HE2 . . . . . . . . . c30643_6pv2 1 . 4 . 1615 . 1 1 3 PHE HZ H 8.697 3.802 5.325 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HZ . . . . . . . . . c30643_6pv2 1 . 4 . 1616 . 1 1 3 PHE N N 7.934 -0.711 1.233 . . . 1.0 . . . . . . . . . . . . A . 3 PHE N . . . . . . . . . c30643_6pv2 1 . 4 . 1617 . 1 1 3 PHE O O 5.173 -1.220 -0.030 . . . 1.0 . . . . . . . . . . . . A . 3 PHE O . . . . . . . . . c30643_6pv2 1 . 4 . 1618 . 1 1 4 NLE C C 3.489 -4.116 1.021 . . . 1.0 . . . . . . . . . . . . A . 4 NLE C . . . . . . . . . c30643_6pv2 1 . 4 . 1619 . 1 1 4 NLE CA C 4.904 -3.900 0.508 . . . 1.0 . . . . . . . . . . . . A . 4 NLE CA . . . . . . . . . c30643_6pv2 1 . 4 . 1620 . 1 1 4 NLE CB C 5.653 -5.235 0.481 . . . 1.0 . . . . . . . . . . . . A . 4 NLE CB . . . . . . . . . c30643_6pv2 1 . 4 . 1621 . 1 1 4 NLE CD C 5.767 -7.585 -0.426 . . . 1.0 . . . . . . . . . . . . A . 4 NLE CD . . . . . . . . . c30643_6pv2 1 . 4 . 1622 . 1 1 4 NLE CE C 5.416 -8.275 0.874 . . . 1.0 . . . . . . . . . . . . A . 4 NLE CE . . . . . . . . . c30643_6pv2 1 . 4 . 1623 . 1 1 4 NLE CG C 5.073 -6.235 -0.510 . . . 1.0 . . . . . . . . . . . . A . 4 NLE CG . . . . . . . . . c30643_6pv2 1 . 4 . 1624 . 1 1 4 NLE H H 6.023 -3.231 2.175 . . . 1.0 . . . . . . . . . . . . A . 4 NLE H . . . . . . . . . c30643_6pv2 1 . 4 . 1625 . 1 1 4 NLE HA H 4.853 -3.505 -0.494 . . . 1.0 . . . . . . . . . . . . A . 4 NLE HA . . . . . . . . . c30643_6pv2 1 . 4 . 1626 . 1 1 4 NLE HB2 H 5.614 -5.673 1.466 . . . 1.0 . . . . . . . . . . . . A . 4 NLE HB2 . . . . . . . . . c30643_6pv2 1 . 4 . 1627 . 1 1 4 NLE HB3 H 6.685 -5.053 0.218 . . . 1.0 . . . . . . . . . . . . A . 4 NLE HB3 . . . . . . . . . c30643_6pv2 1 . 4 . 1628 . 1 1 4 NLE HD2 H 6.836 -7.444 -0.469 . . . 1.0 . . . . . . . . . . . . A . 4 NLE HD2 . . . . . . . . . c30643_6pv2 1 . 4 . 1629 . 1 1 4 NLE HD3 H 5.441 -8.207 -1.246 . . . 1.0 . . . . . . . . . . . . A . 4 NLE HD3 . . . . . . . . . c30643_6pv2 1 . 4 . 1630 . 1 1 4 NLE HE1 H 5.909 -9.234 0.915 . . . 1.0 . . . . . . . . . . . . A . 4 NLE HE1 . . . . . . . . . c30643_6pv2 1 . 4 . 1631 . 1 1 4 NLE HE2 H 4.347 -8.418 0.927 . . . 1.0 . . . . . . . . . . . . A . 4 NLE HE2 . . . . . . . . . c30643_6pv2 1 . 4 . 1632 . 1 1 4 NLE HE3 H 5.740 -7.667 1.705 . . . 1.0 . . . . . . . . . . . . A . 4 NLE HE3 . . . . . . . . . c30643_6pv2 1 . 4 . 1633 . 1 1 4 NLE HG2 H 5.189 -5.844 -1.510 . . . 1.0 . . . . . . . . . . . . A . 4 NLE HG2 . . . . . . . . . c30643_6pv2 1 . 4 . 1634 . 1 1 4 NLE HG3 H 4.025 -6.371 -0.293 . . . 1.0 . . . . . . . . . . . . A . 4 NLE HG3 . . . . . . . . . c30643_6pv2 1 . 4 . 1635 . 1 1 4 NLE N N 5.620 -2.939 1.329 . . . 1.0 . . . . . . . . . . . . A . 4 NLE N . . . . . . . . . c30643_6pv2 1 . 4 . 1636 . 1 1 4 NLE O O 3.257 -4.208 2.228 . . . 1.0 . . . . . . . . . . . . A . 4 NLE O . . . . . . . . . c30643_6pv2 1 . 4 . 1637 . 1 1 5 CYS C C 1.078 -5.985 0.818 . . . 1.0 . . . . . . . . . . . . A . 5 CYS C . . . . . . . . . c30643_6pv2 1 . 4 . 1638 . 1 1 5 CYS CA C 1.171 -4.516 0.414 . . . 1.0 . . . . . . . . . . . . A . 5 CYS CA . . . . . . . . . c30643_6pv2 1 . 4 . 1639 . 1 1 5 CYS CB C 0.269 -4.236 -0.790 . . . 1.0 . . . . . . . . . . . . A . 5 CYS CB . . . . . . . . . c30643_6pv2 1 . 4 . 1640 . 1 1 5 CYS H H 2.785 -3.985 -0.842 . . . 1.0 . . . . . . . . . . . . A . 5 CYS H . . . . . . . . . c30643_6pv2 1 . 4 . 1641 . 1 1 5 CYS HA H 0.858 -3.901 1.244 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HA . . . . . . . . . c30643_6pv2 1 . 4 . 1642 . 1 1 5 CYS HB2 H 0.235 -3.171 -0.964 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HB2 . . . . . . . . . c30643_6pv2 1 . 4 . 1643 . 1 1 5 CYS HB3 H 0.683 -4.723 -1.658 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HB3 . . . . . . . . . c30643_6pv2 1 . 4 . 1644 . 1 1 5 CYS N N 2.546 -4.177 0.093 . . . 1.0 . . . . . . . . . . . . A . 5 CYS N . . . . . . . . . c30643_6pv2 1 . 4 . 1645 . 1 1 5 CYS O O 1.784 -6.833 0.269 . . . 1.0 . . . . . . . . . . . . A . 5 CYS O . . . . . . . . . c30643_6pv2 1 . 4 . 1646 . 1 1 5 CYS SG S -1.429 -4.812 -0.590 . . . 1.0 . . . . . . . . . . . . A . 5 CYS SG . . . . . . . . . c30643_6pv2 1 . 4 . 1647 . 1 1 6 THR C C -1.423 -8.026 2.333 . . . 1.0 . . . . . . . . . . . . A . 6 THR C . . . . . . . . . c30643_6pv2 1 . 4 . 1648 . 1 1 6 THR CA C 0.052 -7.643 2.261 . . . 1.0 . . . . . . . . . . . . A . 6 THR CA . . . . . . . . . c30643_6pv2 1 . 4 . 1649 . 1 1 6 THR CB C 0.711 -7.817 3.643 . . . 1.0 . . . . . . . . . . . . A . 6 THR CB . . . . . . . . . c30643_6pv2 1 . 4 . 1650 . 1 1 6 THR CG2 C 2.221 -7.931 3.512 . . . 1.0 . . . . . . . . . . . . A . 6 THR CG2 . . . . . . . . . c30643_6pv2 1 . 4 . 1651 . 1 1 6 THR H H -0.323 -5.568 2.176 . . . 1.0 . . . . . . . . . . . . A . 6 THR H . . . . . . . . . c30643_6pv2 1 . 4 . 1652 . 1 1 6 THR HA H 0.548 -8.303 1.565 . . . 1.0 . . . . . . . . . . . . A . 6 THR HA . . . . . . . . . c30643_6pv2 1 . 4 . 1653 . 1 1 6 THR HB H 0.334 -8.723 4.094 . . . 1.0 . . . . . . . . . . . . A . 6 THR HB . . . . . . . . . c30643_6pv2 1 . 4 . 1654 . 1 1 6 THR HG1 H 0.933 -6.730 5.278 . . . 1.0 . . . . . . . . . . . . A . 6 THR HG1 . . . . . . . . . c30643_6pv2 1 . 4 . 1655 . 1 1 6 THR HG21 H 2.661 -8.042 4.491 . . . 1.0 . . . . . . . . . . . . A . 6 THR HG21 . . . . . . . . . c30643_6pv2 1 . 4 . 1656 . 1 1 6 THR HG22 H 2.609 -7.040 3.042 . . . 1.0 . . . . . . . . . . . . A . 6 THR HG22 . . . . . . . . . c30643_6pv2 1 . 4 . 1657 . 1 1 6 THR HG23 H 2.467 -8.792 2.906 . . . 1.0 . . . . . . . . . . . . A . 6 THR HG23 . . . . . . . . . c30643_6pv2 1 . 4 . 1658 . 1 1 6 THR N N 0.216 -6.282 1.778 . . . 1.0 . . . . . . . . . . . . A . 6 THR N . . . . . . . . . c30643_6pv2 1 . 4 . 1659 . 1 1 6 THR O O -1.913 -8.493 3.364 . . . 1.0 . . . . . . . . . . . . A . 6 THR O . . . . . . . . . c30643_6pv2 1 . 4 . 1660 . 1 1 6 THR OG1 O 0.382 -6.702 4.486 . . . 1.0 . . . . . . . . . . . . A . 6 THR OG1 . . . . . . . . . c30643_6pv2 1 . 4 . 1661 . 1 1 7 TRP C C -3.729 -9.510 0.497 . . . 1.0 . . . . . . . . . . . . A . 7 TRP C . . . . . . . . . c30643_6pv2 1 . 4 . 1662 . 1 1 7 TRP CA C -3.541 -8.149 1.161 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CA . . . . . . . . . c30643_6pv2 1 . 4 . 1663 . 1 1 7 TRP CB C -4.295 -7.066 0.388 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CB . . . . . . . . . c30643_6pv2 1 . 4 . 1664 . 1 1 7 TRP CD1 C -6.657 -7.837 -0.222 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CD1 . . . . . . . . . c30643_6pv2 1 . 4 . 1665 . 1 1 7 TRP CD2 C -6.566 -6.460 1.536 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CD2 . . . . . . . . . c30643_6pv2 1 . 4 . 1666 . 1 1 7 TRP CE2 C -7.911 -6.804 1.308 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CE2 . . . . . . . . . c30643_6pv2 1 . 4 . 1667 . 1 1 7 TRP CE3 C -6.259 -5.600 2.592 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CE3 . . . . . . . . . c30643_6pv2 1 . 4 . 1668 . 1 1 7 TRP CG C -5.782 -7.135 0.548 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CG . . . . . . . . . c30643_6pv2 1 . 4 . 1669 . 1 1 7 TRP CH2 C -8.618 -5.475 3.128 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CH2 . . . . . . . . . c30643_6pv2 1 . 4 . 1670 . 1 1 7 TRP CZ2 C -8.948 -6.316 2.099 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CZ2 . . . . . . . . . c30643_6pv2 1 . 4 . 1671 . 1 1 7 TRP CZ3 C -7.288 -5.116 3.377 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CZ3 . . . . . . . . . c30643_6pv2 1 . 4 . 1672 . 1 1 7 TRP H H -1.683 -7.452 0.436 . . . 1.0 . . . . . . . . . . . . A . 7 TRP H . . . . . . . . . c30643_6pv2 1 . 4 . 1673 . 1 1 7 TRP HA H -3.923 -8.195 2.169 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HA . . . . . . . . . c30643_6pv2 1 . 4 . 1674 . 1 1 7 TRP HB2 H -3.969 -6.096 0.729 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HB2 . . . . . . . . . c30643_6pv2 1 . 4 . 1675 . 1 1 7 TRP HB3 H -4.068 -7.165 -0.661 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HB3 . . . . . . . . . c30643_6pv2 1 . 4 . 1676 . 1 1 7 TRP HD1 H -6.367 -8.452 -1.060 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HD1 . . . . . . . . . c30643_6pv2 1 . 4 . 1677 . 1 1 7 TRP HE1 H -8.747 -8.051 -0.162 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HE1 . . . . . . . . . c30643_6pv2 1 . 4 . 1678 . 1 1 7 TRP HE3 H -5.238 -5.312 2.799 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HE3 . . . . . . . . . c30643_6pv2 1 . 4 . 1679 . 1 1 7 TRP HH2 H -9.390 -5.071 3.766 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HH2 . . . . . . . . . c30643_6pv2 1 . 4 . 1680 . 1 1 7 TRP HZ2 H -9.978 -6.585 1.921 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HZ2 . . . . . . . . . c30643_6pv2 1 . 4 . 1681 . 1 1 7 TRP HZ3 H -7.070 -4.449 4.198 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HZ3 . . . . . . . . . c30643_6pv2 1 . 4 . 1682 . 1 1 7 TRP N N -2.128 -7.824 1.230 . . . 1.0 . . . . . . . . . . . . A . 7 TRP N . . . . . . . . . c30643_6pv2 1 . 4 . 1683 . 1 1 7 TRP NE1 N -7.941 -7.647 0.228 . . . 1.0 . . . . . . . . . . . . A . 7 TRP NE1 . . . . . . . . . c30643_6pv2 1 . 4 . 1684 . 1 1 7 TRP O O -4.021 -9.601 -0.697 . . . 1.0 . . . . . . . . . . . . A . 7 TRP O . . . . . . . . . c30643_6pv2 1 . 4 . 1685 . 1 1 8 ORN C C -1.480 -10.819 -2.721 . . . 1.0 . . . . . . . . . . . . A . 8 ORN C . . . . . . . . . c30643_6pv2 1 . 4 . 1686 . 1 1 8 ORN CA C -2.104 -11.910 -1.863 . . . 1.0 . . . . . . . . . . . . A . 8 ORN CA . . . . . . . . . c30643_6pv2 1 . 4 . 1687 . 1 1 8 ORN CB C -1.471 -11.884 -0.469 . . . 1.0 . . . . . . . . . . . . A . 8 ORN CB . . . . . . . . . c30643_6pv2 1 . 4 . 1688 . 1 1 8 ORN CD C -3.637 -11.948 0.812 . . . 1.0 . . . . . . . . . . . . A . 8 ORN CD . . . . . . . . . c30643_6pv2 1 . 4 . 1689 . 1 1 8 ORN CG C -2.282 -12.610 0.591 . . . 1.0 . . . . . . . . . . . . A . 8 ORN CG . . . . . . . . . c30643_6pv2 1 . 4 . 1690 . 1 1 8 ORN H H -0.933 -13.448 -2.618 . . . 1.0 . . . . . . . . . . . . A . 8 ORN H . . . . . . . . . c30643_6pv2 1 . 4 . 1691 . 1 1 8 ORN HA H -3.159 -11.710 -1.770 . . . 1.0 . . . . . . . . . . . . A . 8 ORN HA . . . . . . . . . c30643_6pv2 1 . 4 . 1692 . 1 1 8 ORN HB2 H -1.358 -10.856 -0.161 . . . 1.0 . . . . . . . . . . . . A . 8 ORN HB2 . . . . . . . . . c30643_6pv2 1 . 4 . 1693 . 1 1 8 ORN HB3 H -0.495 -12.343 -0.521 . . . 1.0 . . . . . . . . . . . . A . 8 ORN HB3 . . . . . . . . . c30643_6pv2 1 . 4 . 1694 . 1 1 8 ORN HD2 H -4.182 -12.512 1.554 . . . 1.0 . . . . . . . . . . . . A . 8 ORN HD2 . . . . . . . . . c30643_6pv2 1 . 4 . 1695 . 1 1 8 ORN HD3 H -4.187 -11.959 -0.117 . . . 1.0 . . . . . . . . . . . . A . 8 ORN HD3 . . . . . . . . . c30643_6pv2 1 . 4 . 1696 . 1 1 8 ORN HE1 H -3.241 -10.416 2.198 . . . 1.0 . . . . . . . . . . . . A . 8 ORN HE1 . . . . . . . . . c30643_6pv2 1 . 4 . 1697 . 1 1 8 ORN HG2 H -1.731 -12.601 1.520 . . . 1.0 . . . . . . . . . . . . A . 8 ORN HG2 . . . . . . . . . c30643_6pv2 1 . 4 . 1698 . 1 1 8 ORN HG3 H -2.439 -13.629 0.273 . . . 1.0 . . . . . . . . . . . . A . 8 ORN HG3 . . . . . . . . . c30643_6pv2 1 . 4 . 1699 . 1 1 8 ORN N N -1.941 -13.242 -2.481 . . . 1.0 . . . . . . . . . . . . A . 8 ORN N . . . . . . . . . c30643_6pv2 1 . 4 . 1700 . 1 1 8 ORN NE N -3.509 -10.566 1.266 . . . 1.0 . . . . . . . . . . . . A . 8 ORN NE . . . . . . . . . c30643_6pv2 1 . 4 . 1701 . 1 1 8 ORN O O -0.406 -10.999 -3.300 . . . 1.0 . . . . . . . . . . . . A . 8 ORN O . . . . . . . . . c30643_6pv2 1 . 4 . 1702 . 1 1 9 CYS C C -0.473 -7.971 -2.671 . . . 1.0 . . . . . . . . . . . . A . 9 CYS C . . . . . . . . . c30643_6pv2 1 . 4 . 1703 . 1 1 9 CYS CA C -1.656 -8.513 -3.465 . . . 1.0 . . . . . . . . . . . . A . 9 CYS CA . . . . . . . . . c30643_6pv2 1 . 4 . 1704 . 1 1 9 CYS CB C -2.760 -7.460 -3.571 . . . 1.0 . . . . . . . . . . . . A . 9 CYS CB . . . . . . . . . c30643_6pv2 1 . 4 . 1705 . 1 1 9 CYS H H -3.077 -9.663 -2.413 . . . 1.0 . . . . . . . . . . . . A . 9 CYS H . . . . . . . . . c30643_6pv2 1 . 4 . 1706 . 1 1 9 CYS HA H -1.327 -8.789 -4.454 . . . 1.0 . . . . . . . . . . . . A . 9 CYS HA . . . . . . . . . c30643_6pv2 1 . 4 . 1707 . 1 1 9 CYS HB2 H -3.512 -7.807 -4.263 . . . 1.0 . . . . . . . . . . . . A . 9 CYS HB2 . . . . . . . . . c30643_6pv2 1 . 4 . 1708 . 1 1 9 CYS HB3 H -3.210 -7.330 -2.599 . . . 1.0 . . . . . . . . . . . . A . 9 CYS HB3 . . . . . . . . . c30643_6pv2 1 . 4 . 1709 . 1 1 9 CYS N N -2.175 -9.696 -2.809 . . . 1.0 . . . . . . . . . . . . A . 9 CYS N . . . . . . . . . c30643_6pv2 1 . 4 . 1710 . 1 1 9 CYS O O -0.587 -7.743 -1.464 . . . 1.0 . . . . . . . . . . . . A . 9 CYS O . . . . . . . . . c30643_6pv2 1 . 4 . 1711 . 1 1 9 CYS SG S -2.202 -5.842 -4.138 . . . 1.0 . . . . . . . . . . . . A . 9 CYS SG . . . . . . . . . c30643_6pv2 1 . 4 . 1712 . 1 1 10 GLY C C 2.740 -6.456 -3.465 . . . 1.0 . . . . . . . . . . . . A . 10 GLY C . . . . . . . . . c30643_6pv2 1 . 4 . 1713 . 1 1 10 GLY CA C 1.852 -7.359 -2.642 . . . 1.0 . . . . . . . . . . . . A . 10 GLY CA . . . . . . . . . c30643_6pv2 1 . 4 . 1714 . 1 1 10 GLY H H 0.681 -7.918 -4.310 . . . 1.0 . . . . . . . . . . . . A . 10 GLY H . . . . . . . . . c30643_6pv2 1 . 4 . 1715 . 1 1 10 GLY HA2 H 1.562 -6.834 -1.744 . . . 1.0 . . . . . . . . . . . . A . 10 GLY HA2 . . . . . . . . . c30643_6pv2 1 . 4 . 1716 . 1 1 10 GLY HA3 H 2.415 -8.236 -2.363 . . . 1.0 . . . . . . . . . . . . A . 10 GLY HA3 . . . . . . . . . c30643_6pv2 1 . 4 . 1717 . 1 1 10 GLY N N 0.658 -7.777 -3.338 . . . 1.0 . . . . . . . . . . . . A . 10 GLY N . . . . . . . . . c30643_6pv2 1 . 4 . 1718 . 1 1 10 GLY O O 3.910 -6.762 -3.685 . . . 1.0 . . . . . . . . . . . . A . 10 GLY O . . . . . . . . . c30643_6pv2 1 . 4 . 1719 . 1 1 11 LYS C C 3.907 -3.644 -3.645 . . . 1.0 . . . . . . . . . . . . A . 11 LYS C . . . . . . . . . c30643_6pv2 1 . 4 . 1720 . 1 1 11 LYS CA C 2.978 -4.344 -4.627 . . . 1.0 . . . . . . . . . . . . A . 11 LYS CA . . . . . . . . . c30643_6pv2 1 . 4 . 1721 . 1 1 11 LYS CB C 2.070 -3.327 -5.323 . . . 1.0 . . . . . . . . . . . . A . 11 LYS CB . . . . . . . . . c30643_6pv2 1 . 4 . 1722 . 1 1 11 LYS CD C 0.428 -2.867 -7.168 . . . 1.0 . . . . . . . . . . . . A . 11 LYS CD . . . . . . . . . c30643_6pv2 1 . 4 . 1723 . 1 1 11 LYS CE C -0.376 -3.471 -8.307 . . . 1.0 . . . . . . . . . . . . A . 11 LYS CE . . . . . . . . . c30643_6pv2 1 . 4 . 1724 . 1 1 11 LYS CG C 1.246 -3.925 -6.450 . . . 1.0 . . . . . . . . . . . . A . 11 LYS CG . . . . . . . . . c30643_6pv2 1 . 4 . 1725 . 1 1 11 LYS H H 1.230 -5.195 -3.793 . . . 1.0 . . . . . . . . . . . . A . 11 LYS H . . . . . . . . . c30643_6pv2 1 . 4 . 1726 . 1 1 11 LYS HA H 3.574 -4.852 -5.370 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HA . . . . . . . . . c30643_6pv2 1 . 4 . 1727 . 1 1 11 LYS HB2 H 1.390 -2.909 -4.593 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HB2 . . . . . . . . . c30643_6pv2 1 . 4 . 1728 . 1 1 11 LYS HB3 H 2.678 -2.533 -5.732 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HB3 . . . . . . . . . c30643_6pv2 1 . 4 . 1729 . 1 1 11 LYS HD2 H -0.250 -2.414 -6.462 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HD2 . . . . . . . . . c30643_6pv2 1 . 4 . 1730 . 1 1 11 LYS HD3 H 1.094 -2.115 -7.565 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HD3 . . . . . . . . . c30643_6pv2 1 . 4 . 1731 . 1 1 11 LYS HE2 H 0.301 -3.980 -8.978 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HE2 . . . . . . . . . c30643_6pv2 1 . 4 . 1732 . 1 1 11 LYS HE3 H -1.077 -4.182 -7.897 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HE3 . . . . . . . . . c30643_6pv2 1 . 4 . 1733 . 1 1 11 LYS HG2 H 1.913 -4.393 -7.158 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HG2 . . . . . . . . . c30643_6pv2 1 . 4 . 1734 . 1 1 11 LYS HG3 H 0.577 -4.667 -6.038 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HG3 . . . . . . . . . c30643_6pv2 1 . 4 . 1735 . 1 1 11 LYS HZ1 H -0.464 -1.740 -9.467 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HZ1 . . . . . . . . . c30643_6pv2 1 . 4 . 1736 . 1 1 11 LYS HZ2 H -1.795 -1.947 -8.445 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HZ2 . . . . . . . . . c30643_6pv2 1 . 4 . 1737 . 1 1 11 LYS HZ3 H -1.652 -2.880 -9.846 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HZ3 . . . . . . . . . c30643_6pv2 1 . 4 . 1738 . 1 1 11 LYS N N 2.187 -5.346 -3.927 . . . 1.0 . . . . . . . . . . . . A . 11 LYS N . . . . . . . . . c30643_6pv2 1 . 4 . 1739 . 1 1 11 LYS NZ N -1.123 -2.437 -9.069 . . . 1.0 . . . . . . . . . . . . A . 11 LYS NZ . . . . . . . . . c30643_6pv2 1 . 4 . 1740 . 1 1 11 LYS O O 3.530 -3.393 -2.498 . . . 1.0 . . . . . . . . . . . . A . 11 LYS O . . . . . . . . . c30643_6pv2 1 . 4 . 1741 . 1 1 12 ARG C C 6.233 -1.246 -3.522 . . . 1.0 . . . . . . . . . . . . A . 12 ARG C . . . . . . . . . c30643_6pv2 1 . 4 . 1742 . 1 1 12 ARG CA C 6.111 -2.731 -3.216 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CA . . . . . . . . . c30643_6pv2 1 . 4 . 1743 . 1 1 12 ARG CB C 7.469 -3.424 -3.366 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CB . . . . . . . . . c30643_6pv2 1 . 4 . 1744 . 1 1 12 ARG CD C 8.815 -5.540 -3.125 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CD . . . . . . . . . c30643_6pv2 1 . 4 . 1745 . 1 1 12 ARG CG C 7.447 -4.893 -2.971 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CG . . . . . . . . . c30643_6pv2 1 . 4 . 1746 . 1 1 12 ARG CZ C 9.891 -7.686 -2.539 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CZ . . . . . . . . . c30643_6pv2 1 . 4 . 1747 . 1 1 12 ARG H H 5.359 -3.557 -5.014 . . . 1.0 . . . . . . . . . . . . A . 12 ARG H . . . . . . . . . c30643_6pv2 1 . 4 . 1748 . 1 1 12 ARG HA H 5.769 -2.845 -2.197 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HA . . . . . . . . . c30643_6pv2 1 . 4 . 1749 . 1 1 12 ARG HB2 H 7.784 -3.355 -4.397 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HB2 . . . . . . . . . c30643_6pv2 1 . 4 . 1750 . 1 1 12 ARG HB3 H 8.193 -2.916 -2.744 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HB3 . . . . . . . . . c30643_6pv2 1 . 4 . 1751 . 1 1 12 ARG HD2 H 9.138 -5.431 -4.148 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HD2 . . . . . . . . . c30643_6pv2 1 . 4 . 1752 . 1 1 12 ARG HD3 H 9.512 -5.033 -2.473 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HD3 . . . . . . . . . c30643_6pv2 1 . 4 . 1753 . 1 1 12 ARG HE H 7.918 -7.405 -2.736 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HE . . . . . . . . . c30643_6pv2 1 . 4 . 1754 . 1 1 12 ARG HG2 H 7.136 -4.973 -1.940 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HG2 . . . . . . . . . c30643_6pv2 1 . 4 . 1755 . 1 1 12 ARG HG3 H 6.740 -5.413 -3.601 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HG3 . . . . . . . . . c30643_6pv2 1 . 4 . 1756 . 1 1 12 ARG HH11 H 11.183 -6.151 -2.833 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH11 . . . . . . . . . c30643_6pv2 1 . 4 . 1757 . 1 1 12 ARG HH12 H 11.917 -7.669 -2.426 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH12 . . . . . . . . . c30643_6pv2 1 . 4 . 1758 . 1 1 12 ARG HH21 H 10.599 -9.519 -2.049 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH21 . . . . . . . . . c30643_6pv2 1 . 4 . 1759 . 1 1 12 ARG HH22 H 8.875 -9.407 -2.196 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH22 . . . . . . . . . c30643_6pv2 1 . 4 . 1760 . 1 1 12 ARG N N 5.122 -3.354 -4.083 . . . 1.0 . . . . . . . . . . . . A . 12 ARG N . . . . . . . . . c30643_6pv2 1 . 4 . 1761 . 1 1 12 ARG NE N 8.797 -6.963 -2.784 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NE . . . . . . . . . c30643_6pv2 1 . 4 . 1762 . 1 1 12 ARG NH1 N 11.093 -7.124 -2.603 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NH1 . . . . . . . . . c30643_6pv2 1 . 4 . 1763 . 1 1 12 ARG NH2 N 9.781 -8.971 -2.236 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NH2 . . . . . . . . . c30643_6pv2 1 . 4 . 1764 . 1 1 12 ARG O O 6.271 -0.839 -4.685 . . . 1.0 . . . . . . . . . . . . A . 12 ARG O . . . . . . . . . c30643_6pv2 1 . 4 . 1765 . 1 1 13 PHE C C 7.549 1.558 -1.894 . . . 1.0 . . . . . . . . . . . . A . 13 PHE C . . . . . . . . . c30643_6pv2 1 . 4 . 1766 . 1 1 13 PHE CA C 6.333 1.004 -2.611 . . . 1.0 . . . . . . . . . . . . A . 13 PHE CA . . . . . . . . . c30643_6pv2 1 . 4 . 1767 . 1 1 13 PHE CB C 5.063 1.625 -2.041 . . . 1.0 . . . . . . . . . . . . A . 13 PHE CB . . . . . . . . . c30643_6pv2 1 . 4 . 1768 . 1 1 13 PHE CD1 C 3.349 1.652 -3.857 . . . 1.0 . . . . . . . . . . . . A . 13 PHE CD1 . . . . . . . . . c30643_6pv2 1 . 4 . 1769 . 1 1 13 PHE CD2 C 3.140 0.029 -2.127 . . . 1.0 . . . . . . . . . . . . A . 13 PHE CD2 . . . . . . . . . c30643_6pv2 1 . 4 . 1770 . 1 1 13 PHE CE1 C 2.214 1.157 -4.461 . . . 1.0 . . . . . . . . . . . . A . 13 PHE CE1 . . . . . . . . . c30643_6pv2 1 . 4 . 1771 . 1 1 13 PHE CE2 C 2.003 -0.470 -2.724 . . . 1.0 . . . . . . . . . . . . A . 13 PHE CE2 . . . . . . . . . c30643_6pv2 1 . 4 . 1772 . 1 1 13 PHE CG C 3.822 1.096 -2.685 . . . 1.0 . . . . . . . . . . . . A . 13 PHE CG . . . . . . . . . c30643_6pv2 1 . 4 . 1773 . 1 1 13 PHE CZ C 1.540 0.095 -3.895 . . . 1.0 . . . . . . . . . . . . A . 13 PHE CZ . . . . . . . . . c30643_6pv2 1 . 4 . 1774 . 1 1 13 PHE H H 6.252 -0.830 -1.571 . . . 1.0 . . . . . . . . . . . . A . 13 PHE H . . . . . . . . . c30643_6pv2 1 . 4 . 1775 . 1 1 13 PHE HA H 6.401 1.241 -3.662 . . . 1.0 . . . . . . . . . . . . A . 13 PHE HA . . . . . . . . . c30643_6pv2 1 . 4 . 1776 . 1 1 13 PHE HB2 H 5.007 1.413 -0.984 . . . 1.0 . . . . . . . . . . . . A . 13 PHE HB2 . . . . . . . . . c30643_6pv2 1 . 4 . 1777 . 1 1 13 PHE HB3 H 5.091 2.692 -2.193 . . . 1.0 . . . . . . . . . . . . A . 13 PHE HB3 . . . . . . . . . c30643_6pv2 1 . 4 . 1778 . 1 1 13 PHE HD1 H 3.877 2.483 -4.299 . . . 1.0 . . . . . . . . . . . . A . 13 PHE HD1 . . . . . . . . . c30643_6pv2 1 . 4 . 1779 . 1 1 13 PHE HD2 H 3.506 -0.414 -1.212 . . . 1.0 . . . . . . . . . . . . A . 13 PHE HD2 . . . . . . . . . c30643_6pv2 1 . 4 . 1780 . 1 1 13 PHE HE1 H 1.853 1.599 -5.374 . . . 1.0 . . . . . . . . . . . . A . 13 PHE HE1 . . . . . . . . . c30643_6pv2 1 . 4 . 1781 . 1 1 13 PHE HE2 H 1.478 -1.300 -2.277 . . . 1.0 . . . . . . . . . . . . A . 13 PHE HE2 . . . . . . . . . c30643_6pv2 1 . 4 . 1782 . 1 1 13 PHE HZ H 0.649 -0.292 -4.365 . . . 1.0 . . . . . . . . . . . . A . 13 PHE HZ . . . . . . . . . c30643_6pv2 1 . 4 . 1783 . 1 1 13 PHE N N 6.275 -0.441 -2.473 . . . 1.0 . . . . . . . . . . . . A . 13 PHE N . . . . . . . . . c30643_6pv2 1 . 4 . 1784 . 1 1 13 PHE O O 8.021 0.986 -0.911 . . . 1.0 . . . . . . . . . . . . A . 13 PHE O . . . . . . . . . c30643_6pv2 1 . 4 . 1785 . 1 1 14 THR C C 8.852 4.133 -0.600 . . . 1.0 . . . . . . . . . . . . A . 14 THR C . . . . . . . . . c30643_6pv2 1 . 4 . 1786 . 1 1 14 THR CA C 9.230 3.299 -1.824 . . . 1.0 . . . . . . . . . . . . A . 14 THR CA . . . . . . . . . c30643_6pv2 1 . 4 . 1787 . 1 1 14 THR CB C 9.923 4.203 -2.863 . . . 1.0 . . . . . . . . . . . . A . 14 THR CB . . . . . . . . . c30643_6pv2 1 . 4 . 1788 . 1 1 14 THR CG2 C 11.345 4.532 -2.439 . . . 1.0 . . . . . . . . . . . . A . 14 THR CG2 . . . . . . . . . c30643_6pv2 1 . 4 . 1789 . 1 1 14 THR H H 7.641 3.072 -3.189 . . . 1.0 . . . . . . . . . . . . A . 14 THR H . . . . . . . . . c30643_6pv2 1 . 4 . 1790 . 1 1 14 THR HA H 9.920 2.525 -1.524 . . . 1.0 . . . . . . . . . . . . A . 14 THR HA . . . . . . . . . c30643_6pv2 1 . 4 . 1791 . 1 1 14 THR HB H 9.363 5.124 -2.951 . . . 1.0 . . . . . . . . . . . . A . 14 THR HB . . . . . . . . . c30643_6pv2 1 . 4 . 1792 . 1 1 14 THR HG1 H 10.449 4.084 -4.767 . . . 1.0 . . . . . . . . . . . . A . 14 THR HG1 . . . . . . . . . c30643_6pv2 1 . 4 . 1793 . 1 1 14 THR HG21 H 11.917 3.620 -2.356 . . . 1.0 . . . . . . . . . . . . A . 14 THR HG21 . . . . . . . . . c30643_6pv2 1 . 4 . 1794 . 1 1 14 THR HG22 H 11.328 5.034 -1.485 . . . 1.0 . . . . . . . . . . . . A . 14 THR HG22 . . . . . . . . . c30643_6pv2 1 . 4 . 1795 . 1 1 14 THR HG23 H 11.802 5.176 -3.177 . . . 1.0 . . . . . . . . . . . . A . 14 THR HG23 . . . . . . . . . c30643_6pv2 1 . 4 . 1796 . 1 1 14 THR N N 8.058 2.670 -2.398 . . . 1.0 . . . . . . . . . . . . A . 14 THR N . . . . . . . . . c30643_6pv2 1 . 4 . 1797 . 1 1 14 THR O O 9.659 4.322 0.312 . . . 1.0 . . . . . . . . . . . . A . 14 THR O . . . . . . . . . c30643_6pv2 1 . 4 . 1798 . 1 1 14 THR OG1 O 9.950 3.543 -4.139 . . . 1.0 . . . . . . . . . . . . A . 14 THR OG1 . . . . . . . . . c30643_6pv2 1 . 4 . 1799 . 1 1 15 ARG C C 5.855 4.997 1.106 . . . 1.0 . . . . . . . . . . . . A . 15 ARG C . . . . . . . . . c30643_6pv2 1 . 4 . 1800 . 1 1 15 ARG CA C 7.158 5.500 0.485 . . . 1.0 . . . . . . . . . . . . A . 15 ARG CA . . . . . . . . . c30643_6pv2 1 . 4 . 1801 . 1 1 15 ARG CB C 6.979 6.913 -0.074 . . . 1.0 . . . . . . . . . . . . A . 15 ARG CB . . . . . . . . . c30643_6pv2 1 . 4 . 1802 . 1 1 15 ARG CD C 8.037 8.842 -1.301 . . . 1.0 . . . . . . . . . . . . A . 15 ARG CD . . . . . . . . . c30643_6pv2 1 . 4 . 1803 . 1 1 15 ARG CG C 8.278 7.531 -0.570 . . . 1.0 . . . . . . . . . . . . A . 15 ARG CG . . . . . . . . . c30643_6pv2 1 . 4 . 1804 . 1 1 15 ARG CZ C 6.852 9.639 -3.314 . . . 1.0 . . . . . . . . . . . . A . 15 ARG CZ . . . . . . . . . c30643_6pv2 1 . 4 . 1805 . 1 1 15 ARG H H 6.986 4.357 -1.290 . . . 1.0 . . . . . . . . . . . . A . 15 ARG H . . . . . . . . . c30643_6pv2 1 . 4 . 1806 . 1 1 15 ARG HA H 7.922 5.518 1.249 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HA . . . . . . . . . c30643_6pv2 1 . 4 . 1807 . 1 1 15 ARG HB2 H 6.284 6.878 -0.898 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HB2 . . . . . . . . . c30643_6pv2 1 . 4 . 1808 . 1 1 15 ARG HB3 H 6.577 7.549 0.701 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HB3 . . . . . . . . . c30643_6pv2 1 . 4 . 1809 . 1 1 15 ARG HD2 H 7.495 9.512 -0.648 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HD2 . . . . . . . . . c30643_6pv2 1 . 4 . 1810 . 1 1 15 ARG HD3 H 8.990 9.279 -1.554 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HD3 . . . . . . . . . c30643_6pv2 1 . 4 . 1811 . 1 1 15 ARG HE H 7.043 7.720 -2.779 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HE . . . . . . . . . c30643_6pv2 1 . 4 . 1812 . 1 1 15 ARG HG2 H 8.924 7.715 0.274 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HG2 . . . . . . . . . c30643_6pv2 1 . 4 . 1813 . 1 1 15 ARG HG3 H 8.756 6.837 -1.247 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HG3 . . . . . . . . . c30643_6pv2 1 . 4 . 1814 . 1 1 15 ARG HH11 H 7.666 11.109 -2.184 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HH11 . . . . . . . . . c30643_6pv2 1 . 4 . 1815 . 1 1 15 ARG HH12 H 6.827 11.646 -3.601 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HH12 . . . . . . . . . c30643_6pv2 1 . 4 . 1816 . 1 1 15 ARG HH21 H 5.929 8.413 -4.644 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HH21 . . . . . . . . . c30643_6pv2 1 . 4 . 1817 . 1 1 15 ARG HH22 H 5.842 10.114 -5.005 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HH22 . . . . . . . . . c30643_6pv2 1 . 4 . 1818 . 1 1 15 ARG N N 7.612 4.611 -0.575 . . . 1.0 . . . . . . . . . . . . A . 15 ARG N . . . . . . . . . c30643_6pv2 1 . 4 . 1819 . 1 1 15 ARG NE N 7.263 8.647 -2.526 . . . 1.0 . . . . . . . . . . . . A . 15 ARG NE . . . . . . . . . c30643_6pv2 1 . 4 . 1820 . 1 1 15 ARG NH1 N 7.137 10.898 -3.007 . . . 1.0 . . . . . . . . . . . . A . 15 ARG NH1 . . . . . . . . . c30643_6pv2 1 . 4 . 1821 . 1 1 15 ARG NH2 N 6.150 9.370 -4.406 . . . 1.0 . . . . . . . . . . . . A . 15 ARG NH2 . . . . . . . . . c30643_6pv2 1 . 4 . 1822 . 1 1 15 ARG O O 4.988 4.440 0.426 . . . 1.0 . . . . . . . . . . . . A . 15 ARG O . . . . . . . . . c30643_6pv2 1 . 4 . 1823 . 1 1 16 SER C C 3.292 5.323 2.775 . . . 1.0 . . . . . . . . . . . . A . 16 SER C . . . . . . . . . c30643_6pv2 1 . 4 . 1824 . 1 1 16 SER CA C 4.618 4.704 3.203 . . . 1.0 . . . . . . . . . . . . A . 16 SER CA . . . . . . . . . c30643_6pv2 1 . 4 . 1825 . 1 1 16 SER CB C 4.875 4.984 4.685 . . . 1.0 . . . . . . . . . . . . A . 16 SER CB . . . . . . . . . c30643_6pv2 1 . 4 . 1826 . 1 1 16 SER H H 6.436 5.725 2.875 . . . 1.0 . . . . . . . . . . . . A . 16 SER H . . . . . . . . . c30643_6pv2 1 . 4 . 1827 . 1 1 16 SER HA H 4.566 3.636 3.056 . . . 1.0 . . . . . . . . . . . . A . 16 SER HA . . . . . . . . . c30643_6pv2 1 . 4 . 1828 . 1 1 16 SER HB2 H 3.959 4.860 5.241 . . . 1.0 . . . . . . . . . . . . A . 16 SER HB2 . . . . . . . . . c30643_6pv2 1 . 4 . 1829 . 1 1 16 SER HB3 H 5.619 4.296 5.056 . . . 1.0 . . . . . . . . . . . . A . 16 SER HB3 . . . . . . . . . c30643_6pv2 1 . 4 . 1830 . 1 1 16 SER HG H 4.827 6.743 5.557 . . . 1.0 . . . . . . . . . . . . A . 16 SER HG . . . . . . . . . c30643_6pv2 1 . 4 . 1831 . 1 1 16 SER N N 5.737 5.209 2.415 . . . 1.0 . . . . . . . . . . . . A . 16 SER N . . . . . . . . . c30643_6pv2 1 . 4 . 1832 . 1 1 16 SER O O 2.254 4.663 2.823 . . . 1.0 . . . . . . . . . . . . A . 16 SER O . . . . . . . . . c30643_6pv2 1 . 4 . 1833 . 1 1 16 SER OG O 5.347 6.308 4.869 . . . 1.0 . . . . . . . . . . . . A . 16 SER OG . . . . . . . . . c30643_6pv2 1 . 4 . 1834 . 1 1 17 ASP C C 1.605 6.631 0.628 . . . 1.0 . . . . . . . . . . . . A . 17 ASP C . . . . . . . . . c30643_6pv2 1 . 4 . 1835 . 1 1 17 ASP CA C 2.135 7.278 1.894 . . . 1.0 . . . . . . . . . . . . A . 17 ASP CA . . . . . . . . . c30643_6pv2 1 . 4 . 1836 . 1 1 17 ASP CB C 2.417 8.761 1.637 . . . 1.0 . . . . . . . . . . . . A . 17 ASP CB . . . . . . . . . c30643_6pv2 1 . 4 . 1837 . 1 1 17 ASP CG C 2.597 9.555 2.913 . . . 1.0 . . . . . . . . . . . . A . 17 ASP CG . . . . . . . . . c30643_6pv2 1 . 4 . 1838 . 1 1 17 ASP H H 4.181 7.075 2.400 . . . 1.0 . . . . . . . . . . . . A . 17 ASP H . . . . . . . . . c30643_6pv2 1 . 4 . 1839 . 1 1 17 ASP HA H 1.384 7.194 2.662 . . . 1.0 . . . . . . . . . . . . A . 17 ASP HA . . . . . . . . . c30643_6pv2 1 . 4 . 1840 . 1 1 17 ASP HB2 H 3.318 8.852 1.053 . . . 1.0 . . . . . . . . . . . . A . 17 ASP HB2 . . . . . . . . . c30643_6pv2 1 . 4 . 1841 . 1 1 17 ASP HB3 H 1.594 9.185 1.085 . . . 1.0 . . . . . . . . . . . . A . 17 ASP HB3 . . . . . . . . . c30643_6pv2 1 . 4 . 1842 . 1 1 17 ASP N N 3.332 6.588 2.367 . . . 1.0 . . . . . . . . . . . . A . 17 ASP N . . . . . . . . . c30643_6pv2 1 . 4 . 1843 . 1 1 17 ASP O O 0.396 6.588 0.400 . . . 1.0 . . . . . . . . . . . . A . 17 ASP O . . . . . . . . . c30643_6pv2 1 . 4 . 1844 . 1 1 17 ASP OD1 O 1.586 10.014 3.481 . . . 1.0 . . . . . . . . . . . . A . 17 ASP OD1 . . . . . . . . . c30643_6pv2 1 . 4 . 1845 . 1 1 17 ASP OD2 O 3.754 9.732 3.351 . . . 1.0 . . . . . . . . . . . . A . 17 ASP OD2 . . . . . . . . . c30643_6pv2 1 . 4 . 1846 . 1 1 18 GLU C C 1.475 4.113 -1.105 . . . 1.0 . . . . . . . . . . . . A . 18 GLU C . . . . . . . . . c30643_6pv2 1 . 4 . 1847 . 1 1 18 GLU CA C 2.141 5.443 -1.416 . . . 1.0 . . . . . . . . . . . . A . 18 GLU CA . . . . . . . . . c30643_6pv2 1 . 4 . 1848 . 1 1 18 GLU CB C 3.370 5.227 -2.298 . . . 1.0 . . . . . . . . . . . . A . 18 GLU CB . . . . . . . . . c30643_6pv2 1 . 4 . 1849 . 1 1 18 GLU CD C 5.262 6.280 -3.575 . . . 1.0 . . . . . . . . . . . . A . 18 GLU CD . . . . . . . . . c30643_6pv2 1 . 4 . 1850 . 1 1 18 GLU CG C 4.103 6.510 -2.634 . . . 1.0 . . . . . . . . . . . . A . 18 GLU CG . . . . . . . . . c30643_6pv2 1 . 4 . 1851 . 1 1 18 GLU H H 3.458 6.166 0.061 . . . 1.0 . . . . . . . . . . . . A . 18 GLU H . . . . . . . . . c30643_6pv2 1 . 4 . 1852 . 1 1 18 GLU HA H 1.438 6.073 -1.937 . . . 1.0 . . . . . . . . . . . . A . 18 GLU HA . . . . . . . . . c30643_6pv2 1 . 4 . 1853 . 1 1 18 GLU HB2 H 4.057 4.575 -1.781 . . . 1.0 . . . . . . . . . . . . A . 18 GLU HB2 . . . . . . . . . c30643_6pv2 1 . 4 . 1854 . 1 1 18 GLU HB3 H 3.064 4.758 -3.220 . . . 1.0 . . . . . . . . . . . . A . 18 GLU HB3 . . . . . . . . . c30643_6pv2 1 . 4 . 1855 . 1 1 18 GLU HG2 H 3.409 7.196 -3.099 . . . 1.0 . . . . . . . . . . . . A . 18 GLU HG2 . . . . . . . . . c30643_6pv2 1 . 4 . 1856 . 1 1 18 GLU HG3 H 4.480 6.943 -1.720 . . . 1.0 . . . . . . . . . . . . A . 18 GLU HG3 . . . . . . . . . c30643_6pv2 1 . 4 . 1857 . 1 1 18 GLU N N 2.514 6.110 -0.183 . . . 1.0 . . . . . . . . . . . . A . 18 GLU N . . . . . . . . . c30643_6pv2 1 . 4 . 1858 . 1 1 18 GLU O O 0.486 3.741 -1.739 . . . 1.0 . . . . . . . . . . . . A . 18 GLU O . . . . . . . . . c30643_6pv2 1 . 4 . 1859 . 1 1 18 GLU OE1 O 6.189 5.532 -3.204 . . . 1.0 . . . . . . . . . . . . A . 18 GLU OE1 . . . . . . . . . c30643_6pv2 1 . 4 . 1860 . 1 1 18 GLU OE2 O 5.250 6.841 -4.689 . . . 1.0 . . . . . . . . . . . . A . 18 GLU OE2 . . . . . . . . . c30643_6pv2 1 . 4 . 1861 . 1 1 19 LEU C C 0.033 2.420 0.930 . . . 1.0 . . . . . . . . . . . . A . 19 LEU C . . . . . . . . . c30643_6pv2 1 . 4 . 1862 . 1 1 19 LEU CA C 1.410 2.160 0.335 . . . 1.0 . . . . . . . . . . . . A . 19 LEU CA . . . . . . . . . c30643_6pv2 1 . 4 . 1863 . 1 1 19 LEU CB C 2.300 1.459 1.364 . . . 1.0 . . . . . . . . . . . . A . 19 LEU CB . . . . . . . . . c30643_6pv2 1 . 4 . 1864 . 1 1 19 LEU CD1 C 1.329 -0.832 1.015 . . . 1.0 . . . . . . . . . . . . A . 19 LEU CD1 . . . . . . . . . c30643_6pv2 1 . 4 . 1865 . 1 1 19 LEU CD2 C 2.577 -0.319 3.121 . . . 1.0 . . . . . . . . . . . . A . 19 LEU CD2 . . . . . . . . . c30643_6pv2 1 . 4 . 1866 . 1 1 19 LEU CG C 1.662 0.241 2.043 . . . 1.0 . . . . . . . . . . . . A . 19 LEU CG . . . . . . . . . c30643_6pv2 1 . 4 . 1867 . 1 1 19 LEU H H 2.837 3.731 0.314 . . . 1.0 . . . . . . . . . . . . A . 19 LEU H . . . . . . . . . c30643_6pv2 1 . 4 . 1868 . 1 1 19 LEU HA H 1.298 1.518 -0.528 . . . 1.0 . . . . . . . . . . . . A . 19 LEU HA . . . . . . . . . c30643_6pv2 1 . 4 . 1869 . 1 1 19 LEU HB2 H 3.202 1.138 0.865 . . . 1.0 . . . . . . . . . . . . A . 19 LEU HB2 . . . . . . . . . c30643_6pv2 1 . 4 . 1870 . 1 1 19 LEU HB3 H 2.565 2.173 2.126 . . . 1.0 . . . . . . . . . . . . A . 19 LEU HB3 . . . . . . . . . c30643_6pv2 1 . 4 . 1871 . 1 1 19 LEU HD11 H 2.236 -1.150 0.522 . . . 1.0 . . . . . . . . . . . . A . 19 LEU HD11 . . . . . . . . . c30643_6pv2 1 . 4 . 1872 . 1 1 19 LEU HD12 H 0.644 -0.430 0.283 . . . 1.0 . . . . . . . . . . . . A . 19 LEU HD12 . . . . . . . . . c30643_6pv2 1 . 4 . 1873 . 1 1 19 LEU HD13 H 0.873 -1.675 1.510 . . . 1.0 . . . . . . . . . . . . A . 19 LEU HD13 . . . . . . . . . c30643_6pv2 1 . 4 . 1874 . 1 1 19 LEU HD21 H 3.458 -0.742 2.660 . . . 1.0 . . . . . . . . . . . . A . 19 LEU HD21 . . . . . . . . . c30643_6pv2 1 . 4 . 1875 . 1 1 19 LEU HD22 H 2.057 -1.087 3.673 . . . 1.0 . . . . . . . . . . . . A . 19 LEU HD22 . . . . . . . . . c30643_6pv2 1 . 4 . 1876 . 1 1 19 LEU HD23 H 2.870 0.474 3.793 . . . 1.0 . . . . . . . . . . . . A . 19 LEU HD23 . . . . . . . . . c30643_6pv2 1 . 4 . 1877 . 1 1 19 LEU HG H 0.735 0.544 2.514 . . . 1.0 . . . . . . . . . . . . A . 19 LEU HG . . . . . . . . . c30643_6pv2 1 . 4 . 1878 . 1 1 19 LEU N N 2.013 3.407 -0.117 . . . 1.0 . . . . . . . . . . . . A . 19 LEU N . . . . . . . . . c30643_6pv2 1 . 4 . 1879 . 1 1 19 LEU O O -0.921 1.713 0.624 . . . 1.0 . . . . . . . . . . . . A . 19 LEU O . . . . . . . . . c30643_6pv2 1 . 4 . 1880 . 1 1 20 GLN C C -2.363 4.149 1.316 . . . 1.0 . . . . . . . . . . . . A . 20 GLN C . . . . . . . . . c30643_6pv2 1 . 4 . 1881 . 1 1 20 GLN CA C -1.334 3.812 2.390 . . . 1.0 . . . . . . . . . . . . A . 20 GLN CA . . . . . . . . . c30643_6pv2 1 . 4 . 1882 . 1 1 20 GLN CB C -1.140 4.999 3.336 . . . 1.0 . . . . . . . . . . . . A . 20 GLN CB . . . . . . . . . c30643_6pv2 1 . 4 . 1883 . 1 1 20 GLN CD C -2.902 4.291 5.012 . . . 1.0 . . . . . . . . . . . . A . 20 GLN CD . . . . . . . . . c30643_6pv2 1 . 4 . 1884 . 1 1 20 GLN CG C -2.396 5.395 4.102 . . . 1.0 . . . . . . . . . . . . A . 20 GLN CG . . . . . . . . . c30643_6pv2 1 . 4 . 1885 . 1 1 20 GLN H H 0.745 3.957 1.993 . . . 1.0 . . . . . . . . . . . . A . 20 GLN H . . . . . . . . . c30643_6pv2 1 . 4 . 1886 . 1 1 20 GLN HA H -1.686 2.963 2.955 . . . 1.0 . . . . . . . . . . . . A . 20 GLN HA . . . . . . . . . c30643_6pv2 1 . 4 . 1887 . 1 1 20 GLN HB2 H -0.375 4.747 4.053 . . . 1.0 . . . . . . . . . . . . A . 20 GLN HB2 . . . . . . . . . c30643_6pv2 1 . 4 . 1888 . 1 1 20 GLN HB3 H -0.812 5.853 2.760 . . . 1.0 . . . . . . . . . . . . A . 20 GLN HB3 . . . . . . . . . c30643_6pv2 1 . 4 . 1889 . 1 1 20 GLN HE21 H -4.759 4.972 4.845 . . . 1.0 . . . . . . . . . . . . A . 20 GLN HE21 . . . . . . . . . c30643_6pv2 1 . 4 . 1890 . 1 1 20 GLN HE22 H -4.553 3.574 5.843 . . . 1.0 . . . . . . . . . . . . A . 20 GLN HE22 . . . . . . . . . c30643_6pv2 1 . 4 . 1891 . 1 1 20 GLN HG2 H -2.174 6.263 4.703 . . . 1.0 . . . . . . . . . . . . A . 20 GLN HG2 . . . . . . . . . c30643_6pv2 1 . 4 . 1892 . 1 1 20 GLN HG3 H -3.170 5.639 3.390 . . . 1.0 . . . . . . . . . . . . A . 20 GLN HG3 . . . . . . . . . c30643_6pv2 1 . 4 . 1893 . 1 1 20 GLN N N -0.063 3.441 1.773 . . . 1.0 . . . . . . . . . . . . A . 20 GLN N . . . . . . . . . c30643_6pv2 1 . 4 . 1894 . 1 1 20 GLN NE2 N -4.200 4.276 5.258 . . . 1.0 . . . . . . . . . . . . A . 20 GLN NE2 . . . . . . . . . c30643_6pv2 1 . 4 . 1895 . 1 1 20 GLN O O -3.504 3.679 1.357 . . . 1.0 . . . . . . . . . . . . A . 20 GLN O . . . . . . . . . c30643_6pv2 1 . 4 . 1896 . 1 1 20 GLN OE1 O -2.129 3.469 5.506 . . . 1.0 . . . . . . . . . . . . A . 20 GLN OE1 . . . . . . . . . c30643_6pv2 1 . 4 . 1897 . 1 1 21 ARG C C -3.278 4.036 -1.480 . . . 1.0 . . . . . . . . . . . . A . 21 ARG C . . . . . . . . . c30643_6pv2 1 . 4 . 1898 . 1 1 21 ARG CA C -2.781 5.300 -0.793 . . . 1.0 . . . . . . . . . . . . A . 21 ARG CA . . . . . . . . . c30643_6pv2 1 . 4 . 1899 . 1 1 21 ARG CB C -1.989 6.152 -1.786 . . . 1.0 . . . . . . . . . . . . A . 21 ARG CB . . . . . . . . . c30643_6pv2 1 . 4 . 1900 . 1 1 21 ARG CD C -1.882 7.287 -4.012 . . . 1.0 . . . . . . . . . . . . A . 21 ARG CD . . . . . . . . . c30643_6pv2 1 . 4 . 1901 . 1 1 21 ARG CG C -2.752 6.497 -3.052 . . . 1.0 . . . . . . . . . . . . A . 21 ARG CG . . . . . . . . . c30643_6pv2 1 . 4 . 1902 . 1 1 21 ARG CZ C -1.878 7.522 -6.465 . . . 1.0 . . . . . . . . . . . . A . 21 ARG CZ . . . . . . . . . c30643_6pv2 1 . 4 . 1903 . 1 1 21 ARG H H -1.030 5.324 0.398 . . . 1.0 . . . . . . . . . . . . A . 21 ARG H . . . . . . . . . c30643_6pv2 1 . 4 . 1904 . 1 1 21 ARG HA H -3.629 5.864 -0.432 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HA . . . . . . . . . c30643_6pv2 1 . 4 . 1905 . 1 1 21 ARG HB2 H -1.703 7.073 -1.304 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HB2 . . . . . . . . . c30643_6pv2 1 . 4 . 1906 . 1 1 21 ARG HB3 H -1.098 5.613 -2.067 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HB3 . . . . . . . . . c30643_6pv2 1 . 4 . 1907 . 1 1 21 ARG HD2 H -1.661 8.248 -3.573 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HD2 . . . . . . . . . c30643_6pv2 1 . 4 . 1908 . 1 1 21 ARG HD3 H -0.961 6.746 -4.168 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HD3 . . . . . . . . . c30643_6pv2 1 . 4 . 1909 . 1 1 21 ARG HE H -3.506 7.625 -5.304 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HE . . . . . . . . . c30643_6pv2 1 . 4 . 1910 . 1 1 21 ARG HG2 H -3.066 5.582 -3.532 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HG2 . . . . . . . . . c30643_6pv2 1 . 4 . 1911 . 1 1 21 ARG HG3 H -3.621 7.087 -2.793 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HG3 . . . . . . . . . c30643_6pv2 1 . 4 . 1912 . 1 1 21 ARG HH11 H -0.050 7.235 -5.640 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HH11 . . . . . . . . . c30643_6pv2 1 . 4 . 1913 . 1 1 21 ARG HH12 H -0.066 7.382 -7.367 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HH12 . . . . . . . . . c30643_6pv2 1 . 4 . 1914 . 1 1 21 ARG HH21 H -3.540 7.835 -7.579 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HH21 . . . . . . . . . c30643_6pv2 1 . 4 . 1915 . 1 1 21 ARG HH22 H -2.057 7.730 -8.472 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HH22 . . . . . . . . . c30643_6pv2 1 . 4 . 1916 . 1 1 21 ARG N N -1.940 4.953 0.346 . . . 1.0 . . . . . . . . . . . . A . 21 ARG N . . . . . . . . . c30643_6pv2 1 . 4 . 1917 . 1 1 21 ARG NE N -2.531 7.497 -5.304 . . . 1.0 . . . . . . . . . . . . A . 21 ARG NE . . . . . . . . . c30643_6pv2 1 . 4 . 1918 . 1 1 21 ARG NH1 N -0.558 7.369 -6.493 . . . 1.0 . . . . . . . . . . . . A . 21 ARG NH1 . . . . . . . . . c30643_6pv2 1 . 4 . 1919 . 1 1 21 ARG NH2 N -2.544 7.711 -7.595 . . . 1.0 . . . . . . . . . . . . A . 21 ARG NH2 . . . . . . . . . c30643_6pv2 1 . 4 . 1920 . 1 1 21 ARG O O -4.476 3.871 -1.717 . . . 1.0 . . . . . . . . . . . . A . 21 ARG O . . . . . . . . . c30643_6pv2 1 . 4 . 1921 . 1 1 22 HIS C C -3.654 1.080 -1.573 . . . 1.0 . . . . . . . . . . . . A . 22 HIS C . . . . . . . . . c30643_6pv2 1 . 4 . 1922 . 1 1 22 HIS CA C -2.662 1.880 -2.414 . . . 1.0 . . . . . . . . . . . . A . 22 HIS CA . . . . . . . . . c30643_6pv2 1 . 4 . 1923 . 1 1 22 HIS CB C -1.380 1.072 -2.649 . . . 1.0 . . . . . . . . . . . . A . 22 HIS CB . . . . . . . . . c30643_6pv2 1 . 4 . 1924 . 1 1 22 HIS CD2 C -1.871 -1.428 -2.274 . . . 1.0 . . . . . . . . . . . . A . 22 HIS CD2 . . . . . . . . . c30643_6pv2 1 . 4 . 1925 . 1 1 22 HIS CE1 C -2.088 -2.082 -4.337 . . . 1.0 . . . . . . . . . . . . A . 22 HIS CE1 . . . . . . . . . c30643_6pv2 1 . 4 . 1926 . 1 1 22 HIS CG C -1.638 -0.344 -3.053 . . . 1.0 . . . . . . . . . . . . A . 22 HIS CG . . . . . . . . . c30643_6pv2 1 . 4 . 1927 . 1 1 22 HIS H H -1.407 3.333 -1.546 . . . 1.0 . . . . . . . . . . . . A . 22 HIS H . . . . . . . . . c30643_6pv2 1 . 4 . 1928 . 1 1 22 HIS HA H -3.116 2.101 -3.368 . . . 1.0 . . . . . . . . . . . . A . 22 HIS HA . . . . . . . . . c30643_6pv2 1 . 4 . 1929 . 1 1 22 HIS HB2 H -0.802 1.543 -3.430 . . . 1.0 . . . . . . . . . . . . A . 22 HIS HB2 . . . . . . . . . c30643_6pv2 1 . 4 . 1930 . 1 1 22 HIS HB3 H -0.800 1.058 -1.738 . . . 1.0 . . . . . . . . . . . . A . 22 HIS HB3 . . . . . . . . . c30643_6pv2 1 . 4 . 1931 . 1 1 22 HIS HD1 H -1.640 -0.227 -5.175 . . . 1.0 . . . . . . . . . . . . A . 22 HIS HD1 . . . . . . . . . c30643_6pv2 1 . 4 . 1932 . 1 1 22 HIS HD2 H -1.815 -1.466 -1.196 . . . 1.0 . . . . . . . . . . . . A . 22 HIS HD2 . . . . . . . . . c30643_6pv2 1 . 4 . 1933 . 1 1 22 HIS HE1 H -2.259 -2.701 -5.202 . . . 1.0 . . . . . . . . . . . . A . 22 HIS HE1 . . . . . . . . . c30643_6pv2 1 . 4 . 1934 . 1 1 22 HIS N N -2.344 3.140 -1.774 . . . 1.0 . . . . . . . . . . . . A . 22 HIS N . . . . . . . . . c30643_6pv2 1 . 4 . 1935 . 1 1 22 HIS ND1 N -1.765 -0.777 -4.368 . . . 1.0 . . . . . . . . . . . . A . 22 HIS ND1 . . . . . . . . . c30643_6pv2 1 . 4 . 1936 . 1 1 22 HIS NE2 N -2.156 -2.488 -3.097 . . . 1.0 . . . . . . . . . . . . A . 22 HIS NE2 . . . . . . . . . c30643_6pv2 1 . 4 . 1937 . 1 1 22 HIS O O -4.648 0.579 -2.086 . . . 1.0 . . . . . . . . . . . . A . 22 HIS O . . . . . . . . . c30643_6pv2 1 . 4 . 1938 . 1 1 23 LYS C C -5.665 0.705 0.620 . . . 1.0 . . . . . . . . . . . . A . 23 LYS C . . . . . . . . . c30643_6pv2 1 . 4 . 1939 . 1 1 23 LYS CA C -4.229 0.200 0.624 . . . 1.0 . . . . . . . . . . . . A . 23 LYS CA . . . . . . . . . c30643_6pv2 1 . 4 . 1940 . 1 1 23 LYS CB C -3.678 0.237 2.049 . . . 1.0 . . . . . . . . . . . . A . 23 LYS CB . . . . . . . . . c30643_6pv2 1 . 4 . 1941 . 1 1 23 LYS CD C -2.560 -2.028 1.922 . . . 1.0 . . . . . . . . . . . . A . 23 LYS CD . . . . . . . . . c30643_6pv2 1 . 4 . 1942 . 1 1 23 LYS CE C -3.671 -2.666 2.747 . . . 1.0 . . . . . . . . . . . . A . 23 LYS CE . . . . . . . . . c30643_6pv2 1 . 4 . 1943 . 1 1 23 LYS CG C -2.387 -0.548 2.242 . . . 1.0 . . . . . . . . . . . . A . 23 LYS CG . . . . . . . . . c30643_6pv2 1 . 4 . 1944 . 1 1 23 LYS H H -2.592 1.434 0.081 . . . 1.0 . . . . . . . . . . . . A . 23 LYS H . . . . . . . . . c30643_6pv2 1 . 4 . 1945 . 1 1 23 LYS HA H -4.225 -0.819 0.276 . . . 1.0 . . . . . . . . . . . . A . 23 LYS HA . . . . . . . . . c30643_6pv2 1 . 4 . 1946 . 1 1 23 LYS HB2 H -3.489 1.265 2.318 . . . 1.0 . . . . . . . . . . . . A . 23 LYS HB2 . . . . . . . . . c30643_6pv2 1 . 4 . 1947 . 1 1 23 LYS HB3 H -4.422 -0.168 2.718 . . . 1.0 . . . . . . . . . . . . A . 23 LYS HB3 . . . . . . . . . c30643_6pv2 1 . 4 . 1948 . 1 1 23 LYS HD2 H -2.797 -2.135 0.876 . . . 1.0 . . . . . . . . . . . . A . 23 LYS HD2 . . . . . . . . . c30643_6pv2 1 . 4 . 1949 . 1 1 23 LYS HD3 H -1.631 -2.539 2.135 . . . 1.0 . . . . . . . . . . . . A . 23 LYS HD3 . . . . . . . . . c30643_6pv2 1 . 4 . 1950 . 1 1 23 LYS HE2 H -4.612 -2.210 2.475 . . . 1.0 . . . . . . . . . . . . A . 23 LYS HE2 . . . . . . . . . c30643_6pv2 1 . 4 . 1951 . 1 1 23 LYS HE3 H -3.705 -3.721 2.520 . . . 1.0 . . . . . . . . . . . . A . 23 LYS HE3 . . . . . . . . . c30643_6pv2 1 . 4 . 1952 . 1 1 23 LYS HG2 H -1.630 -0.141 1.590 . . . 1.0 . . . . . . . . . . . . A . 23 LYS HG2 . . . . . . . . . c30643_6pv2 1 . 4 . 1953 . 1 1 23 LYS HG3 H -2.068 -0.447 3.270 . . . 1.0 . . . . . . . . . . . . A . 23 LYS HG3 . . . . . . . . . c30643_6pv2 1 . 4 . 1954 . 1 1 23 LYS HZ1 H -3.474 -1.483 4.456 . . . 1.0 . . . . . . . . . . . . A . 23 LYS HZ1 . . . . . . . . . c30643_6pv2 1 . 4 . 1955 . 1 1 23 LYS HZ2 H -2.530 -2.884 4.482 . . . 1.0 . . . . . . . . . . . . A . 23 LYS HZ2 . . . . . . . . . c30643_6pv2 1 . 4 . 1956 . 1 1 23 LYS HZ3 H -4.195 -2.986 4.743 . . . 1.0 . . . . . . . . . . . . A . 23 LYS HZ3 . . . . . . . . . c30643_6pv2 1 . 4 . 1957 . 1 1 23 LYS N N -3.386 0.976 -0.279 . . . 1.0 . . . . . . . . . . . . A . 23 LYS N . . . . . . . . . c30643_6pv2 1 . 4 . 1958 . 1 1 23 LYS NZ N -3.453 -2.492 4.206 . . . 1.0 . . . . . . . . . . . . A . 23 LYS NZ . . . . . . . . . c30643_6pv2 1 . 4 . 1959 . 1 1 23 LYS O O -6.604 -0.069 0.831 . . . 1.0 . . . . . . . . . . . . A . 23 LYS O . . . . . . . . . c30643_6pv2 1 . 4 . 1960 . 1 1 24 ARG C C -8.003 2.094 -0.837 . . . 1.0 . . . . . . . . . . . . A . 24 ARG C . . . . . . . . . c30643_6pv2 1 . 4 . 1961 . 1 1 24 ARG CA C -7.169 2.586 0.345 . . . 1.0 . . . . . . . . . . . . A . 24 ARG CA . . . . . . . . . c30643_6pv2 1 . 4 . 1962 . 1 1 24 ARG CB C -7.086 4.114 0.361 . . . 1.0 . . . . . . . . . . . . A . 24 ARG CB . . . . . . . . . c30643_6pv2 1 . 4 . 1963 . 1 1 24 ARG CD C -6.600 6.179 1.727 . . . 1.0 . . . . . . . . . . . . A . 24 ARG CD . . . . . . . . . c30643_6pv2 1 . 4 . 1964 . 1 1 24 ARG CG C -6.502 4.663 1.653 . . . 1.0 . . . . . . . . . . . . A . 24 ARG CG . . . . . . . . . c30643_6pv2 1 . 4 . 1965 . 1 1 24 ARG CZ C -4.963 7.781 0.803 . . . 1.0 . . . . . . . . . . . . A . 24 ARG CZ . . . . . . . . . c30643_6pv2 1 . 4 . 1966 . 1 1 24 ARG H H -5.055 2.556 0.139 . . . 1.0 . . . . . . . . . . . . A . 24 ARG H . . . . . . . . . c30643_6pv2 1 . 4 . 1967 . 1 1 24 ARG HA H -7.656 2.264 1.252 . . . 1.0 . . . . . . . . . . . . A . 24 ARG HA . . . . . . . . . c30643_6pv2 1 . 4 . 1968 . 1 1 24 ARG HB2 H -6.464 4.440 -0.460 . . . 1.0 . . . . . . . . . . . . A . 24 ARG HB2 . . . . . . . . . c30643_6pv2 1 . 4 . 1969 . 1 1 24 ARG HB3 H -8.078 4.520 0.236 . . . 1.0 . . . . . . . . . . . . A . 24 ARG HB3 . . . . . . . . . c30643_6pv2 1 . 4 . 1970 . 1 1 24 ARG HD2 H -7.642 6.461 1.684 . . . 1.0 . . . . . . . . . . . . A . 24 ARG HD2 . . . . . . . . . c30643_6pv2 1 . 4 . 1971 . 1 1 24 ARG HD3 H -6.181 6.507 2.665 . . . 1.0 . . . . . . . . . . . . A . 24 ARG HD3 . . . . . . . . . c30643_6pv2 1 . 4 . 1972 . 1 1 24 ARG HE H -6.140 6.581 -0.283 . . . 1.0 . . . . . . . . . . . . A . 24 ARG HE . . . . . . . . . c30643_6pv2 1 . 4 . 1973 . 1 1 24 ARG HG2 H -7.041 4.238 2.487 . . . 1.0 . . . . . . . . . . . . A . 24 ARG HG2 . . . . . . . . . c30643_6pv2 1 . 4 . 1974 . 1 1 24 ARG HG3 H -5.462 4.376 1.715 . . . 1.0 . . . . . . . . . . . . A . 24 ARG HG3 . . . . . . . . . c30643_6pv2 1 . 4 . 1975 . 1 1 24 ARG HH11 H -3.867 8.844 2.137 . . . 1.0 . . . . . . . . . . . . A . 24 ARG HH11 . . . . . . . . . c30643_6pv2 1 . 4 . 1976 . 1 1 24 ARG HH12 H -4.955 7.687 2.831 . . . 1.0 . . . . . . . . . . . . A . 24 ARG HH12 . . . . . . . . . c30643_6pv2 1 . 4 . 1977 . 1 1 24 ARG HH21 H -3.720 9.080 -0.142 . . . 1.0 . . . . . . . . . . . . A . 24 ARG HH21 . . . . . . . . . c30643_6pv2 1 . 4 . 1978 . 1 1 24 ARG HH22 H -4.720 8.110 -1.180 . . . 1.0 . . . . . . . . . . . . A . 24 ARG HH22 . . . . . . . . . c30643_6pv2 1 . 4 . 1979 . 1 1 24 ARG N N -5.840 1.993 0.345 . . . 1.0 . . . . . . . . . . . . A . 24 ARG N . . . . . . . . . c30643_6pv2 1 . 4 . 1980 . 1 1 24 ARG NE N -5.890 6.838 0.634 . . . 1.0 . . . . . . . . . . . . A . 24 ARG NE . . . . . . . . . c30643_6pv2 1 . 4 . 1981 . 1 1 24 ARG NH1 N -4.564 8.132 2.020 . . . 1.0 . . . . . . . . . . . . A . 24 ARG NH1 . . . . . . . . . c30643_6pv2 1 . 4 . 1982 . 1 1 24 ARG NH2 N -4.423 8.367 -0.257 . . . 1.0 . . . . . . . . . . . . A . 24 ARG NH2 . . . . . . . . . c30643_6pv2 1 . 4 . 1983 . 1 1 24 ARG O O -9.193 2.403 -0.936 . . . 1.0 . . . . . . . . . . . . A . 24 ARG O . . . . . . . . . c30643_6pv2 1 . 4 . 1984 . 1 1 25 THR C C -8.788 -0.599 -2.267 . . . 1.0 . . . . . . . . . . . . A . 25 THR C . . . . . . . . . c30643_6pv2 1 . 4 . 1985 . 1 1 25 THR CA C -8.128 0.671 -2.794 . . . 1.0 . . . . . . . . . . . . A . 25 THR CA . . . . . . . . . c30643_6pv2 1 . 4 . 1986 . 1 1 25 THR CB C -7.239 0.319 -4.007 . . . 1.0 . . . . . . . . . . . . A . 25 THR CB . . . . . . . . . c30643_6pv2 1 . 4 . 1987 . 1 1 25 THR CG2 C -6.557 1.561 -4.559 . . . 1.0 . . . . . . . . . . . . A . 25 THR CG2 . . . . . . . . . c30643_6pv2 1 . 4 . 1988 . 1 1 25 THR H H -6.415 1.189 -1.664 . . . 1.0 . . . . . . . . . . . . A . 25 THR H . . . . . . . . . c30643_6pv2 1 . 4 . 1989 . 1 1 25 THR HA H -8.897 1.352 -3.123 . . . 1.0 . . . . . . . . . . . . A . 25 THR HA . . . . . . . . . c30643_6pv2 1 . 4 . 1990 . 1 1 25 THR HB H -7.867 -0.097 -4.780 . . . 1.0 . . . . . . . . . . . . A . 25 THR HB . . . . . . . . . c30643_6pv2 1 . 4 . 1991 . 1 1 25 THR HG1 H -5.544 -0.219 -3.138 . . . 1.0 . . . . . . . . . . . . A . 25 THR HG1 . . . . . . . . . c30643_6pv2 1 . 4 . 1992 . 1 1 25 THR HG21 H -5.947 1.290 -5.408 . . . 1.0 . . . . . . . . . . . . A . 25 THR HG21 . . . . . . . . . c30643_6pv2 1 . 4 . 1993 . 1 1 25 THR HG22 H -5.934 2.000 -3.794 . . . 1.0 . . . . . . . . . . . . A . 25 THR HG22 . . . . . . . . . c30643_6pv2 1 . 4 . 1994 . 1 1 25 THR HG23 H -7.305 2.276 -4.866 . . . 1.0 . . . . . . . . . . . . A . 25 THR HG23 . . . . . . . . . c30643_6pv2 1 . 4 . 1995 . 1 1 25 THR N N -7.387 1.320 -1.727 . . . 1.0 . . . . . . . . . . . . A . 25 THR N . . . . . . . . . c30643_6pv2 1 . 4 . 1996 . 1 1 25 THR O O -9.891 -0.955 -2.677 . . . 1.0 . . . . . . . . . . . . A . 25 THR O . . . . . . . . . c30643_6pv2 1 . 4 . 1997 . 1 1 25 THR OG1 O -6.248 -0.649 -3.645 . . . 1.0 . . . . . . . . . . . . A . 25 THR OG1 . . . . . . . . . c30643_6pv2 1 . 4 . 1998 . 1 1 26 HIS C C -9.697 -2.145 0.300 . . . 1.0 . . . . . . . . . . . . A . 26 HIS C . . . . . . . . . c30643_6pv2 1 . 4 . 1999 . 1 1 26 HIS CA C -8.637 -2.487 -0.732 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CA . . . . . . . . . c30643_6pv2 1 . 4 . 2000 . 1 1 26 HIS CB C -7.529 -3.298 -0.053 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CB . . . . . . . . . c30643_6pv2 1 . 4 . 2001 . 1 1 26 HIS CD2 C -5.144 -3.540 -1.015 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CD2 . . . . . . . . . c30643_6pv2 1 . 4 . 2002 . 1 1 26 HIS CE1 C -5.506 -5.058 -2.536 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CE1 . . . . . . . . . c30643_6pv2 1 . 4 . 2003 . 1 1 26 HIS CG C -6.471 -3.826 -0.970 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CG . . . . . . . . . c30643_6pv2 1 . 4 . 2004 . 1 1 26 HIS H H -7.241 -0.925 -1.034 . . . 1.0 . . . . . . . . . . . . A . 26 HIS H . . . . . . . . . c30643_6pv2 1 . 4 . 2005 . 1 1 26 HIS HA H -9.084 -3.079 -1.513 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HA . . . . . . . . . c30643_6pv2 1 . 4 . 2006 . 1 1 26 HIS HB2 H -7.038 -2.673 0.677 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HB2 . . . . . . . . . c30643_6pv2 1 . 4 . 2007 . 1 1 26 HIS HB3 H -7.976 -4.141 0.454 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HB3 . . . . . . . . . c30643_6pv2 1 . 4 . 2008 . 1 1 26 HIS HD1 H -7.549 -5.214 -2.167 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HD1 . . . . . . . . . c30643_6pv2 1 . 4 . 2009 . 1 1 26 HIS HD2 H -4.619 -2.833 -0.392 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HD2 . . . . . . . . . c30643_6pv2 1 . 4 . 2010 . 1 1 26 HIS HE1 H -5.351 -5.775 -3.329 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HE1 . . . . . . . . . c30643_6pv2 1 . 4 . 2011 . 1 1 26 HIS N N -8.111 -1.268 -1.332 . . . 1.0 . . . . . . . . . . . . A . 26 HIS N . . . . . . . . . c30643_6pv2 1 . 4 . 2012 . 1 1 26 HIS ND1 N -6.689 -4.793 -1.948 . . . 1.0 . . . . . . . . . . . . A . 26 HIS ND1 . . . . . . . . . c30643_6pv2 1 . 4 . 2013 . 1 1 26 HIS NE2 N -4.571 -4.322 -1.994 . . . 1.0 . . . . . . . . . . . . A . 26 HIS NE2 . . . . . . . . . c30643_6pv2 1 . 4 . 2014 . 1 1 26 HIS O O -10.729 -2.810 0.391 . . . 1.0 . . . . . . . . . . . . A . 26 HIS O . . . . . . . . . c30643_6pv2 1 . 4 . 2015 . 1 1 27 THR C C -11.417 0.268 1.537 . . . 1.0 . . . . . . . . . . . . A . 27 THR C . . . . . . . . . c30643_6pv2 1 . 4 . 2016 . 1 1 27 THR CA C -10.356 -0.664 2.110 . . . 1.0 . . . . . . . . . . . . A . 27 THR CA . . . . . . . . . c30643_6pv2 1 . 4 . 2017 . 1 1 27 THR CB C -9.612 0.042 3.259 . . . 1.0 . . . . . . . . . . . . A . 27 THR CB . . . . . . . . . c30643_6pv2 1 . 4 . 2018 . 1 1 27 THR CG2 C -8.759 -0.946 4.044 . . . 1.0 . . . . . . . . . . . . A . 27 THR CG2 . . . . . . . . . c30643_6pv2 1 . 4 . 2019 . 1 1 27 THR H H -8.599 -0.601 0.940 . . . 1.0 . . . . . . . . . . . . A . 27 THR H . . . . . . . . . c30643_6pv2 1 . 4 . 2020 . 1 1 27 THR HA H -10.843 -1.543 2.509 . . . 1.0 . . . . . . . . . . . . A . 27 THR HA . . . . . . . . . c30643_6pv2 1 . 4 . 2021 . 1 1 27 THR HB H -10.345 0.471 3.927 . . . 1.0 . . . . . . . . . . . . A . 27 THR HB . . . . . . . . . c30643_6pv2 1 . 4 . 2022 . 1 1 27 THR HG1 H -9.341 1.843 2.501 . . . 1.0 . . . . . . . . . . . . A . 27 THR HG1 . . . . . . . . . c30643_6pv2 1 . 4 . 2023 . 1 1 27 THR HG21 H -8.045 -1.411 3.381 . . . 1.0 . . . . . . . . . . . . A . 27 THR HG21 . . . . . . . . . c30643_6pv2 1 . 4 . 2024 . 1 1 27 THR HG22 H -9.393 -1.706 4.478 . . . 1.0 . . . . . . . . . . . . A . 27 THR HG22 . . . . . . . . . c30643_6pv2 1 . 4 . 2025 . 1 1 27 THR HG23 H -8.234 -0.424 4.830 . . . 1.0 . . . . . . . . . . . . A . 27 THR HG23 . . . . . . . . . c30643_6pv2 1 . 4 . 2026 . 1 1 27 THR N N -9.436 -1.099 1.073 . . . 1.0 . . . . . . . . . . . . A . 27 THR N . . . . . . . . . c30643_6pv2 1 . 4 . 2027 . 1 1 27 THR O O -11.646 1.368 2.047 . . . 1.0 . . . . . . . . . . . . A . 27 THR O . . . . . . . . . c30643_6pv2 1 . 4 . 2028 . 1 1 27 THR OG1 O -8.784 1.092 2.739 . . . 1.0 . . . . . . . . . . . . A . 27 THR OG1 . . . . . . . . . c30643_6pv2 1 . 4 . 2029 . 1 1 28 GLY C C -14.405 0.457 0.613 . . . 1.0 . . . . . . . . . . . . A . 28 GLY C . . . . . . . . . c30643_6pv2 1 . 4 . 2030 . 1 1 28 GLY CA C -13.105 0.600 -0.147 . . . 1.0 . . . . . . . . . . . . A . 28 GLY CA . . . . . . . . . c30643_6pv2 1 . 4 . 2031 . 1 1 28 GLY H H -11.803 -1.049 0.090 . . . 1.0 . . . . . . . . . . . . A . 28 GLY H . . . . . . . . . c30643_6pv2 1 . 4 . 2032 . 1 1 28 GLY HA2 H -12.813 1.639 -0.163 . . . 1.0 . . . . . . . . . . . . A . 28 GLY HA2 . . . . . . . . . c30643_6pv2 1 . 4 . 2033 . 1 1 28 GLY HA3 H -13.252 0.259 -1.160 . . . 1.0 . . . . . . . . . . . . A . 28 GLY HA3 . . . . . . . . . c30643_6pv2 1 . 4 . 2034 . 1 1 28 GLY N N -12.051 -0.176 0.463 . . . 1.0 . . . . . . . . . . . . A . 28 GLY N . . . . . . . . . c30643_6pv2 1 . 4 . 2035 . 1 1 28 GLY O O -14.779 -0.654 1.000 . . . 1.0 . . . . . . . . . . . . A . 28 GLY O . . . . . . . . . c30643_6pv2 1 . 4 . 2036 . 1 1 29 GLU C C -17.418 0.848 0.799 . . . 1.0 . . . . . . . . . . . . A . 29 GLU C . . . . . . . . . c30643_6pv2 1 . 4 . 2037 . 1 1 29 GLU CA C -16.330 1.560 1.594 . . . 1.0 . . . . . . . . . . . . A . 29 GLU CA . . . . . . . . . c30643_6pv2 1 . 4 . 2038 . 1 1 29 GLU CB C -16.764 2.992 1.920 . . . 1.0 . . . . . . . . . . . . A . 29 GLU CB . . . . . . . . . c30643_6pv2 1 . 4 . 2039 . 1 1 29 GLU CD C -17.304 2.581 4.344 . . . 1.0 . . . . . . . . . . . . A . 29 GLU CD . . . . . . . . . c30643_6pv2 1 . 4 . 2040 . 1 1 29 GLU CG C -17.818 3.079 3.010 . . . 1.0 . . . . . . . . . . . . A . 29 GLU CG . . . . . . . . . c30643_6pv2 1 . 4 . 2041 . 1 1 29 GLU H H -14.742 2.422 0.498 . . . 1.0 . . . . . . . . . . . . A . 29 GLU H . . . . . . . . . c30643_6pv2 1 . 4 . 2042 . 1 1 29 GLU HA H -16.160 1.021 2.515 . . . 1.0 . . . . . . . . . . . . A . 29 GLU HA . . . . . . . . . c30643_6pv2 1 . 4 . 2043 . 1 1 29 GLU HB2 H -15.899 3.554 2.241 . . . 1.0 . . . . . . . . . . . . A . 29 GLU HB2 . . . . . . . . . c30643_6pv2 1 . 4 . 2044 . 1 1 29 GLU HB3 H -17.166 3.447 1.027 . . . 1.0 . . . . . . . . . . . . A . 29 GLU HB3 . . . . . . . . . c30643_6pv2 1 . 4 . 2045 . 1 1 29 GLU HG2 H -18.123 4.109 3.118 . . . 1.0 . . . . . . . . . . . . A . 29 GLU HG2 . . . . . . . . . c30643_6pv2 1 . 4 . 2046 . 1 1 29 GLU HG3 H -18.668 2.479 2.721 . . . 1.0 . . . . . . . . . . . . A . 29 GLU HG3 . . . . . . . . . c30643_6pv2 1 . 4 . 2047 . 1 1 29 GLU N N -15.086 1.570 0.843 . . . 1.0 . . . . . . . . . . . . A . 29 GLU N . . . . . . . . . c30643_6pv2 1 . 4 . 2048 . 1 1 29 GLU O O -18.088 -0.053 1.305 . . . 1.0 . . . . . . . . . . . . A . 29 GLU O . . . . . . . . . c30643_6pv2 1 . 4 . 2049 . 1 1 29 GLU OE1 O -16.459 3.269 4.953 . . . 1.0 . . . . . . . . . . . . A . 29 GLU OE1 . . . . . . . . . c30643_6pv2 1 . 4 . 2050 . 1 1 29 GLU OE2 O -17.743 1.503 4.796 . . . 1.0 . . . . . . . . . . . . A . 29 GLU OE2 . . . . . . . . . c30643_6pv2 1 . 4 . 2051 . 1 1 30 LYS C C -17.882 0.078 -2.571 . . . 1.0 . . . . . . . . . . . . A . 30 LYS C . . . . . . . . . c30643_6pv2 1 . 4 . 2052 . 1 1 30 LYS CA C -18.561 0.636 -1.331 . . . 1.0 . . . . . . . . . . . . A . 30 LYS CA . . . . . . . . . c30643_6pv2 1 . 4 . 2053 . 1 1 30 LYS CB C -19.636 1.651 -1.725 . . . 1.0 . . . . . . . . . . . . A . 30 LYS CB . . . . . . . . . c30643_6pv2 1 . 4 . 2054 . 1 1 30 LYS CD C -21.544 3.117 -0.994 . . . 1.0 . . . . . . . . . . . . A . 30 LYS CD . . . . . . . . . c30643_6pv2 1 . 4 . 2055 . 1 1 30 LYS CE C -22.487 3.469 0.145 . . . 1.0 . . . . . . . . . . . . A . 30 LYS CE . . . . . . . . . c30643_6pv2 1 . 4 . 2056 . 1 1 30 LYS CG C -20.534 2.064 -0.570 . . . 1.0 . . . . . . . . . . . . A . 30 LYS CG . . . . . . . . . c30643_6pv2 1 . 4 . 2057 . 1 1 30 LYS H H -17.018 1.976 -0.798 . . . 1.0 . . . . . . . . . . . . A . 30 LYS H . . . . . . . . . c30643_6pv2 1 . 4 . 2058 . 1 1 30 LYS HA H -19.025 -0.177 -0.792 . . . 1.0 . . . . . . . . . . . . A . 30 LYS HA . . . . . . . . . c30643_6pv2 1 . 4 . 2059 . 1 1 30 LYS HB2 H -19.154 2.538 -2.111 . . . 1.0 . . . . . . . . . . . . A . 30 LYS HB2 . . . . . . . . . c30643_6pv2 1 . 4 . 2060 . 1 1 30 LYS HB3 H -20.255 1.222 -2.500 . . . 1.0 . . . . . . . . . . . . A . 30 LYS HB3 . . . . . . . . . c30643_6pv2 1 . 4 . 2061 . 1 1 30 LYS HD2 H -21.015 4.007 -1.299 . . . 1.0 . . . . . . . . . . . . A . 30 LYS HD2 . . . . . . . . . c30643_6pv2 1 . 4 . 2062 . 1 1 30 LYS HD3 H -22.122 2.736 -1.823 . . . 1.0 . . . . . . . . . . . . A . 30 LYS HD3 . . . . . . . . . c30643_6pv2 1 . 4 . 2063 . 1 1 30 LYS HE2 H -23.071 2.595 0.393 . . . 1.0 . . . . . . . . . . . . A . 30 LYS HE2 . . . . . . . . . c30643_6pv2 1 . 4 . 2064 . 1 1 30 LYS HE3 H -21.901 3.762 1.003 . . . 1.0 . . . . . . . . . . . . A . 30 LYS HE3 . . . . . . . . . c30643_6pv2 1 . 4 . 2065 . 1 1 30 LYS HG2 H -21.064 1.194 -0.210 . . . 1.0 . . . . . . . . . . . . A . 30 LYS HG2 . . . . . . . . . c30643_6pv2 1 . 4 . 2066 . 1 1 30 LYS HG3 H -19.921 2.466 0.223 . . . 1.0 . . . . . . . . . . . . A . 30 LYS HG3 . . . . . . . . . c30643_6pv2 1 . 4 . 2067 . 1 1 30 LYS HZ1 H -23.999 4.308 -1.025 . . . 1.0 . . . . . . . . . . . . A . 30 LYS HZ1 . . . . . . . . . c30643_6pv2 1 . 4 . 2068 . 1 1 30 LYS HZ2 H -22.868 5.429 -0.462 . . . 1.0 . . . . . . . . . . . . A . 30 LYS HZ2 . . . . . . . . . c30643_6pv2 1 . 4 . 2069 . 1 1 30 LYS HZ3 H -24.029 4.800 0.591 . . . 1.0 . . . . . . . . . . . . A . 30 LYS HZ3 . . . . . . . . . c30643_6pv2 1 . 4 . 2070 . 1 1 30 LYS N N -17.580 1.249 -0.453 . . . 1.0 . . . . . . . . . . . . A . 30 LYS N . . . . . . . . . c30643_6pv2 1 . 4 . 2071 . 1 1 30 LYS NZ N -23.410 4.577 -0.213 . . . 1.0 . . . . . . . . . . . . A . 30 LYS NZ . . . . . . . . . c30643_6pv2 1 . 4 . 2072 . 1 1 30 LYS O O -17.843 0.720 -3.620 . . . 1.0 . . . . . . . . . . . . A . 30 LYS O . . . . . . . . . c30643_6pv2 1 . 4 . 2073 . 1 1 31 NH2 HN1 H -17.405 -1.569 -1.577 . . . 1.0 . . . . . . . . . . . . A . 31 NH2 HN1 . . . . . . . . . c30643_6pv2 1 . 4 . 2074 . 1 1 31 NH2 HN2 H -16.879 -1.499 -3.221 . . . 1.0 . . . . . . . . . . . . A . 31 NH2 HN2 . . . . . . . . . c30643_6pv2 1 . 4 . 2075 . 1 1 31 NH2 N N -17.334 -1.114 -2.445 . . . 1.0 . . . . . . . . . . . . A . 31 NH2 N . . . . . . . . . c30643_6pv2 1 . 4 . 2076 . 2 2 1 ZN ZN Zn -2.635 -4.315 -2.479 . . . 1.0 . . . . . . . . . . . . A . 101 ZN ZN . . . . . . . . . c30643_6pv2 1 . 5 . 2077 . 1 1 1 ARG C C 11.716 -0.794 2.814 . . . 1.0 . . . . . . . . . . . . A . 1 ARG C . . . . . . . . . c30643_6pv2 1 . 5 . 2078 . 1 1 1 ARG CA C 12.769 -1.237 3.821 . . . 1.0 . . . . . . . . . . . . A . 1 ARG CA . . . . . . . . . c30643_6pv2 1 . 5 . 2079 . 1 1 1 ARG CB C 12.077 -1.907 5.017 . . . 1.0 . . . . . . . . . . . . A . 1 ARG CB . . . . . . . . . c30643_6pv2 1 . 5 . 2080 . 1 1 1 ARG CD C 10.200 -1.827 6.698 . . . 1.0 . . . . . . . . . . . . A . 1 ARG CD . . . . . . . . . c30643_6pv2 1 . 5 . 2081 . 1 1 1 ARG CG C 10.976 -1.059 5.641 . . . 1.0 . . . . . . . . . . . . A . 1 ARG CG . . . . . . . . . c30643_6pv2 1 . 5 . 2082 . 1 1 1 ARG CZ C 10.648 -3.008 8.815 . . . 1.0 . . . . . . . . . . . . A . 1 ARG CZ . . . . . . . . . c30643_6pv2 1 . 5 . 2083 . 1 1 1 ARG H1 H 14.239 -0.347 4.998 . . . 1.0 . . . . . . . . . . . . A . 1 ARG H1 . . . . . . . . . c30643_6pv2 1 . 5 . 2084 . 1 1 1 ARG H2 H 12.925 0.660 4.655 . . . 1.0 . . . . . . . . . . . . A . 1 ARG H2 . . . . . . . . . c30643_6pv2 1 . 5 . 2085 . 1 1 1 ARG H3 H 14.074 0.339 3.461 . . . 1.0 . . . . . . . . . . . . A . 1 ARG H3 . . . . . . . . . c30643_6pv2 1 . 5 . 2086 . 1 1 1 ARG HA H 13.437 -1.941 3.349 . . . 1.0 . . . . . . . . . . . . A . 1 ARG HA . . . . . . . . . c30643_6pv2 1 . 5 . 2087 . 1 1 1 ARG HB2 H 11.641 -2.839 4.692 . . . 1.0 . . . . . . . . . . . . A . 1 ARG HB2 . . . . . . . . . c30643_6pv2 1 . 5 . 2088 . 1 1 1 ARG HB3 H 12.817 -2.112 5.778 . . . 1.0 . . . . . . . . . . . . A . 1 ARG HB3 . . . . . . . . . c30643_6pv2 1 . 5 . 2089 . 1 1 1 ARG HD2 H 9.371 -1.219 7.031 . . . 1.0 . . . . . . . . . . . . A . 1 ARG HD2 . . . . . . . . . c30643_6pv2 1 . 5 . 2090 . 1 1 1 ARG HD3 H 9.819 -2.738 6.257 . . . 1.0 . . . . . . . . . . . . A . 1 ARG HD3 . . . . . . . . . c30643_6pv2 1 . 5 . 2091 . 1 1 1 ARG HE H 11.908 -1.738 7.917 . . . 1.0 . . . . . . . . . . . . A . 1 ARG HE . . . . . . . . . c30643_6pv2 1 . 5 . 2092 . 1 1 1 ARG HG2 H 11.425 -0.189 6.100 . . . 1.0 . . . . . . . . . . . . A . 1 ARG HG2 . . . . . . . . . c30643_6pv2 1 . 5 . 2093 . 1 1 1 ARG HG3 H 10.296 -0.744 4.863 . . . 1.0 . . . . . . . . . . . . A . 1 ARG HG3 . . . . . . . . . c30643_6pv2 1 . 5 . 2094 . 1 1 1 ARG HH11 H 9.187 -4.251 9.472 . . . 1.0 . . . . . . . . . . . . A . 1 ARG HH11 . . . . . . . . . c30643_6pv2 1 . 5 . 2095 . 1 1 1 ARG HH12 H 8.864 -3.459 7.964 . . . 1.0 . . . . . . . . . . . . A . 1 ARG HH12 . . . . . . . . . c30643_6pv2 1 . 5 . 2096 . 1 1 1 ARG HH21 H 12.344 -2.782 9.900 . . . 1.0 . . . . . . . . . . . . A . 1 ARG HH21 . . . . . . . . . c30643_6pv2 1 . 5 . 2097 . 1 1 1 ARG HH22 H 11.171 -3.871 10.572 . . . 1.0 . . . . . . . . . . . . A . 1 ARG HH22 . . . . . . . . . c30643_6pv2 1 . 5 . 2098 . 1 1 1 ARG N N 13.556 -0.067 4.266 . . . 1.0 . . . . . . . . . . . . A . 1 ARG N . . . . . . . . . c30643_6pv2 1 . 5 . 2099 . 1 1 1 ARG NE N 11.027 -2.170 7.851 . . . 1.0 . . . . . . . . . . . . A . 1 ARG NE . . . . . . . . . c30643_6pv2 1 . 5 . 2100 . 1 1 1 ARG NH1 N 9.472 -3.620 8.743 . . . 1.0 . . . . . . . . . . . . A . 1 ARG NH1 . . . . . . . . . c30643_6pv2 1 . 5 . 2101 . 1 1 1 ARG NH2 N 11.451 -3.238 9.844 . . . 1.0 . . . . . . . . . . . . A . 1 ARG NH2 . . . . . . . . . c30643_6pv2 1 . 5 . 2102 . 1 1 1 ARG O O 11.228 0.334 2.880 . . . 1.0 . . . . . . . . . . . . A . 1 ARG O . . . . . . . . . c30643_6pv2 1 . 5 . 2103 . 1 1 2 PRO C C 8.916 -1.583 1.605 . . . 1.0 . . . . . . . . . . . . A . 2 PRO C . . . . . . . . . c30643_6pv2 1 . 5 . 2104 . 1 1 2 PRO CA C 10.270 -1.388 0.935 . . . 1.0 . . . . . . . . . . . . A . 2 PRO CA . . . . . . . . . c30643_6pv2 1 . 5 . 2105 . 1 1 2 PRO CB C 10.472 -2.411 -0.179 . . . 1.0 . . . . . . . . . . . . A . 2 PRO CB . . . . . . . . . c30643_6pv2 1 . 5 . 2106 . 1 1 2 PRO CD C 12.007 -2.961 1.579 . . . 1.0 . . . . . . . . . . . . A . 2 PRO CD . . . . . . . . . c30643_6pv2 1 . 5 . 2107 . 1 1 2 PRO CG C 11.153 -3.555 0.485 . . . 1.0 . . . . . . . . . . . . A . 2 PRO CG . . . . . . . . . c30643_6pv2 1 . 5 . 2108 . 1 1 2 PRO HA H 10.332 -0.388 0.531 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HA . . . . . . . . . c30643_6pv2 1 . 5 . 2109 . 1 1 2 PRO HB2 H 9.512 -2.699 -0.585 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HB2 . . . . . . . . . c30643_6pv2 1 . 5 . 2110 . 1 1 2 PRO HB3 H 11.088 -1.983 -0.956 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HB3 . . . . . . . . . c30643_6pv2 1 . 5 . 2111 . 1 1 2 PRO HD2 H 11.991 -3.594 2.453 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HD2 . . . . . . . . . c30643_6pv2 1 . 5 . 2112 . 1 1 2 PRO HD3 H 13.020 -2.820 1.231 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HD3 . . . . . . . . . c30643_6pv2 1 . 5 . 2113 . 1 1 2 PRO HG2 H 10.415 -4.222 0.906 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HG2 . . . . . . . . . c30643_6pv2 1 . 5 . 2114 . 1 1 2 PRO HG3 H 11.768 -4.080 -0.230 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HG3 . . . . . . . . . c30643_6pv2 1 . 5 . 2115 . 1 1 2 PRO N N 11.363 -1.661 1.856 . . . 1.0 . . . . . . . . . . . . A . 2 PRO N . . . . . . . . . c30643_6pv2 1 . 5 . 2116 . 1 1 2 PRO O O 8.756 -2.447 2.471 . . . 1.0 . . . . . . . . . . . . A . 2 PRO O . . . . . . . . . c30643_6pv2 1 . 5 . 2117 . 1 1 3 PHE C C 5.733 -1.713 0.919 . . . 1.0 . . . . . . . . . . . . A . 3 PHE C . . . . . . . . . c30643_6pv2 1 . 5 . 2118 . 1 1 3 PHE CA C 6.624 -0.827 1.776 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CA . . . . . . . . . c30643_6pv2 1 . 5 . 2119 . 1 1 3 PHE CB C 6.055 0.587 1.879 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CB . . . . . . . . . c30643_6pv2 1 . 5 . 2120 . 1 1 3 PHE CD1 C 7.833 2.319 2.224 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CD1 . . . . . . . . . c30643_6pv2 1 . 5 . 2121 . 1 1 3 PHE CD2 C 6.682 1.476 4.132 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CD2 . . . . . . . . . c30643_6pv2 1 . 5 . 2122 . 1 1 3 PHE CE1 C 8.589 3.138 3.037 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CE1 . . . . . . . . . c30643_6pv2 1 . 5 . 2123 . 1 1 3 PHE CE2 C 7.435 2.294 4.951 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CE2 . . . . . . . . . c30643_6pv2 1 . 5 . 2124 . 1 1 3 PHE CG C 6.871 1.481 2.763 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CG . . . . . . . . . c30643_6pv2 1 . 5 . 2125 . 1 1 3 PHE CZ C 8.392 3.126 4.403 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CZ . . . . . . . . . c30643_6pv2 1 . 5 . 2126 . 1 1 3 PHE H H 8.144 -0.130 0.493 . . . 1.0 . . . . . . . . . . . . A . 3 PHE H . . . . . . . . . c30643_6pv2 1 . 5 . 2127 . 1 1 3 PHE HA H 6.699 -1.254 2.764 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HA . . . . . . . . . c30643_6pv2 1 . 5 . 2128 . 1 1 3 PHE HB2 H 6.021 1.031 0.897 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HB2 . . . . . . . . . c30643_6pv2 1 . 5 . 2129 . 1 1 3 PHE HB3 H 5.057 0.542 2.284 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HB3 . . . . . . . . . c30643_6pv2 1 . 5 . 2130 . 1 1 3 PHE HD1 H 7.987 2.331 1.155 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HD1 . . . . . . . . . c30643_6pv2 1 . 5 . 2131 . 1 1 3 PHE HD2 H 5.935 0.824 4.560 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HD2 . . . . . . . . . c30643_6pv2 1 . 5 . 2132 . 1 1 3 PHE HE1 H 9.334 3.787 2.604 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HE1 . . . . . . . . . c30643_6pv2 1 . 5 . 2133 . 1 1 3 PHE HE2 H 7.276 2.280 6.019 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HE2 . . . . . . . . . c30643_6pv2 1 . 5 . 2134 . 1 1 3 PHE HZ H 8.982 3.767 5.041 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HZ . . . . . . . . . c30643_6pv2 1 . 5 . 2135 . 1 1 3 PHE N N 7.956 -0.778 1.207 . . . 1.0 . . . . . . . . . . . . A . 3 PHE N . . . . . . . . . c30643_6pv2 1 . 5 . 2136 . 1 1 3 PHE O O 5.149 -1.266 -0.063 . . . 1.0 . . . . . . . . . . . . A . 3 PHE O . . . . . . . . . c30643_6pv2 1 . 5 . 2137 . 1 1 4 NLE C C 3.555 -4.232 1.054 . . . 1.0 . . . . . . . . . . . . A . 4 NLE C . . . . . . . . . c30643_6pv2 1 . 5 . 2138 . 1 1 4 NLE CA C 4.947 -3.966 0.493 . . . 1.0 . . . . . . . . . . . . A . 4 NLE CA . . . . . . . . . c30643_6pv2 1 . 5 . 2139 . 1 1 4 NLE CB C 5.756 -5.266 0.446 . . . 1.0 . . . . . . . . . . . . A . 4 NLE CB . . . . . . . . . c30643_6pv2 1 . 5 . 2140 . 1 1 4 NLE CD C 6.021 -7.589 -0.474 . . . 1.0 . . . . . . . . . . . . A . 4 NLE CD . . . . . . . . . c30643_6pv2 1 . 5 . 2141 . 1 1 4 NLE CE C 5.406 -8.636 -1.377 . . . 1.0 . . . . . . . . . . . . A . 4 NLE CE . . . . . . . . . c30643_6pv2 1 . 5 . 2142 . 1 1 4 NLE CG C 5.157 -6.338 -0.452 . . . 1.0 . . . . . . . . . . . . A . 4 NLE CG . . . . . . . . . c30643_6pv2 1 . 5 . 2143 . 1 1 4 NLE H H 6.063 -3.250 2.139 . . . 1.0 . . . . . . . . . . . . A . 4 NLE H . . . . . . . . . c30643_6pv2 1 . 5 . 2144 . 1 1 4 NLE HA H 4.850 -3.574 -0.507 . . . 1.0 . . . . . . . . . . . . A . 4 NLE HA . . . . . . . . . c30643_6pv2 1 . 5 . 2145 . 1 1 4 NLE HB2 H 5.826 -5.666 1.447 . . . 1.0 . . . . . . . . . . . . A . 4 NLE HB2 . . . . . . . . . c30643_6pv2 1 . 5 . 2146 . 1 1 4 NLE HB3 H 6.750 -5.044 0.090 . . . 1.0 . . . . . . . . . . . . A . 4 NLE HB3 . . . . . . . . . c30643_6pv2 1 . 5 . 2147 . 1 1 4 NLE HD2 H 6.097 -7.992 0.526 . . . 1.0 . . . . . . . . . . . . A . 4 NLE HD2 . . . . . . . . . c30643_6pv2 1 . 5 . 2148 . 1 1 4 NLE HD3 H 7.002 -7.340 -0.850 . . . 1.0 . . . . . . . . . . . . A . 4 NLE HD3 . . . . . . . . . c30643_6pv2 1 . 5 . 2149 . 1 1 4 NLE HE1 H 4.433 -8.910 -1.001 . . . 1.0 . . . . . . . . . . . . A . 4 NLE HE1 . . . . . . . . . c30643_6pv2 1 . 5 . 2150 . 1 1 4 NLE HE2 H 6.042 -9.509 -1.401 . . . 1.0 . . . . . . . . . . . . A . 4 NLE HE2 . . . . . . . . . c30643_6pv2 1 . 5 . 2151 . 1 1 4 NLE HE3 H 5.308 -8.236 -2.376 . . . 1.0 . . . . . . . . . . . . A . 4 NLE HE3 . . . . . . . . . c30643_6pv2 1 . 5 . 2152 . 1 1 4 NLE HG2 H 5.077 -5.949 -1.456 . . . 1.0 . . . . . . . . . . . . A . 4 NLE HG2 . . . . . . . . . c30643_6pv2 1 . 5 . 2153 . 1 1 4 NLE HG3 H 4.174 -6.595 -0.084 . . . 1.0 . . . . . . . . . . . . A . 4 NLE HG3 . . . . . . . . . c30643_6pv2 1 . 5 . 2154 . 1 1 4 NLE N N 5.651 -2.977 1.293 . . . 1.0 . . . . . . . . . . . . A . 4 NLE N . . . . . . . . . c30643_6pv2 1 . 5 . 2155 . 1 1 4 NLE O O 3.378 -4.379 2.268 . . . 1.0 . . . . . . . . . . . . A . 4 NLE O . . . . . . . . . c30643_6pv2 1 . 5 . 2156 . 1 1 5 CYS C C 1.117 -6.069 0.957 . . . 1.0 . . . . . . . . . . . . A . 5 CYS C . . . . . . . . . c30643_6pv2 1 . 5 . 2157 . 1 1 5 CYS CA C 1.208 -4.604 0.532 . . . 1.0 . . . . . . . . . . . . A . 5 CYS CA . . . . . . . . . c30643_6pv2 1 . 5 . 2158 . 1 1 5 CYS CB C 0.259 -4.321 -0.640 . . . 1.0 . . . . . . . . . . . . A . 5 CYS CB . . . . . . . . . c30643_6pv2 1 . 5 . 2159 . 1 1 5 CYS H H 2.781 -4.068 -0.778 . . . 1.0 . . . . . . . . . . . . A . 5 CYS H . . . . . . . . . c30643_6pv2 1 . 5 . 2160 . 1 1 5 CYS HA H 0.930 -3.981 1.368 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HA . . . . . . . . . c30643_6pv2 1 . 5 . 2161 . 1 1 5 CYS HB2 H 0.237 -3.256 -0.825 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HB2 . . . . . . . . . c30643_6pv2 1 . 5 . 2162 . 1 1 5 CYS HB3 H 0.626 -4.823 -1.519 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HB3 . . . . . . . . . c30643_6pv2 1 . 5 . 2163 . 1 1 5 CYS N N 2.574 -4.271 0.163 . . . 1.0 . . . . . . . . . . . . A . 5 CYS N . . . . . . . . . c30643_6pv2 1 . 5 . 2164 . 1 1 5 CYS O O 1.866 -6.914 0.468 . . . 1.0 . . . . . . . . . . . . A . 5 CYS O . . . . . . . . . c30643_6pv2 1 . 5 . 2165 . 1 1 5 CYS SG S -1.445 -4.859 -0.363 . . . 1.0 . . . . . . . . . . . . A . 5 CYS SG . . . . . . . . . c30643_6pv2 1 . 5 . 2166 . 1 1 6 THR C C -1.424 -8.070 2.524 . . . 1.0 . . . . . . . . . . . . A . 6 THR C . . . . . . . . . c30643_6pv2 1 . 5 . 2167 . 1 1 6 THR CA C 0.050 -7.699 2.407 . . . 1.0 . . . . . . . . . . . . A . 6 THR CA . . . . . . . . . c30643_6pv2 1 . 5 . 2168 . 1 1 6 THR CB C 0.723 -7.821 3.788 . . . 1.0 . . . . . . . . . . . . A . 6 THR CB . . . . . . . . . c30643_6pv2 1 . 5 . 2169 . 1 1 6 THR CG2 C 2.228 -7.990 3.653 . . . 1.0 . . . . . . . . . . . . A . 6 THR CG2 . . . . . . . . . c30643_6pv2 1 . 5 . 2170 . 1 1 6 THR H H -0.386 -5.649 2.193 . . . 1.0 . . . . . . . . . . . . A . 6 THR H . . . . . . . . . c30643_6pv2 1 . 5 . 2171 . 1 1 6 THR HA H 0.532 -8.388 1.731 . . . 1.0 . . . . . . . . . . . . A . 6 THR HA . . . . . . . . . c30643_6pv2 1 . 5 . 2172 . 1 1 6 THR HB H 0.323 -8.690 4.291 . . . 1.0 . . . . . . . . . . . . A . 6 THR HB . . . . . . . . . c30643_6pv2 1 . 5 . 2173 . 1 1 6 THR HG1 H -0.094 -6.909 5.343 . . . 1.0 . . . . . . . . . . . . A . 6 THR HG1 . . . . . . . . . c30643_6pv2 1 . 5 . 2174 . 1 1 6 THR HG21 H 2.639 -7.144 3.122 . . . 1.0 . . . . . . . . . . . . A . 6 THR HG21 . . . . . . . . . c30643_6pv2 1 . 5 . 2175 . 1 1 6 THR HG22 H 2.442 -8.897 3.106 . . . 1.0 . . . . . . . . . . . . A . 6 THR HG22 . . . . . . . . . c30643_6pv2 1 . 5 . 2176 . 1 1 6 THR HG23 H 2.675 -8.048 4.636 . . . 1.0 . . . . . . . . . . . . A . 6 THR HG23 . . . . . . . . . c30643_6pv2 1 . 5 . 2177 . 1 1 6 THR N N 0.207 -6.357 1.872 . . . 1.0 . . . . . . . . . . . . A . 6 THR N . . . . . . . . . c30643_6pv2 1 . 5 . 2178 . 1 1 6 THR O O -1.904 -8.440 3.597 . . . 1.0 . . . . . . . . . . . . A . 6 THR O . . . . . . . . . c30643_6pv2 1 . 5 . 2179 . 1 1 6 THR OG1 O 0.436 -6.654 4.575 . . . 1.0 . . . . . . . . . . . . A . 6 THR OG1 . . . . . . . . . c30643_6pv2 1 . 5 . 2180 . 1 1 7 TRP C C -3.798 -9.612 0.703 . . . 1.0 . . . . . . . . . . . . A . 7 TRP C . . . . . . . . . c30643_6pv2 1 . 5 . 2181 . 1 1 7 TRP CA C -3.562 -8.280 1.404 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CA . . . . . . . . . c30643_6pv2 1 . 5 . 2182 . 1 1 7 TRP CB C -4.350 -7.166 0.715 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CB . . . . . . . . . c30643_6pv2 1 . 5 . 2183 . 1 1 7 TRP CD1 C -6.738 -7.934 0.192 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CD1 . . . . . . . . . c30643_6pv2 1 . 5 . 2184 . 1 1 7 TRP CD2 C -6.566 -6.631 2.002 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CD2 . . . . . . . . . c30643_6pv2 1 . 5 . 2185 . 1 1 7 TRP CE2 C -7.917 -6.981 1.830 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CE2 . . . . . . . . . c30643_6pv2 1 . 5 . 2186 . 1 1 7 TRP CE3 C -6.212 -5.813 3.079 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CE3 . . . . . . . . . c30643_6pv2 1 . 5 . 2187 . 1 1 7 TRP CG C -5.828 -7.253 0.945 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CG . . . . . . . . . c30643_6pv2 1 . 5 . 2188 . 1 1 7 TRP CH2 C -8.542 -5.740 3.740 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CH2 . . . . . . . . . c30643_6pv2 1 . 5 . 2189 . 1 1 7 TRP CZ2 C -8.917 -6.540 2.695 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CZ2 . . . . . . . . . c30643_6pv2 1 . 5 . 2190 . 1 1 7 TRP CZ3 C -7.204 -5.376 3.937 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CZ3 . . . . . . . . . c30643_6pv2 1 . 5 . 2191 . 1 1 7 TRP H H -1.712 -7.669 0.587 . . . 1.0 . . . . . . . . . . . . A . 7 TRP H . . . . . . . . . c30643_6pv2 1 . 5 . 2192 . 1 1 7 TRP HA H -3.893 -8.364 2.429 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HA . . . . . . . . . c30643_6pv2 1 . 5 . 2193 . 1 1 7 TRP HB2 H -4.010 -6.211 1.083 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HB2 . . . . . . . . . c30643_6pv2 1 . 5 . 2194 . 1 1 7 TRP HB3 H -4.175 -7.219 -0.348 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HB3 . . . . . . . . . c30643_6pv2 1 . 5 . 2195 . 1 1 7 TRP HD1 H -6.488 -8.509 -0.686 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HD1 . . . . . . . . . c30643_6pv2 1 . 5 . 2196 . 1 1 7 TRP HE1 H -8.819 -8.175 0.356 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HE1 . . . . . . . . . c30643_6pv2 1 . 5 . 2197 . 1 1 7 TRP HE3 H -5.185 -5.524 3.246 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HE3 . . . . . . . . . c30643_6pv2 1 . 5 . 2198 . 1 1 7 TRP HH2 H -9.284 -5.376 4.435 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HH2 . . . . . . . . . c30643_6pv2 1 . 5 . 2199 . 1 1 7 TRP HZ2 H -9.954 -6.813 2.557 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HZ2 . . . . . . . . . c30643_6pv2 1 . 5 . 2200 . 1 1 7 TRP HZ3 H -6.949 -4.744 4.775 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HZ3 . . . . . . . . . c30643_6pv2 1 . 5 . 2201 . 1 1 7 TRP N N -2.144 -7.964 1.417 . . . 1.0 . . . . . . . . . . . . A . 7 TRP N . . . . . . . . . c30643_6pv2 1 . 5 . 2202 . 1 1 7 TRP NE1 N -7.996 -7.778 0.719 . . . 1.0 . . . . . . . . . . . . A . 7 TRP NE1 . . . . . . . . . c30643_6pv2 1 . 5 . 2203 . 1 1 7 TRP O O -4.098 -9.654 -0.492 . . . 1.0 . . . . . . . . . . . . A . 7 TRP O . . . . . . . . . c30643_6pv2 1 . 5 . 2204 . 1 1 8 ORN C C -1.565 -10.876 -2.527 . . . 1.0 . . . . . . . . . . . . A . 8 ORN C . . . . . . . . . c30643_6pv2 1 . 5 . 2205 . 1 1 8 ORN CA C -2.193 -12.010 -1.731 . . . 1.0 . . . . . . . . . . . . A . 8 ORN CA . . . . . . . . . c30643_6pv2 1 . 5 . 2206 . 1 1 8 ORN CB C -1.604 -12.035 -0.317 . . . 1.0 . . . . . . . . . . . . A . 8 ORN CB . . . . . . . . . c30643_6pv2 1 . 5 . 2207 . 1 1 8 ORN CD C -3.791 -12.061 0.934 . . . 1.0 . . . . . . . . . . . . A . 8 ORN CD . . . . . . . . . c30643_6pv2 1 . 5 . 2208 . 1 1 8 ORN CG C -2.464 -12.775 0.694 . . . 1.0 . . . . . . . . . . . . A . 8 ORN CG . . . . . . . . . c30643_6pv2 1 . 5 . 2209 . 1 1 8 ORN H H -2.398 -14.078 -1.838 . . . 1.0 . . . . . . . . . . . . A . 8 ORN H . . . . . . . . . c30643_6pv2 1 . 5 . 2210 . 1 1 8 ORN HA H -3.256 -11.832 -1.662 . . . 1.0 . . . . . . . . . . . . A . 8 ORN HA . . . . . . . . . c30643_6pv2 1 . 5 . 2211 . 1 1 8 ORN HB2 H -1.482 -11.018 0.026 . . . 1.0 . . . . . . . . . . . . A . 8 ORN HB2 . . . . . . . . . c30643_6pv2 1 . 5 . 2212 . 1 1 8 ORN HB3 H -0.636 -12.511 -0.351 . . . 1.0 . . . . . . . . . . . . A . 8 ORN HB3 . . . . . . . . . c30643_6pv2 1 . 5 . 2213 . 1 1 8 ORN HD2 H -4.362 -12.623 1.657 . . . 1.0 . . . . . . . . . . . . A . 8 ORN HD2 . . . . . . . . . c30643_6pv2 1 . 5 . 2214 . 1 1 8 ORN HD3 H -4.337 -12.016 0.004 . . . 1.0 . . . . . . . . . . . . A . 8 ORN HD3 . . . . . . . . . c30643_6pv2 1 . 5 . 2215 . 1 1 8 ORN HE1 H -3.317 -10.593 2.367 . . . 1.0 . . . . . . . . . . . . A . 8 ORN HE1 . . . . . . . . . c30643_6pv2 1 . 5 . 2216 . 1 1 8 ORN HG2 H -1.925 -12.842 1.628 . . . 1.0 . . . . . . . . . . . . A . 8 ORN HG2 . . . . . . . . . c30643_6pv2 1 . 5 . 2217 . 1 1 8 ORN HG3 H -2.664 -13.770 0.321 . . . 1.0 . . . . . . . . . . . . A . 8 ORN HG3 . . . . . . . . . c30643_6pv2 1 . 5 . 2218 . 1 1 8 ORN N N -1.989 -13.310 -2.404 . . . 1.0 . . . . . . . . . . . . A . 8 ORN N . . . . . . . . . c30643_6pv2 1 . 5 . 2219 . 1 1 8 ORN NE N -3.607 -10.699 1.436 . . . 1.0 . . . . . . . . . . . . A . 8 ORN NE . . . . . . . . . c30643_6pv2 1 . 5 . 2220 . 1 1 8 ORN O O -0.488 -11.026 -3.105 . . . 1.0 . . . . . . . . . . . . A . 8 ORN O . . . . . . . . . c30643_6pv2 1 . 5 . 2221 . 1 1 9 CYS C C -0.565 -8.001 -2.446 . . . 1.0 . . . . . . . . . . . . A . 9 CYS C . . . . . . . . . c30643_6pv2 1 . 5 . 2222 . 1 1 9 CYS CA C -1.774 -8.547 -3.201 . . . 1.0 . . . . . . . . . . . . A . 9 CYS CA . . . . . . . . . c30643_6pv2 1 . 5 . 2223 . 1 1 9 CYS CB C -2.898 -7.512 -3.242 . . . 1.0 . . . . . . . . . . . . A . 9 CYS CB . . . . . . . . . c30643_6pv2 1 . 5 . 2224 . 1 1 9 CYS H H -3.137 -9.727 -2.109 . . . 1.0 . . . . . . . . . . . . A . 9 CYS H . . . . . . . . . c30643_6pv2 1 . 5 . 2225 . 1 1 9 CYS HA H -1.483 -8.799 -4.208 . . . 1.0 . . . . . . . . . . . . A . 9 CYS HA . . . . . . . . . c30643_6pv2 1 . 5 . 2226 . 1 1 9 CYS HB2 H -3.691 -7.876 -3.881 . . . 1.0 . . . . . . . . . . . . A . 9 CYS HB2 . . . . . . . . . c30643_6pv2 1 . 5 . 2227 . 1 1 9 CYS HB3 H -3.286 -7.378 -2.244 . . . 1.0 . . . . . . . . . . . . A . 9 CYS HB3 . . . . . . . . . c30643_6pv2 1 . 5 . 2228 . 1 1 9 CYS N N -2.259 -9.751 -2.552 . . . 1.0 . . . . . . . . . . . . A . 9 CYS N . . . . . . . . . c30643_6pv2 1 . 5 . 2229 . 1 1 9 CYS O O -0.592 -7.905 -1.217 . . . 1.0 . . . . . . . . . . . . A . 9 CYS O . . . . . . . . . c30643_6pv2 1 . 5 . 2230 . 1 1 9 CYS SG S -2.405 -5.895 -3.860 . . . 1.0 . . . . . . . . . . . . A . 9 CYS SG . . . . . . . . . c30643_6pv2 1 . 5 . 2231 . 1 1 10 GLY C C 2.585 -6.343 -3.410 . . . 1.0 . . . . . . . . . . . . A . 10 GLY C . . . . . . . . . c30643_6pv2 1 . 5 . 2232 . 1 1 10 GLY CA C 1.710 -7.216 -2.532 . . . 1.0 . . . . . . . . . . . . A . 10 GLY CA . . . . . . . . . c30643_6pv2 1 . 5 . 2233 . 1 1 10 GLY H H 0.439 -7.687 -4.153 . . . 1.0 . . . . . . . . . . . . A . 10 GLY H . . . . . . . . . c30643_6pv2 1 . 5 . 2234 . 1 1 10 GLY HA2 H 1.453 -6.663 -1.641 . . . 1.0 . . . . . . . . . . . . A . 10 GLY HA2 . . . . . . . . . c30643_6pv2 1 . 5 . 2235 . 1 1 10 GLY HA3 H 2.273 -8.089 -2.244 . . . 1.0 . . . . . . . . . . . . A . 10 GLY HA3 . . . . . . . . . c30643_6pv2 1 . 5 . 2236 . 1 1 10 GLY N N 0.490 -7.650 -3.175 . . . 1.0 . . . . . . . . . . . . A . 10 GLY N . . . . . . . . . c30643_6pv2 1 . 5 . 2237 . 1 1 10 GLY O O 3.693 -6.736 -3.773 . . . 1.0 . . . . . . . . . . . . A . 10 GLY O . . . . . . . . . c30643_6pv2 1 . 5 . 2238 . 1 1 11 LYS C C 3.930 -3.565 -3.516 . . . 1.0 . . . . . . . . . . . . A . 11 LYS C . . . . . . . . . c30643_6pv2 1 . 5 . 2239 . 1 1 11 LYS CA C 2.908 -4.182 -4.468 . . . 1.0 . . . . . . . . . . . . A . 11 LYS CA . . . . . . . . . c30643_6pv2 1 . 5 . 2240 . 1 1 11 LYS CB C 2.031 -3.083 -5.071 . . . 1.0 . . . . . . . . . . . . A . 11 LYS CB . . . . . . . . . c30643_6pv2 1 . 5 . 2241 . 1 1 11 LYS CD C 0.330 -2.412 -6.795 . . . 1.0 . . . . . . . . . . . . A . 11 LYS CD . . . . . . . . . c30643_6pv2 1 . 5 . 2242 . 1 1 11 LYS CE C 1.190 -1.325 -7.424 . . . 1.0 . . . . . . . . . . . . A . 11 LYS CE . . . . . . . . . c30643_6pv2 1 . 5 . 2243 . 1 1 11 LYS CG C 1.169 -3.550 -6.230 . . . 1.0 . . . . . . . . . . . . A . 11 LYS CG . . . . . . . . . c30643_6pv2 1 . 5 . 2244 . 1 1 11 LYS H H 1.162 -4.949 -3.548 . . . 1.0 . . . . . . . . . . . . A . 11 LYS H . . . . . . . . . c30643_6pv2 1 . 5 . 2245 . 1 1 11 LYS HA H 3.433 -4.693 -5.262 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HA . . . . . . . . . c30643_6pv2 1 . 5 . 2246 . 1 1 11 LYS HB2 H 1.376 -2.703 -4.300 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HB2 . . . . . . . . . c30643_6pv2 1 . 5 . 2247 . 1 1 11 LYS HB3 H 2.665 -2.282 -5.420 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HB3 . . . . . . . . . c30643_6pv2 1 . 5 . 2248 . 1 1 11 LYS HD2 H -0.333 -2.808 -7.548 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HD2 . . . . . . . . . c30643_6pv2 1 . 5 . 2249 . 1 1 11 LYS HD3 H -0.251 -1.979 -5.995 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HD3 . . . . . . . . . c30643_6pv2 1 . 5 . 2250 . 1 1 11 LYS HE2 H 1.842 -0.918 -6.667 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HE2 . . . . . . . . . c30643_6pv2 1 . 5 . 2251 . 1 1 11 LYS HE3 H 1.784 -1.764 -8.211 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HE3 . . . . . . . . . c30643_6pv2 1 . 5 . 2252 . 1 1 11 LYS HG2 H 1.810 -3.933 -7.010 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HG2 . . . . . . . . . c30643_6pv2 1 . 5 . 2253 . 1 1 11 LYS HG3 H 0.511 -4.332 -5.883 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HG3 . . . . . . . . . c30643_6pv2 1 . 5 . 2254 . 1 1 11 LYS HZ1 H 0.976 0.457 -8.489 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HZ1 . . . . . . . . . c30643_6pv2 1 . 5 . 2255 . 1 1 11 LYS HZ2 H -0.139 0.272 -7.237 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HZ2 . . . . . . . . . c30643_6pv2 1 . 5 . 2256 . 1 1 11 LYS HZ3 H -0.326 -0.606 -8.666 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HZ3 . . . . . . . . . c30643_6pv2 1 . 5 . 2257 . 1 1 11 LYS N N 2.092 -5.163 -3.761 . . . 1.0 . . . . . . . . . . . . A . 11 LYS N . . . . . . . . . c30643_6pv2 1 . 5 . 2258 . 1 1 11 LYS NZ N 0.368 -0.225 -7.993 . . . 1.0 . . . . . . . . . . . . A . 11 LYS NZ . . . . . . . . . c30643_6pv2 1 . 5 . 2259 . 1 1 11 LYS O O 3.648 -3.390 -2.329 . . . 1.0 . . . . . . . . . . . . A . 11 LYS O . . . . . . . . . c30643_6pv2 1 . 5 . 2260 . 1 1 12 ARG C C 6.354 -1.196 -3.503 . . . 1.0 . . . . . . . . . . . . A . 12 ARG C . . . . . . . . . c30643_6pv2 1 . 5 . 2261 . 1 1 12 ARG CA C 6.178 -2.680 -3.211 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CA . . . . . . . . . c30643_6pv2 1 . 5 . 2262 . 1 1 12 ARG CB C 7.499 -3.407 -3.466 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CB . . . . . . . . . c30643_6pv2 1 . 5 . 2263 . 1 1 12 ARG CD C 8.786 -5.567 -3.469 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CD . . . . . . . . . c30643_6pv2 1 . 5 . 2264 . 1 1 12 ARG CG C 7.437 -4.906 -3.221 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CG . . . . . . . . . c30643_6pv2 1 . 5 . 2265 . 1 1 12 ARG CZ C 10.524 -5.482 -5.229 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CZ . . . . . . . . . c30643_6pv2 1 . 5 . 2266 . 1 1 12 ARG H H 5.270 -3.389 -4.990 . . . 1.0 . . . . . . . . . . . . A . 12 ARG H . . . . . . . . . c30643_6pv2 1 . 5 . 2267 . 1 1 12 ARG HA H 5.898 -2.800 -2.175 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HA . . . . . . . . . c30643_6pv2 1 . 5 . 2268 . 1 1 12 ARG HB2 H 7.792 -3.245 -4.492 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HB2 . . . . . . . . . c30643_6pv2 1 . 5 . 2269 . 1 1 12 ARG HB3 H 8.257 -2.991 -2.817 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HB3 . . . . . . . . . c30643_6pv2 1 . 5 . 2270 . 1 1 12 ARG HD2 H 9.512 -5.134 -2.797 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HD2 . . . . . . . . . c30643_6pv2 1 . 5 . 2271 . 1 1 12 ARG HD3 H 8.698 -6.624 -3.269 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HD3 . . . . . . . . . c30643_6pv2 1 . 5 . 2272 . 1 1 12 ARG HE H 8.569 -5.173 -5.529 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HE . . . . . . . . . c30643_6pv2 1 . 5 . 2273 . 1 1 12 ARG HG2 H 7.141 -5.082 -2.197 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HG2 . . . . . . . . . c30643_6pv2 1 . 5 . 2274 . 1 1 12 ARG HG3 H 6.705 -5.340 -3.886 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HG3 . . . . . . . . . c30643_6pv2 1 . 5 . 2275 . 1 1 12 ARG HH11 H 11.234 -5.896 -3.376 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH11 . . . . . . . . . c30643_6pv2 1 . 5 . 2276 . 1 1 12 ARG HH12 H 12.428 -5.841 -4.633 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH12 . . . . . . . . . c30643_6pv2 1 . 5 . 2277 . 1 1 12 ARG HH21 H 11.804 -5.369 -6.800 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH21 . . . . . . . . . c30643_6pv2 1 . 5 . 2278 . 1 1 12 ARG HH22 H 10.134 -5.081 -7.176 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH22 . . . . . . . . . c30643_6pv2 1 . 5 . 2279 . 1 1 12 ARG N N 5.112 -3.247 -4.032 . . . 1.0 . . . . . . . . . . . . A . 12 ARG N . . . . . . . . . c30643_6pv2 1 . 5 . 2280 . 1 1 12 ARG NE N 9.251 -5.382 -4.846 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NE . . . . . . . . . c30643_6pv2 1 . 5 . 2281 . 1 1 12 ARG NH1 N 11.472 -5.760 -4.340 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NH1 . . . . . . . . . c30643_6pv2 1 . 5 . 2282 . 1 1 12 ARG NH2 N 10.847 -5.296 -6.503 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NH2 . . . . . . . . . c30643_6pv2 1 . 5 . 2283 . 1 1 12 ARG O O 6.604 -0.801 -4.642 . . . 1.0 . . . . . . . . . . . . A . 12 ARG O . . . . . . . . . c30643_6pv2 1 . 5 . 2284 . 1 1 13 PHE C C 7.568 1.574 -1.876 . . . 1.0 . . . . . . . . . . . . A . 13 PHE C . . . . . . . . . c30643_6pv2 1 . 5 . 2285 . 1 1 13 PHE CA C 6.342 1.059 -2.611 . . . 1.0 . . . . . . . . . . . . A . 13 PHE CA . . . . . . . . . c30643_6pv2 1 . 5 . 2286 . 1 1 13 PHE CB C 5.083 1.725 -2.059 . . . 1.0 . . . . . . . . . . . . A . 13 PHE CB . . . . . . . . . c30643_6pv2 1 . 5 . 2287 . 1 1 13 PHE CD1 C 3.336 1.914 -3.838 . . . 1.0 . . . . . . . . . . . . A . 13 PHE CD1 . . . . . . . . . c30643_6pv2 1 . 5 . 2288 . 1 1 13 PHE CD2 C 3.152 0.144 -2.255 . . . 1.0 . . . . . . . . . . . . A . 13 PHE CD2 . . . . . . . . . c30643_6pv2 1 . 5 . 2289 . 1 1 13 PHE CE1 C 2.179 1.490 -4.453 . . . 1.0 . . . . . . . . . . . . A . 13 PHE CE1 . . . . . . . . . c30643_6pv2 1 . 5 . 2290 . 1 1 13 PHE CE2 C 1.995 -0.287 -2.867 . . . 1.0 . . . . . . . . . . . . A . 13 PHE CE2 . . . . . . . . . c30643_6pv2 1 . 5 . 2291 . 1 1 13 PHE CG C 3.834 1.247 -2.733 . . . 1.0 . . . . . . . . . . . . A . 13 PHE CG . . . . . . . . . c30643_6pv2 1 . 5 . 2292 . 1 1 13 PHE CZ C 1.540 0.339 -3.990 . . . 1.0 . . . . . . . . . . . . A . 13 PHE CZ . . . . . . . . . c30643_6pv2 1 . 5 . 2293 . 1 1 13 PHE H H 6.058 -0.762 -1.580 . . . 1.0 . . . . . . . . . . . . A . 13 PHE H . . . . . . . . . c30643_6pv2 1 . 5 . 2294 . 1 1 13 PHE HA H 6.433 1.291 -3.660 . . . 1.0 . . . . . . . . . . . . A . 13 PHE HA . . . . . . . . . c30643_6pv2 1 . 5 . 2295 . 1 1 13 PHE HB2 H 4.996 1.508 -1.004 . . . 1.0 . . . . . . . . . . . . A . 13 PHE HB2 . . . . . . . . . c30643_6pv2 1 . 5 . 2296 . 1 1 13 PHE HB3 H 5.153 2.792 -2.202 . . . 1.0 . . . . . . . . . . . . A . 13 PHE HB3 . . . . . . . . . c30643_6pv2 1 . 5 . 2297 . 1 1 13 PHE HD1 H 3.861 2.778 -4.216 . . . 1.0 . . . . . . . . . . . . A . 13 PHE HD1 . . . . . . . . . c30643_6pv2 1 . 5 . 2298 . 1 1 13 PHE HD2 H 3.533 -0.384 -1.395 . . . 1.0 . . . . . . . . . . . . A . 13 PHE HD2 . . . . . . . . . c30643_6pv2 1 . 5 . 2299 . 1 1 13 PHE HE1 H 1.799 2.019 -5.315 . . . 1.0 . . . . . . . . . . . . A . 13 PHE HE1 . . . . . . . . . c30643_6pv2 1 . 5 . 2300 . 1 1 13 PHE HE2 H 1.470 -1.149 -2.486 . . . 1.0 . . . . . . . . . . . . A . 13 PHE HE2 . . . . . . . . . c30643_6pv2 1 . 5 . 2301 . 1 1 13 PHE HZ H 0.646 -0.016 -4.480 . . . 1.0 . . . . . . . . . . . . A . 13 PHE HZ . . . . . . . . . c30643_6pv2 1 . 5 . 2302 . 1 1 13 PHE N N 6.233 -0.382 -2.471 . . . 1.0 . . . . . . . . . . . . A . 13 PHE N . . . . . . . . . c30643_6pv2 1 . 5 . 2303 . 1 1 13 PHE O O 8.018 0.973 -0.904 . . . 1.0 . . . . . . . . . . . . A . 13 PHE O . . . . . . . . . c30643_6pv2 1 . 5 . 2304 . 1 1 14 THR C C 8.806 4.355 -0.714 . . . 1.0 . . . . . . . . . . . . A . 14 THR C . . . . . . . . . c30643_6pv2 1 . 5 . 2305 . 1 1 14 THR CA C 9.267 3.291 -1.710 . . . 1.0 . . . . . . . . . . . . A . 14 THR CA . . . . . . . . . c30643_6pv2 1 . 5 . 2306 . 1 1 14 THR CB C 10.199 3.921 -2.762 . . . 1.0 . . . . . . . . . . . . A . 14 THR CB . . . . . . . . . c30643_6pv2 1 . 5 . 2307 . 1 1 14 THR CG2 C 11.555 4.261 -2.161 . . . 1.0 . . . . . . . . . . . . A . 14 THR CG2 . . . . . . . . . c30643_6pv2 1 . 5 . 2308 . 1 1 14 THR H H 7.741 3.095 -3.157 . . . 1.0 . . . . . . . . . . . . A . 14 THR H . . . . . . . . . c30643_6pv2 1 . 5 . 2309 . 1 1 14 THR HA H 9.811 2.521 -1.182 . . . 1.0 . . . . . . . . . . . . A . 14 THR HA . . . . . . . . . c30643_6pv2 1 . 5 . 2310 . 1 1 14 THR HB H 9.744 4.829 -3.130 . . . 1.0 . . . . . . . . . . . . A . 14 THR HB . . . . . . . . . c30643_6pv2 1 . 5 . 2311 . 1 1 14 THR HG1 H 9.954 2.161 -3.641 . . . 1.0 . . . . . . . . . . . . A . 14 THR HG1 . . . . . . . . . c30643_6pv2 1 . 5 . 2312 . 1 1 14 THR HG21 H 11.419 4.918 -1.316 . . . 1.0 . . . . . . . . . . . . A . 14 THR HG21 . . . . . . . . . c30643_6pv2 1 . 5 . 2313 . 1 1 14 THR HG22 H 12.166 4.752 -2.905 . . . 1.0 . . . . . . . . . . . . A . 14 THR HG22 . . . . . . . . . c30643_6pv2 1 . 5 . 2314 . 1 1 14 THR HG23 H 12.044 3.353 -1.838 . . . 1.0 . . . . . . . . . . . . A . 14 THR HG23 . . . . . . . . . c30643_6pv2 1 . 5 . 2315 . 1 1 14 THR N N 8.117 2.679 -2.351 . . . 1.0 . . . . . . . . . . . . A . 14 THR N . . . . . . . . . c30643_6pv2 1 . 5 . 2316 . 1 1 14 THR O O 9.604 4.932 0.031 . . . 1.0 . . . . . . . . . . . . A . 14 THR O . . . . . . . . . c30643_6pv2 1 . 5 . 2317 . 1 1 14 THR OG1 O 10.382 3.005 -3.855 . . . 1.0 . . . . . . . . . . . . A . 14 THR OG1 . . . . . . . . . c30643_6pv2 1 . 5 . 2318 . 1 1 15 ARG C C 5.739 4.968 0.947 . . . 1.0 . . . . . . . . . . . . A . 15 ARG C . . . . . . . . . c30643_6pv2 1 . 5 . 2319 . 1 1 15 ARG CA C 6.920 5.580 0.200 . . . 1.0 . . . . . . . . . . . . A . 15 ARG CA . . . . . . . . . c30643_6pv2 1 . 5 . 2320 . 1 1 15 ARG CB C 6.464 6.825 -0.568 . . . 1.0 . . . . . . . . . . . . A . 15 ARG CB . . . . . . . . . c30643_6pv2 1 . 5 . 2321 . 1 1 15 ARG CD C 7.097 8.894 -1.834 . . . 1.0 . . . . . . . . . . . . A . 15 ARG CD . . . . . . . . . c30643_6pv2 1 . 5 . 2322 . 1 1 15 ARG CG C 7.590 7.577 -1.257 . . . 1.0 . . . . . . . . . . . . A . 15 ARG CG . . . . . . . . . c30643_6pv2 1 . 5 . 2323 . 1 1 15 ARG CZ C 5.449 10.484 -0.898 . . . 1.0 . . . . . . . . . . . . A . 15 ARG CZ . . . . . . . . . c30643_6pv2 1 . 5 . 2324 . 1 1 15 ARG H H 6.922 4.123 -1.327 . . . 1.0 . . . . . . . . . . . . A . 15 ARG H . . . . . . . . . c30643_6pv2 1 . 5 . 2325 . 1 1 15 ARG HA H 7.678 5.861 0.916 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HA . . . . . . . . . c30643_6pv2 1 . 5 . 2326 . 1 1 15 ARG HB2 H 5.752 6.523 -1.321 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HB2 . . . . . . . . . c30643_6pv2 1 . 5 . 2327 . 1 1 15 ARG HB3 H 5.978 7.500 0.120 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HB3 . . . . . . . . . c30643_6pv2 1 . 5 . 2328 . 1 1 15 ARG HD2 H 7.916 9.382 -2.338 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HD2 . . . . . . . . . c30643_6pv2 1 . 5 . 2329 . 1 1 15 ARG HD3 H 6.310 8.690 -2.544 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HD3 . . . . . . . . . c30643_6pv2 1 . 5 . 2330 . 1 1 15 ARG HE H 7.111 9.862 0.031 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HE . . . . . . . . . c30643_6pv2 1 . 5 . 2331 . 1 1 15 ARG HG2 H 8.371 7.778 -0.540 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HG2 . . . . . . . . . c30643_6pv2 1 . 5 . 2332 . 1 1 15 ARG HG3 H 7.982 6.968 -2.059 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HG3 . . . . . . . . . c30643_6pv2 1 . 5 . 2333 . 1 1 15 ARG HH11 H 5.037 9.876 -2.790 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HH11 . . . . . . . . . c30643_6pv2 1 . 5 . 2334 . 1 1 15 ARG HH12 H 3.873 10.953 -2.091 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HH12 . . . . . . . . . c30643_6pv2 1 . 5 . 2335 . 1 1 15 ARG HH21 H 5.588 11.301 0.954 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HH21 . . . . . . . . . c30643_6pv2 1 . 5 . 2336 . 1 1 15 ARG HH22 H 4.191 11.768 0.038 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HH22 . . . . . . . . . c30643_6pv2 1 . 5 . 2337 . 1 1 15 ARG N N 7.505 4.608 -0.705 . . . 1.0 . . . . . . . . . . . . A . 15 ARG N . . . . . . . . . c30643_6pv2 1 . 5 . 2338 . 1 1 15 ARG NE N 6.581 9.785 -0.793 . . . 1.0 . . . . . . . . . . . . A . 15 ARG NE . . . . . . . . . c30643_6pv2 1 . 5 . 2339 . 1 1 15 ARG NH1 N 4.731 10.436 -2.017 . . . 1.0 . . . . . . . . . . . . A . 15 ARG NH1 . . . . . . . . . c30643_6pv2 1 . 5 . 2340 . 1 1 15 ARG NH2 N 5.045 11.246 0.111 . . . 1.0 . . . . . . . . . . . . A . 15 ARG NH2 . . . . . . . . . c30643_6pv2 1 . 5 . 2341 . 1 1 15 ARG O O 4.847 4.361 0.346 . . . 1.0 . . . . . . . . . . . . A . 15 ARG O . . . . . . . . . c30643_6pv2 1 . 5 . 2342 . 1 1 16 SER C C 3.354 5.245 2.803 . . . 1.0 . . . . . . . . . . . . A . 16 SER C . . . . . . . . . c30643_6pv2 1 . 5 . 2343 . 1 1 16 SER CA C 4.699 4.605 3.122 . . . 1.0 . . . . . . . . . . . . A . 16 SER CA . . . . . . . . . c30643_6pv2 1 . 5 . 2344 . 1 1 16 SER CB C 5.068 4.841 4.587 . . . 1.0 . . . . . . . . . . . . A . 16 SER CB . . . . . . . . . c30643_6pv2 1 . 5 . 2345 . 1 1 16 SER H H 6.477 5.647 2.676 . . . 1.0 . . . . . . . . . . . . A . 16 SER H . . . . . . . . . c30643_6pv2 1 . 5 . 2346 . 1 1 16 SER HA H 4.633 3.542 2.941 . . . 1.0 . . . . . . . . . . . . A . 16 SER HA . . . . . . . . . c30643_6pv2 1 . 5 . 2347 . 1 1 16 SER HB2 H 4.186 4.733 5.199 . . . 1.0 . . . . . . . . . . . . A . 16 SER HB2 . . . . . . . . . c30643_6pv2 1 . 5 . 2348 . 1 1 16 SER HB3 H 5.808 4.116 4.892 . . . 1.0 . . . . . . . . . . . . A . 16 SER HB3 . . . . . . . . . c30643_6pv2 1 . 5 . 2349 . 1 1 16 SER HG H 5.091 6.597 5.460 . . . 1.0 . . . . . . . . . . . . A . 16 SER HG . . . . . . . . . c30643_6pv2 1 . 5 . 2350 . 1 1 16 SER N N 5.745 5.139 2.263 . . . 1.0 . . . . . . . . . . . . A . 16 SER N . . . . . . . . . c30643_6pv2 1 . 5 . 2351 . 1 1 16 SER O O 2.308 4.608 2.915 . . . 1.0 . . . . . . . . . . . . A . 16 SER O . . . . . . . . . c30643_6pv2 1 . 5 . 2352 . 1 1 16 SER OG O 5.597 6.144 4.774 . . . 1.0 . . . . . . . . . . . . A . 16 SER OG . . . . . . . . . c30643_6pv2 1 . 5 . 2353 . 1 1 17 ASP C C 1.593 6.599 0.751 . . . 1.0 . . . . . . . . . . . . A . 17 ASP C . . . . . . . . . c30643_6pv2 1 . 5 . 2354 . 1 1 17 ASP CA C 2.190 7.224 2.001 . . . 1.0 . . . . . . . . . . . . A . 17 ASP CA . . . . . . . . . c30643_6pv2 1 . 5 . 2355 . 1 1 17 ASP CB C 2.485 8.702 1.746 . . . 1.0 . . . . . . . . . . . . A . 17 ASP CB . . . . . . . . . c30643_6pv2 1 . 5 . 2356 . 1 1 17 ASP CG C 2.926 9.435 2.994 . . . 1.0 . . . . . . . . . . . . A . 17 ASP CG . . . . . . . . . c30643_6pv2 1 . 5 . 2357 . 1 1 17 ASP H H 4.258 6.977 2.385 . . . 1.0 . . . . . . . . . . . . A . 17 ASP H . . . . . . . . . c30643_6pv2 1 . 5 . 2358 . 1 1 17 ASP HA H 1.474 7.140 2.803 . . . 1.0 . . . . . . . . . . . . A . 17 ASP HA . . . . . . . . . c30643_6pv2 1 . 5 . 2359 . 1 1 17 ASP HB2 H 3.269 8.784 1.010 . . . 1.0 . . . . . . . . . . . . A . 17 ASP HB2 . . . . . . . . . c30643_6pv2 1 . 5 . 2360 . 1 1 17 ASP HB3 H 1.596 9.177 1.366 . . . 1.0 . . . . . . . . . . . . A . 17 ASP HB3 . . . . . . . . . c30643_6pv2 1 . 5 . 2361 . 1 1 17 ASP N N 3.394 6.509 2.402 . . . 1.0 . . . . . . . . . . . . A . 17 ASP N . . . . . . . . . c30643_6pv2 1 . 5 . 2362 . 1 1 17 ASP O O 0.379 6.555 0.589 . . . 1.0 . . . . . . . . . . . . A . 17 ASP O . . . . . . . . . c30643_6pv2 1 . 5 . 2363 . 1 1 17 ASP OD1 O 2.072 9.699 3.868 . . . 1.0 . . . . . . . . . . . . A . 17 ASP OD1 . . . . . . . . . c30643_6pv2 1 . 5 . 2364 . 1 1 17 ASP OD2 O 4.126 9.762 3.105 . . . 1.0 . . . . . . . . . . . . A . 17 ASP OD2 . . . . . . . . . c30643_6pv2 1 . 5 . 2365 . 1 1 18 GLU C C 1.453 4.085 -1.084 . . . 1.0 . . . . . . . . . . . . A . 18 GLU C . . . . . . . . . c30643_6pv2 1 . 5 . 2366 . 1 1 18 GLU CA C 2.015 5.471 -1.352 . . . 1.0 . . . . . . . . . . . . A . 18 GLU CA . . . . . . . . . c30643_6pv2 1 . 5 . 2367 . 1 1 18 GLU CB C 3.160 5.404 -2.355 . . . 1.0 . . . . . . . . . . . . A . 18 GLU CB . . . . . . . . . c30643_6pv2 1 . 5 . 2368 . 1 1 18 GLU CD C 2.424 7.488 -3.557 . . . 1.0 . . . . . . . . . . . . A . 18 GLU CD . . . . . . . . . c30643_6pv2 1 . 5 . 2369 . 1 1 18 GLU CG C 3.569 6.765 -2.878 . . . 1.0 . . . . . . . . . . . . A . 18 GLU CG . . . . . . . . . c30643_6pv2 1 . 5 . 2370 . 1 1 18 GLU H H 3.411 6.133 0.082 . . . 1.0 . . . . . . . . . . . . A . 18 GLU H . . . . . . . . . c30643_6pv2 1 . 5 . 2371 . 1 1 18 GLU HA H 1.230 6.085 -1.763 . . . 1.0 . . . . . . . . . . . . A . 18 GLU HA . . . . . . . . . c30643_6pv2 1 . 5 . 2372 . 1 1 18 GLU HB2 H 4.017 4.951 -1.878 . . . 1.0 . . . . . . . . . . . . A . 18 GLU HB2 . . . . . . . . . c30643_6pv2 1 . 5 . 2373 . 1 1 18 GLU HB3 H 2.858 4.794 -3.192 . . . 1.0 . . . . . . . . . . . . A . 18 GLU HB3 . . . . . . . . . c30643_6pv2 1 . 5 . 2374 . 1 1 18 GLU HG2 H 3.914 7.368 -2.049 . . . 1.0 . . . . . . . . . . . . A . 18 GLU HG2 . . . . . . . . . c30643_6pv2 1 . 5 . 2375 . 1 1 18 GLU HG3 H 4.371 6.635 -3.589 . . . 1.0 . . . . . . . . . . . . A . 18 GLU HG3 . . . . . . . . . c30643_6pv2 1 . 5 . 2376 . 1 1 18 GLU N N 2.456 6.094 -0.117 . . . 1.0 . . . . . . . . . . . . A . 18 GLU N . . . . . . . . . c30643_6pv2 1 . 5 . 2377 . 1 1 18 GLU O O 0.550 3.632 -1.786 . . . 1.0 . . . . . . . . . . . . A . 18 GLU O . . . . . . . . . c30643_6pv2 1 . 5 . 2378 . 1 1 18 GLU OE1 O 1.832 8.391 -2.934 . . . 1.0 . . . . . . . . . . . . A . 18 GLU OE1 . . . . . . . . . c30643_6pv2 1 . 5 . 2379 . 1 1 18 GLU OE2 O 2.111 7.157 -4.718 . . . 1.0 . . . . . . . . . . . . A . 18 GLU OE2 . . . . . . . . . c30643_6pv2 1 . 5 . 2380 . 1 1 19 LEU C C 0.056 2.313 0.960 . . . 1.0 . . . . . . . . . . . . A . 19 LEU C . . . . . . . . . c30643_6pv2 1 . 5 . 2381 . 1 1 19 LEU CA C 1.440 2.130 0.346 . . . 1.0 . . . . . . . . . . . . A . 19 LEU CA . . . . . . . . . c30643_6pv2 1 . 5 . 2382 . 1 1 19 LEU CB C 2.366 1.422 1.338 . . . 1.0 . . . . . . . . . . . . A . 19 LEU CB . . . . . . . . . c30643_6pv2 1 . 5 . 2383 . 1 1 19 LEU CD1 C 1.497 -0.883 0.842 . . . 1.0 . . . . . . . . . . . . A . 19 LEU CD1 . . . . . . . . . c30643_6pv2 1 . 5 . 2384 . 1 1 19 LEU CD2 C 2.749 -0.457 2.962 . . . 1.0 . . . . . . . . . . . . A . 19 LEU CD2 . . . . . . . . . c30643_6pv2 1 . 5 . 2385 . 1 1 19 LEU CG C 1.795 0.131 1.936 . . . 1.0 . . . . . . . . . . . . A . 19 LEU CG . . . . . . . . . c30643_6pv2 1 . 5 . 2386 . 1 1 19 LEU H H 2.774 3.781 0.395 . . . 1.0 . . . . . . . . . . . . A . 19 LEU H . . . . . . . . . c30643_6pv2 1 . 5 . 2387 . 1 1 19 LEU HA H 1.342 1.517 -0.538 . . . 1.0 . . . . . . . . . . . . A . 19 LEU HA . . . . . . . . . c30643_6pv2 1 . 5 . 2388 . 1 1 19 LEU HB2 H 3.291 1.187 0.831 . . . 1.0 . . . . . . . . . . . . A . 19 LEU HB2 . . . . . . . . . c30643_6pv2 1 . 5 . 2389 . 1 1 19 LEU HB3 H 2.582 2.102 2.147 . . . 1.0 . . . . . . . . . . . . A . 19 LEU HB3 . . . . . . . . . c30643_6pv2 1 . 5 . 2390 . 1 1 19 LEU HD11 H 2.408 -1.118 0.313 . . . 1.0 . . . . . . . . . . . . A . 19 LEU HD11 . . . . . . . . . c30643_6pv2 1 . 5 . 2391 . 1 1 19 LEU HD12 H 0.775 -0.468 0.153 . . . 1.0 . . . . . . . . . . . . A . 19 LEU HD12 . . . . . . . . . c30643_6pv2 1 . 5 . 2392 . 1 1 19 LEU HD13 H 1.096 -1.781 1.284 . . . 1.0 . . . . . . . . . . . . A . 19 LEU HD13 . . . . . . . . . c30643_6pv2 1 . 5 . 2393 . 1 1 19 LEU HD21 H 3.046 0.312 3.660 . . . 1.0 . . . . . . . . . . . . A . 19 LEU HD21 . . . . . . . . . c30643_6pv2 1 . 5 . 2394 . 1 1 19 LEU HD22 H 3.623 -0.849 2.461 . . . 1.0 . . . . . . . . . . . . A . 19 LEU HD22 . . . . . . . . . c30643_6pv2 1 . 5 . 2395 . 1 1 19 LEU HD23 H 2.256 -1.255 3.497 . . . 1.0 . . . . . . . . . . . . A . 19 LEU HD23 . . . . . . . . . c30643_6pv2 1 . 5 . 2396 . 1 1 19 LEU HG H 0.865 0.359 2.438 . . . 1.0 . . . . . . . . . . . . A . 19 LEU HG . . . . . . . . . c30643_6pv2 1 . 5 . 2397 . 1 1 19 LEU N N 1.988 3.414 -0.069 . . . 1.0 . . . . . . . . . . . . A . 19 LEU N . . . . . . . . . c30643_6pv2 1 . 5 . 2398 . 1 1 19 LEU O O -0.863 1.559 0.660 . . . 1.0 . . . . . . . . . . . . A . 19 LEU O . . . . . . . . . c30643_6pv2 1 . 5 . 2399 . 1 1 20 GLN C C -2.369 4.056 1.319 . . . 1.0 . . . . . . . . . . . . A . 20 GLN C . . . . . . . . . c30643_6pv2 1 . 5 . 2400 . 1 1 20 GLN CA C -1.391 3.626 2.407 . . . 1.0 . . . . . . . . . . . . A . 20 GLN CA . . . . . . . . . c30643_6pv2 1 . 5 . 2401 . 1 1 20 GLN CB C -1.267 4.723 3.465 . . . 1.0 . . . . . . . . . . . . A . 20 GLN CB . . . . . . . . . c30643_6pv2 1 . 5 . 2402 . 1 1 20 GLN CD C -0.341 5.427 5.699 . . . 1.0 . . . . . . . . . . . . A . 20 GLN CD . . . . . . . . . c30643_6pv2 1 . 5 . 2403 . 1 1 20 GLN CG C -0.422 4.327 4.664 . . . 1.0 . . . . . . . . . . . . A . 20 GLN CG . . . . . . . . . c30643_6pv2 1 . 5 . 2404 . 1 1 20 GLN H H 0.692 3.867 2.059 . . . 1.0 . . . . . . . . . . . . A . 20 GLN H . . . . . . . . . c30643_6pv2 1 . 5 . 2405 . 1 1 20 GLN HA H -1.762 2.725 2.872 . . . 1.0 . . . . . . . . . . . . A . 20 GLN HA . . . . . . . . . c30643_6pv2 1 . 5 . 2406 . 1 1 20 GLN HB2 H -0.819 5.594 3.010 . . . 1.0 . . . . . . . . . . . . A . 20 GLN HB2 . . . . . . . . . c30643_6pv2 1 . 5 . 2407 . 1 1 20 GLN HB3 H -2.255 4.979 3.817 . . . 1.0 . . . . . . . . . . . . A . 20 GLN HB3 . . . . . . . . . c30643_6pv2 1 . 5 . 2408 . 1 1 20 GLN HE21 H 1.224 6.215 4.771 . . . 1.0 . . . . . . . . . . . . A . 20 GLN HE21 . . . . . . . . . c30643_6pv2 1 . 5 . 2409 . 1 1 20 GLN HE22 H 0.696 7.047 6.191 . . . 1.0 . . . . . . . . . . . . A . 20 GLN HE22 . . . . . . . . . c30643_6pv2 1 . 5 . 2410 . 1 1 20 GLN HG2 H -0.859 3.453 5.125 . . . 1.0 . . . . . . . . . . . . A . 20 GLN HG2 . . . . . . . . . c30643_6pv2 1 . 5 . 2411 . 1 1 20 GLN HG3 H 0.578 4.096 4.327 . . . 1.0 . . . . . . . . . . . . A . 20 GLN HG3 . . . . . . . . . c30643_6pv2 1 . 5 . 2412 . 1 1 20 GLN N N -0.090 3.321 1.816 . . . 1.0 . . . . . . . . . . . . A . 20 GLN N . . . . . . . . . c30643_6pv2 1 . 5 . 2413 . 1 1 20 GLN NE2 N 0.624 6.317 5.539 . . . 1.0 . . . . . . . . . . . . A . 20 GLN NE2 . . . . . . . . . c30643_6pv2 1 . 5 . 2414 . 1 1 20 GLN O O -3.533 3.641 1.305 . . . 1.0 . . . . . . . . . . . . A . 20 GLN O . . . . . . . . . c30643_6pv2 1 . 5 . 2415 . 1 1 20 GLN OE1 O -1.148 5.488 6.625 . . . 1.0 . . . . . . . . . . . . A . 20 GLN OE1 . . . . . . . . . c30643_6pv2 1 . 5 . 2416 . 1 1 21 ARG C C -3.143 4.067 -1.500 . . . 1.0 . . . . . . . . . . . . A . 21 ARG C . . . . . . . . . c30643_6pv2 1 . 5 . 2417 . 1 1 21 ARG CA C -2.617 5.298 -0.776 . . . 1.0 . . . . . . . . . . . . A . 21 ARG CA . . . . . . . . . c30643_6pv2 1 . 5 . 2418 . 1 1 21 ARG CB C -1.698 6.106 -1.697 . . . 1.0 . . . . . . . . . . . . A . 21 ARG CB . . . . . . . . . c30643_6pv2 1 . 5 . 2419 . 1 1 21 ARG CD C -1.327 7.318 -3.849 . . . 1.0 . . . . . . . . . . . . A . 21 ARG CD . . . . . . . . . c30643_6pv2 1 . 5 . 2420 . 1 1 21 ARG CG C -2.350 6.616 -2.969 . . . 1.0 . . . . . . . . . . . . A . 21 ARG CG . . . . . . . . . c30643_6pv2 1 . 5 . 2421 . 1 1 21 ARG CZ C -1.205 8.381 -6.075 . . . 1.0 . . . . . . . . . . . . A . 21 ARG CZ . . . . . . . . . c30643_6pv2 1 . 5 . 2422 . 1 1 21 ARG H H -0.966 5.250 0.543 . . . 1.0 . . . . . . . . . . . . A . 21 ARG H . . . . . . . . . c30643_6pv2 1 . 5 . 2423 . 1 1 21 ARG HA H -3.446 5.913 -0.464 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HA . . . . . . . . . c30643_6pv2 1 . 5 . 2424 . 1 1 21 ARG HB2 H -1.327 6.958 -1.150 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HB2 . . . . . . . . . c30643_6pv2 1 . 5 . 2425 . 1 1 21 ARG HB3 H -0.861 5.484 -1.977 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HB3 . . . . . . . . . c30643_6pv2 1 . 5 . 2426 . 1 1 21 ARG HD2 H -0.892 8.135 -3.293 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HD2 . . . . . . . . . c30643_6pv2 1 . 5 . 2427 . 1 1 21 ARG HD3 H -0.552 6.611 -4.105 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HD3 . . . . . . . . . c30643_6pv2 1 . 5 . 2428 . 1 1 21 ARG HE H -2.894 7.809 -5.161 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HE . . . . . . . . . c30643_6pv2 1 . 5 . 2429 . 1 1 21 ARG HG2 H -2.771 5.782 -3.511 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HG2 . . . . . . . . . c30643_6pv2 1 . 5 . 2430 . 1 1 21 ARG HG3 H -3.132 7.316 -2.710 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HG3 . . . . . . . . . c30643_6pv2 1 . 5 . 2431 . 1 1 21 ARG HH11 H 0.614 8.031 -5.220 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HH11 . . . . . . . . . c30643_6pv2 1 . 5 . 2432 . 1 1 21 ARG HH12 H 0.648 8.822 -6.770 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HH12 . . . . . . . . . c30643_6pv2 1 . 5 . 2433 . 1 1 21 ARG HH21 H -2.825 8.839 -7.205 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HH21 . . . . . . . . . c30643_6pv2 1 . 5 . 2434 . 1 1 21 ARG HH22 H -1.293 9.277 -7.892 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HH22 . . . . . . . . . c30643_6pv2 1 . 5 . 2435 . 1 1 21 ARG N N -1.872 4.889 0.409 . . . 1.0 . . . . . . . . . . . . A . 21 ARG N . . . . . . . . . c30643_6pv2 1 . 5 . 2436 . 1 1 21 ARG NE N -1.913 7.845 -5.080 . . . 1.0 . . . . . . . . . . . . A . 21 ARG NE . . . . . . . . . c30643_6pv2 1 . 5 . 2437 . 1 1 21 ARG NH1 N 0.124 8.413 -6.018 . . . 1.0 . . . . . . . . . . . . A . 21 ARG NH1 . . . . . . . . . c30643_6pv2 1 . 5 . 2438 . 1 1 21 ARG NH2 N -1.824 8.870 -7.142 . . . 1.0 . . . . . . . . . . . . A . 21 ARG NH2 . . . . . . . . . c30643_6pv2 1 . 5 . 2439 . 1 1 21 ARG O O -4.340 3.949 -1.766 . . . 1.0 . . . . . . . . . . . . A . 21 ARG O . . . . . . . . . c30643_6pv2 1 . 5 . 2440 . 1 1 22 HIS C C -3.647 1.143 -1.607 . . . 1.0 . . . . . . . . . . . . A . 22 HIS C . . . . . . . . . c30643_6pv2 1 . 5 . 2441 . 1 1 22 HIS CA C -2.581 1.882 -2.408 . . . 1.0 . . . . . . . . . . . . A . 22 HIS CA . . . . . . . . . c30643_6pv2 1 . 5 . 2442 . 1 1 22 HIS CB C -1.332 1.005 -2.551 . . . 1.0 . . . . . . . . . . . . A . 22 HIS CB . . . . . . . . . c30643_6pv2 1 . 5 . 2443 . 1 1 22 HIS CD2 C -1.897 -1.469 -2.081 . . . 1.0 . . . . . . . . . . . . A . 22 HIS CD2 . . . . . . . . . c30643_6pv2 1 . 5 . 2444 . 1 1 22 HIS CE1 C -2.155 -2.180 -4.120 . . . 1.0 . . . . . . . . . . . . A . 22 HIS CE1 . . . . . . . . . c30643_6pv2 1 . 5 . 2445 . 1 1 22 HIS CG C -1.641 -0.416 -2.899 . . . 1.0 . . . . . . . . . . . . A . 22 HIS CG . . . . . . . . . c30643_6pv2 1 . 5 . 2446 . 1 1 22 HIS H H -1.298 3.305 -1.533 . . . 1.0 . . . . . . . . . . . . A . 22 HIS H . . . . . . . . . c30643_6pv2 1 . 5 . 2447 . 1 1 22 HIS HA H -2.971 2.101 -3.389 . . . 1.0 . . . . . . . . . . . . A . 22 HIS HA . . . . . . . . . c30643_6pv2 1 . 5 . 2448 . 1 1 22 HIS HB2 H -0.703 1.410 -3.327 . . . 1.0 . . . . . . . . . . . . A . 22 HIS HB2 . . . . . . . . . c30643_6pv2 1 . 5 . 2449 . 1 1 22 HIS HB3 H -0.790 1.007 -1.616 . . . 1.0 . . . . . . . . . . . . A . 22 HIS HB3 . . . . . . . . . c30643_6pv2 1 . 5 . 2450 . 1 1 22 HIS HD1 H -1.686 -0.362 -5.020 . . . 1.0 . . . . . . . . . . . . A . 22 HIS HD1 . . . . . . . . . c30643_6pv2 1 . 5 . 2451 . 1 1 22 HIS HD2 H -1.837 -1.475 -1.003 . . . 1.0 . . . . . . . . . . . . A . 22 HIS HD2 . . . . . . . . . c30643_6pv2 1 . 5 . 2452 . 1 1 22 HIS HE1 H -2.356 -2.819 -4.964 . . . 1.0 . . . . . . . . . . . . A . 22 HIS HE1 . . . . . . . . . c30643_6pv2 1 . 5 . 2453 . 1 1 22 HIS N N -2.236 3.138 -1.772 . . . 1.0 . . . . . . . . . . . . A . 22 HIS N . . . . . . . . . c30643_6pv2 1 . 5 . 2454 . 1 1 22 HIS ND1 N -1.799 -0.886 -4.196 . . . 1.0 . . . . . . . . . . . . A . 22 HIS ND1 . . . . . . . . . c30643_6pv2 1 . 5 . 2455 . 1 1 22 HIS NE2 N -2.220 -2.545 -2.868 . . . 1.0 . . . . . . . . . . . . A . 22 HIS NE2 . . . . . . . . . c30643_6pv2 1 . 5 . 2456 . 1 1 22 HIS O O -4.659 0.721 -2.155 . . . 1.0 . . . . . . . . . . . . A . 22 HIS O . . . . . . . . . c30643_6pv2 1 . 5 . 2457 . 1 1 23 LYS C C -5.709 0.831 0.577 . . . 1.0 . . . . . . . . . . . . A . 23 LYS C . . . . . . . . . c30643_6pv2 1 . 5 . 2458 . 1 1 23 LYS CA C -4.305 0.242 0.553 . . . 1.0 . . . . . . . . . . . . A . 23 LYS CA . . . . . . . . . c30643_6pv2 1 . 5 . 2459 . 1 1 23 LYS CB C -3.747 0.154 1.971 . . . 1.0 . . . . . . . . . . . . A . 23 LYS CB . . . . . . . . . c30643_6pv2 1 . 5 . 2460 . 1 1 23 LYS CD C -2.067 -0.852 3.535 . . . 1.0 . . . . . . . . . . . . A . 23 LYS CD . . . . . . . . . c30643_6pv2 1 . 5 . 2461 . 1 1 23 LYS CE C -0.928 -1.848 3.683 . . . 1.0 . . . . . . . . . . . . A . 23 LYS CE . . . . . . . . . c30643_6pv2 1 . 5 . 2462 . 1 1 23 LYS CG C -2.532 -0.750 2.097 . . . 1.0 . . . . . . . . . . . . A . 23 LYS CG . . . . . . . . . c30643_6pv2 1 . 5 . 2463 . 1 1 23 LYS H H -2.609 1.416 0.077 . . . 1.0 . . . . . . . . . . . . A . 23 LYS H . . . . . . . . . c30643_6pv2 1 . 5 . 2464 . 1 1 23 LYS HA H -4.364 -0.755 0.148 . . . 1.0 . . . . . . . . . . . . A . 23 LYS HA . . . . . . . . . c30643_6pv2 1 . 5 . 2465 . 1 1 23 LYS HB2 H -3.468 1.145 2.296 . . . 1.0 . . . . . . . . . . . . A . 23 LYS HB2 . . . . . . . . . c30643_6pv2 1 . 5 . 2466 . 1 1 23 LYS HB3 H -4.519 -0.226 2.622 . . . 1.0 . . . . . . . . . . . . A . 23 LYS HB3 . . . . . . . . . c30643_6pv2 1 . 5 . 2467 . 1 1 23 LYS HD2 H -1.729 0.118 3.863 . . . 1.0 . . . . . . . . . . . . A . 23 LYS HD2 . . . . . . . . . c30643_6pv2 1 . 5 . 2468 . 1 1 23 LYS HD3 H -2.896 -1.174 4.147 . . . 1.0 . . . . . . . . . . . . A . 23 LYS HD3 . . . . . . . . . c30643_6pv2 1 . 5 . 2469 . 1 1 23 LYS HE2 H -1.275 -2.822 3.368 . . . 1.0 . . . . . . . . . . . . A . 23 LYS HE2 . . . . . . . . . c30643_6pv2 1 . 5 . 2470 . 1 1 23 LYS HE3 H -0.112 -1.535 3.050 . . . 1.0 . . . . . . . . . . . . A . 23 LYS HE3 . . . . . . . . . c30643_6pv2 1 . 5 . 2471 . 1 1 23 LYS HG2 H -2.787 -1.736 1.740 . . . 1.0 . . . . . . . . . . . . A . 23 LYS HG2 . . . . . . . . . c30643_6pv2 1 . 5 . 2472 . 1 1 23 LYS HG3 H -1.729 -0.344 1.497 . . . 1.0 . . . . . . . . . . . . A . 23 LYS HG3 . . . . . . . . . c30643_6pv2 1 . 5 . 2473 . 1 1 23 LYS HZ1 H -0.047 -1.030 5.390 . . . 1.0 . . . . . . . . . . . . A . 23 LYS HZ1 . . . . . . . . . c30643_6pv2 1 . 5 . 2474 . 1 1 23 LYS HZ2 H 0.294 -2.669 5.165 . . . 1.0 . . . . . . . . . . . . A . 23 LYS HZ2 . . . . . . . . . c30643_6pv2 1 . 5 . 2475 . 1 1 23 LYS HZ3 H -1.228 -2.191 5.721 . . . 1.0 . . . . . . . . . . . . A . 23 LYS HZ3 . . . . . . . . . c30643_6pv2 1 . 5 . 2476 . 1 1 23 LYS N N -3.412 1.002 -0.311 . . . 1.0 . . . . . . . . . . . . A . 23 LYS N . . . . . . . . . c30643_6pv2 1 . 5 . 2477 . 1 1 23 LYS NZ N -0.443 -1.940 5.086 . . . 1.0 . . . . . . . . . . . . A . 23 LYS NZ . . . . . . . . . c30643_6pv2 1 . 5 . 2478 . 1 1 23 LYS O O -6.664 0.142 0.938 . . . 1.0 . . . . . . . . . . . . A . 23 LYS O . . . . . . . . . c30643_6pv2 1 . 5 . 2479 . 1 1 24 ARG C C -8.040 2.027 -0.951 . . . 1.0 . . . . . . . . . . . . A . 24 ARG C . . . . . . . . . c30643_6pv2 1 . 5 . 2480 . 1 1 24 ARG CA C -7.158 2.723 0.092 . . . 1.0 . . . . . . . . . . . . A . 24 ARG CA . . . . . . . . . c30643_6pv2 1 . 5 . 2481 . 1 1 24 ARG CB C -7.033 4.217 -0.226 . . . 1.0 . . . . . . . . . . . . A . 24 ARG CB . . . . . . . . . c30643_6pv2 1 . 5 . 2482 . 1 1 24 ARG CD C -6.435 6.519 0.607 . . . 1.0 . . . . . . . . . . . . A . 24 ARG CD . . . . . . . . . c30643_6pv2 1 . 5 . 2483 . 1 1 24 ARG CG C -6.358 5.021 0.874 . . . 1.0 . . . . . . . . . . . . A . 24 ARG CG . . . . . . . . . c30643_6pv2 1 . 5 . 2484 . 1 1 24 ARG CZ C -8.106 8.332 0.773 . . . 1.0 . . . . . . . . . . . . A . 24 ARG CZ . . . . . . . . . c30643_6pv2 1 . 5 . 2485 . 1 1 24 ARG H H -5.040 2.612 -0.074 . . . 1.0 . . . . . . . . . . . . A . 24 ARG H . . . . . . . . . c30643_6pv2 1 . 5 . 2486 . 1 1 24 ARG HA H -7.625 2.613 1.060 . . . 1.0 . . . . . . . . . . . . A . 24 ARG HA . . . . . . . . . c30643_6pv2 1 . 5 . 2487 . 1 1 24 ARG HB2 H -6.453 4.332 -1.131 . . . 1.0 . . . . . . . . . . . . A . 24 ARG HB2 . . . . . . . . . c30643_6pv2 1 . 5 . 2488 . 1 1 24 ARG HB3 H -8.018 4.624 -0.388 . . . 1.0 . . . . . . . . . . . . A . 24 ARG HB3 . . . . . . . . . c30643_6pv2 1 . 5 . 2489 . 1 1 24 ARG HD2 H -5.783 7.031 1.299 . . . 1.0 . . . . . . . . . . . . A . 24 ARG HD2 . . . . . . . . . c30643_6pv2 1 . 5 . 2490 . 1 1 24 ARG HD3 H -6.107 6.710 -0.404 . . . 1.0 . . . . . . . . . . . . A . 24 ARG HD3 . . . . . . . . . c30643_6pv2 1 . 5 . 2491 . 1 1 24 ARG HE H -8.515 6.376 0.895 . . . 1.0 . . . . . . . . . . . . A . 24 ARG HE . . . . . . . . . c30643_6pv2 1 . 5 . 2492 . 1 1 24 ARG HG2 H -6.848 4.809 1.811 . . . 1.0 . . . . . . . . . . . . A . 24 ARG HG2 . . . . . . . . . c30643_6pv2 1 . 5 . 2493 . 1 1 24 ARG HG3 H -5.321 4.729 0.935 . . . 1.0 . . . . . . . . . . . . A . 24 ARG HG3 . . . . . . . . . c30643_6pv2 1 . 5 . 2494 . 1 1 24 ARG HH11 H -7.393 10.224 0.594 . . . 1.0 . . . . . . . . . . . . A . 24 ARG HH11 . . . . . . . . . c30643_6pv2 1 . 5 . 2495 . 1 1 24 ARG HH12 H -6.212 8.965 0.447 . . . 1.0 . . . . . . . . . . . . A . 24 ARG HH12 . . . . . . . . . c30643_6pv2 1 . 5 . 2496 . 1 1 24 ARG HH21 H -9.602 9.688 0.958 . . . 1.0 . . . . . . . . . . . . A . 24 ARG HH21 . . . . . . . . . c30643_6pv2 1 . 5 . 2497 . 1 1 24 ARG HH22 H -10.085 8.026 1.079 . . . 1.0 . . . . . . . . . . . . A . 24 ARG HH22 . . . . . . . . . c30643_6pv2 1 . 5 . 2498 . 1 1 24 ARG N N -5.845 2.093 0.171 . . . 1.0 . . . . . . . . . . . . A . 24 ARG N . . . . . . . . . c30643_6pv2 1 . 5 . 2499 . 1 1 24 ARG NE N -7.795 7.036 0.769 . . . 1.0 . . . . . . . . . . . . A . 24 ARG NE . . . . . . . . . c30643_6pv2 1 . 5 . 2500 . 1 1 24 ARG NH1 N -7.161 9.246 0.592 . . . 1.0 . . . . . . . . . . . . A . 24 ARG NH1 . . . . . . . . . c30643_6pv2 1 . 5 . 2501 . 1 1 24 ARG NH2 N -9.363 8.713 0.953 . . . 1.0 . . . . . . . . . . . . A . 24 ARG NH2 . . . . . . . . . c30643_6pv2 1 . 5 . 2502 . 1 1 24 ARG O O -9.261 2.199 -0.958 . . . 1.0 . . . . . . . . . . . . A . 24 ARG O . . . . . . . . . c30643_6pv2 1 . 5 . 2503 . 1 1 25 THR C C -8.782 -0.774 -2.144 . . . 1.0 . . . . . . . . . . . . A . 25 THR C . . . . . . . . . c30643_6pv2 1 . 5 . 2504 . 1 1 25 THR CA C -8.178 0.462 -2.801 . . . 1.0 . . . . . . . . . . . . A . 25 THR CA . . . . . . . . . c30643_6pv2 1 . 5 . 2505 . 1 1 25 THR CB C -7.309 0.037 -4.005 . . . 1.0 . . . . . . . . . . . . A . 25 THR CB . . . . . . . . . c30643_6pv2 1 . 5 . 2506 . 1 1 25 THR CG2 C -6.783 1.255 -4.744 . . . 1.0 . . . . . . . . . . . . A . 25 THR CG2 . . . . . . . . . c30643_6pv2 1 . 5 . 2507 . 1 1 25 THR H H -6.443 1.182 -1.821 . . . 1.0 . . . . . . . . . . . . A . 25 THR H . . . . . . . . . c30643_6pv2 1 . 5 . 2508 . 1 1 25 THR HA H -8.981 1.087 -3.168 . . . 1.0 . . . . . . . . . . . . A . 25 THR HA . . . . . . . . . c30643_6pv2 1 . 5 . 2509 . 1 1 25 THR HB H -7.923 -0.536 -4.683 . . . 1.0 . . . . . . . . . . . . A . 25 THR HB . . . . . . . . . c30643_6pv2 1 . 5 . 2510 . 1 1 25 THR HG1 H -5.596 -0.246 -3.048 . . . 1.0 . . . . . . . . . . . . A . 25 THR HG1 . . . . . . . . . c30643_6pv2 1 . 5 . 2511 . 1 1 25 THR HG21 H -6.171 0.938 -5.575 . . . 1.0 . . . . . . . . . . . . A . 25 THR HG21 . . . . . . . . . c30643_6pv2 1 . 5 . 2512 . 1 1 25 THR HG22 H -6.192 1.857 -4.071 . . . 1.0 . . . . . . . . . . . . A . 25 THR HG22 . . . . . . . . . c30643_6pv2 1 . 5 . 2513 . 1 1 25 THR HG23 H -7.615 1.837 -5.113 . . . 1.0 . . . . . . . . . . . . A . 25 THR HG23 . . . . . . . . . c30643_6pv2 1 . 5 . 2514 . 1 1 25 THR N N -7.425 1.238 -1.827 . . . 1.0 . . . . . . . . . . . . A . 25 THR N . . . . . . . . . c30643_6pv2 1 . 5 . 2515 . 1 1 25 THR O O -9.802 -1.298 -2.596 . . . 1.0 . . . . . . . . . . . . A . 25 THR O . . . . . . . . . c30643_6pv2 1 . 5 . 2516 . 1 1 25 THR OG1 O -6.209 -0.777 -3.575 . . . 1.0 . . . . . . . . . . . . A . 25 THR OG1 . . . . . . . . . c30643_6pv2 1 . 5 . 2517 . 1 1 26 HIS C C -9.666 -1.903 0.720 . . . 1.0 . . . . . . . . . . . . A . 26 HIS C . . . . . . . . . c30643_6pv2 1 . 5 . 2518 . 1 1 26 HIS CA C -8.655 -2.372 -0.318 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CA . . . . . . . . . c30643_6pv2 1 . 5 . 2519 . 1 1 26 HIS CB C -7.518 -3.136 0.375 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CB . . . . . . . . . c30643_6pv2 1 . 5 . 2520 . 1 1 26 HIS CD2 C -5.170 -3.479 -0.657 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CD2 . . . . . . . . . c30643_6pv2 1 . 5 . 2521 . 1 1 26 HIS CE1 C -5.623 -5.032 -2.117 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CE1 . . . . . . . . . c30643_6pv2 1 . 5 . 2522 . 1 1 26 HIS CG C -6.501 -3.732 -0.554 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CG . . . . . . . . . c30643_6pv2 1 . 5 . 2523 . 1 1 26 HIS H H -7.337 -0.779 -0.758 . . . 1.0 . . . . . . . . . . . . A . 26 HIS H . . . . . . . . . c30643_6pv2 1 . 5 . 2524 . 1 1 26 HIS HA H -9.150 -3.028 -1.015 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HA . . . . . . . . . c30643_6pv2 1 . 5 . 2525 . 1 1 26 HIS HB2 H -6.996 -2.463 1.037 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HB2 . . . . . . . . . c30643_6pv2 1 . 5 . 2526 . 1 1 26 HIS HB3 H -7.942 -3.941 0.957 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HB3 . . . . . . . . . c30643_6pv2 1 . 5 . 2527 . 1 1 26 HIS HD1 H -7.656 -5.128 -1.661 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HD1 . . . . . . . . . c30643_6pv2 1 . 5 . 2528 . 1 1 26 HIS HD2 H -4.605 -2.769 -0.073 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HD2 . . . . . . . . . c30643_6pv2 1 . 5 . 2529 . 1 1 26 HIS HE1 H -5.515 -5.777 -2.890 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HE1 . . . . . . . . . c30643_6pv2 1 . 5 . 2530 . 1 1 26 HIS N N -8.153 -1.230 -1.065 . . . 1.0 . . . . . . . . . . . . A . 26 HIS N . . . . . . . . . c30643_6pv2 1 . 5 . 2531 . 1 1 26 HIS ND1 N -6.778 -4.722 -1.491 . . . 1.0 . . . . . . . . . . . . A . 26 HIS ND1 . . . . . . . . . c30643_6pv2 1 . 5 . 2532 . 1 1 26 HIS NE2 N -4.650 -4.302 -1.635 . . . 1.0 . . . . . . . . . . . . A . 26 HIS NE2 . . . . . . . . . c30643_6pv2 1 . 5 . 2533 . 1 1 26 HIS O O -10.810 -2.355 0.736 . . . 1.0 . . . . . . . . . . . . A . 26 HIS O . . . . . . . . . c30643_6pv2 1 . 5 . 2534 . 1 1 27 THR C C -11.044 0.615 2.039 . . . 1.0 . . . . . . . . . . . . A . 27 THR C . . . . . . . . . c30643_6pv2 1 . 5 . 2535 . 1 1 27 THR CA C -10.112 -0.447 2.610 . . . 1.0 . . . . . . . . . . . . A . 27 THR CA . . . . . . . . . c30643_6pv2 1 . 5 . 2536 . 1 1 27 THR CB C -9.295 0.147 3.773 . . . 1.0 . . . . . . . . . . . . A . 27 THR CB . . . . . . . . . c30643_6pv2 1 . 5 . 2537 . 1 1 27 THR CG2 C -8.639 -0.956 4.595 . . . 1.0 . . . . . . . . . . . . A . 27 THR CG2 . . . . . . . . . c30643_6pv2 1 . 5 . 2538 . 1 1 27 THR H H -8.330 -0.628 1.493 . . . 1.0 . . . . . . . . . . . . A . 27 THR H . . . . . . . . . c30643_6pv2 1 . 5 . 2539 . 1 1 27 THR HA H -10.707 -1.263 2.995 . . . 1.0 . . . . . . . . . . . . A . 27 THR HA . . . . . . . . . c30643_6pv2 1 . 5 . 2540 . 1 1 27 THR HB H -9.962 0.704 4.414 . . . 1.0 . . . . . . . . . . . . A . 27 THR HB . . . . . . . . . c30643_6pv2 1 . 5 . 2541 . 1 1 27 THR HG1 H -8.715 1.737 2.759 . . . 1.0 . . . . . . . . . . . . A . 27 THR HG1 . . . . . . . . . c30643_6pv2 1 . 5 . 2542 . 1 1 27 THR HG21 H -9.402 -1.600 5.005 . . . 1.0 . . . . . . . . . . . . A . 27 THR HG21 . . . . . . . . . c30643_6pv2 1 . 5 . 2543 . 1 1 27 THR HG22 H -8.068 -0.515 5.399 . . . 1.0 . . . . . . . . . . . . A . 27 THR HG22 . . . . . . . . . c30643_6pv2 1 . 5 . 2544 . 1 1 27 THR HG23 H -7.983 -1.534 3.962 . . . 1.0 . . . . . . . . . . . . A . 27 THR HG23 . . . . . . . . . c30643_6pv2 1 . 5 . 2545 . 1 1 27 THR N N -9.246 -0.975 1.571 . . . 1.0 . . . . . . . . . . . . A . 27 THR N . . . . . . . . . c30643_6pv2 1 . 5 . 2546 . 1 1 27 THR O O -10.632 1.750 1.788 . . . 1.0 . . . . . . . . . . . . A . 27 THR O . . . . . . . . . c30643_6pv2 1 . 5 . 2547 . 1 1 27 THR OG1 O -8.289 1.033 3.263 . . . 1.0 . . . . . . . . . . . . A . 27 THR OG1 . . . . . . . . . c30643_6pv2 1 . 5 . 2548 . 1 1 28 GLY C C -13.552 0.788 -0.212 . . . 1.0 . . . . . . . . . . . . A . 28 GLY C . . . . . . . . . c30643_6pv2 1 . 5 . 2549 . 1 1 28 GLY CA C -13.254 1.140 1.227 . . . 1.0 . . . . . . . . . . . . A . 28 GLY CA . . . . . . . . . c30643_6pv2 1 . 5 . 2550 . 1 1 28 GLY H H -12.560 -0.686 2.040 . . . 1.0 . . . . . . . . . . . . A . 28 GLY H . . . . . . . . . c30643_6pv2 1 . 5 . 2551 . 1 1 28 GLY HA2 H -14.169 1.094 1.798 . . . 1.0 . . . . . . . . . . . . A . 28 GLY HA2 . . . . . . . . . c30643_6pv2 1 . 5 . 2552 . 1 1 28 GLY HA3 H -12.860 2.145 1.270 . . . 1.0 . . . . . . . . . . . . A . 28 GLY HA3 . . . . . . . . . c30643_6pv2 1 . 5 . 2553 . 1 1 28 GLY N N -12.290 0.230 1.810 . . . 1.0 . . . . . . . . . . . . A . 28 GLY N . . . . . . . . . c30643_6pv2 1 . 5 . 2554 . 1 1 28 GLY O O -14.580 1.191 -0.756 . . . 1.0 . . . . . . . . . . . . A . 28 GLY O . . . . . . . . . c30643_6pv2 1 . 5 . 2555 . 1 1 29 GLU C C -12.888 0.746 -3.171 . . . 1.0 . . . . . . . . . . . . A . 29 GLU C . . . . . . . . . c30643_6pv2 1 . 5 . 2556 . 1 1 29 GLU CA C -12.790 -0.437 -2.199 . . . 1.0 . . . . . . . . . . . . A . 29 GLU CA . . . . . . . . . c30643_6pv2 1 . 5 . 2557 . 1 1 29 GLU CB C -14.021 -1.350 -2.307 . . . 1.0 . . . . . . . . . . . . A . 29 GLU CB . . . . . . . . . c30643_6pv2 1 . 5 . 2558 . 1 1 29 GLU CD C -15.284 -3.075 -3.641 . . . 1.0 . . . . . . . . . . . . A . 29 GLU CD . . . . . . . . . c30643_6pv2 1 . 5 . 2559 . 1 1 29 GLU CG C -14.128 -2.102 -3.625 . . . 1.0 . . . . . . . . . . . . A . 29 GLU CG . . . . . . . . . c30643_6pv2 1 . 5 . 2560 . 1 1 29 GLU H H -11.845 -0.238 -0.318 . . . 1.0 . . . . . . . . . . . . A . 29 GLU H . . . . . . . . . c30643_6pv2 1 . 5 . 2561 . 1 1 29 GLU HA H -11.908 -1.010 -2.448 . . . 1.0 . . . . . . . . . . . . A . 29 GLU HA . . . . . . . . . c30643_6pv2 1 . 5 . 2562 . 1 1 29 GLU HB2 H -13.987 -2.075 -1.507 . . . 1.0 . . . . . . . . . . . . A . 29 GLU HB2 . . . . . . . . . c30643_6pv2 1 . 5 . 2563 . 1 1 29 GLU HB3 H -14.909 -0.746 -2.191 . . . 1.0 . . . . . . . . . . . . A . 29 GLU HB3 . . . . . . . . . c30643_6pv2 1 . 5 . 2564 . 1 1 29 GLU HG2 H -14.266 -1.387 -4.421 . . . 1.0 . . . . . . . . . . . . A . 29 GLU HG2 . . . . . . . . . c30643_6pv2 1 . 5 . 2565 . 1 1 29 GLU HG3 H -13.211 -2.649 -3.788 . . . 1.0 . . . . . . . . . . . . A . 29 GLU HG3 . . . . . . . . . c30643_6pv2 1 . 5 . 2566 . 1 1 29 GLU N N -12.641 0.028 -0.820 . . . 1.0 . . . . . . . . . . . . A . 29 GLU N . . . . . . . . . c30643_6pv2 1 . 5 . 2567 . 1 1 29 GLU O O -13.557 0.678 -4.201 . . . 1.0 . . . . . . . . . . . . A . 29 GLU O . . . . . . . . . c30643_6pv2 1 . 5 . 2568 . 1 1 29 GLU OE1 O -16.441 -2.639 -3.830 . . . 1.0 . . . . . . . . . . . . A . 29 GLU OE1 . . . . . . . . . c30643_6pv2 1 . 5 . 2569 . 1 1 29 GLU OE2 O -15.046 -4.285 -3.463 . . . 1.0 . . . . . . . . . . . . A . 29 GLU OE2 . . . . . . . . . c30643_6pv2 1 . 5 . 2570 . 1 1 30 LYS C C -10.892 3.211 -4.380 . . . 1.0 . . . . . . . . . . . . A . 30 LYS C . . . . . . . . . c30643_6pv2 1 . 5 . 2571 . 1 1 30 LYS CA C -12.236 3.019 -3.681 . . . 1.0 . . . . . . . . . . . . A . 30 LYS CA . . . . . . . . . c30643_6pv2 1 . 5 . 2572 . 1 1 30 LYS CB C -12.597 4.252 -2.845 . . . 1.0 . . . . . . . . . . . . A . 30 LYS CB . . . . . . . . . c30643_6pv2 1 . 5 . 2573 . 1 1 30 LYS CD C -13.028 6.724 -2.764 . . . 1.0 . . . . . . . . . . . . A . 30 LYS CD . . . . . . . . . c30643_6pv2 1 . 5 . 2574 . 1 1 30 LYS CE C -13.049 8.019 -3.560 . . . 1.0 . . . . . . . . . . . . A . 30 LYS CE . . . . . . . . . c30643_6pv2 1 . 5 . 2575 . 1 1 30 LYS CG C -12.729 5.530 -3.656 . . . 1.0 . . . . . . . . . . . . A . 30 LYS CG . . . . . . . . . c30643_6pv2 1 . 5 . 2576 . 1 1 30 LYS H H -11.664 1.830 -2.028 . . . 1.0 . . . . . . . . . . . . A . 30 LYS H . . . . . . . . . c30643_6pv2 1 . 5 . 2577 . 1 1 30 LYS HA H -12.996 2.869 -4.434 . . . 1.0 . . . . . . . . . . . . A . 30 LYS HA . . . . . . . . . c30643_6pv2 1 . 5 . 2578 . 1 1 30 LYS HB2 H -13.537 4.071 -2.346 . . . 1.0 . . . . . . . . . . . . A . 30 LYS HB2 . . . . . . . . . c30643_6pv2 1 . 5 . 2579 . 1 1 30 LYS HB3 H -11.831 4.402 -2.103 . . . 1.0 . . . . . . . . . . . . A . 30 LYS HB3 . . . . . . . . . c30643_6pv2 1 . 5 . 2580 . 1 1 30 LYS HD2 H -13.992 6.584 -2.299 . . . 1.0 . . . . . . . . . . . . A . 30 LYS HD2 . . . . . . . . . c30643_6pv2 1 . 5 . 2581 . 1 1 30 LYS HD3 H -12.266 6.793 -2.003 . . . 1.0 . . . . . . . . . . . . A . 30 LYS HD3 . . . . . . . . . c30643_6pv2 1 . 5 . 2582 . 1 1 30 LYS HE2 H -12.108 8.123 -4.077 . . . 1.0 . . . . . . . . . . . . A . 30 LYS HE2 . . . . . . . . . c30643_6pv2 1 . 5 . 2583 . 1 1 30 LYS HE3 H -13.850 7.969 -4.280 . . . 1.0 . . . . . . . . . . . . A . 30 LYS HE3 . . . . . . . . . c30643_6pv2 1 . 5 . 2584 . 1 1 30 LYS HG2 H -11.805 5.708 -4.184 . . . 1.0 . . . . . . . . . . . . A . 30 LYS HG2 . . . . . . . . . c30643_6pv2 1 . 5 . 2585 . 1 1 30 LYS HG3 H -13.535 5.412 -4.365 . . . 1.0 . . . . . . . . . . . . A . 30 LYS HG3 . . . . . . . . . c30643_6pv2 1 . 5 . 2586 . 1 1 30 LYS HZ1 H -12.510 9.252 -1.966 . . . 1.0 . . . . . . . . . . . . A . 30 LYS HZ1 . . . . . . . . . c30643_6pv2 1 . 5 . 2587 . 1 1 30 LYS HZ2 H -14.177 9.149 -2.217 . . . 1.0 . . . . . . . . . . . . A . 30 LYS HZ2 . . . . . . . . . c30643_6pv2 1 . 5 . 2588 . 1 1 30 LYS HZ3 H -13.223 10.075 -3.258 . . . 1.0 . . . . . . . . . . . . A . 30 LYS HZ3 . . . . . . . . . c30643_6pv2 1 . 5 . 2589 . 1 1 30 LYS N N -12.205 1.831 -2.844 . . . 1.0 . . . . . . . . . . . . A . 30 LYS N . . . . . . . . . c30643_6pv2 1 . 5 . 2590 . 1 1 30 LYS NZ N -13.254 9.204 -2.689 . . . 1.0 . . . . . . . . . . . . A . 30 LYS NZ . . . . . . . . . c30643_6pv2 1 . 5 . 2591 . 1 1 30 LYS O O -10.734 2.860 -5.548 . . . 1.0 . . . . . . . . . . . . A . 30 LYS O . . . . . . . . . c30643_6pv2 1 . 5 . 2592 . 1 1 31 NH2 HN1 H -10.117 4.014 -2.740 . . . 1.0 . . . . . . . . . . . . A . 31 NH2 HN1 . . . . . . . . . c30643_6pv2 1 . 5 . 2593 . 1 1 31 NH2 HN2 H -9.050 3.887 -4.094 . . . 1.0 . . . . . . . . . . . . A . 31 NH2 HN2 . . . . . . . . . c30643_6pv2 1 . 5 . 2594 . 1 1 31 NH2 N N -9.923 3.757 -3.665 . . . 1.0 . . . . . . . . . . . . A . 31 NH2 N . . . . . . . . . c30643_6pv2 1 . 5 . 2595 . 2 2 1 ZN ZN Zn -2.733 -4.347 -2.197 . . . 1.0 . . . . . . . . . . . . A . 101 ZN ZN . . . . . . . . . c30643_6pv2 1 . 6 . 2596 . 1 1 1 ARG C C 12.128 -1.195 2.415 . . . 1.0 . . . . . . . . . . . . A . 1 ARG C . . . . . . . . . c30643_6pv2 1 . 6 . 2597 . 1 1 1 ARG CA C 13.297 -1.903 3.086 . . . 1.0 . . . . . . . . . . . . A . 1 ARG CA . . . . . . . . . c30643_6pv2 1 . 6 . 2598 . 1 1 1 ARG CB C 12.858 -2.410 4.467 . . . 1.0 . . . . . . . . . . . . A . 1 ARG CB . . . . . . . . . c30643_6pv2 1 . 6 . 2599 . 1 1 1 ARG CD C 13.441 -3.631 6.586 . . . 1.0 . . . . . . . . . . . . A . 1 ARG CD . . . . . . . . . c30643_6pv2 1 . 6 . 2600 . 1 1 1 ARG CG C 13.935 -3.176 5.219 . . . 1.0 . . . . . . . . . . . . A . 1 ARG CG . . . . . . . . . c30643_6pv2 1 . 6 . 2601 . 1 1 1 ARG CZ C 14.356 -4.686 8.626 . . . 1.0 . . . . . . . . . . . . A . 1 ARG CZ . . . . . . . . . c30643_6pv2 1 . 6 . 2602 . 1 1 1 ARG H1 H 15.249 -1.450 3.660 . . . 1.0 . . . . . . . . . . . . A . 1 ARG H1 . . . . . . . . . c30643_6pv2 1 . 6 . 2603 . 1 1 1 ARG H2 H 14.177 -0.148 3.779 . . . 1.0 . . . . . . . . . . . . A . 1 ARG H2 . . . . . . . . . c30643_6pv2 1 . 6 . 2604 . 1 1 1 ARG H3 H 14.734 -0.644 2.266 . . . 1.0 . . . . . . . . . . . . A . 1 ARG H3 . . . . . . . . . c30643_6pv2 1 . 6 . 2605 . 1 1 1 ARG HA H 13.600 -2.740 2.477 . . . 1.0 . . . . . . . . . . . . A . 1 ARG HA . . . . . . . . . c30643_6pv2 1 . 6 . 2606 . 1 1 1 ARG HB2 H 12.562 -1.565 5.069 . . . 1.0 . . . . . . . . . . . . A . 1 ARG HB2 . . . . . . . . . c30643_6pv2 1 . 6 . 2607 . 1 1 1 ARG HB3 H 12.007 -3.063 4.340 . . . 1.0 . . . . . . . . . . . . A . 1 ARG HB3 . . . . . . . . . c30643_6pv2 1 . 6 . 2608 . 1 1 1 ARG HD2 H 13.111 -2.767 7.145 . . . 1.0 . . . . . . . . . . . . A . 1 ARG HD2 . . . . . . . . . c30643_6pv2 1 . 6 . 2609 . 1 1 1 ARG HD3 H 12.609 -4.306 6.449 . . . 1.0 . . . . . . . . . . . . A . 1 ARG HD3 . . . . . . . . . c30643_6pv2 1 . 6 . 2610 . 1 1 1 ARG HE H 15.328 -4.508 6.884 . . . 1.0 . . . . . . . . . . . . A . 1 ARG HE . . . . . . . . . c30643_6pv2 1 . 6 . 2611 . 1 1 1 ARG HG2 H 14.214 -4.044 4.641 . . . 1.0 . . . . . . . . . . . . A . 1 ARG HG2 . . . . . . . . . c30643_6pv2 1 . 6 . 2612 . 1 1 1 ARG HG3 H 14.796 -2.535 5.348 . . . 1.0 . . . . . . . . . . . . A . 1 ARG HG3 . . . . . . . . . c30643_6pv2 1 . 6 . 2613 . 1 1 1 ARG HH11 H 13.131 -4.713 10.246 . . . 1.0 . . . . . . . . . . . . A . 1 ARG HH11 . . . . . . . . . c30643_6pv2 1 . 6 . 2614 . 1 1 1 ARG HH12 H 12.469 -3.966 8.828 . . . 1.0 . . . . . . . . . . . . A . 1 ARG HH12 . . . . . . . . . c30643_6pv2 1 . 6 . 2615 . 1 1 1 ARG HH21 H 16.207 -5.508 8.748 . . . 1.0 . . . . . . . . . . . . A . 1 ARG HH21 . . . . . . . . . c30643_6pv2 1 . 6 . 2616 . 1 1 1 ARG HH22 H 15.262 -5.591 10.199 . . . 1.0 . . . . . . . . . . . . A . 1 ARG HH22 . . . . . . . . . c30643_6pv2 1 . 6 . 2617 . 1 1 1 ARG N N 14.444 -0.976 3.208 . . . 1.0 . . . . . . . . . . . . A . 1 ARG N . . . . . . . . . c30643_6pv2 1 . 6 . 2618 . 1 1 1 ARG NE N 14.485 -4.314 7.350 . . . 1.0 . . . . . . . . . . . . A . 1 ARG NE . . . . . . . . . c30643_6pv2 1 . 6 . 2619 . 1 1 1 ARG NH1 N 13.229 -4.435 9.286 . . . 1.0 . . . . . . . . . . . . A . 1 ARG NH1 . . . . . . . . . c30643_6pv2 1 . 6 . 2620 . 1 1 1 ARG NH2 N 15.355 -5.311 9.239 . . . 1.0 . . . . . . . . . . . . A . 1 ARG NH2 . . . . . . . . . c30643_6pv2 1 . 6 . 2621 . 1 1 1 ARG O O 11.781 -0.072 2.785 . . . 1.0 . . . . . . . . . . . . A . 1 ARG O . . . . . . . . . c30643_6pv2 1 . 6 . 2622 . 1 1 2 PRO C C 9.074 -1.426 1.528 . . . 1.0 . . . . . . . . . . . . A . 2 PRO C . . . . . . . . . c30643_6pv2 1 . 6 . 2623 . 1 1 2 PRO CA C 10.355 -1.265 0.721 . . . 1.0 . . . . . . . . . . . . A . 2 PRO CA . . . . . . . . . c30643_6pv2 1 . 6 . 2624 . 1 1 2 PRO CB C 10.283 -2.086 -0.564 . . . 1.0 . . . . . . . . . . . . A . 2 PRO CB . . . . . . . . . c30643_6pv2 1 . 6 . 2625 . 1 1 2 PRO CD C 11.887 -3.151 0.865 . . . 1.0 . . . . . . . . . . . . A . 2 PRO CD . . . . . . . . . c30643_6pv2 1 . 6 . 2626 . 1 1 2 PRO CG C 10.829 -3.419 -0.179 . . . 1.0 . . . . . . . . . . . . A . 2 PRO CG . . . . . . . . . c30643_6pv2 1 . 6 . 2627 . 1 1 2 PRO HA H 10.503 -0.222 0.482 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HA . . . . . . . . . c30643_6pv2 1 . 6 . 2628 . 1 1 2 PRO HB2 H 9.252 -2.156 -0.893 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HB2 . . . . . . . . . c30643_6pv2 1 . 6 . 2629 . 1 1 2 PRO HB3 H 10.884 -1.619 -1.331 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HB3 . . . . . . . . . c30643_6pv2 1 . 6 . 2630 . 1 1 2 PRO HD2 H 11.857 -3.909 1.633 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HD2 . . . . . . . . . c30643_6pv2 1 . 6 . 2631 . 1 1 2 PRO HD3 H 12.865 -3.112 0.409 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HD3 . . . . . . . . . c30643_6pv2 1 . 6 . 2632 . 1 1 2 PRO HG2 H 10.040 -4.030 0.235 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HG2 . . . . . . . . . c30643_6pv2 1 . 6 . 2633 . 1 1 2 PRO HG3 H 11.264 -3.901 -1.041 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HG3 . . . . . . . . . c30643_6pv2 1 . 6 . 2634 . 1 1 2 PRO N N 11.511 -1.832 1.411 . . . 1.0 . . . . . . . . . . . . A . 2 PRO N . . . . . . . . . c30643_6pv2 1 . 6 . 2635 . 1 1 2 PRO O O 9.012 -2.212 2.475 . . . 1.0 . . . . . . . . . . . . A . 2 PRO O . . . . . . . . . c30643_6pv2 1 . 6 . 2636 . 1 1 3 PHE C C 5.859 -1.635 0.926 . . . 1.0 . . . . . . . . . . . . A . 3 PHE C . . . . . . . . . c30643_6pv2 1 . 6 . 2637 . 1 1 3 PHE CA C 6.759 -0.750 1.772 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CA . . . . . . . . . c30643_6pv2 1 . 6 . 2638 . 1 1 3 PHE CB C 6.153 0.646 1.914 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CB . . . . . . . . . c30643_6pv2 1 . 6 . 2639 . 1 1 3 PHE CD1 C 7.910 2.402 2.280 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CD1 . . . . . . . . . c30643_6pv2 1 . 6 . 2640 . 1 1 3 PHE CD2 C 6.718 1.569 4.169 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CD2 . . . . . . . . . c30643_6pv2 1 . 6 . 2641 . 1 1 3 PHE CE1 C 8.636 3.240 3.104 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CE1 . . . . . . . . . c30643_6pv2 1 . 6 . 2642 . 1 1 3 PHE CE2 C 7.440 2.404 4.998 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CE2 . . . . . . . . . c30643_6pv2 1 . 6 . 2643 . 1 1 3 PHE CG C 6.944 1.558 2.804 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CG . . . . . . . . . c30643_6pv2 1 . 6 . 2644 . 1 1 3 PHE CZ C 8.401 3.242 4.465 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CZ . . . . . . . . . c30643_6pv2 1 . 6 . 2645 . 1 1 3 PHE H H 8.198 -0.036 0.414 . . . 1.0 . . . . . . . . . . . . A . 3 PHE H . . . . . . . . . c30643_6pv2 1 . 6 . 2646 . 1 1 3 PHE HA H 6.876 -1.194 2.750 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HA . . . . . . . . . c30643_6pv2 1 . 6 . 2647 . 1 1 3 PHE HB2 H 6.092 1.105 0.940 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HB2 . . . . . . . . . c30643_6pv2 1 . 6 . 2648 . 1 1 3 PHE HB3 H 5.163 0.559 2.326 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HB3 . . . . . . . . . c30643_6pv2 1 . 6 . 2649 . 1 1 3 PHE HD1 H 8.093 2.401 1.215 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HD1 . . . . . . . . . c30643_6pv2 1 . 6 . 2650 . 1 1 3 PHE HD2 H 5.966 0.915 4.586 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HD2 . . . . . . . . . c30643_6pv2 1 . 6 . 2651 . 1 1 3 PHE HE1 H 9.386 3.894 2.682 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HE1 . . . . . . . . . c30643_6pv2 1 . 6 . 2652 . 1 1 3 PHE HE2 H 7.253 2.403 6.062 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HE2 . . . . . . . . . c30643_6pv2 1 . 6 . 2653 . 1 1 3 PHE HZ H 8.967 3.897 5.111 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HZ . . . . . . . . . c30643_6pv2 1 . 6 . 2654 . 1 1 3 PHE N N 8.064 -0.669 1.150 . . . 1.0 . . . . . . . . . . . . A . 3 PHE N . . . . . . . . . c30643_6pv2 1 . 6 . 2655 . 1 1 3 PHE O O 5.233 -1.173 -0.026 . . . 1.0 . . . . . . . . . . . . A . 3 PHE O . . . . . . . . . c30643_6pv2 1 . 6 . 2656 . 1 1 4 NLE C C 3.694 -4.107 1.075 . . . 1.0 . . . . . . . . . . . . A . 4 NLE C . . . . . . . . . c30643_6pv2 1 . 6 . 2657 . 1 1 4 NLE CA C 5.076 -3.884 0.478 . . . 1.0 . . . . . . . . . . . . A . 4 NLE CA . . . . . . . . . c30643_6pv2 1 . 6 . 2658 . 1 1 4 NLE CB C 5.839 -5.213 0.422 . . . 1.0 . . . . . . . . . . . . A . 4 NLE CB . . . . . . . . . c30643_6pv2 1 . 6 . 2659 . 1 1 4 NLE CD C 5.964 -7.569 -0.441 . . . 1.0 . . . . . . . . . . . . A . 4 NLE CD . . . . . . . . . c30643_6pv2 1 . 6 . 2660 . 1 1 4 NLE CE C 5.261 -8.617 -1.274 . . . 1.0 . . . . . . . . . . . . A . 4 NLE CE . . . . . . . . . c30643_6pv2 1 . 6 . 2661 . 1 1 4 NLE CG C 5.166 -6.276 -0.434 . . . 1.0 . . . . . . . . . . . . A . 4 NLE CG . . . . . . . . . c30643_6pv2 1 . 6 . 2662 . 1 1 4 NLE H H 6.317 -3.213 2.053 . . . 1.0 . . . . . . . . . . . . A . 4 NLE H . . . . . . . . . c30643_6pv2 1 . 6 . 2663 . 1 1 4 NLE HA H 4.966 -3.497 -0.521 . . . 1.0 . . . . . . . . . . . . A . 4 NLE HA . . . . . . . . . c30643_6pv2 1 . 6 . 2664 . 1 1 4 NLE HB2 H 5.932 -5.600 1.425 . . . 1.0 . . . . . . . . . . . . A . 4 NLE HB2 . . . . . . . . . c30643_6pv2 1 . 6 . 2665 . 1 1 4 NLE HB3 H 6.827 -5.033 0.026 . . . 1.0 . . . . . . . . . . . . A . 4 NLE HB3 . . . . . . . . . c30643_6pv2 1 . 6 . 2666 . 1 1 4 NLE HD2 H 6.063 -7.936 0.572 . . . 1.0 . . . . . . . . . . . . A . 4 NLE HD2 . . . . . . . . . c30643_6pv2 1 . 6 . 2667 . 1 1 4 NLE HD3 H 6.939 -7.386 -0.865 . . . 1.0 . . . . . . . . . . . . A . 4 NLE HD3 . . . . . . . . . c30643_6pv2 1 . 6 . 2668 . 1 1 4 NLE HE1 H 5.152 -8.258 -2.288 . . . 1.0 . . . . . . . . . . . . A . 4 NLE HE1 . . . . . . . . . c30643_6pv2 1 . 6 . 2669 . 1 1 4 NLE HE2 H 4.286 -8.815 -0.855 . . . 1.0 . . . . . . . . . . . . A . 4 NLE HE2 . . . . . . . . . c30643_6pv2 1 . 6 . 2670 . 1 1 4 NLE HE3 H 5.843 -9.526 -1.275 . . . 1.0 . . . . . . . . . . . . A . 4 NLE HE3 . . . . . . . . . c30643_6pv2 1 . 6 . 2671 . 1 1 4 NLE HG2 H 5.082 -5.910 -1.447 . . . 1.0 . . . . . . . . . . . . A . 4 NLE HG2 . . . . . . . . . c30643_6pv2 1 . 6 . 2672 . 1 1 4 NLE HG3 H 4.183 -6.476 -0.035 . . . 1.0 . . . . . . . . . . . . A . 4 NLE HG3 . . . . . . . . . c30643_6pv2 1 . 6 . 2673 . 1 1 4 NLE N N 5.827 -2.913 1.256 . . . 1.0 . . . . . . . . . . . . A . 4 NLE N . . . . . . . . . c30643_6pv2 1 . 6 . 2674 . 1 1 4 NLE O O 3.544 -4.233 2.293 . . . 1.0 . . . . . . . . . . . . A . 4 NLE O . . . . . . . . . c30643_6pv2 1 . 6 . 2675 . 1 1 5 CYS C C 1.282 -5.915 1.086 . . . 1.0 . . . . . . . . . . . . A . 5 CYS C . . . . . . . . . c30643_6pv2 1 . 6 . 2676 . 1 1 5 CYS CA C 1.334 -4.460 0.625 . . . 1.0 . . . . . . . . . . . . A . 5 CYS CA . . . . . . . . . c30643_6pv2 1 . 6 . 2677 . 1 1 5 CYS CB C 0.358 -4.223 -0.529 . . . 1.0 . . . . . . . . . . . . A . 5 CYS CB . . . . . . . . . c30643_6pv2 1 . 6 . 2678 . 1 1 5 CYS H H 2.863 -3.918 -0.732 . . . 1.0 . . . . . . . . . . . . A . 5 CYS H . . . . . . . . . c30643_6pv2 1 . 6 . 2679 . 1 1 5 CYS HA H 1.070 -3.820 1.452 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HA . . . . . . . . . c30643_6pv2 1 . 6 . 2680 . 1 1 5 CYS HB2 H 0.378 -3.179 -0.799 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HB2 . . . . . . . . . c30643_6pv2 1 . 6 . 2681 . 1 1 5 CYS HB3 H 0.670 -4.812 -1.377 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HB3 . . . . . . . . . c30643_6pv2 1 . 6 . 2682 . 1 1 5 CYS N N 2.687 -4.130 0.213 . . . 1.0 . . . . . . . . . . . . A . 5 CYS N . . . . . . . . . c30643_6pv2 1 . 6 . 2683 . 1 1 5 CYS O O 1.878 -6.789 0.459 . . . 1.0 . . . . . . . . . . . . A . 5 CYS O . . . . . . . . . c30643_6pv2 1 . 6 . 2684 . 1 1 5 CYS SG S -1.356 -4.657 -0.156 . . . 1.0 . . . . . . . . . . . . A . 5 CYS SG . . . . . . . . . c30643_6pv2 1 . 6 . 2685 . 1 1 6 THR C C -0.954 -7.968 2.824 . . . 1.0 . . . . . . . . . . . . A . 6 THR C . . . . . . . . . c30643_6pv2 1 . 6 . 2686 . 1 1 6 THR CA C 0.499 -7.513 2.733 . . . 1.0 . . . . . . . . . . . . A . 6 THR CA . . . . . . . . . c30643_6pv2 1 . 6 . 2687 . 1 1 6 THR CB C 1.164 -7.594 4.123 . . . 1.0 . . . . . . . . . . . . A . 6 THR CB . . . . . . . . . c30643_6pv2 1 . 6 . 2688 . 1 1 6 THR CG2 C 2.682 -7.565 4.005 . . . 1.0 . . . . . . . . . . . . A . 6 THR CG2 . . . . . . . . . c30643_6pv2 1 . 6 . 2689 . 1 1 6 THR H H 0.138 -5.431 2.650 . . . 1.0 . . . . . . . . . . . . A . 6 THR H . . . . . . . . . c30643_6pv2 1 . 6 . 2690 . 1 1 6 THR HA H 1.027 -8.176 2.066 . . . 1.0 . . . . . . . . . . . . A . 6 THR HA . . . . . . . . . c30643_6pv2 1 . 6 . 2691 . 1 1 6 THR HB H 0.872 -8.525 4.589 . . . 1.0 . . . . . . . . . . . . A . 6 THR HB . . . . . . . . . c30643_6pv2 1 . 6 . 2692 . 1 1 6 THR HG1 H 1.195 -5.699 4.682 . . . 1.0 . . . . . . . . . . . . A . 6 THR HG1 . . . . . . . . . c30643_6pv2 1 . 6 . 2693 . 1 1 6 THR HG21 H 3.014 -8.410 3.421 . . . 1.0 . . . . . . . . . . . . A . 6 THR HG21 . . . . . . . . . c30643_6pv2 1 . 6 . 2694 . 1 1 6 THR HG22 H 3.120 -7.612 4.991 . . . 1.0 . . . . . . . . . . . . A . 6 THR HG22 . . . . . . . . . c30643_6pv2 1 . 6 . 2695 . 1 1 6 THR HG23 H 2.986 -6.649 3.519 . . . 1.0 . . . . . . . . . . . . A . 6 THR HG23 . . . . . . . . . c30643_6pv2 1 . 6 . 2696 . 1 1 6 THR N N 0.593 -6.167 2.188 . . . 1.0 . . . . . . . . . . . . A . 6 THR N . . . . . . . . . c30643_6pv2 1 . 6 . 2697 . 1 1 6 THR O O -1.343 -8.677 3.755 . . . 1.0 . . . . . . . . . . . . A . 6 THR O . . . . . . . . . c30643_6pv2 1 . 6 . 2698 . 1 1 6 THR OG1 O 0.725 -6.501 4.943 . . . 1.0 . . . . . . . . . . . . A . 6 THR OG1 . . . . . . . . . c30643_6pv2 1 . 6 . 2699 . 1 1 7 TRP C C -3.387 -9.269 1.199 . . . 1.0 . . . . . . . . . . . . A . 7 TRP C . . . . . . . . . c30643_6pv2 1 . 6 . 2700 . 1 1 7 TRP CA C -3.169 -7.901 1.841 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CA . . . . . . . . . c30643_6pv2 1 . 6 . 2701 . 1 1 7 TRP CB C -3.967 -6.834 1.091 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CB . . . . . . . . . c30643_6pv2 1 . 6 . 2702 . 1 1 7 TRP CD1 C -6.381 -7.667 0.921 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CD1 . . . . . . . . . c30643_6pv2 1 . 6 . 2703 . 1 1 7 TRP CD2 C -6.091 -5.958 2.333 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CD2 . . . . . . . . . c30643_6pv2 1 . 6 . 2704 . 1 1 7 TRP CE2 C -7.451 -6.315 2.339 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CE2 . . . . . . . . . c30643_6pv2 1 . 6 . 2705 . 1 1 7 TRP CE3 C -5.665 -4.905 3.144 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CE3 . . . . . . . . . c30643_6pv2 1 . 6 . 2706 . 1 1 7 TRP CG C -5.424 -6.838 1.424 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CG . . . . . . . . . c30643_6pv2 1 . 6 . 2707 . 1 1 7 TRP CH2 C -7.944 -4.624 3.911 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CH2 . . . . . . . . . c30643_6pv2 1 . 6 . 2708 . 1 1 7 TRP CZ2 C -8.389 -5.654 3.127 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CZ2 . . . . . . . . . c30643_6pv2 1 . 6 . 2709 . 1 1 7 TRP CZ3 C -6.596 -4.249 3.924 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CZ3 . . . . . . . . . c30643_6pv2 1 . 6 . 2710 . 1 1 7 TRP H H -1.388 -7.031 1.109 . . . 1.0 . . . . . . . . . . . . A . 7 TRP H . . . . . . . . . c30643_6pv2 1 . 6 . 2711 . 1 1 7 TRP HA H -3.509 -7.940 2.865 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HA . . . . . . . . . c30643_6pv2 1 . 6 . 2712 . 1 1 7 TRP HB2 H -3.572 -5.860 1.333 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HB2 . . . . . . . . . c30643_6pv2 1 . 6 . 2713 . 1 1 7 TRP HB3 H -3.866 -7.003 0.030 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HB3 . . . . . . . . . c30643_6pv2 1 . 6 . 2714 . 1 1 7 TRP HD1 H -6.188 -8.446 0.200 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HD1 . . . . . . . . . c30643_6pv2 1 . 6 . 2715 . 1 1 7 TRP HE1 H -8.449 -7.823 1.269 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HE1 . . . . . . . . . c30643_6pv2 1 . 6 . 2716 . 1 1 7 TRP HE3 H -4.628 -4.602 3.165 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HE3 . . . . . . . . . c30643_6pv2 1 . 6 . 2717 . 1 1 7 TRP HH2 H -8.636 -4.081 4.537 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HH2 . . . . . . . . . c30643_6pv2 1 . 6 . 2718 . 1 1 7 TRP HZ2 H -9.433 -5.932 3.129 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HZ2 . . . . . . . . . c30643_6pv2 1 . 6 . 2719 . 1 1 7 TRP HZ3 H -6.285 -3.430 4.555 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HZ3 . . . . . . . . . c30643_6pv2 1 . 6 . 2720 . 1 1 7 TRP N N -1.756 -7.564 1.847 . . . 1.0 . . . . . . . . . . . . A . 7 TRP N . . . . . . . . . c30643_6pv2 1 . 6 . 2721 . 1 1 7 TRP NE1 N -7.604 -7.365 1.469 . . . 1.0 . . . . . . . . . . . . A . 7 TRP NE1 . . . . . . . . . c30643_6pv2 1 . 6 . 2722 . 1 1 7 TRP O O -3.698 -9.368 0.012 . . . 1.0 . . . . . . . . . . . . A . 7 TRP O . . . . . . . . . c30643_6pv2 1 . 6 . 2723 . 1 1 8 ORN C C -1.405 -10.870 -2.196 . . . 1.0 . . . . . . . . . . . . A . 8 ORN C . . . . . . . . . c30643_6pv2 1 . 6 . 2724 . 1 1 8 ORN CA C -1.898 -11.942 -1.239 . . . 1.0 . . . . . . . . . . . . A . 8 ORN CA . . . . . . . . . c30643_6pv2 1 . 6 . 2725 . 1 1 8 ORN CB C -1.255 -11.731 0.136 . . . 1.0 . . . . . . . . . . . . A . 8 ORN CB . . . . . . . . . c30643_6pv2 1 . 6 . 2726 . 1 1 8 ORN CD C -3.345 -11.708 1.541 . . . 1.0 . . . . . . . . . . . . A . 8 ORN CD . . . . . . . . . c30643_6pv2 1 . 6 . 2727 . 1 1 8 ORN CG C -2.010 -12.394 1.276 . . . 1.0 . . . . . . . . . . . . A . 8 ORN CG . . . . . . . . . c30643_6pv2 1 . 6 . 2728 . 1 1 8 ORN H H -1.894 -14.019 -1.078 . . . 1.0 . . . . . . . . . . . . A . 8 ORN H . . . . . . . . . c30643_6pv2 1 . 6 . 2729 . 1 1 8 ORN HA H -2.970 -11.855 -1.144 . . . 1.0 . . . . . . . . . . . . A . 8 ORN HA . . . . . . . . . c30643_6pv2 1 . 6 . 2730 . 1 1 8 ORN HB2 H -1.208 -10.671 0.336 . . . 1.0 . . . . . . . . . . . . A . 8 ORN HB2 . . . . . . . . . c30643_6pv2 1 . 6 . 2731 . 1 1 8 ORN HB3 H -0.253 -12.130 0.117 . . . 1.0 . . . . . . . . . . . . A . 8 ORN HB3 . . . . . . . . . c30643_6pv2 1 . 6 . 2732 . 1 1 8 ORN HD2 H -3.873 -12.257 2.306 . . . 1.0 . . . . . . . . . . . . A . 8 ORN HD2 . . . . . . . . . c30643_6pv2 1 . 6 . 2733 . 1 1 8 ORN HD3 H -3.926 -11.716 0.632 . . . 1.0 . . . . . . . . . . . . A . 8 ORN HD3 . . . . . . . . . c30643_6pv2 1 . 6 . 2734 . 1 1 8 ORN HE1 H -2.904 -10.169 2.908 . . . 1.0 . . . . . . . . . . . . A . 8 ORN HE1 . . . . . . . . . c30643_6pv2 1 . 6 . 2735 . 1 1 8 ORN HG2 H -1.405 -12.345 2.170 . . . 1.0 . . . . . . . . . . . . A . 8 ORN HG2 . . . . . . . . . c30643_6pv2 1 . 6 . 2736 . 1 1 8 ORN HG3 H -2.192 -13.427 1.021 . . . 1.0 . . . . . . . . . . . . A . 8 ORN HG3 . . . . . . . . . c30643_6pv2 1 . 6 . 2737 . 1 1 8 ORN N N -1.587 -13.293 -1.755 . . . 1.0 . . . . . . . . . . . . A . 8 ORN N . . . . . . . . . c30643_6pv2 1 . 6 . 2738 . 1 1 8 ORN NE N -3.182 -10.322 1.980 . . . 1.0 . . . . . . . . . . . . A . 8 ORN NE . . . . . . . . . c30643_6pv2 1 . 6 . 2739 . 1 1 8 ORN O O -0.427 -11.067 -2.919 . . . 1.0 . . . . . . . . . . . . A . 8 ORN O . . . . . . . . . c30643_6pv2 1 . 6 . 2740 . 1 1 9 CYS C C -0.377 -8.041 -2.325 . . . 1.0 . . . . . . . . . . . . A . 9 CYS C . . . . . . . . . c30643_6pv2 1 . 6 . 2741 . 1 1 9 CYS CA C -1.662 -8.575 -2.945 . . . 1.0 . . . . . . . . . . . . A . 9 CYS CA . . . . . . . . . c30643_6pv2 1 . 6 . 2742 . 1 1 9 CYS CB C -2.753 -7.508 -2.914 . . . 1.0 . . . . . . . . . . . . A . 9 CYS CB . . . . . . . . . c30643_6pv2 1 . 6 . 2743 . 1 1 9 CYS H H -2.937 -9.694 -1.688 . . . 1.0 . . . . . . . . . . . . A . 9 CYS H . . . . . . . . . c30643_6pv2 1 . 6 . 2744 . 1 1 9 CYS HA H -1.474 -8.869 -3.966 . . . 1.0 . . . . . . . . . . . . A . 9 CYS HA . . . . . . . . . c30643_6pv2 1 . 6 . 2745 . 1 1 9 CYS HB2 H -3.605 -7.853 -3.479 . . . 1.0 . . . . . . . . . . . . A . 9 CYS HB2 . . . . . . . . . c30643_6pv2 1 . 6 . 2746 . 1 1 9 CYS HB3 H -3.051 -7.346 -1.889 . . . 1.0 . . . . . . . . . . . . A . 9 CYS HB3 . . . . . . . . . c30643_6pv2 1 . 6 . 2747 . 1 1 9 CYS N N -2.100 -9.744 -2.206 . . . 1.0 . . . . . . . . . . . . A . 9 CYS N . . . . . . . . . c30643_6pv2 1 . 6 . 2748 . 1 1 9 CYS O O -0.334 -7.778 -1.122 . . . 1.0 . . . . . . . . . . . . A . 9 CYS O . . . . . . . . . c30643_6pv2 1 . 6 . 2749 . 1 1 9 CYS SG S -2.251 -5.916 -3.596 . . . 1.0 . . . . . . . . . . . . A . 9 CYS SG . . . . . . . . . c30643_6pv2 1 . 6 . 2750 . 1 1 10 GLY C C 2.720 -6.570 -3.502 . . . 1.0 . . . . . . . . . . . . A . 10 GLY C . . . . . . . . . c30643_6pv2 1 . 6 . 2751 . 1 1 10 GLY CA C 1.953 -7.508 -2.598 . . . 1.0 . . . . . . . . . . . . A . 10 GLY CA . . . . . . . . . c30643_6pv2 1 . 6 . 2752 . 1 1 10 GLY H H 0.564 -8.059 -4.091 . . . 1.0 . . . . . . . . . . . . A . 10 GLY H . . . . . . . . . c30643_6pv2 1 . 6 . 2753 . 1 1 10 GLY HA2 H 1.799 -7.023 -1.647 . . . 1.0 . . . . . . . . . . . . A . 10 GLY HA2 . . . . . . . . . c30643_6pv2 1 . 6 . 2754 . 1 1 10 GLY HA3 H 2.543 -8.398 -2.441 . . . 1.0 . . . . . . . . . . . . A . 10 GLY HA3 . . . . . . . . . c30643_6pv2 1 . 6 . 2755 . 1 1 10 GLY N N 0.667 -7.898 -3.131 . . . 1.0 . . . . . . . . . . . . A . 10 GLY N . . . . . . . . . c30643_6pv2 1 . 6 . 2756 . 1 1 10 GLY O O 3.813 -6.895 -3.963 . . . 1.0 . . . . . . . . . . . . A . 10 GLY O . . . . . . . . . c30643_6pv2 1 . 6 . 2757 . 1 1 11 LYS C C 3.843 -3.671 -3.580 . . . 1.0 . . . . . . . . . . . . A . 11 LYS C . . . . . . . . . c30643_6pv2 1 . 6 . 2758 . 1 1 11 LYS CA C 2.853 -4.370 -4.503 . . . 1.0 . . . . . . . . . . . . A . 11 LYS CA . . . . . . . . . c30643_6pv2 1 . 6 . 2759 . 1 1 11 LYS CB C 1.862 -3.358 -5.080 . . . 1.0 . . . . . . . . . . . . A . 11 LYS CB . . . . . . . . . c30643_6pv2 1 . 6 . 2760 . 1 1 11 LYS CD C -0.081 -2.911 -6.599 . . . 1.0 . . . . . . . . . . . . A . 11 LYS CD . . . . . . . . . c30643_6pv2 1 . 6 . 2761 . 1 1 11 LYS CE C -1.032 -3.488 -7.635 . . . 1.0 . . . . . . . . . . . . A . 11 LYS CE . . . . . . . . . c30643_6pv2 1 . 6 . 2762 . 1 1 11 LYS CG C 0.923 -3.944 -6.120 . . . 1.0 . . . . . . . . . . . . A . 11 LYS CG . . . . . . . . . c30643_6pv2 1 . 6 . 2763 . 1 1 11 LYS H H 1.234 -5.243 -3.462 . . . 1.0 . . . . . . . . . . . . A . 11 LYS H . . . . . . . . . c30643_6pv2 1 . 6 . 2764 . 1 1 11 LYS HA H 3.394 -4.840 -5.312 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HA . . . . . . . . . c30643_6pv2 1 . 6 . 2765 . 1 1 11 LYS HB2 H 1.266 -2.958 -4.274 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HB2 . . . . . . . . . c30643_6pv2 1 . 6 . 2766 . 1 1 11 LYS HB3 H 2.416 -2.553 -5.541 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HB3 . . . . . . . . . c30643_6pv2 1 . 6 . 2767 . 1 1 11 LYS HD2 H -0.653 -2.565 -5.752 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HD2 . . . . . . . . . c30643_6pv2 1 . 6 . 2768 . 1 1 11 LYS HD3 H 0.454 -2.080 -7.036 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HD3 . . . . . . . . . c30643_6pv2 1 . 6 . 2769 . 1 1 11 LYS HE2 H -1.493 -4.374 -7.225 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HE2 . . . . . . . . . c30643_6pv2 1 . 6 . 2770 . 1 1 11 LYS HE3 H -1.795 -2.755 -7.851 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HE3 . . . . . . . . . c30643_6pv2 1 . 6 . 2771 . 1 1 11 LYS HG2 H 1.503 -4.288 -6.963 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HG2 . . . . . . . . . c30643_6pv2 1 . 6 . 2772 . 1 1 11 LYS HG3 H 0.390 -4.776 -5.683 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HG3 . . . . . . . . . c30643_6pv2 1 . 6 . 2773 . 1 1 11 LYS HZ1 H 0.422 -4.533 -8.707 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HZ1 . . . . . . . . . c30643_6pv2 1 . 6 . 2774 . 1 1 11 LYS HZ2 H 0.086 -3.001 -9.328 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HZ2 . . . . . . . . . c30643_6pv2 1 . 6 . 2775 . 1 1 11 LYS HZ3 H -1.005 -4.269 -9.569 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HZ3 . . . . . . . . . c30643_6pv2 1 . 6 . 2776 . 1 1 11 LYS N N 2.148 -5.408 -3.767 . . . 1.0 . . . . . . . . . . . . A . 11 LYS N . . . . . . . . . c30643_6pv2 1 . 6 . 2777 . 1 1 11 LYS NZ N -0.334 -3.848 -8.897 . . . 1.0 . . . . . . . . . . . . A . 11 LYS NZ . . . . . . . . . c30643_6pv2 1 . 6 . 2778 . 1 1 11 LYS O O 3.530 -3.399 -2.420 . . . 1.0 . . . . . . . . . . . . A . 11 LYS O . . . . . . . . . c30643_6pv2 1 . 6 . 2779 . 1 1 12 ARG C C 6.169 -1.277 -3.615 . . . 1.0 . . . . . . . . . . . . A . 12 ARG C . . . . . . . . . c30643_6pv2 1 . 6 . 2780 . 1 1 12 ARG CA C 6.077 -2.762 -3.290 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CA . . . . . . . . . c30643_6pv2 1 . 6 . 2781 . 1 1 12 ARG CB C 7.428 -3.437 -3.529 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CB . . . . . . . . . c30643_6pv2 1 . 6 . 2782 . 1 1 12 ARG CD C 8.795 -5.548 -3.424 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CD . . . . . . . . . c30643_6pv2 1 . 6 . 2783 . 1 1 12 ARG CG C 7.473 -4.884 -3.067 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CG . . . . . . . . . c30643_6pv2 1 . 6 . 2784 . 1 1 12 ARG CZ C 9.153 -7.988 -3.606 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CZ . . . . . . . . . c30643_6pv2 1 . 6 . 2785 . 1 1 12 ARG H H 5.235 -3.656 -5.012 . . . 1.0 . . . . . . . . . . . . A . 12 ARG H . . . . . . . . . c30643_6pv2 1 . 6 . 2786 . 1 1 12 ARG HA H 5.807 -2.869 -2.249 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HA . . . . . . . . . c30643_6pv2 1 . 6 . 2787 . 1 1 12 ARG HB2 H 7.648 -3.412 -4.586 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HB2 . . . . . . . . . c30643_6pv2 1 . 6 . 2788 . 1 1 12 ARG HB3 H 8.191 -2.887 -2.998 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HB3 . . . . . . . . . c30643_6pv2 1 . 6 . 2789 . 1 1 12 ARG HD2 H 8.878 -5.597 -4.498 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HD2 . . . . . . . . . c30643_6pv2 1 . 6 . 2790 . 1 1 12 ARG HD3 H 9.603 -4.953 -3.026 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HD3 . . . . . . . . . c30643_6pv2 1 . 6 . 2791 . 1 1 12 ARG HE H 8.760 -7.003 -1.907 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HE . . . . . . . . . c30643_6pv2 1 . 6 . 2792 . 1 1 12 ARG HG2 H 7.347 -4.914 -1.997 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HG2 . . . . . . . . . c30643_6pv2 1 . 6 . 2793 . 1 1 12 ARG HG3 H 6.669 -5.428 -3.541 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HG3 . . . . . . . . . c30643_6pv2 1 . 6 . 2794 . 1 1 12 ARG HH11 H 9.232 -7.012 -5.384 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH11 . . . . . . . . . c30643_6pv2 1 . 6 . 2795 . 1 1 12 ARG HH12 H 9.512 -8.720 -5.464 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH12 . . . . . . . . . c30643_6pv2 1 . 6 . 2796 . 1 1 12 ARG HH21 H 9.443 -9.992 -3.560 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH21 . . . . . . . . . c30643_6pv2 1 . 6 . 2797 . 1 1 12 ARG HH22 H 9.116 -9.254 -2.025 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH22 . . . . . . . . . c30643_6pv2 1 . 6 . 2798 . 1 1 12 ARG N N 5.040 -3.408 -4.084 . . . 1.0 . . . . . . . . . . . . A . 12 ARG N . . . . . . . . . c30643_6pv2 1 . 6 . 2799 . 1 1 12 ARG NE N 8.888 -6.902 -2.878 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NE . . . . . . . . . c30643_6pv2 1 . 6 . 2800 . 1 1 12 ARG NH1 N 9.310 -7.898 -4.923 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NH1 . . . . . . . . . c30643_6pv2 1 . 6 . 2801 . 1 1 12 ARG NH2 N 9.245 -9.171 -3.015 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NH2 . . . . . . . . . c30643_6pv2 1 . 6 . 2802 . 1 1 12 ARG O O 6.195 -0.883 -4.781 . . . 1.0 . . . . . . . . . . . . A . 12 ARG O . . . . . . . . . c30643_6pv2 1 . 6 . 2803 . 1 1 13 PHE C C 7.503 1.522 -1.994 . . . 1.0 . . . . . . . . . . . . A . 13 PHE C . . . . . . . . . c30643_6pv2 1 . 6 . 2804 . 1 1 13 PHE CA C 6.285 0.985 -2.726 . . . 1.0 . . . . . . . . . . . . A . 13 PHE CA . . . . . . . . . c30643_6pv2 1 . 6 . 2805 . 1 1 13 PHE CB C 5.016 1.629 -2.170 . . . 1.0 . . . . . . . . . . . . A . 13 PHE CB . . . . . . . . . c30643_6pv2 1 . 6 . 2806 . 1 1 13 PHE CD1 C 3.271 1.591 -3.958 . . . 1.0 . . . . . . . . . . . . A . 13 PHE CD1 . . . . . . . . . c30643_6pv2 1 . 6 . 2807 . 1 1 13 PHE CD2 C 3.083 0.039 -2.160 . . . 1.0 . . . . . . . . . . . . A . 13 PHE CD2 . . . . . . . . . c30643_6pv2 1 . 6 . 2808 . 1 1 13 PHE CE1 C 2.114 1.092 -4.515 . . . 1.0 . . . . . . . . . . . . A . 13 PHE CE1 . . . . . . . . . c30643_6pv2 1 . 6 . 2809 . 1 1 13 PHE CE2 C 1.925 -0.466 -2.712 . . . 1.0 . . . . . . . . . . . . A . 13 PHE CE2 . . . . . . . . . c30643_6pv2 1 . 6 . 2810 . 1 1 13 PHE CG C 3.767 1.071 -2.777 . . . 1.0 . . . . . . . . . . . . A . 13 PHE CG . . . . . . . . . c30643_6pv2 1 . 6 . 2811 . 1 1 13 PHE CZ C 1.472 0.013 -3.911 . . . 1.0 . . . . . . . . . . . . A . 13 PHE CZ . . . . . . . . . c30643_6pv2 1 . 6 . 2812 . 1 1 13 PHE H H 6.179 -0.838 -1.668 . . . 1.0 . . . . . . . . . . . . A . 13 PHE H . . . . . . . . . c30643_6pv2 1 . 6 . 2813 . 1 1 13 PHE HA H 6.370 1.213 -3.777 . . . 1.0 . . . . . . . . . . . . A . 13 PHE HA . . . . . . . . . c30643_6pv2 1 . 6 . 2814 . 1 1 13 PHE HB2 H 4.972 1.463 -1.103 . . . 1.0 . . . . . . . . . . . . A . 13 PHE HB2 . . . . . . . . . c30643_6pv2 1 . 6 . 2815 . 1 1 13 PHE HB3 H 5.039 2.690 -2.366 . . . 1.0 . . . . . . . . . . . . A . 13 PHE HB3 . . . . . . . . . c30643_6pv2 1 . 6 . 2816 . 1 1 13 PHE HD1 H 3.798 2.399 -4.443 . . . 1.0 . . . . . . . . . . . . A . 13 PHE HD1 . . . . . . . . . c30643_6pv2 1 . 6 . 2817 . 1 1 13 PHE HD2 H 3.465 -0.373 -1.239 . . . 1.0 . . . . . . . . . . . . A . 13 PHE HD2 . . . . . . . . . c30643_6pv2 1 . 6 . 2818 . 1 1 13 PHE HE1 H 1.737 1.507 -5.438 . . . 1.0 . . . . . . . . . . . . A . 13 PHE HE1 . . . . . . . . . c30643_6pv2 1 . 6 . 2819 . 1 1 13 PHE HE2 H 1.398 -1.272 -2.223 . . . 1.0 . . . . . . . . . . . . A . 13 PHE HE2 . . . . . . . . . c30643_6pv2 1 . 6 . 2820 . 1 1 13 PHE HZ H 0.577 -0.399 -4.350 . . . 1.0 . . . . . . . . . . . . A . 13 PHE HZ . . . . . . . . . c30643_6pv2 1 . 6 . 2821 . 1 1 13 PHE N N 6.210 -0.459 -2.575 . . . 1.0 . . . . . . . . . . . . A . 13 PHE N . . . . . . . . . c30643_6pv2 1 . 6 . 2822 . 1 1 13 PHE O O 7.983 0.911 -1.047 . . . 1.0 . . . . . . . . . . . . A . 13 PHE O . . . . . . . . . c30643_6pv2 1 . 6 . 2823 . 1 1 14 THR C C 8.739 4.296 -0.765 . . . 1.0 . . . . . . . . . . . . A . 14 THR C . . . . . . . . . c30643_6pv2 1 . 6 . 2824 . 1 1 14 THR CA C 9.172 3.262 -1.808 . . . 1.0 . . . . . . . . . . . . A . 14 THR CA . . . . . . . . . c30643_6pv2 1 . 6 . 2825 . 1 1 14 THR CB C 10.072 3.926 -2.868 . . . 1.0 . . . . . . . . . . . . A . 14 THR CB . . . . . . . . . c30643_6pv2 1 . 6 . 2826 . 1 1 14 THR CG2 C 11.487 4.131 -2.345 . . . 1.0 . . . . . . . . . . . . A . 14 THR CG2 . . . . . . . . . c30643_6pv2 1 . 6 . 2827 . 1 1 14 THR H H 7.620 3.083 -3.229 . . . 1.0 . . . . . . . . . . . . A . 14 THR H . . . . . . . . . c30643_6pv2 1 . 6 . 2828 . 1 1 14 THR HA H 9.736 2.480 -1.318 . . . 1.0 . . . . . . . . . . . . A . 14 THR HA . . . . . . . . . c30643_6pv2 1 . 6 . 2829 . 1 1 14 THR HB H 9.651 4.887 -3.129 . . . 1.0 . . . . . . . . . . . . A . 14 THR HB . . . . . . . . . c30643_6pv2 1 . 6 . 2830 . 1 1 14 THR HG1 H 10.962 3.225 -4.488 . . . 1.0 . . . . . . . . . . . . A . 14 THR HG1 . . . . . . . . . c30643_6pv2 1 . 6 . 2831 . 1 1 14 THR HG21 H 11.457 4.752 -1.461 . . . 1.0 . . . . . . . . . . . . A . 14 THR HG21 . . . . . . . . . c30643_6pv2 1 . 6 . 2832 . 1 1 14 THR HG22 H 12.085 4.613 -3.104 . . . 1.0 . . . . . . . . . . . . A . 14 THR HG22 . . . . . . . . . c30643_6pv2 1 . 6 . 2833 . 1 1 14 THR HG23 H 11.922 3.175 -2.098 . . . 1.0 . . . . . . . . . . . . A . 14 THR HG23 . . . . . . . . . c30643_6pv2 1 . 6 . 2834 . 1 1 14 THR N N 8.013 2.656 -2.440 . . . 1.0 . . . . . . . . . . . . A . 14 THR N . . . . . . . . . c30643_6pv2 1 . 6 . 2835 . 1 1 14 THR O O 9.568 4.914 -0.095 . . . 1.0 . . . . . . . . . . . . A . 14 THR O . . . . . . . . . c30643_6pv2 1 . 6 . 2836 . 1 1 14 THR OG1 O 10.120 3.094 -4.038 . . . 1.0 . . . . . . . . . . . . A . 14 THR OG1 . . . . . . . . . c30643_6pv2 1 . 6 . 2837 . 1 1 15 ARG C C 5.693 4.861 1.064 . . . 1.0 . . . . . . . . . . . . A . 15 ARG C . . . . . . . . . c30643_6pv2 1 . 6 . 2838 . 1 1 15 ARG CA C 6.876 5.451 0.304 . . . 1.0 . . . . . . . . . . . . A . 15 ARG CA . . . . . . . . . c30643_6pv2 1 . 6 . 2839 . 1 1 15 ARG CB C 6.422 6.702 -0.457 . . . 1.0 . . . . . . . . . . . . A . 15 ARG CB . . . . . . . . . c30643_6pv2 1 . 6 . 2840 . 1 1 15 ARG CD C 7.046 8.699 -1.849 . . . 1.0 . . . . . . . . . . . . A . 15 ARG CD . . . . . . . . . c30643_6pv2 1 . 6 . 2841 . 1 1 15 ARG CG C 7.536 7.408 -1.215 . . . 1.0 . . . . . . . . . . . . A . 15 ARG CG . . . . . . . . . c30643_6pv2 1 . 6 . 2842 . 1 1 15 ARG CZ C 8.144 10.696 -2.782 . . . 1.0 . . . . . . . . . . . . A . 15 ARG CZ . . . . . . . . . c30643_6pv2 1 . 6 . 2843 . 1 1 15 ARG H H 6.816 3.907 -1.142 . . . 1.0 . . . . . . . . . . . . A . 15 ARG H . . . . . . . . . c30643_6pv2 1 . 6 . 2844 . 1 1 15 ARG HA H 7.652 5.720 1.007 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HA . . . . . . . . . c30643_6pv2 1 . 6 . 2845 . 1 1 15 ARG HB2 H 5.663 6.416 -1.167 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HB2 . . . . . . . . . c30643_6pv2 1 . 6 . 2846 . 1 1 15 ARG HB3 H 5.997 7.401 0.247 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HB3 . . . . . . . . . c30643_6pv2 1 . 6 . 2847 . 1 1 15 ARG HD2 H 6.242 8.470 -2.531 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HD2 . . . . . . . . . c30643_6pv2 1 . 6 . 2848 . 1 1 15 ARG HD3 H 6.682 9.353 -1.070 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HD3 . . . . . . . . . c30643_6pv2 1 . 6 . 2849 . 1 1 15 ARG HE H 8.831 8.825 -2.948 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HE . . . . . . . . . c30643_6pv2 1 . 6 . 2850 . 1 1 15 ARG HG2 H 8.338 7.636 -0.530 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HG2 . . . . . . . . . c30643_6pv2 1 . 6 . 2851 . 1 1 15 ARG HG3 H 7.899 6.751 -1.991 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HG3 . . . . . . . . . c30643_6pv2 1 . 6 . 2852 . 1 1 15 ARG HH11 H 6.421 11.072 -1.784 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HH11 . . . . . . . . . c30643_6pv2 1 . 6 . 2853 . 1 1 15 ARG HH12 H 7.213 12.464 -2.444 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HH12 . . . . . . . . . c30643_6pv2 1 . 6 . 2854 . 1 1 15 ARG HH21 H 9.873 10.652 -3.842 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HH21 . . . . . . . . . c30643_6pv2 1 . 6 . 2855 . 1 1 15 ARG HH22 H 9.176 12.225 -3.619 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HH22 . . . . . . . . . c30643_6pv2 1 . 6 . 2856 . 1 1 15 ARG N N 7.429 4.467 -0.621 . . . 1.0 . . . . . . . . . . . . A . 15 ARG N . . . . . . . . . c30643_6pv2 1 . 6 . 2857 . 1 1 15 ARG NE N 8.106 9.382 -2.582 . . . 1.0 . . . . . . . . . . . . A . 15 ARG NE . . . . . . . . . c30643_6pv2 1 . 6 . 2858 . 1 1 15 ARG NH1 N 7.181 11.473 -2.300 . . . 1.0 . . . . . . . . . . . . A . 15 ARG NH1 . . . . . . . . . c30643_6pv2 1 . 6 . 2859 . 1 1 15 ARG NH2 N 9.143 11.234 -3.471 . . . 1.0 . . . . . . . . . . . . A . 15 ARG NH2 . . . . . . . . . c30643_6pv2 1 . 6 . 2860 . 1 1 15 ARG O O 4.833 4.195 0.479 . . . 1.0 . . . . . . . . . . . . A . 15 ARG O . . . . . . . . . c30643_6pv2 1 . 6 . 2861 . 1 1 16 SER C C 3.257 5.280 2.877 . . . 1.0 . . . . . . . . . . . . A . 16 SER C . . . . . . . . . c30643_6pv2 1 . 6 . 2862 . 1 1 16 SER CA C 4.584 4.613 3.222 . . . 1.0 . . . . . . . . . . . . A . 16 SER CA . . . . . . . . . c30643_6pv2 1 . 6 . 2863 . 1 1 16 SER CB C 4.933 4.858 4.688 . . . 1.0 . . . . . . . . . . . . A . 16 SER CB . . . . . . . . . c30643_6pv2 1 . 6 . 2864 . 1 1 16 SER H H 6.363 5.662 2.775 . . . 1.0 . . . . . . . . . . . . A . 16 SER H . . . . . . . . . c30643_6pv2 1 . 6 . 2865 . 1 1 16 SER HA H 4.497 3.549 3.053 . . . 1.0 . . . . . . . . . . . . A . 16 SER HA . . . . . . . . . c30643_6pv2 1 . 6 . 2866 . 1 1 16 SER HB2 H 4.051 4.724 5.294 . . . 1.0 . . . . . . . . . . . . A . 16 SER HB2 . . . . . . . . . c30643_6pv2 1 . 6 . 2867 . 1 1 16 SER HB3 H 5.696 4.162 4.998 . . . 1.0 . . . . . . . . . . . . A . 16 SER HB3 . . . . . . . . . c30643_6pv2 1 . 6 . 2868 . 1 1 16 SER HG H 4.718 6.718 5.266 . . . 1.0 . . . . . . . . . . . . A . 16 SER HG . . . . . . . . . c30643_6pv2 1 . 6 . 2869 . 1 1 16 SER N N 5.653 5.115 2.369 . . . 1.0 . . . . . . . . . . . . A . 16 SER N . . . . . . . . . c30643_6pv2 1 . 6 . 2870 . 1 1 16 SER O O 2.198 4.662 2.968 . . . 1.0 . . . . . . . . . . . . A . 16 SER O . . . . . . . . . c30643_6pv2 1 . 6 . 2871 . 1 1 16 SER OG O 5.415 6.177 4.874 . . . 1.0 . . . . . . . . . . . . A . 16 SER OG . . . . . . . . . c30643_6pv2 1 . 6 . 2872 . 1 1 17 ASP C C 1.579 6.669 0.771 . . . 1.0 . . . . . . . . . . . . A . 17 ASP C . . . . . . . . . c30643_6pv2 1 . 6 . 2873 . 1 1 17 ASP CA C 2.153 7.286 2.037 . . . 1.0 . . . . . . . . . . . . A . 17 ASP CA . . . . . . . . . c30643_6pv2 1 . 6 . 2874 . 1 1 17 ASP CB C 2.487 8.761 1.785 . . . 1.0 . . . . . . . . . . . . A . 17 ASP CB . . . . . . . . . c30643_6pv2 1 . 6 . 2875 . 1 1 17 ASP CG C 2.649 9.565 3.062 . . . 1.0 . . . . . . . . . . . . A . 17 ASP CG . . . . . . . . . c30643_6pv2 1 . 6 . 2876 . 1 1 17 ASP H H 4.201 7.001 2.500 . . . 1.0 . . . . . . . . . . . . A . 17 ASP H . . . . . . . . . c30643_6pv2 1 . 6 . 2877 . 1 1 17 ASP HA H 1.412 7.223 2.819 . . . 1.0 . . . . . . . . . . . . A . 17 ASP HA . . . . . . . . . c30643_6pv2 1 . 6 . 2878 . 1 1 17 ASP HB2 H 3.407 8.824 1.228 . . . 1.0 . . . . . . . . . . . . A . 17 ASP HB2 . . . . . . . . . c30643_6pv2 1 . 6 . 2879 . 1 1 17 ASP HB3 H 1.695 9.203 1.204 . . . 1.0 . . . . . . . . . . . . A . 17 ASP HB3 . . . . . . . . . c30643_6pv2 1 . 6 . 2880 . 1 1 17 ASP N N 3.330 6.547 2.480 . . . 1.0 . . . . . . . . . . . . A . 17 ASP N . . . . . . . . . c30643_6pv2 1 . 6 . 2881 . 1 1 17 ASP O O 0.370 6.668 0.563 . . . 1.0 . . . . . . . . . . . . A . 17 ASP O . . . . . . . . . c30643_6pv2 1 . 6 . 2882 . 1 1 17 ASP OD1 O 1.649 10.139 3.542 . . . 1.0 . . . . . . . . . . . . A . 17 ASP OD1 . . . . . . . . . c30643_6pv2 1 . 6 . 2883 . 1 1 17 ASP OD2 O 3.781 9.639 3.587 . . . 1.0 . . . . . . . . . . . . A . 17 ASP OD2 . . . . . . . . . c30643_6pv2 1 . 6 . 2884 . 1 1 18 GLU C C 1.448 4.116 -1.008 . . . 1.0 . . . . . . . . . . . . A . 18 GLU C . . . . . . . . . c30643_6pv2 1 . 6 . 2885 . 1 1 18 GLU CA C 2.042 5.486 -1.300 . . . 1.0 . . . . . . . . . . . . A . 18 GLU CA . . . . . . . . . c30643_6pv2 1 . 6 . 2886 . 1 1 18 GLU CB C 3.223 5.363 -2.259 . . . 1.0 . . . . . . . . . . . . A . 18 GLU CB . . . . . . . . . c30643_6pv2 1 . 6 . 2887 . 1 1 18 GLU CD C 2.662 7.153 -3.954 . . . 1.0 . . . . . . . . . . . . A . 18 GLU CD . . . . . . . . . c30643_6pv2 1 . 6 . 2888 . 1 1 18 GLU CG C 3.633 6.684 -2.886 . . . 1.0 . . . . . . . . . . . . A . 18 GLU CG . . . . . . . . . c30643_6pv2 1 . 6 . 2889 . 1 1 18 GLU H H 3.408 6.174 0.152 . . . 1.0 . . . . . . . . . . . . A . 18 GLU H . . . . . . . . . c30643_6pv2 1 . 6 . 2890 . 1 1 18 GLU HA H 1.282 6.101 -1.756 . . . 1.0 . . . . . . . . . . . . A . 18 GLU HA . . . . . . . . . c30643_6pv2 1 . 6 . 2891 . 1 1 18 GLU HB2 H 4.071 4.968 -1.721 . . . 1.0 . . . . . . . . . . . . A . 18 GLU HB2 . . . . . . . . . c30643_6pv2 1 . 6 . 2892 . 1 1 18 GLU HB3 H 2.960 4.679 -3.053 . . . 1.0 . . . . . . . . . . . . A . 18 GLU HB3 . . . . . . . . . c30643_6pv2 1 . 6 . 2893 . 1 1 18 GLU HG2 H 3.679 7.436 -2.109 . . . 1.0 . . . . . . . . . . . . A . 18 GLU HG2 . . . . . . . . . c30643_6pv2 1 . 6 . 2894 . 1 1 18 GLU HG3 H 4.609 6.565 -3.332 . . . 1.0 . . . . . . . . . . . . A . 18 GLU HG3 . . . . . . . . . c30643_6pv2 1 . 6 . 2895 . 1 1 18 GLU N N 2.457 6.135 -0.067 . . . 1.0 . . . . . . . . . . . . A . 18 GLU N . . . . . . . . . c30643_6pv2 1 . 6 . 2896 . 1 1 18 GLU O O 0.515 3.683 -1.681 . . . 1.0 . . . . . . . . . . . . A . 18 GLU O . . . . . . . . . c30643_6pv2 1 . 6 . 2897 . 1 1 18 GLU OE1 O 2.830 6.749 -5.124 . . . 1.0 . . . . . . . . . . . . A . 18 GLU OE1 . . . . . . . . . c30643_6pv2 1 . 6 . 2898 . 1 1 18 GLU OE2 O 1.737 7.929 -3.639 . . . 1.0 . . . . . . . . . . . . A . 18 GLU OE2 . . . . . . . . . c30643_6pv2 1 . 6 . 2899 . 1 1 19 LEU C C 0.042 2.370 1.025 . . . 1.0 . . . . . . . . . . . . A . 19 LEU C . . . . . . . . . c30643_6pv2 1 . 6 . 2900 . 1 1 19 LEU CA C 1.433 2.166 0.439 . . . 1.0 . . . . . . . . . . . . A . 19 LEU CA . . . . . . . . . c30643_6pv2 1 . 6 . 2901 . 1 1 19 LEU CB C 2.344 1.503 1.471 . . . 1.0 . . . . . . . . . . . . A . 19 LEU CB . . . . . . . . . c30643_6pv2 1 . 6 . 2902 . 1 1 19 LEU CD1 C 1.475 -0.817 1.079 . . . 1.0 . . . . . . . . . . . . A . 19 LEU CD1 . . . . . . . . . c30643_6pv2 1 . 6 . 2903 . 1 1 19 LEU CD2 C 2.720 -0.298 3.178 . . . 1.0 . . . . . . . . . . . . A . 19 LEU CD2 . . . . . . . . . c30643_6pv2 1 . 6 . 2904 . 1 1 19 LEU CG C 1.767 0.244 2.126 . . . 1.0 . . . . . . . . . . . . A . 19 LEU CG . . . . . . . . . c30643_6pv2 1 . 6 . 2905 . 1 1 19 LEU H H 2.788 3.796 0.448 . . . 1.0 . . . . . . . . . . . . A . 19 LEU H . . . . . . . . . c30643_6pv2 1 . 6 . 2906 . 1 1 19 LEU HA H 1.354 1.524 -0.426 . . . 1.0 . . . . . . . . . . . . A . 19 LEU HA . . . . . . . . . c30643_6pv2 1 . 6 . 2907 . 1 1 19 LEU HB2 H 3.272 1.239 0.984 . . . 1.0 . . . . . . . . . . . . A . 19 LEU HB2 . . . . . . . . . c30643_6pv2 1 . 6 . 2908 . 1 1 19 LEU HB3 H 2.555 2.221 2.247 . . . 1.0 . . . . . . . . . . . . A . 19 LEU HB3 . . . . . . . . . c30643_6pv2 1 . 6 . 2909 . 1 1 19 LEU HD11 H 2.394 -1.096 0.585 . . . 1.0 . . . . . . . . . . . . A . 19 LEU HD11 . . . . . . . . . c30643_6pv2 1 . 6 . 2910 . 1 1 19 LEU HD12 H 0.780 -0.424 0.351 . . . 1.0 . . . . . . . . . . . . A . 19 LEU HD12 . . . . . . . . . c30643_6pv2 1 . 6 . 2911 . 1 1 19 LEU HD13 H 1.044 -1.683 1.556 . . . 1.0 . . . . . . . . . . . . A . 19 LEU HD13 . . . . . . . . . c30643_6pv2 1 . 6 . 2912 . 1 1 19 LEU HD21 H 2.240 -1.098 3.720 . . . 1.0 . . . . . . . . . . . . A . 19 LEU HD21 . . . . . . . . . c30643_6pv2 1 . 6 . 2913 . 1 1 19 LEU HD22 H 2.991 0.491 3.863 . . . 1.0 . . . . . . . . . . . . A . 19 LEU HD22 . . . . . . . . . c30643_6pv2 1 . 6 . 2914 . 1 1 19 LEU HD23 H 3.608 -0.677 2.695 . . . 1.0 . . . . . . . . . . . . A . 19 LEU HD23 . . . . . . . . . c30643_6pv2 1 . 6 . 2915 . 1 1 19 LEU HG H 0.834 0.496 2.615 . . . 1.0 . . . . . . . . . . . . A . 19 LEU HG . . . . . . . . . c30643_6pv2 1 . 6 . 2916 . 1 1 19 LEU N N 1.989 3.439 -0.001 . . . 1.0 . . . . . . . . . . . . A . 19 LEU N . . . . . . . . . c30643_6pv2 1 . 6 . 2917 . 1 1 19 LEU O O -0.888 1.638 0.702 . . . 1.0 . . . . . . . . . . . . A . 19 LEU O . . . . . . . . . c30643_6pv2 1 . 6 . 2918 . 1 1 20 GLN C C -2.362 4.084 1.364 . . . 1.0 . . . . . . . . . . . . A . 20 GLN C . . . . . . . . . c30643_6pv2 1 . 6 . 2919 . 1 1 20 GLN CA C -1.380 3.721 2.470 . . . 1.0 . . . . . . . . . . . . A . 20 GLN CA . . . . . . . . . c30643_6pv2 1 . 6 . 2920 . 1 1 20 GLN CB C -1.218 4.898 3.433 . . . 1.0 . . . . . . . . . . . . A . 20 GLN CB . . . . . . . . . c30643_6pv2 1 . 6 . 2921 . 1 1 20 GLN CD C -2.319 6.545 4.994 . . . 1.0 . . . . . . . . . . . . A . 20 GLN CD . . . . . . . . . c30643_6pv2 1 . 6 . 2922 . 1 1 20 GLN CG C -2.514 5.345 4.091 . . . 1.0 . . . . . . . . . . . . A . 20 GLN CG . . . . . . . . . c30643_6pv2 1 . 6 . 2923 . 1 1 20 GLN H H 0.709 3.880 2.153 . . . 1.0 . . . . . . . . . . . . A . 20 GLN H . . . . . . . . . c30643_6pv2 1 . 6 . 2924 . 1 1 20 GLN HA H -1.752 2.864 3.009 . . . 1.0 . . . . . . . . . . . . A . 20 GLN HA . . . . . . . . . c30643_6pv2 1 . 6 . 2925 . 1 1 20 GLN HB2 H -0.527 4.613 4.211 . . . 1.0 . . . . . . . . . . . . A . 20 GLN HB2 . . . . . . . . . c30643_6pv2 1 . 6 . 2926 . 1 1 20 GLN HB3 H -0.807 5.736 2.891 . . . 1.0 . . . . . . . . . . . . A . 20 GLN HB3 . . . . . . . . . c30643_6pv2 1 . 6 . 2927 . 1 1 20 GLN HE21 H -3.802 5.934 6.160 . . . 1.0 . . . . . . . . . . . . A . 20 GLN HE21 . . . . . . . . . c30643_6pv2 1 . 6 . 2928 . 1 1 20 GLN HE22 H -3.018 7.398 6.643 . . . 1.0 . . . . . . . . . . . . A . 20 GLN HE22 . . . . . . . . . c30643_6pv2 1 . 6 . 2929 . 1 1 20 GLN HG2 H -3.224 5.606 3.320 . . . 1.0 . . . . . . . . . . . . A . 20 GLN HG2 . . . . . . . . . c30643_6pv2 1 . 6 . 2930 . 1 1 20 GLN HG3 H -2.906 4.529 4.679 . . . 1.0 . . . . . . . . . . . . A . 20 GLN HG3 . . . . . . . . . c30643_6pv2 1 . 6 . 2931 . 1 1 20 GLN N N -0.089 3.368 1.891 . . . 1.0 . . . . . . . . . . . . A . 20 GLN N . . . . . . . . . c30643_6pv2 1 . 6 . 2932 . 1 1 20 GLN NE2 N -3.129 6.635 6.034 . . . 1.0 . . . . . . . . . . . . A . 20 GLN NE2 . . . . . . . . . c30643_6pv2 1 . 6 . 2933 . 1 1 20 GLN O O -3.502 3.607 1.334 . . . 1.0 . . . . . . . . . . . . A . 20 GLN O . . . . . . . . . c30643_6pv2 1 . 6 . 2934 . 1 1 20 GLN OE1 O -1.450 7.386 4.758 . . . 1.0 . . . . . . . . . . . . A . 20 GLN OE1 . . . . . . . . . c30643_6pv2 1 . 6 . 2935 . 1 1 21 ARG C C -3.149 4.077 -1.463 . . . 1.0 . . . . . . . . . . . . A . 21 ARG C . . . . . . . . . c30643_6pv2 1 . 6 . 2936 . 1 1 21 ARG CA C -2.650 5.310 -0.725 . . . 1.0 . . . . . . . . . . . . A . 21 ARG CA . . . . . . . . . c30643_6pv2 1 . 6 . 2937 . 1 1 21 ARG CB C -1.765 6.151 -1.641 . . . 1.0 . . . . . . . . . . . . A . 21 ARG CB . . . . . . . . . c30643_6pv2 1 . 6 . 2938 . 1 1 21 ARG CD C -1.484 7.522 -3.690 . . . 1.0 . . . . . . . . . . . . A . 21 ARG CD . . . . . . . . . c30643_6pv2 1 . 6 . 2939 . 1 1 21 ARG CG C -2.463 6.716 -2.860 . . . 1.0 . . . . . . . . . . . . A . 21 ARG CG . . . . . . . . . c30643_6pv2 1 . 6 . 2940 . 1 1 21 ARG CZ C -1.443 8.895 -5.720 . . . 1.0 . . . . . . . . . . . . A . 21 ARG CZ . . . . . . . . . c30643_6pv2 1 . 6 . 2941 . 1 1 21 ARG H H -0.991 5.300 0.578 . . . 1.0 . . . . . . . . . . . . A . 21 ARG H . . . . . . . . . c30643_6pv2 1 . 6 . 2942 . 1 1 21 ARG HA H -3.493 5.900 -0.403 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HA . . . . . . . . . c30643_6pv2 1 . 6 . 2943 . 1 1 21 ARG HB2 H -1.366 6.975 -1.072 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HB2 . . . . . . . . . c30643_6pv2 1 . 6 . 2944 . 1 1 21 ARG HB3 H -0.945 5.537 -1.982 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HB3 . . . . . . . . . c30643_6pv2 1 . 6 . 2945 . 1 1 21 ARG HD2 H -1.044 8.284 -3.063 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HD2 . . . . . . . . . c30643_6pv2 1 . 6 . 2946 . 1 1 21 ARG HD3 H -0.707 6.861 -4.041 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HD3 . . . . . . . . . c30643_6pv2 1 . 6 . 2947 . 1 1 21 ARG HE H -3.083 8.046 -4.946 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HE . . . . . . . . . c30643_6pv2 1 . 6 . 2948 . 1 1 21 ARG HG2 H -2.851 5.903 -3.457 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HG2 . . . . . . . . . c30643_6pv2 1 . 6 . 2949 . 1 1 21 ARG HG3 H -3.273 7.358 -2.545 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HG3 . . . . . . . . . c30643_6pv2 1 . 6 . 2950 . 1 1 21 ARG HH11 H 0.372 8.592 -4.844 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HH11 . . . . . . . . . c30643_6pv2 1 . 6 . 2951 . 1 1 21 ARG HH12 H 0.382 9.592 -6.266 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HH12 . . . . . . . . . c30643_6pv2 1 . 6 . 2952 . 1 1 21 ARG HH21 H -3.077 9.365 -6.823 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HH21 . . . . . . . . . c30643_6pv2 1 . 6 . 2953 . 1 1 21 ARG HH22 H -1.580 10.031 -7.392 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HH22 . . . . . . . . . c30643_6pv2 1 . 6 . 2954 . 1 1 21 ARG N N -1.888 4.920 0.450 . . . 1.0 . . . . . . . . . . . . A . 21 ARG N . . . . . . . . . c30643_6pv2 1 . 6 . 2955 . 1 1 21 ARG NE N -2.112 8.162 -4.836 . . . 1.0 . . . . . . . . . . . . A . 21 ARG NE . . . . . . . . . c30643_6pv2 1 . 6 . 2956 . 1 1 21 ARG NH1 N -0.125 9.039 -5.602 . . . 1.0 . . . . . . . . . . . . A . 21 ARG NH1 . . . . . . . . . c30643_6pv2 1 . 6 . 2957 . 1 1 21 ARG NH2 N -2.085 9.476 -6.725 . . . 1.0 . . . . . . . . . . . . A . 21 ARG NH2 . . . . . . . . . c30643_6pv2 1 . 6 . 2958 . 1 1 21 ARG O O -4.335 3.958 -1.765 . . . 1.0 . . . . . . . . . . . . A . 21 ARG O . . . . . . . . . c30643_6pv2 1 . 6 . 2959 . 1 1 22 HIS C C -3.620 1.128 -1.576 . . . 1.0 . . . . . . . . . . . . A . 22 HIS C . . . . . . . . . c30643_6pv2 1 . 6 . 2960 . 1 1 22 HIS CA C -2.587 1.905 -2.384 . . . 1.0 . . . . . . . . . . . . A . 22 HIS CA . . . . . . . . . c30643_6pv2 1 . 6 . 2961 . 1 1 22 HIS CB C -1.340 1.043 -2.617 . . . 1.0 . . . . . . . . . . . . A . 22 HIS CB . . . . . . . . . c30643_6pv2 1 . 6 . 2962 . 1 1 22 HIS CD2 C -1.776 -1.436 -2.066 . . . 1.0 . . . . . . . . . . . . A . 22 HIS CD2 . . . . . . . . . c30643_6pv2 1 . 6 . 2963 . 1 1 22 HIS CE1 C -2.420 -2.143 -4.019 . . . 1.0 . . . . . . . . . . . . A . 22 HIS CE1 . . . . . . . . . c30643_6pv2 1 . 6 . 2964 . 1 1 22 HIS CG C -1.672 -0.385 -2.916 . . . 1.0 . . . . . . . . . . . . A . 22 HIS CG . . . . . . . . . c30643_6pv2 1 . 6 . 2965 . 1 1 22 HIS H H -1.304 3.300 -1.455 . . . 1.0 . . . . . . . . . . . . A . 22 HIS H . . . . . . . . . c30643_6pv2 1 . 6 . 2966 . 1 1 22 HIS HA H -3.018 2.156 -3.339 . . . 1.0 . . . . . . . . . . . . A . 22 HIS HA . . . . . . . . . c30643_6pv2 1 . 6 . 2967 . 1 1 22 HIS HB2 H -0.783 1.441 -3.451 . . . 1.0 . . . . . . . . . . . . A . 22 HIS HB2 . . . . . . . . . c30643_6pv2 1 . 6 . 2968 . 1 1 22 HIS HB3 H -0.722 1.065 -1.730 . . . 1.0 . . . . . . . . . . . . A . 22 HIS HB3 . . . . . . . . . c30643_6pv2 1 . 6 . 2969 . 1 1 22 HIS HD1 H -2.106 -0.331 -4.998 . . . 1.0 . . . . . . . . . . . . A . 22 HIS HD1 . . . . . . . . . c30643_6pv2 1 . 6 . 2970 . 1 1 22 HIS HD2 H -1.517 -1.443 -1.017 . . . 1.0 . . . . . . . . . . . . A . 22 HIS HD2 . . . . . . . . . c30643_6pv2 1 . 6 . 2971 . 1 1 22 HIS HE1 H -2.792 -2.777 -4.809 . . . 1.0 . . . . . . . . . . . . A . 22 HIS HE1 . . . . . . . . . c30643_6pv2 1 . 6 . 2972 . 1 1 22 HIS N N -2.238 3.146 -1.722 . . . 1.0 . . . . . . . . . . . . A . 22 HIS N . . . . . . . . . c30643_6pv2 1 . 6 . 2973 . 1 1 22 HIS ND1 N -2.071 -0.853 -4.163 . . . 1.0 . . . . . . . . . . . . A . 22 HIS ND1 . . . . . . . . . c30643_6pv2 1 . 6 . 2974 . 1 1 22 HIS NE2 N -2.252 -2.509 -2.777 . . . 1.0 . . . . . . . . . . . . A . 22 HIS NE2 . . . . . . . . . c30643_6pv2 1 . 6 . 2975 . 1 1 22 HIS O O -4.582 0.612 -2.132 . . . 1.0 . . . . . . . . . . . . A . 22 HIS O . . . . . . . . . c30643_6pv2 1 . 6 . 2976 . 1 1 23 LYS C C -5.732 0.882 0.542 . . . 1.0 . . . . . . . . . . . . A . 23 LYS C . . . . . . . . . c30643_6pv2 1 . 6 . 2977 . 1 1 23 LYS CA C -4.326 0.305 0.594 . . . 1.0 . . . . . . . . . . . . A . 23 LYS CA . . . . . . . . . c30643_6pv2 1 . 6 . 2978 . 1 1 23 LYS CB C -3.821 0.275 2.036 . . . 1.0 . . . . . . . . . . . . A . 23 LYS CB . . . . . . . . . c30643_6pv2 1 . 6 . 2979 . 1 1 23 LYS CD C -2.274 -0.778 3.706 . . . 1.0 . . . . . . . . . . . . A . 23 LYS CD . . . . . . . . . c30643_6pv2 1 . 6 . 2980 . 1 1 23 LYS CE C -1.083 -1.700 3.907 . . . 1.0 . . . . . . . . . . . . A . 23 LYS CE . . . . . . . . . c30643_6pv2 1 . 6 . 2981 . 1 1 23 LYS CG C -2.596 -0.605 2.235 . . . 1.0 . . . . . . . . . . . . A . 23 LYS CG . . . . . . . . . c30643_6pv2 1 . 6 . 2982 . 1 1 23 LYS H H -2.640 1.500 0.127 . . . 1.0 . . . . . . . . . . . . A . 23 LYS H . . . . . . . . . c30643_6pv2 1 . 6 . 2983 . 1 1 23 LYS HA H -4.362 -0.705 0.223 . . . 1.0 . . . . . . . . . . . . A . 23 LYS HA . . . . . . . . . c30643_6pv2 1 . 6 . 2984 . 1 1 23 LYS HB2 H -3.569 1.280 2.334 . . . 1.0 . . . . . . . . . . . . A . 23 LYS HB2 . . . . . . . . . c30643_6pv2 1 . 6 . 2985 . 1 1 23 LYS HB3 H -4.612 -0.094 2.672 . . . 1.0 . . . . . . . . . . . . A . 23 LYS HB3 . . . . . . . . . c30643_6pv2 1 . 6 . 2986 . 1 1 23 LYS HD2 H -2.048 0.188 4.130 . . . 1.0 . . . . . . . . . . . . A . 23 LYS HD2 . . . . . . . . . c30643_6pv2 1 . 6 . 2987 . 1 1 23 LYS HD3 H -3.134 -1.201 4.203 . . . 1.0 . . . . . . . . . . . . A . 23 LYS HD3 . . . . . . . . . c30643_6pv2 1 . 6 . 2988 . 1 1 23 LYS HE2 H -1.303 -2.654 3.451 . . . 1.0 . . . . . . . . . . . . A . 23 LYS HE2 . . . . . . . . . c30643_6pv2 1 . 6 . 2989 . 1 1 23 LYS HE3 H -0.222 -1.263 3.426 . . . 1.0 . . . . . . . . . . . . A . 23 LYS HE3 . . . . . . . . . c30643_6pv2 1 . 6 . 2990 . 1 1 23 LYS HG2 H -2.786 -1.575 1.803 . . . 1.0 . . . . . . . . . . . . A . 23 LYS HG2 . . . . . . . . . c30643_6pv2 1 . 6 . 2991 . 1 1 23 LYS HG3 H -1.751 -0.147 1.741 . . . 1.0 . . . . . . . . . . . . A . 23 LYS HG3 . . . . . . . . . c30643_6pv2 1 . 6 . 2992 . 1 1 23 LYS HZ1 H -0.636 -1.001 5.823 . . . 1.0 . . . . . . . . . . . . A . 23 LYS HZ1 . . . . . . . . . c30643_6pv2 1 . 6 . 2993 . 1 1 23 LYS HZ2 H 0.089 -2.479 5.449 . . . 1.0 . . . . . . . . . . . . A . 23 LYS HZ2 . . . . . . . . . c30643_6pv2 1 . 6 . 2994 . 1 1 23 LYS HZ3 H -1.559 -2.417 5.811 . . . 1.0 . . . . . . . . . . . . A . 23 LYS HZ3 . . . . . . . . . c30643_6pv2 1 . 6 . 2995 . 1 1 23 LYS N N -3.419 1.050 -0.268 . . . 1.0 . . . . . . . . . . . . A . 23 LYS N . . . . . . . . . c30643_6pv2 1 . 6 . 2996 . 1 1 23 LYS NZ N -0.777 -1.913 5.346 . . . 1.0 . . . . . . . . . . . . A . 23 LYS NZ . . . . . . . . . c30643_6pv2 1 . 6 . 2997 . 1 1 23 LYS O O -6.708 0.189 0.837 . . . 1.0 . . . . . . . . . . . . A . 23 LYS O . . . . . . . . . c30643_6pv2 1 . 6 . 2998 . 1 1 24 ARG C C -7.928 2.144 -1.186 . . . 1.0 . . . . . . . . . . . . A . 24 ARG C . . . . . . . . . c30643_6pv2 1 . 6 . 2999 . 1 1 24 ARG CA C -7.142 2.774 -0.031 . . . 1.0 . . . . . . . . . . . . A . 24 ARG CA . . . . . . . . . c30643_6pv2 1 . 6 . 3000 . 1 1 24 ARG CB C -7.001 4.280 -0.255 . . . 1.0 . . . . . . . . . . . . A . 24 ARG CB . . . . . . . . . c30643_6pv2 1 . 6 . 3001 . 1 1 24 ARG CD C -6.432 6.522 0.714 . . . 1.0 . . . . . . . . . . . . A . 24 ARG CD . . . . . . . . . c30643_6pv2 1 . 6 . 3002 . 1 1 24 ARG CG C -6.364 5.016 0.910 . . . 1.0 . . . . . . . . . . . . A . 24 ARG CG . . . . . . . . . c30643_6pv2 1 . 6 . 3003 . 1 1 24 ARG CZ C -8.191 8.213 0.340 . . . 1.0 . . . . . . . . . . . . A . 24 ARG CZ . . . . . . . . . c30643_6pv2 1 . 6 . 3004 . 1 1 24 ARG H H -5.021 2.660 -0.067 . . . 1.0 . . . . . . . . . . . . A . 24 ARG H . . . . . . . . . c30643_6pv2 1 . 6 . 3005 . 1 1 24 ARG HA H -7.692 2.613 0.884 . . . 1.0 . . . . . . . . . . . . A . 24 ARG HA . . . . . . . . . c30643_6pv2 1 . 6 . 3006 . 1 1 24 ARG HB2 H -6.389 4.444 -1.129 . . . 1.0 . . . . . . . . . . . . A . 24 ARG HB2 . . . . . . . . . c30643_6pv2 1 . 6 . 3007 . 1 1 24 ARG HB3 H -7.979 4.701 -0.427 . . . 1.0 . . . . . . . . . . . . A . 24 ARG HB3 . . . . . . . . . c30643_6pv2 1 . 6 . 3008 . 1 1 24 ARG HD2 H -5.858 7.003 1.493 . . . 1.0 . . . . . . . . . . . . A . 24 ARG HD2 . . . . . . . . . c30643_6pv2 1 . 6 . 3009 . 1 1 24 ARG HD3 H -6.010 6.766 -0.249 . . . 1.0 . . . . . . . . . . . . A . 24 ARG HD3 . . . . . . . . . c30643_6pv2 1 . 6 . 3010 . 1 1 24 ARG HE H -8.483 6.409 1.154 . . . 1.0 . . . . . . . . . . . . A . 24 ARG HE . . . . . . . . . c30643_6pv2 1 . 6 . 3011 . 1 1 24 ARG HG2 H -6.889 4.757 1.818 . . . 1.0 . . . . . . . . . . . . A . 24 ARG HG2 . . . . . . . . . c30643_6pv2 1 . 6 . 3012 . 1 1 24 ARG HG3 H -5.330 4.718 0.992 . . . 1.0 . . . . . . . . . . . . A . 24 ARG HG3 . . . . . . . . . c30643_6pv2 1 . 6 . 3013 . 1 1 24 ARG HH11 H -7.602 9.941 -0.545 . . . 1.0 . . . . . . . . . . . . A . 24 ARG HH11 . . . . . . . . . c30643_6pv2 1 . 6 . 3014 . 1 1 24 ARG HH12 H -6.357 8.750 -0.340 . . . 1.0 . . . . . . . . . . . . A . 24 ARG HH12 . . . . . . . . . c30643_6pv2 1 . 6 . 3015 . 1 1 24 ARG HH21 H -9.747 9.494 0.153 . . . 1.0 . . . . . . . . . . . . A . 24 ARG HH21 . . . . . . . . . c30643_6pv2 1 . 6 . 3016 . 1 1 24 ARG HH22 H -10.126 7.974 0.894 . . . 1.0 . . . . . . . . . . . . A . 24 ARG HH22 . . . . . . . . . c30643_6pv2 1 . 6 . 3017 . 1 1 24 ARG N N -5.840 2.141 0.129 . . . 1.0 . . . . . . . . . . . . A . 24 ARG N . . . . . . . . . c30643_6pv2 1 . 6 . 3018 . 1 1 24 ARG NE N -7.809 7.011 0.765 . . . 1.0 . . . . . . . . . . . . A . 24 ARG NE . . . . . . . . . c30643_6pv2 1 . 6 . 3019 . 1 1 24 ARG NH1 N -7.313 9.033 -0.226 . . . 1.0 . . . . . . . . . . . . A . 24 ARG NH1 . . . . . . . . . c30643_6pv2 1 . 6 . 3020 . 1 1 24 ARG NH2 N -9.456 8.590 0.472 . . . 1.0 . . . . . . . . . . . . A . 24 ARG NH2 . . . . . . . . . c30643_6pv2 1 . 6 . 3021 . 1 1 24 ARG O O -9.078 2.507 -1.428 . . . 1.0 . . . . . . . . . . . . A . 24 ARG O . . . . . . . . . c30643_6pv2 1 . 6 . 3022 . 1 1 25 THR C C -8.682 -0.762 -2.295 . . . 1.0 . . . . . . . . . . . . A . 25 THR C . . . . . . . . . c30643_6pv2 1 . 6 . 3023 . 1 1 25 THR CA C -8.018 0.456 -2.927 . . . 1.0 . . . . . . . . . . . . A . 25 THR CA . . . . . . . . . c30643_6pv2 1 . 6 . 3024 . 1 1 25 THR CB C -7.089 -0.003 -4.072 . . . 1.0 . . . . . . . . . . . . A . 25 THR CB . . . . . . . . . c30643_6pv2 1 . 6 . 3025 . 1 1 25 THR CG2 C -6.405 1.185 -4.730 . . . 1.0 . . . . . . . . . . . . A . 25 THR CG2 . . . . . . . . . c30643_6pv2 1 . 6 . 3026 . 1 1 25 THR H H -6.352 1.047 -1.762 . . . 1.0 . . . . . . . . . . . . A . 25 THR H . . . . . . . . . c30643_6pv2 1 . 6 . 3027 . 1 1 25 THR HA H -8.784 1.096 -3.341 . . . 1.0 . . . . . . . . . . . . A . 25 THR HA . . . . . . . . . c30643_6pv2 1 . 6 . 3028 . 1 1 25 THR HB H -7.687 -0.509 -4.815 . . . 1.0 . . . . . . . . . . . . A . 25 THR HB . . . . . . . . . c30643_6pv2 1 . 6 . 3029 . 1 1 25 THR HG1 H -5.371 -0.408 -3.175 . . . 1.0 . . . . . . . . . . . . A . 25 THR HG1 . . . . . . . . . c30643_6pv2 1 . 6 . 3030 . 1 1 25 THR HG21 H -5.762 0.836 -5.525 . . . 1.0 . . . . . . . . . . . . A . 25 THR HG21 . . . . . . . . . c30643_6pv2 1 . 6 . 3031 . 1 1 25 THR HG22 H -5.815 1.712 -3.995 . . . 1.0 . . . . . . . . . . . . A . 25 THR HG22 . . . . . . . . . c30643_6pv2 1 . 6 . 3032 . 1 1 25 THR HG23 H -7.151 1.852 -5.136 . . . 1.0 . . . . . . . . . . . . A . 25 THR HG23 . . . . . . . . . c30643_6pv2 1 . 6 . 3033 . 1 1 25 THR N N -7.308 1.216 -1.909 . . . 1.0 . . . . . . . . . . . . A . 25 THR N . . . . . . . . . c30643_6pv2 1 . 6 . 3034 . 1 1 25 THR O O -9.717 -1.242 -2.766 . . . 1.0 . . . . . . . . . . . . A . 25 THR O . . . . . . . . . c30643_6pv2 1 . 6 . 3035 . 1 1 25 THR OG1 O -6.096 -0.912 -3.578 . . . 1.0 . . . . . . . . . . . . A . 25 THR OG1 . . . . . . . . . c30643_6pv2 1 . 6 . 3036 . 1 1 26 HIS C C -9.721 -1.855 0.466 . . . 1.0 . . . . . . . . . . . . A . 26 HIS C . . . . . . . . . c30643_6pv2 1 . 6 . 3037 . 1 1 26 HIS CA C -8.643 -2.371 -0.473 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CA . . . . . . . . . c30643_6pv2 1 . 6 . 3038 . 1 1 26 HIS CB C -7.563 -3.110 0.328 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CB . . . . . . . . . c30643_6pv2 1 . 6 . 3039 . 1 1 26 HIS CD2 C -5.170 -3.424 -0.611 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CD2 . . . . . . . . . c30643_6pv2 1 . 6 . 3040 . 1 1 26 HIS CE1 C -5.500 -5.148 -1.902 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CE1 . . . . . . . . . c30643_6pv2 1 . 6 . 3041 . 1 1 26 HIS CG C -6.487 -3.745 -0.503 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CG . . . . . . . . . c30643_6pv2 1 . 6 . 3042 . 1 1 26 HIS H H -7.244 -0.847 -0.904 . . . 1.0 . . . . . . . . . . . . A . 26 HIS H . . . . . . . . . c30643_6pv2 1 . 6 . 3043 . 1 1 26 HIS HA H -9.091 -3.050 -1.181 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HA . . . . . . . . . c30643_6pv2 1 . 6 . 3044 . 1 1 26 HIS HB2 H -7.085 -2.411 0.999 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HB2 . . . . . . . . . c30643_6pv2 1 . 6 . 3045 . 1 1 26 HIS HB3 H -8.032 -3.890 0.911 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HB3 . . . . . . . . . c30643_6pv2 1 . 6 . 3046 . 1 1 26 HIS HD1 H -7.529 -5.321 -1.469 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HD1 . . . . . . . . . c30643_6pv2 1 . 6 . 3047 . 1 1 26 HIS HD2 H -4.659 -2.633 -0.090 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HD2 . . . . . . . . . c30643_6pv2 1 . 6 . 3048 . 1 1 26 HIS HE1 H -5.331 -5.962 -2.589 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HE1 . . . . . . . . . c30643_6pv2 1 . 6 . 3049 . 1 1 26 HIS N N -8.081 -1.255 -1.215 . . . 1.0 . . . . . . . . . . . . A . 26 HIS N . . . . . . . . . c30643_6pv2 1 . 6 . 3050 . 1 1 26 HIS ND1 N -6.682 -4.844 -1.332 . . . 1.0 . . . . . . . . . . . . A . 26 HIS ND1 . . . . . . . . . c30643_6pv2 1 . 6 . 3051 . 1 1 26 HIS NE2 N -4.584 -4.312 -1.487 . . . 1.0 . . . . . . . . . . . . A . 26 HIS NE2 . . . . . . . . . c30643_6pv2 1 . 6 . 3052 . 1 1 26 HIS O O -10.819 -2.404 0.535 . . . 1.0 . . . . . . . . . . . . A . 26 HIS O . . . . . . . . . c30643_6pv2 1 . 6 . 3053 . 1 1 27 THR C C -10.802 1.180 1.435 . . . 1.0 . . . . . . . . . . . . A . 27 THR C . . . . . . . . . c30643_6pv2 1 . 6 . 3054 . 1 1 27 THR CA C -10.346 -0.136 2.061 . . . 1.0 . . . . . . . . . . . . A . 27 THR CA . . . . . . . . . c30643_6pv2 1 . 6 . 3055 . 1 1 27 THR CB C -9.724 0.123 3.448 . . . 1.0 . . . . . . . . . . . . A . 27 THR CB . . . . . . . . . c30643_6pv2 1 . 6 . 3056 . 1 1 27 THR CG2 C -10.797 0.472 4.468 . . . 1.0 . . . . . . . . . . . . A . 27 THR CG2 . . . . . . . . . c30643_6pv2 1 . 6 . 3057 . 1 1 27 THR H H -8.487 -0.424 1.111 . . . 1.0 . . . . . . . . . . . . A . 27 THR H . . . . . . . . . c30643_6pv2 1 . 6 . 3058 . 1 1 27 THR HA H -11.200 -0.788 2.181 . . . 1.0 . . . . . . . . . . . . A . 27 THR HA . . . . . . . . . c30643_6pv2 1 . 6 . 3059 . 1 1 27 THR HB H -9.033 0.950 3.370 . . . 1.0 . . . . . . . . . . . . A . 27 THR HB . . . . . . . . . c30643_6pv2 1 . 6 . 3060 . 1 1 27 THR HG1 H -9.522 -1.835 3.646 . . . 1.0 . . . . . . . . . . . . A . 27 THR HG1 . . . . . . . . . c30643_6pv2 1 . 6 . 3061 . 1 1 27 THR HG21 H -10.334 0.659 5.426 . . . 1.0 . . . . . . . . . . . . A . 27 THR HG21 . . . . . . . . . c30643_6pv2 1 . 6 . 3062 . 1 1 27 THR HG22 H -11.490 -0.351 4.558 . . . 1.0 . . . . . . . . . . . . A . 27 THR HG22 . . . . . . . . . c30643_6pv2 1 . 6 . 3063 . 1 1 27 THR HG23 H -11.327 1.357 4.146 . . . 1.0 . . . . . . . . . . . . A . 27 THR HG23 . . . . . . . . . c30643_6pv2 1 . 6 . 3064 . 1 1 27 THR N N -9.397 -0.788 1.180 . . . 1.0 . . . . . . . . . . . . A . 27 THR N . . . . . . . . . c30643_6pv2 1 . 6 . 3065 . 1 1 27 THR O O -10.495 2.272 1.923 . . . 1.0 . . . . . . . . . . . . A . 27 THR O . . . . . . . . . c30643_6pv2 1 . 6 . 3066 . 1 1 27 THR OG1 O -9.017 -1.047 3.886 . . . 1.0 . . . . . . . . . . . . A . 27 THR OG1 . . . . . . . . . c30643_6pv2 1 . 6 . 3067 . 1 1 28 GLY C C -13.288 2.753 0.136 . . . 1.0 . . . . . . . . . . . . A . 28 GLY C . . . . . . . . . c30643_6pv2 1 . 6 . 3068 . 1 1 28 GLY CA C -11.972 2.229 -0.391 . . . 1.0 . . . . . . . . . . . . A . 28 GLY CA . . . . . . . . . c30643_6pv2 1 . 6 . 3069 . 1 1 28 GLY H H -11.745 0.168 0.002 . . . 1.0 . . . . . . . . . . . . A . 28 GLY H . . . . . . . . . c30643_6pv2 1 . 6 . 3070 . 1 1 28 GLY HA2 H -11.226 3.003 -0.304 . . . 1.0 . . . . . . . . . . . . A . 28 GLY HA2 . . . . . . . . . c30643_6pv2 1 . 6 . 3071 . 1 1 28 GLY HA3 H -12.091 1.972 -1.434 . . . 1.0 . . . . . . . . . . . . A . 28 GLY HA3 . . . . . . . . . c30643_6pv2 1 . 6 . 3072 . 1 1 28 GLY N N -11.516 1.063 0.329 . . . 1.0 . . . . . . . . . . . . A . 28 GLY N . . . . . . . . . c30643_6pv2 1 . 6 . 3073 . 1 1 28 GLY O O -14.019 2.037 0.825 . . . 1.0 . . . . . . . . . . . . A . 28 GLY O . . . . . . . . . c30643_6pv2 1 . 6 . 3074 . 1 1 29 GLU C C -15.930 4.318 -0.771 . . . 1.0 . . . . . . . . . . . . A . 29 GLU C . . . . . . . . . c30643_6pv2 1 . 6 . 3075 . 1 1 29 GLU CA C -14.830 4.623 0.242 . . . 1.0 . . . . . . . . . . . . A . 29 GLU CA . . . . . . . . . c30643_6pv2 1 . 6 . 3076 . 1 1 29 GLU CB C -14.640 6.137 0.387 . . . 1.0 . . . . . . . . . . . . A . 29 GLU CB . . . . . . . . . c30643_6pv2 1 . 6 . 3077 . 1 1 29 GLU CD C -15.649 8.351 1.041 . . . 1.0 . . . . . . . . . . . . A . 29 GLU CD . . . . . . . . . c30643_6pv2 1 . 6 . 3078 . 1 1 29 GLU CG C -15.823 6.848 1.021 . . . 1.0 . . . . . . . . . . . . A . 29 GLU CG . . . . . . . . . c30643_6pv2 1 . 6 . 3079 . 1 1 29 GLU H H -12.962 4.518 -0.736 . . . 1.0 . . . . . . . . . . . . A . 29 GLU H . . . . . . . . . c30643_6pv2 1 . 6 . 3080 . 1 1 29 GLU HA H -15.104 4.202 1.197 . . . 1.0 . . . . . . . . . . . . A . 29 GLU HA . . . . . . . . . c30643_6pv2 1 . 6 . 3081 . 1 1 29 GLU HB2 H -13.766 6.324 0.997 . . . 1.0 . . . . . . . . . . . . A . 29 GLU HB2 . . . . . . . . . c30643_6pv2 1 . 6 . 3082 . 1 1 29 GLU HB3 H -14.479 6.562 -0.592 . . . 1.0 . . . . . . . . . . . . A . 29 GLU HB3 . . . . . . . . . c30643_6pv2 1 . 6 . 3083 . 1 1 29 GLU HG2 H -16.712 6.612 0.456 . . . 1.0 . . . . . . . . . . . . A . 29 GLU HG2 . . . . . . . . . c30643_6pv2 1 . 6 . 3084 . 1 1 29 GLU HG3 H -15.939 6.499 2.037 . . . 1.0 . . . . . . . . . . . . A . 29 GLU HG3 . . . . . . . . . c30643_6pv2 1 . 6 . 3085 . 1 1 29 GLU N N -13.590 4.001 -0.187 . . . 1.0 . . . . . . . . . . . . A . 29 GLU N . . . . . . . . . c30643_6pv2 1 . 6 . 3086 . 1 1 29 GLU O O -16.253 5.143 -1.626 . . . 1.0 . . . . . . . . . . . . A . 29 GLU O . . . . . . . . . c30643_6pv2 1 . 6 . 3087 . 1 1 29 GLU OE1 O -14.925 8.859 1.922 . . . 1.0 . . . . . . . . . . . . A . 29 GLU OE1 . . . . . . . . . c30643_6pv2 1 . 6 . 3088 . 1 1 29 GLU OE2 O -16.229 9.033 0.170 . . . 1.0 . . . . . . . . . . . . A . 29 GLU OE2 . . . . . . . . . c30643_6pv2 1 . 6 . 3089 . 1 1 30 LYS C C -18.674 2.064 -0.848 . . . 1.0 . . . . . . . . . . . . A . 30 LYS C . . . . . . . . . c30643_6pv2 1 . 6 . 3090 . 1 1 30 LYS CA C -17.515 2.690 -1.613 . . . 1.0 . . . . . . . . . . . . A . 30 LYS CA . . . . . . . . . c30643_6pv2 1 . 6 . 3091 . 1 1 30 LYS CB C -16.941 1.697 -2.628 . . . 1.0 . . . . . . . . . . . . A . 30 LYS CB . . . . . . . . . c30643_6pv2 1 . 6 . 3092 . 1 1 30 LYS CD C -17.267 0.412 -4.763 . . . 1.0 . . . . . . . . . . . . A . 30 LYS CD . . . . . . . . . c30643_6pv2 1 . 6 . 3093 . 1 1 30 LYS CE C -18.206 0.121 -5.923 . . . 1.0 . . . . . . . . . . . . A . 30 LYS CE . . . . . . . . . c30643_6pv2 1 . 6 . 3094 . 1 1 30 LYS CG C -17.903 1.351 -3.751 . . . 1.0 . . . . . . . . . . . . A . 30 LYS CG . . . . . . . . . c30643_6pv2 1 . 6 . 3095 . 1 1 30 LYS H H -16.184 2.499 0.014 . . . 1.0 . . . . . . . . . . . . A . 30 LYS H . . . . . . . . . c30643_6pv2 1 . 6 . 3096 . 1 1 30 LYS HA H -17.874 3.564 -2.137 . . . 1.0 . . . . . . . . . . . . A . 30 LYS HA . . . . . . . . . c30643_6pv2 1 . 6 . 3097 . 1 1 30 LYS HB2 H -16.049 2.122 -3.066 . . . 1.0 . . . . . . . . . . . . A . 30 LYS HB2 . . . . . . . . . c30643_6pv2 1 . 6 . 3098 . 1 1 30 LYS HB3 H -16.678 0.785 -2.113 . . . 1.0 . . . . . . . . . . . . A . 30 LYS HB3 . . . . . . . . . c30643_6pv2 1 . 6 . 3099 . 1 1 30 LYS HD2 H -16.369 0.867 -5.148 . . . 1.0 . . . . . . . . . . . . A . 30 LYS HD2 . . . . . . . . . c30643_6pv2 1 . 6 . 3100 . 1 1 30 LYS HD3 H -17.022 -0.517 -4.271 . . . 1.0 . . . . . . . . . . . . A . 30 LYS HD3 . . . . . . . . . c30643_6pv2 1 . 6 . 3101 . 1 1 30 LYS HE2 H -17.716 -0.559 -6.603 . . . 1.0 . . . . . . . . . . . . A . 30 LYS HE2 . . . . . . . . . c30643_6pv2 1 . 6 . 3102 . 1 1 30 LYS HE3 H -19.102 -0.342 -5.536 . . . 1.0 . . . . . . . . . . . . A . 30 LYS HE3 . . . . . . . . . c30643_6pv2 1 . 6 . 3103 . 1 1 30 LYS HG2 H -18.776 0.874 -3.331 . . . 1.0 . . . . . . . . . . . . A . 30 LYS HG2 . . . . . . . . . c30643_6pv2 1 . 6 . 3104 . 1 1 30 LYS HG3 H -18.194 2.262 -4.252 . . . 1.0 . . . . . . . . . . . . A . 30 LYS HG3 . . . . . . . . . c30643_6pv2 1 . 6 . 3105 . 1 1 30 LYS HZ1 H -19.198 1.120 -7.461 . . . 1.0 . . . . . . . . . . . . A . 30 LYS HZ1 . . . . . . . . . c30643_6pv2 1 . 6 . 3106 . 1 1 30 LYS HZ2 H -17.728 1.831 -7.022 . . . 1.0 . . . . . . . . . . . . A . 30 LYS HZ2 . . . . . . . . . c30643_6pv2 1 . 6 . 3107 . 1 1 30 LYS HZ3 H -19.083 2.012 -6.031 . . . 1.0 . . . . . . . . . . . . A . 30 LYS HZ3 . . . . . . . . . c30643_6pv2 1 . 6 . 3108 . 1 1 30 LYS N N -16.481 3.117 -0.689 . . . 1.0 . . . . . . . . . . . . A . 30 LYS N . . . . . . . . . c30643_6pv2 1 . 6 . 3109 . 1 1 30 LYS NZ N -18.580 1.356 -6.660 . . . 1.0 . . . . . . . . . . . . A . 30 LYS NZ . . . . . . . . . c30643_6pv2 1 . 6 . 3110 . 1 1 30 LYS O O -18.639 0.890 -0.483 . . . 1.0 . . . . . . . . . . . . A . 30 LYS O . . . . . . . . . c30643_6pv2 1 . 6 . 3111 . 1 1 31 NH2 HN1 H -19.650 3.785 -0.912 . . . 1.0 . . . . . . . . . . . . A . 31 NH2 HN1 . . . . . . . . . c30643_6pv2 1 . 6 . 3112 . 1 1 31 NH2 HN2 H -20.451 2.496 -0.087 . . . 1.0 . . . . . . . . . . . . A . 31 NH2 HN2 . . . . . . . . . c30643_6pv2 1 . 6 . 3113 . 1 1 31 NH2 N N -19.693 2.859 -0.589 . . . 1.0 . . . . . . . . . . . . A . 31 NH2 N . . . . . . . . . c30643_6pv2 1 . 6 . 3114 . 2 2 1 ZN ZN Zn -2.660 -4.301 -2.018 . . . 1.0 . . . . . . . . . . . . A . 101 ZN ZN . . . . . . . . . c30643_6pv2 1 . 7 . 3115 . 1 1 1 ARG C C 11.853 -2.027 2.966 . . . 1.0 . . . . . . . . . . . . A . 1 ARG C . . . . . . . . . c30643_6pv2 1 . 7 . 3116 . 1 1 1 ARG CA C 12.906 -2.930 3.591 . . . 1.0 . . . . . . . . . . . . A . 1 ARG CA . . . . . . . . . c30643_6pv2 1 . 7 . 3117 . 1 1 1 ARG CB C 12.301 -3.684 4.782 . . . 1.0 . . . . . . . . . . . . A . 1 ARG CB . . . . . . . . . c30643_6pv2 1 . 7 . 3118 . 1 1 1 ARG CD C 13.450 -5.888 4.369 . . . 1.0 . . . . . . . . . . . . A . 1 ARG CD . . . . . . . . . c30643_6pv2 1 . 7 . 3119 . 1 1 1 ARG CG C 13.214 -4.755 5.359 . . . 1.0 . . . . . . . . . . . . A . 1 ARG CG . . . . . . . . . c30643_6pv2 1 . 7 . 3120 . 1 1 1 ARG CZ C 12.074 -7.448 3.039 . . . 1.0 . . . . . . . . . . . . A . 1 ARG CZ . . . . . . . . . c30643_6pv2 1 . 7 . 3121 . 1 1 1 ARG H1 H 14.498 -1.647 3.209 . . . 1.0 . . . . . . . . . . . . A . 1 ARG H1 . . . . . . . . . c30643_6pv2 1 . 7 . 3122 . 1 1 1 ARG H2 H 14.789 -2.737 4.467 . . . 1.0 . . . . . . . . . . . . A . 1 ARG H2 . . . . . . . . . c30643_6pv2 1 . 7 . 3123 . 1 1 1 ARG H3 H 13.773 -1.408 4.716 . . . 1.0 . . . . . . . . . . . . A . 1 ARG H3 . . . . . . . . . c30643_6pv2 1 . 7 . 3124 . 1 1 1 ARG HA H 13.241 -3.641 2.852 . . . 1.0 . . . . . . . . . . . . A . 1 ARG HA . . . . . . . . . c30643_6pv2 1 . 7 . 3125 . 1 1 1 ARG HB2 H 12.076 -2.976 5.564 . . . 1.0 . . . . . . . . . . . . A . 1 ARG HB2 . . . . . . . . . c30643_6pv2 1 . 7 . 3126 . 1 1 1 ARG HB3 H 11.385 -4.158 4.463 . . . 1.0 . . . . . . . . . . . . A . 1 ARG HB3 . . . . . . . . . c30643_6pv2 1 . 7 . 3127 . 1 1 1 ARG HD2 H 13.821 -5.471 3.445 . . . 1.0 . . . . . . . . . . . . A . 1 ARG HD2 . . . . . . . . . c30643_6pv2 1 . 7 . 3128 . 1 1 1 ARG HD3 H 14.189 -6.561 4.780 . . . 1.0 . . . . . . . . . . . . A . 1 ARG HD3 . . . . . . . . . c30643_6pv2 1 . 7 . 3129 . 1 1 1 ARG HE H 11.489 -6.558 4.734 . . . 1.0 . . . . . . . . . . . . A . 1 ARG HE . . . . . . . . . c30643_6pv2 1 . 7 . 3130 . 1 1 1 ARG HG2 H 14.163 -4.308 5.610 . . . 1.0 . . . . . . . . . . . . A . 1 ARG HG2 . . . . . . . . . c30643_6pv2 1 . 7 . 3131 . 1 1 1 ARG HG3 H 12.756 -5.158 6.253 . . . 1.0 . . . . . . . . . . . . A . 1 ARG HG3 . . . . . . . . . c30643_6pv2 1 . 7 . 3132 . 1 1 1 ARG HH11 H 12.913 -8.149 1.336 . . . 1.0 . . . . . . . . . . . . A . 1 ARG HH11 . . . . . . . . . c30643_6pv2 1 . 7 . 3133 . 1 1 1 ARG HH12 H 13.867 -6.995 2.208 . . . 1.0 . . . . . . . . . . . . A . 1 ARG HH12 . . . . . . . . . c30643_6pv2 1 . 7 . 3134 . 1 1 1 ARG HH21 H 10.217 -8.071 3.571 . . . 1.0 . . . . . . . . . . . . A . 1 ARG HH21 . . . . . . . . . c30643_6pv2 1 . 7 . 3135 . 1 1 1 ARG HH22 H 10.840 -8.753 2.100 . . . 1.0 . . . . . . . . . . . . A . 1 ARG HH22 . . . . . . . . . c30643_6pv2 1 . 7 . 3136 . 1 1 1 ARG N N 14.072 -2.127 4.026 . . . 1.0 . . . . . . . . . . . . A . 1 ARG N . . . . . . . . . c30643_6pv2 1 . 7 . 3137 . 1 1 1 ARG NE N 12.227 -6.641 4.088 . . . 1.0 . . . . . . . . . . . . A . 1 ARG NE . . . . . . . . . c30643_6pv2 1 . 7 . 3138 . 1 1 1 ARG NH1 N 13.029 -7.541 2.123 . . . 1.0 . . . . . . . . . . . . A . 1 ARG NH1 . . . . . . . . . c30643_6pv2 1 . 7 . 3139 . 1 1 1 ARG NH2 N 10.956 -8.146 2.893 . . . 1.0 . . . . . . . . . . . . A . 1 ARG NH2 . . . . . . . . . c30643_6pv2 1 . 7 . 3140 . 1 1 1 ARG O O 11.520 -0.981 3.522 . . . 1.0 . . . . . . . . . . . . A . 1 ARG O . . . . . . . . . c30643_6pv2 1 . 7 . 3141 . 1 1 2 PRO C C 8.936 -1.734 1.734 . . . 1.0 . . . . . . . . . . . . A . 2 PRO C . . . . . . . . . c30643_6pv2 1 . 7 . 3142 . 1 1 2 PRO CA C 10.313 -1.616 1.095 . . . 1.0 . . . . . . . . . . . . A . 2 PRO CA . . . . . . . . . c30643_6pv2 1 . 7 . 3143 . 1 1 2 PRO CB C 10.303 -2.224 -0.307 . . . 1.0 . . . . . . . . . . . . A . 2 PRO CB . . . . . . . . . c30643_6pv2 1 . 7 . 3144 . 1 1 2 PRO CD C 11.653 -3.650 1.063 . . . 1.0 . . . . . . . . . . . . A . 2 PRO CD . . . . . . . . . c30643_6pv2 1 . 7 . 3145 . 1 1 2 PRO CG C 10.696 -3.645 -0.101 . . . 1.0 . . . . . . . . . . . . A . 2 PRO CG . . . . . . . . . c30643_6pv2 1 . 7 . 3146 . 1 1 2 PRO HA H 10.596 -0.574 1.039 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HA . . . . . . . . . c30643_6pv2 1 . 7 . 3147 . 1 1 2 PRO HB2 H 9.310 -2.143 -0.730 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HB2 . . . . . . . . . c30643_6pv2 1 . 7 . 3148 . 1 1 2 PRO HB3 H 11.013 -1.705 -0.932 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HB3 . . . . . . . . . c30643_6pv2 1 . 7 . 3149 . 1 1 2 PRO HD2 H 11.489 -4.521 1.682 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HD2 . . . . . . . . . c30643_6pv2 1 . 7 . 3150 . 1 1 2 PRO HD3 H 12.675 -3.624 0.710 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HD3 . . . . . . . . . c30643_6pv2 1 . 7 . 3151 . 1 1 2 PRO HG2 H 9.821 -4.236 0.130 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HG2 . . . . . . . . . c30643_6pv2 1 . 7 . 3152 . 1 1 2 PRO HG3 H 11.180 -4.024 -0.988 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HG3 . . . . . . . . . c30643_6pv2 1 . 7 . 3153 . 1 1 2 PRO N N 11.320 -2.410 1.797 . . . 1.0 . . . . . . . . . . . . A . 2 PRO N . . . . . . . . . c30643_6pv2 1 . 7 . 3154 . 1 1 2 PRO O O 8.695 -2.607 2.569 . . . 1.0 . . . . . . . . . . . . A . 2 PRO O . . . . . . . . . c30643_6pv2 1 . 7 . 3155 . 1 1 3 PHE C C 5.829 -1.749 0.952 . . . 1.0 . . . . . . . . . . . . A . 3 PHE C . . . . . . . . . c30643_6pv2 1 . 7 . 3156 . 1 1 3 PHE CA C 6.679 -0.856 1.840 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CA . . . . . . . . . c30643_6pv2 1 . 7 . 3157 . 1 1 3 PHE CB C 6.112 0.565 1.862 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CB . . . . . . . . . c30643_6pv2 1 . 7 . 3158 . 1 1 3 PHE CD1 C 7.912 2.260 2.292 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CD1 . . . . . . . . . c30643_6pv2 1 . 7 . 3159 . 1 1 3 PHE CD2 C 6.494 1.623 4.098 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CD2 . . . . . . . . . c30643_6pv2 1 . 7 . 3160 . 1 1 3 PHE CE1 C 8.594 3.124 3.126 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CE1 . . . . . . . . . c30643_6pv2 1 . 7 . 3161 . 1 1 3 PHE CE2 C 7.171 2.485 4.937 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CE2 . . . . . . . . . c30643_6pv2 1 . 7 . 3162 . 1 1 3 PHE CG C 6.856 1.501 2.770 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CG . . . . . . . . . c30643_6pv2 1 . 7 . 3163 . 1 1 3 PHE CZ C 8.223 3.237 4.451 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CZ . . . . . . . . . c30643_6pv2 1 . 7 . 3164 . 1 1 3 PHE H H 8.300 -0.173 0.675 . . . 1.0 . . . . . . . . . . . . A . 3 PHE H . . . . . . . . . c30643_6pv2 1 . 7 . 3165 . 1 1 3 PHE HA H 6.687 -1.256 2.842 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HA . . . . . . . . . c30643_6pv2 1 . 7 . 3166 . 1 1 3 PHE HB2 H 6.149 0.975 0.866 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HB2 . . . . . . . . . c30643_6pv2 1 . 7 . 3167 . 1 1 3 PHE HB3 H 5.087 0.531 2.190 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HB3 . . . . . . . . . c30643_6pv2 1 . 7 . 3168 . 1 1 3 PHE HD1 H 8.203 2.171 1.255 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HD1 . . . . . . . . . c30643_6pv2 1 . 7 . 3169 . 1 1 3 PHE HD2 H 5.672 1.035 4.478 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HD2 . . . . . . . . . c30643_6pv2 1 . 7 . 3170 . 1 1 3 PHE HE1 H 9.414 3.711 2.740 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HE1 . . . . . . . . . c30643_6pv2 1 . 7 . 3171 . 1 1 3 PHE HE2 H 6.879 2.571 5.971 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HE2 . . . . . . . . . c30643_6pv2 1 . 7 . 3172 . 1 1 3 PHE HZ H 8.753 3.912 5.105 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HZ . . . . . . . . . c30643_6pv2 1 . 7 . 3173 . 1 1 3 PHE N N 8.041 -0.847 1.341 . . . 1.0 . . . . . . . . . . . . A . 3 PHE N . . . . . . . . . c30643_6pv2 1 . 7 . 3174 . 1 1 3 PHE O O 5.188 -1.278 0.016 . . . 1.0 . . . . . . . . . . . . A . 3 PHE O . . . . . . . . . c30643_6pv2 1 . 7 . 3175 . 1 1 4 NLE C C 3.776 -4.310 0.901 . . . 1.0 . . . . . . . . . . . . A . 4 NLE C . . . . . . . . . c30643_6pv2 1 . 7 . 3176 . 1 1 4 NLE CA C 5.174 -4.009 0.387 . . . 1.0 . . . . . . . . . . . . A . 4 NLE CA . . . . . . . . . c30643_6pv2 1 . 7 . 3177 . 1 1 4 NLE CB C 5.987 -5.305 0.309 . . . 1.0 . . . . . . . . . . . . A . 4 NLE CB . . . . . . . . . c30643_6pv2 1 . 7 . 3178 . 1 1 4 NLE CD C 6.196 -7.631 -0.653 . . . 1.0 . . . . . . . . . . . . A . 4 NLE CD . . . . . . . . . c30643_6pv2 1 . 7 . 3179 . 1 1 4 NLE CE C 6.028 -8.320 0.683 . . . 1.0 . . . . . . . . . . . . A . 4 NLE CE . . . . . . . . . c30643_6pv2 1 . 7 . 3180 . 1 1 4 NLE CG C 5.423 -6.321 -0.677 . . . 1.0 . . . . . . . . . . . . A . 4 NLE CG . . . . . . . . . c30643_6pv2 1 . 7 . 3181 . 1 1 4 NLE H H 6.319 -3.347 2.037 . . . 1.0 . . . . . . . . . . . . A . 4 NLE H . . . . . . . . . c30643_6pv2 1 . 7 . 3182 . 1 1 4 NLE HA H 5.092 -3.586 -0.598 . . . 1.0 . . . . . . . . . . . . A . 4 NLE HA . . . . . . . . . c30643_6pv2 1 . 7 . 3183 . 1 1 4 NLE HB2 H 6.008 -5.759 1.286 . . . 1.0 . . . . . . . . . . . . A . 4 NLE HB2 . . . . . . . . . c30643_6pv2 1 . 7 . 3184 . 1 1 4 NLE HB3 H 6.998 -5.067 0.012 . . . 1.0 . . . . . . . . . . . . A . 4 NLE HB3 . . . . . . . . . c30643_6pv2 1 . 7 . 3185 . 1 1 4 NLE HD2 H 7.245 -7.431 -0.813 . . . 1.0 . . . . . . . . . . . . A . 4 NLE HD2 . . . . . . . . . c30643_6pv2 1 . 7 . 3186 . 1 1 4 NLE HD3 H 5.822 -8.283 -1.428 . . . 1.0 . . . . . . . . . . . . A . 4 NLE HD3 . . . . . . . . . c30643_6pv2 1 . 7 . 3187 . 1 1 4 NLE HE1 H 4.979 -8.488 0.871 . . . 1.0 . . . . . . . . . . . . A . 4 NLE HE1 . . . . . . . . . c30643_6pv2 1 . 7 . 3188 . 1 1 4 NLE HE2 H 6.442 -7.700 1.464 . . . 1.0 . . . . . . . . . . . . A . 4 NLE HE2 . . . . . . . . . c30643_6pv2 1 . 7 . 3189 . 1 1 4 NLE HE3 H 6.545 -9.268 0.666 . . . 1.0 . . . . . . . . . . . . A . 4 NLE HE3 . . . . . . . . . c30643_6pv2 1 . 7 . 3190 . 1 1 4 NLE HG2 H 5.471 -5.905 -1.673 . . . 1.0 . . . . . . . . . . . . A . 4 NLE HG2 . . . . . . . . . c30643_6pv2 1 . 7 . 3191 . 1 1 4 NLE HG3 H 4.394 -6.521 -0.421 . . . 1.0 . . . . . . . . . . . . A . 4 NLE HG3 . . . . . . . . . c30643_6pv2 1 . 7 . 3192 . 1 1 4 NLE N N 5.846 -3.039 1.234 . . . 1.0 . . . . . . . . . . . . A . 4 NLE N . . . . . . . . . c30643_6pv2 1 . 7 . 3193 . 1 1 4 NLE O O 3.572 -4.523 2.095 . . . 1.0 . . . . . . . . . . . . A . 4 NLE O . . . . . . . . . c30643_6pv2 1 . 7 . 3194 . 1 1 5 CYS C C 1.413 -6.214 0.558 . . . 1.0 . . . . . . . . . . . . A . 5 CYS C . . . . . . . . . c30643_6pv2 1 . 7 . 3195 . 1 1 5 CYS CA C 1.460 -4.707 0.313 . . . 1.0 . . . . . . . . . . . . A . 5 CYS CA . . . . . . . . . c30643_6pv2 1 . 7 . 3196 . 1 1 5 CYS CB C 0.501 -4.313 -0.819 . . . 1.0 . . . . . . . . . . . . A . 5 CYS CB . . . . . . . . . c30643_6pv2 1 . 7 . 3197 . 1 1 5 CYS H H 3.025 -4.032 -0.930 . . . 1.0 . . . . . . . . . . . . A . 5 CYS H . . . . . . . . . c30643_6pv2 1 . 7 . 3198 . 1 1 5 CYS HA H 1.171 -4.195 1.218 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HA . . . . . . . . . c30643_6pv2 1 . 7 . 3199 . 1 1 5 CYS HB2 H 0.526 -3.240 -0.944 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HB2 . . . . . . . . . c30643_6pv2 1 . 7 . 3200 . 1 1 5 CYS HB3 H 0.827 -4.782 -1.733 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HB3 . . . . . . . . . c30643_6pv2 1 . 7 . 3201 . 1 1 5 CYS N N 2.815 -4.311 -0.010 . . . 1.0 . . . . . . . . . . . . A . 5 CYS N . . . . . . . . . c30643_6pv2 1 . 7 . 3202 . 1 1 5 CYS O O 2.111 -6.983 -0.107 . . . 1.0 . . . . . . . . . . . . A . 5 CYS O . . . . . . . . . c30643_6pv2 1 . 7 . 3203 . 1 1 5 CYS SG S -1.220 -4.789 -0.536 . . . 1.0 . . . . . . . . . . . . A . 5 CYS SG . . . . . . . . . c30643_6pv2 1 . 7 . 3204 . 1 1 6 THR C C -0.977 -8.430 1.977 . . . 1.0 . . . . . . . . . . . . A . 6 THR C . . . . . . . . . c30643_6pv2 1 . 7 . 3205 . 1 1 6 THR CA C 0.488 -8.031 1.868 . . . 1.0 . . . . . . . . . . . . A . 6 THR CA . . . . . . . . . c30643_6pv2 1 . 7 . 3206 . 1 1 6 THR CB C 1.210 -8.340 3.193 . . . 1.0 . . . . . . . . . . . . A . 6 THR CB . . . . . . . . . c30643_6pv2 1 . 7 . 3207 . 1 1 6 THR CG2 C 2.715 -8.392 2.992 . . . 1.0 . . . . . . . . . . . . A . 6 THR CG2 . . . . . . . . . c30643_6pv2 1 . 7 . 3208 . 1 1 6 THR H H 0.092 -5.967 2.030 . . . 1.0 . . . . . . . . . . . . A . 6 THR H . . . . . . . . . c30643_6pv2 1 . 7 . 3209 . 1 1 6 THR HA H 0.954 -8.608 1.082 . . . 1.0 . . . . . . . . . . . . A . 6 THR HA . . . . . . . . . c30643_6pv2 1 . 7 . 3210 . 1 1 6 THR HB H 0.876 -9.304 3.549 . . . 1.0 . . . . . . . . . . . . A . 6 THR HB . . . . . . . . . c30643_6pv2 1 . 7 . 3211 . 1 1 6 THR HG1 H 0.193 -7.684 4.755 . . . 1.0 . . . . . . . . . . . . A . 6 THR HG1 . . . . . . . . . c30643_6pv2 1 . 7 . 3212 . 1 1 6 THR HG21 H 3.057 -7.447 2.595 . . . 1.0 . . . . . . . . . . . . A . 6 THR HG21 . . . . . . . . . c30643_6pv2 1 . 7 . 3213 . 1 1 6 THR HG22 H 2.958 -9.183 2.299 . . . 1.0 . . . . . . . . . . . . A . 6 THR HG22 . . . . . . . . . c30643_6pv2 1 . 7 . 3214 . 1 1 6 THR HG23 H 3.199 -8.581 3.938 . . . 1.0 . . . . . . . . . . . . A . 6 THR HG23 . . . . . . . . . c30643_6pv2 1 . 7 . 3215 . 1 1 6 THR N N 0.613 -6.625 1.526 . . . 1.0 . . . . . . . . . . . . A . 6 THR N . . . . . . . . . c30643_6pv2 1 . 7 . 3216 . 1 1 6 THR O O -1.399 -9.033 2.962 . . . 1.0 . . . . . . . . . . . . A . 6 THR O . . . . . . . . . c30643_6pv2 1 . 7 . 3217 . 1 1 6 THR OG1 O 0.883 -7.342 4.173 . . . 1.0 . . . . . . . . . . . . A . 6 THR OG1 . . . . . . . . . c30643_6pv2 1 . 7 . 3218 . 1 1 7 TRP C C -3.465 -9.691 0.270 . . . 1.0 . . . . . . . . . . . . A . 7 TRP C . . . . . . . . . c30643_6pv2 1 . 7 . 3219 . 1 1 7 TRP CA C -3.182 -8.361 0.963 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CA . . . . . . . . . c30643_6pv2 1 . 7 . 3220 . 1 1 7 TRP CB C -3.938 -7.224 0.277 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CB . . . . . . . . . c30643_6pv2 1 . 7 . 3221 . 1 1 7 TRP CD1 C -6.370 -7.876 -0.174 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CD1 . . . . . . . . . c30643_6pv2 1 . 7 . 3222 . 1 1 7 TRP CD2 C -6.084 -6.555 1.603 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CD2 . . . . . . . . . c30643_6pv2 1 . 7 . 3223 . 1 1 7 TRP CE2 C -7.455 -6.834 1.469 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CE2 . . . . . . . . . c30643_6pv2 1 . 7 . 3224 . 1 1 7 TRP CE3 C -5.661 -5.740 2.655 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CE3 . . . . . . . . . c30643_6pv2 1 . 7 . 3225 . 1 1 7 TRP CG C -5.409 -7.233 0.544 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CG . . . . . . . . . c30643_6pv2 1 . 7 . 3226 . 1 1 7 TRP CH2 C -7.965 -5.529 3.365 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CH2 . . . . . . . . . c30643_6pv2 1 . 7 . 3227 . 1 1 7 TRP CZ2 C -8.407 -6.325 2.344 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CZ2 . . . . . . . . . c30643_6pv2 1 . 7 . 3228 . 1 1 7 TRP CZ3 C -6.605 -5.235 3.524 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CZ3 . . . . . . . . . c30643_6pv2 1 . 7 . 3229 . 1 1 7 TRP H H -1.358 -7.637 0.180 . . . 1.0 . . . . . . . . . . . . A . 7 TRP H . . . . . . . . . c30643_6pv2 1 . 7 . 3230 . 1 1 7 TRP HA H -3.506 -8.428 1.991 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HA . . . . . . . . . c30643_6pv2 1 . 7 . 3231 . 1 1 7 TRP HB2 H -3.545 -6.279 0.617 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HB2 . . . . . . . . . c30643_6pv2 1 . 7 . 3232 . 1 1 7 TRP HB3 H -3.794 -7.303 -0.789 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HB3 . . . . . . . . . c30643_6pv2 1 . 7 . 3233 . 1 1 7 TRP HD1 H -6.173 -8.479 -1.046 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HD1 . . . . . . . . . c30643_6pv2 1 . 7 . 3234 . 1 1 7 TRP HE1 H -8.455 -7.997 0.041 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HE1 . . . . . . . . . c30643_6pv2 1 . 7 . 3235 . 1 1 7 TRP HE3 H -4.615 -5.502 2.791 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HE3 . . . . . . . . . c30643_6pv2 1 . 7 . 3236 . 1 1 7 TRP HH2 H -8.671 -5.111 4.067 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HH2 . . . . . . . . . c30643_6pv2 1 . 7 . 3237 . 1 1 7 TRP HZ2 H -9.459 -6.543 2.236 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HZ2 . . . . . . . . . c30643_6pv2 1 . 7 . 3238 . 1 1 7 TRP HZ3 H -6.298 -4.602 4.343 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HZ3 . . . . . . . . . c30643_6pv2 1 . 7 . 3239 . 1 1 7 TRP N N -1.755 -8.084 0.959 . . . 1.0 . . . . . . . . . . . . A . 7 TRP N . . . . . . . . . c30643_6pv2 1 . 7 . 3240 . 1 1 7 TRP NE1 N -7.603 -7.642 0.376 . . . 1.0 . . . . . . . . . . . . A . 7 TRP NE1 . . . . . . . . . c30643_6pv2 1 . 7 . 3241 . 1 1 7 TRP O O -3.873 -9.729 -0.896 . . . 1.0 . . . . . . . . . . . . A . 7 TRP O . . . . . . . . . c30643_6pv2 1 . 7 . 3242 . 1 1 8 ORN C C -1.359 -10.828 -3.059 . . . 1.0 . . . . . . . . . . . . A . 8 ORN C . . . . . . . . . c30643_6pv2 1 . 7 . 3243 . 1 1 8 ORN CA C -1.958 -11.983 -2.272 . . . 1.0 . . . . . . . . . . . . A . 8 ORN CA . . . . . . . . . c30643_6pv2 1 . 7 . 3244 . 1 1 8 ORN CB C -1.297 -12.060 -0.892 . . . 1.0 . . . . . . . . . . . . A . 8 ORN CB . . . . . . . . . c30643_6pv2 1 . 7 . 3245 . 1 1 8 ORN CD C -3.409 -12.143 0.479 . . . 1.0 . . . . . . . . . . . . A . 8 ORN CD . . . . . . . . . c30643_6pv2 1 . 7 . 3246 . 1 1 8 ORN CG C -2.097 -12.843 0.138 . . . 1.0 . . . . . . . . . . . . A . 8 ORN CG . . . . . . . . . c30643_6pv2 1 . 7 . 3247 . 1 1 8 ORN H H -2.204 -14.042 -2.462 . . . 1.0 . . . . . . . . . . . . A . 8 ORN H . . . . . . . . . c30643_6pv2 1 . 7 . 3248 . 1 1 8 ORN HA H -3.016 -11.808 -2.148 . . . 1.0 . . . . . . . . . . . . A . 8 ORN HA . . . . . . . . . c30643_6pv2 1 . 7 . 3249 . 1 1 8 ORN HB2 H -1.161 -11.057 -0.518 . . . 1.0 . . . . . . . . . . . . A . 8 ORN HB2 . . . . . . . . . c30643_6pv2 1 . 7 . 3250 . 1 1 8 ORN HB3 H -0.332 -12.530 -0.995 . . . 1.0 . . . . . . . . . . . . A . 8 ORN HB3 . . . . . . . . . c30643_6pv2 1 . 7 . 3251 . 1 1 8 ORN HD2 H -3.922 -12.717 1.236 . . . 1.0 . . . . . . . . . . . . A . 8 ORN HD2 . . . . . . . . . c30643_6pv2 1 . 7 . 3252 . 1 1 8 ORN HD3 H -4.021 -12.099 -0.409 . . . 1.0 . . . . . . . . . . . . A . 8 ORN HD3 . . . . . . . . . c30643_6pv2 1 . 7 . 3253 . 1 1 8 ORN HE1 H -2.844 -10.678 1.883 . . . 1.0 . . . . . . . . . . . . A . 8 ORN HE1 . . . . . . . . . c30643_6pv2 1 . 7 . 3254 . 1 1 8 ORN HG2 H -1.508 -12.943 1.039 . . . 1.0 . . . . . . . . . . . . A . 8 ORN HG2 . . . . . . . . . c30643_6pv2 1 . 7 . 3255 . 1 1 8 ORN HG3 H -2.315 -13.824 -0.260 . . . 1.0 . . . . . . . . . . . . A . 8 ORN HG3 . . . . . . . . . c30643_6pv2 1 . 7 . 3256 . 1 1 8 ORN N N -1.782 -13.259 -2.999 . . . 1.0 . . . . . . . . . . . . A . 8 ORN N . . . . . . . . . c30643_6pv2 1 . 7 . 3257 . 1 1 8 ORN NE N -3.201 -10.783 0.975 . . . 1.0 . . . . . . . . . . . . A . 8 ORN NE . . . . . . . . . c30643_6pv2 1 . 7 . 3258 . 1 1 8 ORN O O -0.320 -10.972 -3.700 . . . 1.0 . . . . . . . . . . . . A . 8 ORN O . . . . . . . . . c30643_6pv2 1 . 7 . 3259 . 1 1 9 CYS C C -0.269 -8.011 -2.922 . . . 1.0 . . . . . . . . . . . . A . 9 CYS C . . . . . . . . . c30643_6pv2 1 . 7 . 3260 . 1 1 9 CYS CA C -1.535 -8.474 -3.638 . . . 1.0 . . . . . . . . . . . . A . 9 CYS CA . . . . . . . . . c30643_6pv2 1 . 7 . 3261 . 1 1 9 CYS CB C -2.609 -7.388 -3.584 . . . 1.0 . . . . . . . . . . . . A . 9 CYS CB . . . . . . . . . c30643_6pv2 1 . 7 . 3262 . 1 1 9 CYS H H -2.894 -9.660 -2.541 . . . 1.0 . . . . . . . . . . . . A . 9 CYS H . . . . . . . . . c30643_6pv2 1 . 7 . 3263 . 1 1 9 CYS HA H -1.301 -8.694 -4.668 . . . 1.0 . . . . . . . . . . . . A . 9 CYS HA . . . . . . . . . c30643_6pv2 1 . 7 . 3264 . 1 1 9 CYS HB2 H -3.427 -7.668 -4.229 . . . 1.0 . . . . . . . . . . . . A . 9 CYS HB2 . . . . . . . . . c30643_6pv2 1 . 7 . 3265 . 1 1 9 CYS HB3 H -2.970 -7.307 -2.572 . . . 1.0 . . . . . . . . . . . . A . 9 CYS HB3 . . . . . . . . . c30643_6pv2 1 . 7 . 3266 . 1 1 9 CYS N N -2.033 -9.689 -3.016 . . . 1.0 . . . . . . . . . . . . A . 9 CYS N . . . . . . . . . c30643_6pv2 1 . 7 . 3267 . 1 1 9 CYS O O -0.313 -7.670 -1.739 . . . 1.0 . . . . . . . . . . . . A . 9 CYS O . . . . . . . . . c30643_6pv2 1 . 7 . 3268 . 1 1 9 CYS SG S -2.046 -5.752 -4.095 . . . 1.0 . . . . . . . . . . . . A . 9 CYS SG . . . . . . . . . c30643_6pv2 1 . 7 . 3269 . 1 1 10 GLY C C 2.856 -6.572 -3.745 . . . 1.0 . . . . . . . . . . . . A . 10 GLY C . . . . . . . . . c30643_6pv2 1 . 7 . 3270 . 1 1 10 GLY CA C 2.121 -7.678 -3.023 . . . 1.0 . . . . . . . . . . . . A . 10 GLY CA . . . . . . . . . c30643_6pv2 1 . 7 . 3271 . 1 1 10 GLY H H 0.819 -8.249 -4.586 . . . 1.0 . . . . . . . . . . . . A . 10 GLY H . . . . . . . . . c30643_6pv2 1 . 7 . 3272 . 1 1 10 GLY HA2 H 1.945 -7.370 -2.004 . . . 1.0 . . . . . . . . . . . . A . 10 GLY HA2 . . . . . . . . . c30643_6pv2 1 . 7 . 3273 . 1 1 10 GLY HA3 H 2.743 -8.559 -3.015 . . . 1.0 . . . . . . . . . . . . A . 10 GLY HA3 . . . . . . . . . c30643_6pv2 1 . 7 . 3274 . 1 1 10 GLY N N 0.853 -8.014 -3.634 . . . 1.0 . . . . . . . . . . . . A . 10 GLY N . . . . . . . . . c30643_6pv2 1 . 7 . 3275 . 1 1 10 GLY O O 4.051 -6.679 -4.012 . . . 1.0 . . . . . . . . . . . . A . 10 GLY O . . . . . . . . . c30643_6pv2 1 . 7 . 3276 . 1 1 11 LYS C C 3.609 -3.600 -3.713 . . . 1.0 . . . . . . . . . . . . A . 11 LYS C . . . . . . . . . c30643_6pv2 1 . 7 . 3277 . 1 1 11 LYS CA C 2.735 -4.352 -4.716 . . . 1.0 . . . . . . . . . . . . A . 11 LYS CA . . . . . . . . . c30643_6pv2 1 . 7 . 3278 . 1 1 11 LYS CB C 1.631 -3.449 -5.270 . . . 1.0 . . . . . . . . . . . . A . 11 LYS CB . . . . . . . . . c30643_6pv2 1 . 7 . 3279 . 1 1 11 LYS CD C 0.981 -1.607 -6.841 . . . 1.0 . . . . . . . . . . . . A . 11 LYS CD . . . . . . . . . c30643_6pv2 1 . 7 . 3280 . 1 1 11 LYS CE C 1.454 -0.411 -7.649 . . . 1.0 . . . . . . . . . . . . A . 11 LYS CE . . . . . . . . . c30643_6pv2 1 . 7 . 3281 . 1 1 11 LYS CG C 2.132 -2.300 -6.128 . . . 1.0 . . . . . . . . . . . . A . 11 LYS CG . . . . . . . . . c30643_6pv2 1 . 7 . 3282 . 1 1 11 LYS H H 1.181 -5.509 -3.876 . . . 1.0 . . . . . . . . . . . . A . 11 LYS H . . . . . . . . . c30643_6pv2 1 . 7 . 3283 . 1 1 11 LYS HA H 3.353 -4.700 -5.529 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HA . . . . . . . . . c30643_6pv2 1 . 7 . 3284 . 1 1 11 LYS HB2 H 0.961 -4.048 -5.869 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HB2 . . . . . . . . . c30643_6pv2 1 . 7 . 3285 . 1 1 11 LYS HB3 H 1.077 -3.032 -4.441 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HB3 . . . . . . . . . c30643_6pv2 1 . 7 . 3286 . 1 1 11 LYS HD2 H 0.512 -2.313 -7.507 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HD2 . . . . . . . . . c30643_6pv2 1 . 7 . 3287 . 1 1 11 LYS HD3 H 0.264 -1.274 -6.107 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HD3 . . . . . . . . . c30643_6pv2 1 . 7 . 3288 . 1 1 11 LYS HE2 H 1.941 0.288 -6.986 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HE2 . . . . . . . . . c30643_6pv2 1 . 7 . 3289 . 1 1 11 LYS HE3 H 2.160 -0.752 -8.394 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HE3 . . . . . . . . . c30643_6pv2 1 . 7 . 3290 . 1 1 11 LYS HG2 H 2.633 -1.584 -5.496 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HG2 . . . . . . . . . c30643_6pv2 1 . 7 . 3291 . 1 1 11 LYS HG3 H 2.821 -2.684 -6.864 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HG3 . . . . . . . . . c30643_6pv2 1 . 7 . 3292 . 1 1 11 LYS HZ1 H -0.101 -0.349 -9.046 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HZ1 . . . . . . . . . c30643_6pv2 1 . 7 . 3293 . 1 1 11 LYS HZ2 H 0.657 1.142 -8.798 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HZ2 . . . . . . . . . c30643_6pv2 1 . 7 . 3294 . 1 1 11 LYS HZ3 H -0.408 0.534 -7.635 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HZ3 . . . . . . . . . c30643_6pv2 1 . 7 . 3295 . 1 1 11 LYS N N 2.138 -5.512 -4.072 . . . 1.0 . . . . . . . . . . . . A . 11 LYS N . . . . . . . . . c30643_6pv2 1 . 7 . 3296 . 1 1 11 LYS NZ N 0.323 0.275 -8.329 . . . 1.0 . . . . . . . . . . . . A . 11 LYS NZ . . . . . . . . . c30643_6pv2 1 . 7 . 3297 . 1 1 11 LYS O O 3.166 -3.300 -2.606 . . . 1.0 . . . . . . . . . . . . A . 11 LYS O . . . . . . . . . c30643_6pv2 1 . 7 . 3298 . 1 1 12 ARG C C 6.021 -1.236 -3.486 . . . 1.0 . . . . . . . . . . . . A . 12 ARG C . . . . . . . . . c30643_6pv2 1 . 7 . 3299 . 1 1 12 ARG CA C 5.796 -2.706 -3.164 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CA . . . . . . . . . c30643_6pv2 1 . 7 . 3300 . 1 1 12 ARG CB C 7.130 -3.461 -3.162 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CB . . . . . . . . . c30643_6pv2 1 . 7 . 3301 . 1 1 12 ARG CD C 9.242 -4.049 -4.391 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CD . . . . . . . . . c30643_6pv2 1 . 7 . 3302 . 1 1 12 ARG CG C 7.872 -3.400 -4.486 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CG . . . . . . . . . c30643_6pv2 1 . 7 . 3303 . 1 1 12 ARG CZ C 11.105 -4.592 -5.909 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CZ . . . . . . . . . c30643_6pv2 1 . 7 . 3304 . 1 1 12 ARG H H 5.131 -3.526 -5.005 . . . 1.0 . . . . . . . . . . . . A . 12 ARG H . . . . . . . . . c30643_6pv2 1 . 7 . 3305 . 1 1 12 ARG HA H 5.365 -2.766 -2.180 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HA . . . . . . . . . c30643_6pv2 1 . 7 . 3306 . 1 1 12 ARG HB2 H 7.767 -3.040 -2.399 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HB2 . . . . . . . . . c30643_6pv2 1 . 7 . 3307 . 1 1 12 ARG HB3 H 6.942 -4.498 -2.929 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HB3 . . . . . . . . . c30643_6pv2 1 . 7 . 3308 . 1 1 12 ARG HD2 H 9.804 -3.569 -3.603 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HD2 . . . . . . . . . c30643_6pv2 1 . 7 . 3309 . 1 1 12 ARG HD3 H 9.116 -5.096 -4.158 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HD3 . . . . . . . . . c30643_6pv2 1 . 7 . 3310 . 1 1 12 ARG HE H 9.623 -3.316 -6.320 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HE . . . . . . . . . c30643_6pv2 1 . 7 . 3311 . 1 1 12 ARG HG2 H 7.292 -3.918 -5.235 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HG2 . . . . . . . . . c30643_6pv2 1 . 7 . 3312 . 1 1 12 ARG HG3 H 7.990 -2.366 -4.772 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HG3 . . . . . . . . . c30643_6pv2 1 . 7 . 3313 . 1 1 12 ARG HH11 H 11.178 -5.550 -4.123 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH11 . . . . . . . . . c30643_6pv2 1 . 7 . 3314 . 1 1 12 ARG HH12 H 12.471 -5.920 -5.220 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH12 . . . . . . . . . c30643_6pv2 1 . 7 . 3315 . 1 1 12 ARG HH21 H 12.555 -4.923 -7.285 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH21 . . . . . . . . . c30643_6pv2 1 . 7 . 3316 . 1 1 12 ARG HH22 H 11.321 -3.794 -7.758 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH22 . . . . . . . . . c30643_6pv2 1 . 7 . 3317 . 1 1 12 ARG N N 4.849 -3.323 -4.088 . . . 1.0 . . . . . . . . . . . . A . 12 ARG N . . . . . . . . . c30643_6pv2 1 . 7 . 3318 . 1 1 12 ARG NE N 9.984 -3.929 -5.641 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NE . . . . . . . . . c30643_6pv2 1 . 7 . 3319 . 1 1 12 ARG NH1 N 11.627 -5.420 -5.012 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NH1 . . . . . . . . . c30643_6pv2 1 . 7 . 3320 . 1 1 12 ARG NH2 N 11.708 -4.423 -7.079 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NH2 . . . . . . . . . c30643_6pv2 1 . 7 . 3321 . 1 1 12 ARG O O 5.975 -0.824 -4.646 . . . 1.0 . . . . . . . . . . . . A . 12 ARG O . . . . . . . . . c30643_6pv2 1 . 7 . 3322 . 1 1 13 PHE C C 7.647 1.471 -1.826 . . . 1.0 . . . . . . . . . . . . A . 13 PHE C . . . . . . . . . c30643_6pv2 1 . 7 . 3323 . 1 1 13 PHE CA C 6.414 0.986 -2.574 . . . 1.0 . . . . . . . . . . . . A . 13 PHE CA . . . . . . . . . c30643_6pv2 1 . 7 . 3324 . 1 1 13 PHE CB C 5.176 1.683 -2.018 . . . 1.0 . . . . . . . . . . . . A . 13 PHE CB . . . . . . . . . c30643_6pv2 1 . 7 . 3325 . 1 1 13 PHE CD1 C 3.439 1.713 -3.813 . . . 1.0 . . . . . . . . . . . . A . 13 PHE CD1 . . . . . . . . . c30643_6pv2 1 . 7 . 3326 . 1 1 13 PHE CD2 C 3.179 0.183 -2.005 . . . 1.0 . . . . . . . . . . . . A . 13 PHE CD2 . . . . . . . . . c30643_6pv2 1 . 7 . 3327 . 1 1 13 PHE CE1 C 2.272 1.249 -4.375 . . . 1.0 . . . . . . . . . . . . A . 13 PHE CE1 . . . . . . . . . c30643_6pv2 1 . 7 . 3328 . 1 1 13 PHE CE2 C 2.012 -0.285 -2.562 . . . 1.0 . . . . . . . . . . . . A . 13 PHE CE2 . . . . . . . . . c30643_6pv2 1 . 7 . 3329 . 1 1 13 PHE CG C 3.904 1.186 -2.623 . . . 1.0 . . . . . . . . . . . . A . 13 PHE CG . . . . . . . . . c30643_6pv2 1 . 7 . 3330 . 1 1 13 PHE CZ C 1.558 0.248 -3.747 . . . 1.0 . . . . . . . . . . . . A . 13 PHE CZ . . . . . . . . . c30643_6pv2 1 . 7 . 3331 . 1 1 13 PHE H H 6.325 -0.855 -1.549 . . . 1.0 . . . . . . . . . . . . A . 13 PHE H . . . . . . . . . c30643_6pv2 1 . 7 . 3332 . 1 1 13 PHE HA H 6.513 1.223 -3.621 . . . 1.0 . . . . . . . . . . . . A . 13 PHE HA . . . . . . . . . c30643_6pv2 1 . 7 . 3333 . 1 1 13 PHE HB2 H 5.122 1.518 -0.953 . . . 1.0 . . . . . . . . . . . . A . 13 PHE HB2 . . . . . . . . . c30643_6pv2 1 . 7 . 3334 . 1 1 13 PHE HB3 H 5.248 2.741 -2.214 . . . 1.0 . . . . . . . . . . . . A . 13 PHE HB3 . . . . . . . . . c30643_6pv2 1 . 7 . 3335 . 1 1 13 PHE HD1 H 3.999 2.493 -4.302 . . . 1.0 . . . . . . . . . . . . A . 13 PHE HD1 . . . . . . . . . c30643_6pv2 1 . 7 . 3336 . 1 1 13 PHE HD2 H 3.540 -0.236 -1.077 . . . 1.0 . . . . . . . . . . . . A . 13 PHE HD2 . . . . . . . . . c30643_6pv2 1 . 7 . 3337 . 1 1 13 PHE HE1 H 1.918 1.666 -5.303 . . . 1.0 . . . . . . . . . . . . A . 13 PHE HE1 . . . . . . . . . c30643_6pv2 1 . 7 . 3338 . 1 1 13 PHE HE2 H 1.454 -1.069 -2.072 . . . 1.0 . . . . . . . . . . . . A . 13 PHE HE2 . . . . . . . . . c30643_6pv2 1 . 7 . 3339 . 1 1 13 PHE HZ H 0.642 -0.116 -4.183 . . . 1.0 . . . . . . . . . . . . A . 13 PHE HZ . . . . . . . . . c30643_6pv2 1 . 7 . 3340 . 1 1 13 PHE N N 6.261 -0.452 -2.444 . . . 1.0 . . . . . . . . . . . . A . 13 PHE N . . . . . . . . . c30643_6pv2 1 . 7 . 3341 . 1 1 13 PHE O O 8.126 0.812 -0.901 . . . 1.0 . . . . . . . . . . . . A . 13 PHE O . . . . . . . . . c30643_6pv2 1 . 7 . 3342 . 1 1 14 THR C C 8.858 4.300 -0.570 . . . 1.0 . . . . . . . . . . . . A . 14 THR C . . . . . . . . . c30643_6pv2 1 . 7 . 3343 . 1 1 14 THR CA C 9.299 3.228 -1.566 . . . 1.0 . . . . . . . . . . . . A . 14 THR CA . . . . . . . . . c30643_6pv2 1 . 7 . 3344 . 1 1 14 THR CB C 10.259 3.846 -2.597 . . . 1.0 . . . . . . . . . . . . A . 14 THR CB . . . . . . . . . c30643_6pv2 1 . 7 . 3345 . 1 1 14 THR CG2 C 11.174 2.790 -3.202 . . . 1.0 . . . . . . . . . . . . A . 14 THR CG2 . . . . . . . . . c30643_6pv2 1 . 7 . 3346 . 1 1 14 THR H H 7.759 3.081 -3.001 . . . 1.0 . . . . . . . . . . . . A . 14 THR H . . . . . . . . . c30643_6pv2 1 . 7 . 3347 . 1 1 14 THR HA H 9.826 2.451 -1.033 . . . 1.0 . . . . . . . . . . . . A . 14 THR HA . . . . . . . . . c30643_6pv2 1 . 7 . 3348 . 1 1 14 THR HB H 10.866 4.588 -2.099 . . . 1.0 . . . . . . . . . . . . A . 14 THR HB . . . . . . . . . c30643_6pv2 1 . 7 . 3349 . 1 1 14 THR HG1 H 9.296 3.836 -4.320 . . . 1.0 . . . . . . . . . . . . A . 14 THR HG1 . . . . . . . . . c30643_6pv2 1 . 7 . 3350 . 1 1 14 THR HG21 H 11.775 2.343 -2.423 . . . 1.0 . . . . . . . . . . . . A . 14 THR HG21 . . . . . . . . . c30643_6pv2 1 . 7 . 3351 . 1 1 14 THR HG22 H 11.822 3.252 -3.934 . . . 1.0 . . . . . . . . . . . . A . 14 THR HG22 . . . . . . . . . c30643_6pv2 1 . 7 . 3352 . 1 1 14 THR HG23 H 10.578 2.028 -3.678 . . . 1.0 . . . . . . . . . . . . A . 14 THR HG23 . . . . . . . . . c30643_6pv2 1 . 7 . 3353 . 1 1 14 THR N N 8.156 2.625 -2.227 . . . 1.0 . . . . . . . . . . . . A . 14 THR N . . . . . . . . . c30643_6pv2 1 . 7 . 3354 . 1 1 14 THR O O 9.684 4.913 0.109 . . . 1.0 . . . . . . . . . . . . A . 14 THR O . . . . . . . . . c30643_6pv2 1 . 7 . 3355 . 1 1 14 THR OG1 O 9.503 4.483 -3.634 . . . 1.0 . . . . . . . . . . . . A . 14 THR OG1 . . . . . . . . . c30643_6pv2 1 . 7 . 3356 . 1 1 15 ARG C C 5.788 4.946 1.162 . . . 1.0 . . . . . . . . . . . . A . 15 ARG C . . . . . . . . . c30643_6pv2 1 . 7 . 3357 . 1 1 15 ARG CA C 7.006 5.511 0.439 . . . 1.0 . . . . . . . . . . . . A . 15 ARG CA . . . . . . . . . c30643_6pv2 1 . 7 . 3358 . 1 1 15 ARG CB C 6.599 6.797 -0.293 . . . 1.0 . . . . . . . . . . . . A . 15 ARG CB . . . . . . . . . c30643_6pv2 1 . 7 . 3359 . 1 1 15 ARG CD C 7.359 8.847 -1.528 . . . 1.0 . . . . . . . . . . . . A . 15 ARG CD . . . . . . . . . c30643_6pv2 1 . 7 . 3360 . 1 1 15 ARG CG C 7.690 7.409 -1.153 . . . 1.0 . . . . . . . . . . . . A . 15 ARG CG . . . . . . . . . c30643_6pv2 1 . 7 . 3361 . 1 1 15 ARG CZ C 5.330 10.120 -2.131 . . . 1.0 . . . . . . . . . . . . A . 15 ARG CZ . . . . . . . . . c30643_6pv2 1 . 7 . 3362 . 1 1 15 ARG H H 6.938 4.004 -1.048 . . . 1.0 . . . . . . . . . . . . A . 15 ARG H . . . . . . . . . c30643_6pv2 1 . 7 . 3363 . 1 1 15 ARG HA H 7.770 5.741 1.167 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HA . . . . . . . . . c30643_6pv2 1 . 7 . 3364 . 1 1 15 ARG HB2 H 5.758 6.578 -0.930 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HB2 . . . . . . . . . c30643_6pv2 1 . 7 . 3365 . 1 1 15 ARG HB3 H 6.297 7.531 0.439 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HB3 . . . . . . . . . c30643_6pv2 1 . 7 . 3366 . 1 1 15 ARG HD2 H 7.403 9.457 -0.639 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HD2 . . . . . . . . . c30643_6pv2 1 . 7 . 3367 . 1 1 15 ARG HD3 H 8.094 9.196 -2.235 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HD3 . . . . . . . . . c30643_6pv2 1 . 7 . 3368 . 1 1 15 ARG HE H 5.637 8.185 -2.545 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HE . . . . . . . . . c30643_6pv2 1 . 7 . 3369 . 1 1 15 ARG HG2 H 8.620 7.392 -0.606 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HG2 . . . . . . . . . c30643_6pv2 1 . 7 . 3370 . 1 1 15 ARG HG3 H 7.791 6.824 -2.057 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HG3 . . . . . . . . . c30643_6pv2 1 . 7 . 3371 . 1 1 15 ARG HH11 H 6.772 11.218 -1.209 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HH11 . . . . . . . . . c30643_6pv2 1 . 7 . 3372 . 1 1 15 ARG HH12 H 5.323 12.085 -1.619 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HH12 . . . . . . . . . c30643_6pv2 1 . 7 . 3373 . 1 1 15 ARG HH21 H 3.710 9.326 -3.078 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HH21 . . . . . . . . . c30643_6pv2 1 . 7 . 3374 . 1 1 15 ARG HH22 H 3.598 11.016 -2.673 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HH22 . . . . . . . . . c30643_6pv2 1 . 7 . 3375 . 1 1 15 ARG N N 7.550 4.524 -0.485 . . . 1.0 . . . . . . . . . . . . A . 15 ARG N . . . . . . . . . c30643_6pv2 1 . 7 . 3376 . 1 1 15 ARG NE N 6.029 8.982 -2.127 . . . 1.0 . . . . . . . . . . . . A . 15 ARG NE . . . . . . . . . c30643_6pv2 1 . 7 . 3377 . 1 1 15 ARG NH1 N 5.850 11.229 -1.610 . . . 1.0 . . . . . . . . . . . . A . 15 ARG NH1 . . . . . . . . . c30643_6pv2 1 . 7 . 3378 . 1 1 15 ARG NH2 N 4.117 10.158 -2.667 . . . 1.0 . . . . . . . . . . . . A . 15 ARG NH2 . . . . . . . . . c30643_6pv2 1 . 7 . 3379 . 1 1 15 ARG O O 4.944 4.273 0.558 . . . 1.0 . . . . . . . . . . . . A . 15 ARG O . . . . . . . . . c30643_6pv2 1 . 7 . 3380 . 1 1 16 SER C C 3.293 5.503 2.750 . . . 1.0 . . . . . . . . . . . . A . 16 SER C . . . . . . . . . c30643_6pv2 1 . 7 . 3381 . 1 1 16 SER CA C 4.559 4.831 3.267 . . . 1.0 . . . . . . . . . . . . A . 16 SER CA . . . . . . . . . c30643_6pv2 1 . 7 . 3382 . 1 1 16 SER CB C 4.787 5.197 4.742 . . . 1.0 . . . . . . . . . . . . A . 16 SER CB . . . . . . . . . c30643_6pv2 1 . 7 . 3383 . 1 1 16 SER H H 6.433 5.737 2.884 . . . 1.0 . . . . . . . . . . . . A . 16 SER H . . . . . . . . . c30643_6pv2 1 . 7 . 3384 . 1 1 16 SER HA H 4.449 3.760 3.180 . . . 1.0 . . . . . . . . . . . . A . 16 SER HA . . . . . . . . . c30643_6pv2 1 . 7 . 3385 . 1 1 16 SER HB2 H 5.651 4.666 5.111 . . . 1.0 . . . . . . . . . . . . A . 16 SER HB2 . . . . . . . . . c30643_6pv2 1 . 7 . 3386 . 1 1 16 SER HB3 H 4.955 6.260 4.826 . . . 1.0 . . . . . . . . . . . . A . 16 SER HB3 . . . . . . . . . c30643_6pv2 1 . 7 . 3387 . 1 1 16 SER HG H 3.421 3.931 5.361 . . . 1.0 . . . . . . . . . . . . A . 16 SER HG . . . . . . . . . c30643_6pv2 1 . 7 . 3388 . 1 1 16 SER N N 5.703 5.232 2.457 . . . 1.0 . . . . . . . . . . . . A . 16 SER N . . . . . . . . . c30643_6pv2 1 . 7 . 3389 . 1 1 16 SER O O 2.206 4.934 2.819 . . . 1.0 . . . . . . . . . . . . A . 16 SER O . . . . . . . . . c30643_6pv2 1 . 7 . 3390 . 1 1 16 SER OG O 3.667 4.849 5.539 . . . 1.0 . . . . . . . . . . . . A . 16 SER OG . . . . . . . . . c30643_6pv2 1 . 7 . 3391 . 1 1 17 ASP C C 1.730 6.658 0.498 . . . 1.0 . . . . . . . . . . . . A . 17 ASP C . . . . . . . . . c30643_6pv2 1 . 7 . 3392 . 1 1 17 ASP CA C 2.342 7.455 1.636 . . . 1.0 . . . . . . . . . . . . A . 17 ASP CA . . . . . . . . . c30643_6pv2 1 . 7 . 3393 . 1 1 17 ASP CB C 2.819 8.811 1.110 . . . 1.0 . . . . . . . . . . . . A . 17 ASP CB . . . . . . . . . c30643_6pv2 1 . 7 . 3394 . 1 1 17 ASP CG C 3.459 9.664 2.183 . . . 1.0 . . . . . . . . . . . . A . 17 ASP CG . . . . . . . . . c30643_6pv2 1 . 7 . 3395 . 1 1 17 ASP H H 4.336 7.139 2.263 . . . 1.0 . . . . . . . . . . . . A . 17 ASP H . . . . . . . . . c30643_6pv2 1 . 7 . 3396 . 1 1 17 ASP HA H 1.593 7.610 2.397 . . . 1.0 . . . . . . . . . . . . A . 17 ASP HA . . . . . . . . . c30643_6pv2 1 . 7 . 3397 . 1 1 17 ASP HB2 H 3.541 8.652 0.327 . . . 1.0 . . . . . . . . . . . . A . 17 ASP HB2 . . . . . . . . . c30643_6pv2 1 . 7 . 3398 . 1 1 17 ASP HB3 H 1.975 9.347 0.708 . . . 1.0 . . . . . . . . . . . . A . 17 ASP HB3 . . . . . . . . . c30643_6pv2 1 . 7 . 3399 . 1 1 17 ASP N N 3.450 6.719 2.230 . . . 1.0 . . . . . . . . . . . . A . 17 ASP N . . . . . . . . . c30643_6pv2 1 . 7 . 3400 . 1 1 17 ASP O O 0.510 6.540 0.390 . . . 1.0 . . . . . . . . . . . . A . 17 ASP O . . . . . . . . . c30643_6pv2 1 . 7 . 3401 . 1 1 17 ASP OD1 O 2.769 10.545 2.740 . . . 1.0 . . . . . . . . . . . . A . 17 ASP OD1 . . . . . . . . . c30643_6pv2 1 . 7 . 3402 . 1 1 17 ASP OD2 O 4.654 9.459 2.477 . . . 1.0 . . . . . . . . . . . . A . 17 ASP OD2 . . . . . . . . . c30643_6pv2 1 . 7 . 3403 . 1 1 18 GLU C C 1.411 4.062 -1.012 . . . 1.0 . . . . . . . . . . . . A . 18 GLU C . . . . . . . . . c30643_6pv2 1 . 7 . 3404 . 1 1 18 GLU CA C 2.157 5.301 -1.471 . . . 1.0 . . . . . . . . . . . . A . 18 GLU CA . . . . . . . . . c30643_6pv2 1 . 7 . 3405 . 1 1 18 GLU CB C 3.352 4.900 -2.330 . . . 1.0 . . . . . . . . . . . . A . 18 GLU CB . . . . . . . . . c30643_6pv2 1 . 7 . 3406 . 1 1 18 GLU CD C 3.111 6.807 -3.958 . . . 1.0 . . . . . . . . . . . . A . 18 GLU CD . . . . . . . . . c30643_6pv2 1 . 7 . 3407 . 1 1 18 GLU CG C 4.033 6.068 -3.015 . . . 1.0 . . . . . . . . . . . . A . 18 GLU CG . . . . . . . . . c30643_6pv2 1 . 7 . 3408 . 1 1 18 GLU H H 3.549 6.174 -0.153 . . . 1.0 . . . . . . . . . . . . A . 18 GLU H . . . . . . . . . c30643_6pv2 1 . 7 . 3409 . 1 1 18 GLU HA H 1.492 5.913 -2.058 . . . 1.0 . . . . . . . . . . . . A . 18 GLU HA . . . . . . . . . c30643_6pv2 1 . 7 . 3410 . 1 1 18 GLU HB2 H 4.079 4.409 -1.702 . . . 1.0 . . . . . . . . . . . . A . 18 GLU HB2 . . . . . . . . . c30643_6pv2 1 . 7 . 3411 . 1 1 18 GLU HB3 H 3.019 4.210 -3.090 . . . 1.0 . . . . . . . . . . . . A . 18 GLU HB3 . . . . . . . . . c30643_6pv2 1 . 7 . 3412 . 1 1 18 GLU HG2 H 4.375 6.761 -2.261 . . . 1.0 . . . . . . . . . . . . A . 18 GLU HG2 . . . . . . . . . c30643_6pv2 1 . 7 . 3413 . 1 1 18 GLU HG3 H 4.877 5.695 -3.574 . . . 1.0 . . . . . . . . . . . . A . 18 GLU HG3 . . . . . . . . . c30643_6pv2 1 . 7 . 3414 . 1 1 18 GLU N N 2.593 6.084 -0.329 . . . 1.0 . . . . . . . . . . . . A . 18 GLU N . . . . . . . . . c30643_6pv2 1 . 7 . 3415 . 1 1 18 GLU O O 0.355 3.733 -1.545 . . . 1.0 . . . . . . . . . . . . A . 18 GLU O . . . . . . . . . c30643_6pv2 1 . 7 . 3416 . 1 1 18 GLU OE1 O 2.884 8.019 -3.758 . . . 1.0 . . . . . . . . . . . . A . 18 GLU OE1 . . . . . . . . . c30643_6pv2 1 . 7 . 3417 . 1 1 18 GLU OE2 O 2.598 6.172 -4.898 . . . 1.0 . . . . . . . . . . . . A . 18 GLU OE2 . . . . . . . . . c30643_6pv2 1 . 7 . 3418 . 1 1 19 LEU C C -0.025 2.506 1.149 . . . 1.0 . . . . . . . . . . . . A . 19 LEU C . . . . . . . . . c30643_6pv2 1 . 7 . 3419 . 1 1 19 LEU CA C 1.330 2.183 0.525 . . . 1.0 . . . . . . . . . . . . A . 19 LEU CA . . . . . . . . . c30643_6pv2 1 . 7 . 3420 . 1 1 19 LEU CB C 2.238 1.500 1.551 . . . 1.0 . . . . . . . . . . . . A . 19 LEU CB . . . . . . . . . c30643_6pv2 1 . 7 . 3421 . 1 1 19 LEU CD1 C 1.347 -0.818 1.129 . . . 1.0 . . . . . . . . . . . . A . 19 LEU CD1 . . . . . . . . . c30643_6pv2 1 . 7 . 3422 . 1 1 19 LEU CD2 C 2.612 -0.330 3.226 . . . 1.0 . . . . . . . . . . . . A . 19 LEU CD2 . . . . . . . . . c30643_6pv2 1 . 7 . 3423 . 1 1 19 LEU CG C 1.655 0.232 2.188 . . . 1.0 . . . . . . . . . . . . A . 19 LEU CG . . . . . . . . . c30643_6pv2 1 . 7 . 3424 . 1 1 19 LEU H H 2.801 3.704 0.387 . . . 1.0 . . . . . . . . . . . . A . 19 LEU H . . . . . . . . . c30643_6pv2 1 . 7 . 3425 . 1 1 19 LEU HA H 1.171 1.510 -0.303 . . . 1.0 . . . . . . . . . . . . A . 19 LEU HA . . . . . . . . . c30643_6pv2 1 . 7 . 3426 . 1 1 19 LEU HB2 H 3.169 1.243 1.063 . . . 1.0 . . . . . . . . . . . . A . 19 LEU HB2 . . . . . . . . . c30643_6pv2 1 . 7 . 3427 . 1 1 19 LEU HB3 H 2.449 2.205 2.339 . . . 1.0 . . . . . . . . . . . . A . 19 LEU HB3 . . . . . . . . . c30643_6pv2 1 . 7 . 3428 . 1 1 19 LEU HD11 H 2.250 -1.064 0.590 . . . 1.0 . . . . . . . . . . . . A . 19 LEU HD11 . . . . . . . . . c30643_6pv2 1 . 7 . 3429 . 1 1 19 LEU HD12 H 0.611 -0.429 0.439 . . . 1.0 . . . . . . . . . . . . A . 19 LEU HD12 . . . . . . . . . c30643_6pv2 1 . 7 . 3430 . 1 1 19 LEU HD13 H 0.959 -1.706 1.604 . . . 1.0 . . . . . . . . . . . . A . 19 LEU HD13 . . . . . . . . . c30643_6pv2 1 . 7 . 3431 . 1 1 19 LEU HD21 H 3.501 -0.695 2.735 . . . 1.0 . . . . . . . . . . . . A . 19 LEU HD21 . . . . . . . . . c30643_6pv2 1 . 7 . 3432 . 1 1 19 LEU HD22 H 2.133 -1.140 3.756 . . . 1.0 . . . . . . . . . . . . A . 19 LEU HD22 . . . . . . . . . c30643_6pv2 1 . 7 . 3433 . 1 1 19 LEU HD23 H 2.882 0.448 3.924 . . . 1.0 . . . . . . . . . . . . A . 19 LEU HD23 . . . . . . . . . c30643_6pv2 1 . 7 . 3434 . 1 1 19 LEU HG H 0.729 0.484 2.686 . . . 1.0 . . . . . . . . . . . . A . 19 LEU HG . . . . . . . . . c30643_6pv2 1 . 7 . 3435 . 1 1 19 LEU N N 1.956 3.387 -0.005 . . . 1.0 . . . . . . . . . . . . A . 19 LEU N . . . . . . . . . c30643_6pv2 1 . 7 . 3436 . 1 1 19 LEU O O -0.976 1.748 0.994 . . . 1.0 . . . . . . . . . . . . A . 19 LEU O . . . . . . . . . c30643_6pv2 1 . 7 . 3437 . 1 1 20 GLN C C -2.412 4.325 1.354 . . . 1.0 . . . . . . . . . . . . A . 20 GLN C . . . . . . . . . c30643_6pv2 1 . 7 . 3438 . 1 1 20 GLN CA C -1.370 4.074 2.441 . . . 1.0 . . . . . . . . . . . . A . 20 GLN CA . . . . . . . . . c30643_6pv2 1 . 7 . 3439 . 1 1 20 GLN CB C -1.168 5.346 3.271 . . . 1.0 . . . . . . . . . . . . A . 20 GLN CB . . . . . . . . . c30643_6pv2 1 . 7 . 3440 . 1 1 20 GLN CD C -2.272 7.221 4.582 . . . 1.0 . . . . . . . . . . . . A . 20 GLN CD . . . . . . . . . c30643_6pv2 1 . 7 . 3441 . 1 1 20 GLN CG C -2.465 5.917 3.831 . . . 1.0 . . . . . . . . . . . . A . 20 GLN CG . . . . . . . . . c30643_6pv2 1 . 7 . 3442 . 1 1 20 GLN H H 0.698 4.183 1.975 . . . 1.0 . . . . . . . . . . . . A . 20 GLN H . . . . . . . . . c30643_6pv2 1 . 7 . 3443 . 1 1 20 GLN HA H -1.721 3.285 3.086 . . . 1.0 . . . . . . . . . . . . A . 20 GLN HA . . . . . . . . . c30643_6pv2 1 . 7 . 3444 . 1 1 20 GLN HB2 H -0.512 5.122 4.097 . . . 1.0 . . . . . . . . . . . . A . 20 GLN HB2 . . . . . . . . . c30643_6pv2 1 . 7 . 3445 . 1 1 20 GLN HB3 H -0.705 6.100 2.650 . . . 1.0 . . . . . . . . . . . . A . 20 GLN HB3 . . . . . . . . . c30643_6pv2 1 . 7 . 3446 . 1 1 20 GLN HE21 H -0.739 7.714 3.421 . . . 1.0 . . . . . . . . . . . . A . 20 GLN HE21 . . . . . . . . . c30643_6pv2 1 . 7 . 3447 . 1 1 20 GLN HE22 H -1.145 8.856 4.653 . . . 1.0 . . . . . . . . . . . . A . 20 GLN HE22 . . . . . . . . . c30643_6pv2 1 . 7 . 3448 . 1 1 20 GLN HG2 H -3.146 6.093 3.012 . . . 1.0 . . . . . . . . . . . . A . 20 GLN HG2 . . . . . . . . . c30643_6pv2 1 . 7 . 3449 . 1 1 20 GLN HG3 H -2.897 5.191 4.505 . . . 1.0 . . . . . . . . . . . . A . 20 GLN HG3 . . . . . . . . . c30643_6pv2 1 . 7 . 3450 . 1 1 20 GLN N N -0.109 3.637 1.848 . . . 1.0 . . . . . . . . . . . . A . 20 GLN N . . . . . . . . . c30643_6pv2 1 . 7 . 3451 . 1 1 20 GLN NE2 N -1.288 8.007 4.177 . . . 1.0 . . . . . . . . . . . . A . 20 GLN NE2 . . . . . . . . . c30643_6pv2 1 . 7 . 3452 . 1 1 20 GLN O O -3.546 3.836 1.430 . . . 1.0 . . . . . . . . . . . . A . 20 GLN O . . . . . . . . . c30643_6pv2 1 . 7 . 3453 . 1 1 20 GLN OE1 O -3.013 7.525 5.517 . . . 1.0 . . . . . . . . . . . . A . 20 GLN OE1 . . . . . . . . . c30643_6pv2 1 . 7 . 3454 . 1 1 21 ARG C C -3.339 4.090 -1.454 . . . 1.0 . . . . . . . . . . . . A . 21 ARG C . . . . . . . . . c30643_6pv2 1 . 7 . 3455 . 1 1 21 ARG CA C -2.892 5.380 -0.786 . . . 1.0 . . . . . . . . . . . . A . 21 ARG CA . . . . . . . . . c30643_6pv2 1 . 7 . 3456 . 1 1 21 ARG CB C -2.182 6.274 -1.804 . . . 1.0 . . . . . . . . . . . . A . 21 ARG CB . . . . . . . . . c30643_6pv2 1 . 7 . 3457 . 1 1 21 ARG CD C -0.916 8.390 -2.245 . . . 1.0 . . . . . . . . . . . . A . 21 ARG CD . . . . . . . . . c30643_6pv2 1 . 7 . 3458 . 1 1 21 ARG CG C -1.808 7.646 -1.267 . . . 1.0 . . . . . . . . . . . . A . 21 ARG CG . . . . . . . . . c30643_6pv2 1 . 7 . 3459 . 1 1 21 ARG CZ C 0.340 10.510 -2.364 . . . 1.0 . . . . . . . . . . . . A . 21 ARG CZ . . . . . . . . . c30643_6pv2 1 . 7 . 3460 . 1 1 21 ARG H H -1.093 5.433 0.339 . . . 1.0 . . . . . . . . . . . . A . 21 ARG H . . . . . . . . . c30643_6pv2 1 . 7 . 3461 . 1 1 21 ARG HA H -3.759 5.896 -0.404 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HA . . . . . . . . . c30643_6pv2 1 . 7 . 3462 . 1 1 21 ARG HB2 H -1.280 5.781 -2.127 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HB2 . . . . . . . . . c30643_6pv2 1 . 7 . 3463 . 1 1 21 ARG HB3 H -2.833 6.410 -2.656 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HB3 . . . . . . . . . c30643_6pv2 1 . 7 . 3464 . 1 1 21 ARG HD2 H -0.043 7.788 -2.447 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HD2 . . . . . . . . . c30643_6pv2 1 . 7 . 3465 . 1 1 21 ARG HD3 H -1.462 8.548 -3.162 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HD3 . . . . . . . . . c30643_6pv2 1 . 7 . 3466 . 1 1 21 ARG HE H -0.831 9.951 -0.836 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HE . . . . . . . . . c30643_6pv2 1 . 7 . 3467 . 1 1 21 ARG HG2 H -2.709 8.219 -1.108 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HG2 . . . . . . . . . c30643_6pv2 1 . 7 . 3468 . 1 1 21 ARG HG3 H -1.283 7.528 -0.330 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HG3 . . . . . . . . . c30643_6pv2 1 . 7 . 3469 . 1 1 21 ARG HH11 H 0.584 9.291 -3.971 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HH11 . . . . . . . . . c30643_6pv2 1 . 7 . 3470 . 1 1 21 ARG HH12 H 1.448 10.795 -4.042 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HH12 . . . . . . . . . c30643_6pv2 1 . 7 . 3471 . 1 1 21 ARG HH21 H 0.315 11.926 -0.913 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HH21 . . . . . . . . . c30643_6pv2 1 . 7 . 3472 . 1 1 21 ARG HH22 H 1.301 12.296 -2.296 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HH22 . . . . . . . . . c30643_6pv2 1 . 7 . 3473 . 1 1 21 ARG N N -2.012 5.079 0.337 . . . 1.0 . . . . . . . . . . . . A . 21 ARG N . . . . . . . . . c30643_6pv2 1 . 7 . 3474 . 1 1 21 ARG NE N -0.485 9.685 -1.721 . . . 1.0 . . . . . . . . . . . . A . 21 ARG NE . . . . . . . . . c30643_6pv2 1 . 7 . 3475 . 1 1 21 ARG NH1 N 0.830 10.172 -3.552 . . . 1.0 . . . . . . . . . . . . A . 21 ARG NH1 . . . . . . . . . c30643_6pv2 1 . 7 . 3476 . 1 1 21 ARG NH2 N 0.678 11.670 -1.815 . . . 1.0 . . . . . . . . . . . . A . 21 ARG NH2 . . . . . . . . . c30643_6pv2 1 . 7 . 3477 . 1 1 21 ARG O O -4.518 3.902 -1.747 . . . 1.0 . . . . . . . . . . . . A . 21 ARG O . . . . . . . . . c30643_6pv2 1 . 7 . 3478 . 1 1 22 HIS C C -3.631 1.095 -1.404 . . . 1.0 . . . . . . . . . . . . A . 22 HIS C . . . . . . . . . c30643_6pv2 1 . 7 . 3479 . 1 1 22 HIS CA C -2.664 1.906 -2.267 . . . 1.0 . . . . . . . . . . . . A . 22 HIS CA . . . . . . . . . c30643_6pv2 1 . 7 . 3480 . 1 1 22 HIS CB C -1.357 1.139 -2.480 . . . 1.0 . . . . . . . . . . . . A . 22 HIS CB . . . . . . . . . c30643_6pv2 1 . 7 . 3481 . 1 1 22 HIS CD2 C -1.809 -1.367 -2.144 . . . 1.0 . . . . . . . . . . . . A . 22 HIS CD2 . . . . . . . . . c30643_6pv2 1 . 7 . 3482 . 1 1 22 HIS CE1 C -1.924 -2.010 -4.221 . . . 1.0 . . . . . . . . . . . . A . 22 HIS CE1 . . . . . . . . . c30643_6pv2 1 . 7 . 3483 . 1 1 22 HIS CG C -1.571 -0.275 -2.905 . . . 1.0 . . . . . . . . . . . . A . 22 HIS CG . . . . . . . . . c30643_6pv2 1 . 7 . 3484 . 1 1 22 HIS H H -1.462 3.409 -1.408 . . . 1.0 . . . . . . . . . . . . A . 22 HIS H . . . . . . . . . c30643_6pv2 1 . 7 . 3485 . 1 1 22 HIS HA H -3.123 2.085 -3.225 . . . 1.0 . . . . . . . . . . . . A . 22 HIS HA . . . . . . . . . c30643_6pv2 1 . 7 . 3486 . 1 1 22 HIS HB2 H -0.775 1.634 -3.241 . . . 1.0 . . . . . . . . . . . . A . 22 HIS HB2 . . . . . . . . . c30643_6pv2 1 . 7 . 3487 . 1 1 22 HIS HB3 H -0.799 1.128 -1.554 . . . 1.0 . . . . . . . . . . . . A . 22 HIS HB3 . . . . . . . . . c30643_6pv2 1 . 7 . 3488 . 1 1 22 HIS HD1 H -1.496 -0.139 -5.027 . . . 1.0 . . . . . . . . . . . . A . 22 HIS HD1 . . . . . . . . . c30643_6pv2 1 . 7 . 3489 . 1 1 22 HIS HD2 H -1.802 -1.412 -1.065 . . . 1.0 . . . . . . . . . . . . A . 22 HIS HD2 . . . . . . . . . c30643_6pv2 1 . 7 . 3490 . 1 1 22 HIS HE1 H -2.042 -2.627 -5.098 . . . 1.0 . . . . . . . . . . . . A . 22 HIS HE1 . . . . . . . . . c30643_6pv2 1 . 7 . 3491 . 1 1 22 HIS N N -2.387 3.194 -1.665 . . . 1.0 . . . . . . . . . . . . A . 22 HIS N . . . . . . . . . c30643_6pv2 1 . 7 . 3492 . 1 1 22 HIS ND1 N -1.637 -0.697 -4.229 . . . 1.0 . . . . . . . . . . . . A . 22 HIS ND1 . . . . . . . . . c30643_6pv2 1 . 7 . 3493 . 1 1 22 HIS NE2 N -2.032 -2.427 -2.984 . . . 1.0 . . . . . . . . . . . . A . 22 HIS NE2 . . . . . . . . . c30643_6pv2 1 . 7 . 3494 . 1 1 22 HIS O O -4.553 0.469 -1.920 . . . 1.0 . . . . . . . . . . . . A . 22 HIS O . . . . . . . . . c30643_6pv2 1 . 7 . 3495 . 1 1 23 LYS C C -5.739 0.828 0.667 . . . 1.0 . . . . . . . . . . . . A . 23 LYS C . . . . . . . . . c30643_6pv2 1 . 7 . 3496 . 1 1 23 LYS CA C -4.288 0.408 0.847 . . . 1.0 . . . . . . . . . . . . A . 23 LYS CA . . . . . . . . . c30643_6pv2 1 . 7 . 3497 . 1 1 23 LYS CB C -3.855 0.676 2.289 . . . 1.0 . . . . . . . . . . . . A . 23 LYS CB . . . . . . . . . c30643_6pv2 1 . 7 . 3498 . 1 1 23 LYS CD C -3.204 -1.560 3.282 . . . 1.0 . . . . . . . . . . . . A . 23 LYS CD . . . . . . . . . c30643_6pv2 1 . 7 . 3499 . 1 1 23 LYS CE C -4.177 -1.411 4.446 . . . 1.0 . . . . . . . . . . . . A . 23 LYS CE . . . . . . . . . c30643_6pv2 1 . 7 . 3500 . 1 1 23 LYS CG C -2.713 -0.204 2.780 . . . 1.0 . . . . . . . . . . . . A . 23 LYS CG . . . . . . . . . c30643_6pv2 1 . 7 . 3501 . 1 1 23 LYS H H -2.636 1.601 0.257 . . . 1.0 . . . . . . . . . . . . A . 23 LYS H . . . . . . . . . c30643_6pv2 1 . 7 . 3502 . 1 1 23 LYS HA H -4.206 -0.648 0.646 . . . 1.0 . . . . . . . . . . . . A . 23 LYS HA . . . . . . . . . c30643_6pv2 1 . 7 . 3503 . 1 1 23 LYS HB2 H -3.540 1.706 2.366 . . . 1.0 . . . . . . . . . . . . A . 23 LYS HB2 . . . . . . . . . c30643_6pv2 1 . 7 . 3504 . 1 1 23 LYS HB3 H -4.703 0.521 2.936 . . . 1.0 . . . . . . . . . . . . A . 23 LYS HB3 . . . . . . . . . c30643_6pv2 1 . 7 . 3505 . 1 1 23 LYS HD2 H -3.700 -2.076 2.476 . . . 1.0 . . . . . . . . . . . . A . 23 LYS HD2 . . . . . . . . . c30643_6pv2 1 . 7 . 3506 . 1 1 23 LYS HD3 H -2.353 -2.138 3.610 . . . 1.0 . . . . . . . . . . . . A . 23 LYS HD3 . . . . . . . . . c30643_6pv2 1 . 7 . 3507 . 1 1 23 LYS HE2 H -3.757 -0.724 5.162 . . . 1.0 . . . . . . . . . . . . A . 23 LYS HE2 . . . . . . . . . c30643_6pv2 1 . 7 . 3508 . 1 1 23 LYS HE3 H -5.108 -1.011 4.070 . . . 1.0 . . . . . . . . . . . . A . 23 LYS HE3 . . . . . . . . . c30643_6pv2 1 . 7 . 3509 . 1 1 23 LYS HG2 H -2.024 -0.366 1.965 . . . 1.0 . . . . . . . . . . . . A . 23 LYS HG2 . . . . . . . . . c30643_6pv2 1 . 7 . 3510 . 1 1 23 LYS HG3 H -2.204 0.304 3.585 . . . 1.0 . . . . . . . . . . . . A . 23 LYS HG3 . . . . . . . . . c30643_6pv2 1 . 7 . 3511 . 1 1 23 LYS HZ1 H -3.573 -3.085 5.538 . . . 1.0 . . . . . . . . . . . . A . 23 LYS HZ1 . . . . . . . . . c30643_6pv2 1 . 7 . 3512 . 1 1 23 LYS HZ2 H -4.832 -3.396 4.455 . . . 1.0 . . . . . . . . . . . . A . 23 LYS HZ2 . . . . . . . . . c30643_6pv2 1 . 7 . 3513 . 1 1 23 LYS HZ3 H -5.144 -2.565 5.894 . . . 1.0 . . . . . . . . . . . . A . 23 LYS HZ3 . . . . . . . . . c30643_6pv2 1 . 7 . 3514 . 1 1 23 LYS N N -3.415 1.109 -0.093 . . . 1.0 . . . . . . . . . . . . A . 23 LYS N . . . . . . . . . c30643_6pv2 1 . 7 . 3515 . 1 1 23 LYS NZ N -4.451 -2.705 5.128 . . . 1.0 . . . . . . . . . . . . A . 23 LYS NZ . . . . . . . . . c30643_6pv2 1 . 7 . 3516 . 1 1 23 LYS O O -6.655 0.035 0.904 . . . 1.0 . . . . . . . . . . . . A . 23 LYS O . . . . . . . . . c30643_6pv2 1 . 7 . 3517 . 1 1 24 ARG C C -8.032 1.780 -1.059 . . . 1.0 . . . . . . . . . . . . A . 24 ARG C . . . . . . . . . c30643_6pv2 1 . 7 . 3518 . 1 1 24 ARG CA C -7.292 2.583 0.007 . . . 1.0 . . . . . . . . . . . . A . 24 ARG CA . . . . . . . . . c30643_6pv2 1 . 7 . 3519 . 1 1 24 ARG CB C -7.254 4.055 -0.398 . . . 1.0 . . . . . . . . . . . . A . 24 ARG CB . . . . . . . . . c30643_6pv2 1 . 7 . 3520 . 1 1 24 ARG CD C -6.818 6.435 0.248 . . . 1.0 . . . . . . . . . . . . A . 24 ARG CD . . . . . . . . . c30643_6pv2 1 . 7 . 3521 . 1 1 24 ARG CG C -6.782 4.986 0.703 . . . 1.0 . . . . . . . . . . . . A . 24 ARG CG . . . . . . . . . c30643_6pv2 1 . 7 . 3522 . 1 1 24 ARG CZ C -6.266 8.664 1.140 . . . 1.0 . . . . . . . . . . . . A . 24 ARG CZ . . . . . . . . . c30643_6pv2 1 . 7 . 3523 . 1 1 24 ARG H H -5.169 2.653 0.059 . . . 1.0 . . . . . . . . . . . . A . 24 ARG H . . . . . . . . . c30643_6pv2 1 . 7 . 3524 . 1 1 24 ARG HA H -7.831 2.495 0.938 . . . 1.0 . . . . . . . . . . . . A . 24 ARG HA . . . . . . . . . c30643_6pv2 1 . 7 . 3525 . 1 1 24 ARG HB2 H -6.589 4.166 -1.241 . . . 1.0 . . . . . . . . . . . . A . 24 ARG HB2 . . . . . . . . . c30643_6pv2 1 . 7 . 3526 . 1 1 24 ARG HB3 H -8.248 4.358 -0.694 . . . 1.0 . . . . . . . . . . . . A . 24 ARG HB3 . . . . . . . . . c30643_6pv2 1 . 7 . 3527 . 1 1 24 ARG HD2 H -6.164 6.551 -0.602 . . . 1.0 . . . . . . . . . . . . A . 24 ARG HD2 . . . . . . . . . c30643_6pv2 1 . 7 . 3528 . 1 1 24 ARG HD3 H -7.829 6.683 -0.041 . . . 1.0 . . . . . . . . . . . . A . 24 ARG HD3 . . . . . . . . . c30643_6pv2 1 . 7 . 3529 . 1 1 24 ARG HE H -6.197 6.960 2.185 . . . 1.0 . . . . . . . . . . . . A . 24 ARG HE . . . . . . . . . c30643_6pv2 1 . 7 . 3530 . 1 1 24 ARG HG2 H -7.427 4.871 1.562 . . . 1.0 . . . . . . . . . . . . A . 24 ARG HG2 . . . . . . . . . c30643_6pv2 1 . 7 . 3531 . 1 1 24 ARG HG3 H -5.770 4.726 0.974 . . . 1.0 . . . . . . . . . . . . A . 24 ARG HG3 . . . . . . . . . c30643_6pv2 1 . 7 . 3532 . 1 1 24 ARG HH11 H -6.417 10.207 -0.167 . . . 1.0 . . . . . . . . . . . . A . 24 ARG HH11 . . . . . . . . . c30643_6pv2 1 . 7 . 3533 . 1 1 24 ARG HH12 H -6.794 8.646 -0.819 . . . 1.0 . . . . . . . . . . . . A . 24 ARG HH12 . . . . . . . . . c30643_6pv2 1 . 7 . 3534 . 1 1 24 ARG HH21 H -5.797 10.418 2.037 . . . 1.0 . . . . . . . . . . . . A . 24 ARG HH21 . . . . . . . . . c30643_6pv2 1 . 7 . 3535 . 1 1 24 ARG HH22 H -5.711 9.016 3.058 . . . 1.0 . . . . . . . . . . . . A . 24 ARG HH22 . . . . . . . . . c30643_6pv2 1 . 7 . 3536 . 1 1 24 ARG N N -5.945 2.068 0.232 . . . 1.0 . . . . . . . . . . . . A . 24 ARG N . . . . . . . . . c30643_6pv2 1 . 7 . 3537 . 1 1 24 ARG NE N -6.391 7.351 1.302 . . . 1.0 . . . . . . . . . . . . A . 24 ARG NE . . . . . . . . . c30643_6pv2 1 . 7 . 3538 . 1 1 24 ARG NH1 N -6.511 9.216 -0.043 . . . 1.0 . . . . . . . . . . . . A . 24 ARG NH1 . . . . . . . . . c30643_6pv2 1 . 7 . 3539 . 1 1 24 ARG NH2 N -5.894 9.427 2.158 . . . 1.0 . . . . . . . . . . . . A . 24 ARG NH2 . . . . . . . . . c30643_6pv2 1 . 7 . 3540 . 1 1 24 ARG O O -9.260 1.775 -1.092 . . . 1.0 . . . . . . . . . . . . A . 24 ARG O . . . . . . . . . c30643_6pv2 1 . 7 . 3541 . 1 1 25 THR C C -8.540 -0.959 -2.376 . . . 1.0 . . . . . . . . . . . . A . 25 THR C . . . . . . . . . c30643_6pv2 1 . 7 . 3542 . 1 1 25 THR CA C -7.908 0.293 -2.974 . . . 1.0 . . . . . . . . . . . . A . 25 THR CA . . . . . . . . . c30643_6pv2 1 . 7 . 3543 . 1 1 25 THR CB C -6.903 -0.119 -4.075 . . . 1.0 . . . . . . . . . . . . A . 25 THR CB . . . . . . . . . c30643_6pv2 1 . 7 . 3544 . 1 1 25 THR CG2 C -6.218 1.101 -4.678 . . . 1.0 . . . . . . . . . . . . A . 25 THR CG2 . . . . . . . . . c30643_6pv2 1 . 7 . 3545 . 1 1 25 THR H H -6.310 1.135 -1.864 . . . 1.0 . . . . . . . . . . . . A . 25 THR H . . . . . . . . . c30643_6pv2 1 . 7 . 3546 . 1 1 25 THR HA H -8.685 0.889 -3.429 . . . 1.0 . . . . . . . . . . . . A . 25 THR HA . . . . . . . . . c30643_6pv2 1 . 7 . 3547 . 1 1 25 THR HB H -7.445 -0.627 -4.858 . . . 1.0 . . . . . . . . . . . . A . 25 THR HB . . . . . . . . . c30643_6pv2 1 . 7 . 3548 . 1 1 25 THR HG1 H -5.248 -0.501 -3.056 . . . 1.0 . . . . . . . . . . . . A . 25 THR HG1 . . . . . . . . . c30643_6pv2 1 . 7 . 3549 . 1 1 25 THR HG21 H -5.666 1.620 -3.909 . . . 1.0 . . . . . . . . . . . . A . 25 THR HG21 . . . . . . . . . c30643_6pv2 1 . 7 . 3550 . 1 1 25 THR HG22 H -6.962 1.763 -5.095 . . . 1.0 . . . . . . . . . . . . A . 25 THR HG22 . . . . . . . . . c30643_6pv2 1 . 7 . 3551 . 1 1 25 THR HG23 H -5.539 0.784 -5.456 . . . 1.0 . . . . . . . . . . . . A . 25 THR HG23 . . . . . . . . . c30643_6pv2 1 . 7 . 3552 . 1 1 25 THR N N -7.290 1.096 -1.929 . . . 1.0 . . . . . . . . . . . . A . 25 THR N . . . . . . . . . c30643_6pv2 1 . 7 . 3553 . 1 1 25 THR O O -9.516 -1.491 -2.907 . . . 1.0 . . . . . . . . . . . . A . 25 THR O . . . . . . . . . c30643_6pv2 1 . 7 . 3554 . 1 1 25 THR OG1 O -5.911 -1.010 -3.546 . . . 1.0 . . . . . . . . . . . . A . 25 THR OG1 . . . . . . . . . c30643_6pv2 1 . 7 . 3555 . 1 1 26 HIS C C -9.513 -2.192 0.493 . . . 1.0 . . . . . . . . . . . . A . 26 HIS C . . . . . . . . . c30643_6pv2 1 . 7 . 3556 . 1 1 26 HIS CA C -8.499 -2.594 -0.573 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CA . . . . . . . . . c30643_6pv2 1 . 7 . 3557 . 1 1 26 HIS CB C -7.370 -3.382 0.097 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CB . . . . . . . . . c30643_6pv2 1 . 7 . 3558 . 1 1 26 HIS CD2 C -4.986 -3.563 -0.886 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CD2 . . . . . . . . . c30643_6pv2 1 . 7 . 3559 . 1 1 26 HIS CE1 C -5.329 -5.075 -2.417 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CE1 . . . . . . . . . c30643_6pv2 1 . 7 . 3560 . 1 1 26 HIS CG C -6.306 -3.881 -0.832 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CG . . . . . . . . . c30643_6pv2 1 . 7 . 3561 . 1 1 26 HIS H H -7.200 -0.952 -0.890 . . . 1.0 . . . . . . . . . . . . A . 26 HIS H . . . . . . . . . c30643_6pv2 1 . 7 . 3562 . 1 1 26 HIS HA H -8.985 -3.222 -1.302 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HA . . . . . . . . . c30643_6pv2 1 . 7 . 3563 . 1 1 26 HIS HB2 H -6.891 -2.748 0.829 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HB2 . . . . . . . . . c30643_6pv2 1 . 7 . 3564 . 1 1 26 HIS HB3 H -7.795 -4.237 0.602 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HB3 . . . . . . . . . c30643_6pv2 1 . 7 . 3565 . 1 1 26 HIS HD1 H -7.364 -5.289 -2.025 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HD1 . . . . . . . . . c30643_6pv2 1 . 7 . 3566 . 1 1 26 HIS HD2 H -4.471 -2.851 -0.259 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HD2 . . . . . . . . . c30643_6pv2 1 . 7 . 3567 . 1 1 26 HIS HE1 H -5.166 -5.780 -3.219 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HE1 . . . . . . . . . c30643_6pv2 1 . 7 . 3568 . 1 1 26 HIS N N -7.983 -1.417 -1.258 . . . 1.0 . . . . . . . . . . . . A . 26 HIS N . . . . . . . . . c30643_6pv2 1 . 7 . 3569 . 1 1 26 HIS ND1 N -6.511 -4.844 -1.816 . . . 1.0 . . . . . . . . . . . . A . 26 HIS ND1 . . . . . . . . . c30643_6pv2 1 . 7 . 3570 . 1 1 26 HIS NE2 N -4.405 -4.323 -1.879 . . . 1.0 . . . . . . . . . . . . A . 26 HIS NE2 . . . . . . . . . c30643_6pv2 1 . 7 . 3571 . 1 1 26 HIS O O -10.490 -2.896 0.737 . . . 1.0 . . . . . . . . . . . . A . 26 HIS O . . . . . . . . . c30643_6pv2 1 . 7 . 3572 . 1 1 27 THR C C -11.053 0.504 1.804 . . . 1.0 . . . . . . . . . . . . A . 27 THR C . . . . . . . . . c30643_6pv2 1 . 7 . 3573 . 1 1 27 THR CA C -10.094 -0.601 2.231 . . . 1.0 . . . . . . . . . . . . A . 27 THR CA . . . . . . . . . c30643_6pv2 1 . 7 . 3574 . 1 1 27 THR CB C -9.216 -0.114 3.398 . . . 1.0 . . . . . . . . . . . . A . 27 THR CB . . . . . . . . . c30643_6pv2 1 . 7 . 3575 . 1 1 27 THR CG2 C -8.526 -1.288 4.079 . . . 1.0 . . . . . . . . . . . . A . 27 THR CG2 . . . . . . . . . c30643_6pv2 1 . 7 . 3576 . 1 1 27 THR H H -8.525 -0.491 0.822 . . . 1.0 . . . . . . . . . . . . A . 27 THR H . . . . . . . . . c30643_6pv2 1 . 7 . 3577 . 1 1 27 THR HA H -10.673 -1.446 2.576 . . . 1.0 . . . . . . . . . . . . A . 27 THR HA . . . . . . . . . c30643_6pv2 1 . 7 . 3578 . 1 1 27 THR HB H -9.847 0.382 4.118 . . . 1.0 . . . . . . . . . . . . A . 27 THR HB . . . . . . . . . c30643_6pv2 1 . 7 . 3579 . 1 1 27 THR HG1 H -7.688 0.388 2.244 . . . 1.0 . . . . . . . . . . . . A . 27 THR HG1 . . . . . . . . . c30643_6pv2 1 . 7 . 3580 . 1 1 27 THR HG21 H -7.879 -0.922 4.862 . . . 1.0 . . . . . . . . . . . . A . 27 THR HG21 . . . . . . . . . c30643_6pv2 1 . 7 . 3581 . 1 1 27 THR HG22 H -7.941 -1.831 3.351 . . . 1.0 . . . . . . . . . . . . A . 27 THR HG22 . . . . . . . . . c30643_6pv2 1 . 7 . 3582 . 1 1 27 THR HG23 H -9.270 -1.946 4.506 . . . 1.0 . . . . . . . . . . . . A . 27 THR HG23 . . . . . . . . . c30643_6pv2 1 . 7 . 3583 . 1 1 27 THR N N -9.273 -1.050 1.119 . . . 1.0 . . . . . . . . . . . . A . 27 THR N . . . . . . . . . c30643_6pv2 1 . 7 . 3584 . 1 1 27 THR O O -11.366 1.411 2.577 . . . 1.0 . . . . . . . . . . . . A . 27 THR O . . . . . . . . . c30643_6pv2 1 . 7 . 3585 . 1 1 27 THR OG1 O -8.231 0.814 2.921 . . . 1.0 . . . . . . . . . . . . A . 27 THR OG1 . . . . . . . . . c30643_6pv2 1 . 7 . 3586 . 1 1 28 GLY C C -13.903 0.860 0.253 . . . 1.0 . . . . . . . . . . . . A . 28 GLY C . . . . . . . . . c30643_6pv2 1 . 7 . 3587 . 1 1 28 GLY CA C -12.490 1.367 0.073 . . . 1.0 . . . . . . . . . . . . A . 28 GLY CA . . . . . . . . . c30643_6pv2 1 . 7 . 3588 . 1 1 28 GLY H H -11.217 -0.318 -0.005 . . . 1.0 . . . . . . . . . . . . A . 28 GLY H . . . . . . . . . c30643_6pv2 1 . 7 . 3589 . 1 1 28 GLY HA2 H -12.376 2.297 0.609 . . . 1.0 . . . . . . . . . . . . A . 28 GLY HA2 . . . . . . . . . c30643_6pv2 1 . 7 . 3590 . 1 1 28 GLY HA3 H -12.308 1.539 -0.977 . . . 1.0 . . . . . . . . . . . . A . 28 GLY HA3 . . . . . . . . . c30643_6pv2 1 . 7 . 3591 . 1 1 28 GLY N N -11.524 0.413 0.573 . . . 1.0 . . . . . . . . . . . . A . 28 GLY N . . . . . . . . . c30643_6pv2 1 . 7 . 3592 . 1 1 28 GLY O O -14.784 1.133 -0.562 . . . 1.0 . . . . . . . . . . . . A . 28 GLY O . . . . . . . . . c30643_6pv2 1 . 7 . 3593 . 1 1 29 GLU C C -15.914 0.049 2.961 . . . 1.0 . . . . . . . . . . . . A . 29 GLU C . . . . . . . . . c30643_6pv2 1 . 7 . 3594 . 1 1 29 GLU CA C -15.399 -0.484 1.625 . . . 1.0 . . . . . . . . . . . . A . 29 GLU CA . . . . . . . . . c30643_6pv2 1 . 7 . 3595 . 1 1 29 GLU CB C -15.262 -2.011 1.661 . . . 1.0 . . . . . . . . . . . . A . 29 GLU CB . . . . . . . . . c30643_6pv2 1 . 7 . 3596 . 1 1 29 GLU CD C -16.400 -4.257 1.674 . . . 1.0 . . . . . . . . . . . . A . 29 GLU CD . . . . . . . . . c30643_6pv2 1 . 7 . 3597 . 1 1 29 GLU CG C -16.585 -2.757 1.654 . . . 1.0 . . . . . . . . . . . . A . 29 GLU CG . . . . . . . . . c30643_6pv2 1 . 7 . 3598 . 1 1 29 GLU H H -13.364 -0.038 1.946 . . . 1.0 . . . . . . . . . . . . A . 29 GLU H . . . . . . . . . c30643_6pv2 1 . 7 . 3599 . 1 1 29 GLU HA H -16.089 -0.203 0.843 . . . 1.0 . . . . . . . . . . . . A . 29 GLU HA . . . . . . . . . c30643_6pv2 1 . 7 . 3600 . 1 1 29 GLU HB2 H -14.691 -2.329 0.800 . . . 1.0 . . . . . . . . . . . . A . 29 GLU HB2 . . . . . . . . . c30643_6pv2 1 . 7 . 3601 . 1 1 29 GLU HB3 H -14.725 -2.289 2.557 . . . 1.0 . . . . . . . . . . . . A . 29 GLU HB3 . . . . . . . . . c30643_6pv2 1 . 7 . 3602 . 1 1 29 GLU HG2 H -17.151 -2.466 2.526 . . . 1.0 . . . . . . . . . . . . A . 29 GLU HG2 . . . . . . . . . c30643_6pv2 1 . 7 . 3603 . 1 1 29 GLU HG3 H -17.133 -2.487 0.764 . . . 1.0 . . . . . . . . . . . . A . 29 GLU HG3 . . . . . . . . . c30643_6pv2 1 . 7 . 3604 . 1 1 29 GLU N N -14.109 0.114 1.327 . . . 1.0 . . . . . . . . . . . . A . 29 GLU N . . . . . . . . . c30643_6pv2 1 . 7 . 3605 . 1 1 29 GLU O O -16.757 -0.562 3.620 . . . 1.0 . . . . . . . . . . . . A . 29 GLU O . . . . . . . . . c30643_6pv2 1 . 7 . 3606 . 1 1 29 GLU OE1 O -16.314 -4.836 2.780 . . . 1.0 . . . . . . . . . . . . A . 29 GLU OE1 . . . . . . . . . c30643_6pv2 1 . 7 . 3607 . 1 1 29 GLU OE2 O -16.345 -4.869 0.589 . . . 1.0 . . . . . . . . . . . . A . 29 GLU OE2 . . . . . . . . . c30643_6pv2 1 . 7 . 3608 . 1 1 30 LYS C C -16.623 3.060 4.335 . . . 1.0 . . . . . . . . . . . . A . 30 LYS C . . . . . . . . . c30643_6pv2 1 . 7 . 3609 . 1 1 30 LYS CA C -15.785 1.818 4.609 . . . 1.0 . . . . . . . . . . . . A . 30 LYS CA . . . . . . . . . c30643_6pv2 1 . 7 . 3610 . 1 1 30 LYS CB C -14.549 2.187 5.434 . . . 1.0 . . . . . . . . . . . . A . 30 LYS CB . . . . . . . . . c30643_6pv2 1 . 7 . 3611 . 1 1 30 LYS CD C -13.643 3.131 7.582 . . . 1.0 . . . . . . . . . . . . A . 30 LYS CD . . . . . . . . . c30643_6pv2 1 . 7 . 3612 . 1 1 30 LYS CE C -13.978 3.532 9.010 . . . 1.0 . . . . . . . . . . . . A . 30 LYS CE . . . . . . . . . c30643_6pv2 1 . 7 . 3613 . 1 1 30 LYS CG C -14.882 2.675 6.834 . . . 1.0 . . . . . . . . . . . . A . 30 LYS CG . . . . . . . . . c30643_6pv2 1 . 7 . 3614 . 1 1 30 LYS H H -14.733 1.644 2.787 . . . 1.0 . . . . . . . . . . . . A . 30 LYS H . . . . . . . . . c30643_6pv2 1 . 7 . 3615 . 1 1 30 LYS HA H -16.382 1.108 5.162 . . . 1.0 . . . . . . . . . . . . A . 30 LYS HA . . . . . . . . . c30643_6pv2 1 . 7 . 3616 . 1 1 30 LYS HB2 H -13.912 1.318 5.521 . . . 1.0 . . . . . . . . . . . . A . 30 LYS HB2 . . . . . . . . . c30643_6pv2 1 . 7 . 3617 . 1 1 30 LYS HB3 H -14.008 2.969 4.921 . . . 1.0 . . . . . . . . . . . . A . 30 LYS HB3 . . . . . . . . . c30643_6pv2 1 . 7 . 3618 . 1 1 30 LYS HD2 H -12.928 2.323 7.604 . . . 1.0 . . . . . . . . . . . . A . 30 LYS HD2 . . . . . . . . . c30643_6pv2 1 . 7 . 3619 . 1 1 30 LYS HD3 H -13.215 3.981 7.070 . . . 1.0 . . . . . . . . . . . . A . 30 LYS HD3 . . . . . . . . . c30643_6pv2 1 . 7 . 3620 . 1 1 30 LYS HE2 H -14.361 2.668 9.530 . . . 1.0 . . . . . . . . . . . . A . 30 LYS HE2 . . . . . . . . . c30643_6pv2 1 . 7 . 3621 . 1 1 30 LYS HE3 H -13.077 3.872 9.495 . . . 1.0 . . . . . . . . . . . . A . 30 LYS HE3 . . . . . . . . . c30643_6pv2 1 . 7 . 3622 . 1 1 30 LYS HG2 H -15.569 3.504 6.758 . . . 1.0 . . . . . . . . . . . . A . 30 LYS HG2 . . . . . . . . . c30643_6pv2 1 . 7 . 3623 . 1 1 30 LYS HG3 H -15.346 1.869 7.382 . . . 1.0 . . . . . . . . . . . . A . 30 LYS HG3 . . . . . . . . . c30643_6pv2 1 . 7 . 3624 . 1 1 30 LYS HZ1 H -15.855 4.332 8.558 . . . 1.0 . . . . . . . . . . . . A . 30 LYS HZ1 . . . . . . . . . c30643_6pv2 1 . 7 . 3625 . 1 1 30 LYS HZ2 H -14.621 5.484 8.631 . . . 1.0 . . . . . . . . . . . . A . 30 LYS HZ2 . . . . . . . . . c30643_6pv2 1 . 7 . 3626 . 1 1 30 LYS HZ3 H -15.243 4.821 10.056 . . . 1.0 . . . . . . . . . . . . A . 30 LYS HZ3 . . . . . . . . . c30643_6pv2 1 . 7 . 3627 . 1 1 30 LYS N N -15.394 1.197 3.357 . . . 1.0 . . . . . . . . . . . . A . 30 LYS N . . . . . . . . . c30643_6pv2 1 . 7 . 3628 . 1 1 30 LYS NZ N -14.995 4.616 9.067 . . . 1.0 . . . . . . . . . . . . A . 30 LYS NZ . . . . . . . . . c30643_6pv2 1 . 7 . 3629 . 1 1 30 LYS O O -16.092 4.153 4.138 . . . 1.0 . . . . . . . . . . . . A . 30 LYS O . . . . . . . . . c30643_6pv2 1 . 7 . 3630 . 1 1 31 NH2 HN1 H -18.286 1.987 4.464 . . . 1.0 . . . . . . . . . . . . A . 31 NH2 HN1 . . . . . . . . . c30643_6pv2 1 . 7 . 3631 . 1 1 31 NH2 HN2 H -18.497 3.665 4.117 . . . 1.0 . . . . . . . . . . . . A . 31 NH2 HN2 . . . . . . . . . c30643_6pv2 1 . 7 . 3632 . 1 1 31 NH2 N N -17.931 2.887 4.301 . . . 1.0 . . . . . . . . . . . . A . 31 NH2 N . . . . . . . . . c30643_6pv2 1 . 7 . 3633 . 2 2 1 ZN ZN Zn -2.476 -4.271 -2.392 . . . 1.0 . . . . . . . . . . . . A . 101 ZN ZN . . . . . . . . . c30643_6pv2 1 . 8 . 3634 . 1 1 1 ARG C C 11.798 -1.461 2.721 . . . 1.0 . . . . . . . . . . . . A . 1 ARG C . . . . . . . . . c30643_6pv2 1 . 8 . 3635 . 1 1 1 ARG CA C 12.806 -2.200 3.594 . . . 1.0 . . . . . . . . . . . . A . 1 ARG CA . . . . . . . . . c30643_6pv2 1 . 8 . 3636 . 1 1 1 ARG CB C 12.113 -2.690 4.874 . . . 1.0 . . . . . . . . . . . . A . 1 ARG CB . . . . . . . . . c30643_6pv2 1 . 8 . 3637 . 1 1 1 ARG CD C 10.628 -2.118 6.834 . . . 1.0 . . . . . . . . . . . . A . 1 ARG CD . . . . . . . . . c30643_6pv2 1 . 8 . 3638 . 1 1 1 ARG CG C 11.492 -1.573 5.705 . . . 1.0 . . . . . . . . . . . . A . 1 ARG CG . . . . . . . . . c30643_6pv2 1 . 8 . 3639 . 1 1 1 ARG CZ C 8.735 -1.127 8.081 . . . 1.0 . . . . . . . . . . . . A . 1 ARG CZ . . . . . . . . . c30643_6pv2 1 . 8 . 3640 . 1 1 1 ARG H1 H 14.438 -1.031 3.055 . . . 1.0 . . . . . . . . . . . . A . 1 ARG H1 . . . . . . . . . c30643_6pv2 1 . 8 . 3641 . 1 1 1 ARG H2 H 14.614 -1.805 4.545 . . . 1.0 . . . . . . . . . . . . A . 1 ARG H2 . . . . . . . . . c30643_6pv2 1 . 8 . 3642 . 1 1 1 ARG H3 H 13.601 -0.459 4.405 . . . 1.0 . . . . . . . . . . . . A . 1 ARG H3 . . . . . . . . . c30643_6pv2 1 . 8 . 3643 . 1 1 1 ARG HA H 13.187 -3.050 3.047 . . . 1.0 . . . . . . . . . . . . A . 1 ARG HA . . . . . . . . . c30643_6pv2 1 . 8 . 3644 . 1 1 1 ARG HB2 H 11.331 -3.383 4.603 . . . 1.0 . . . . . . . . . . . . A . 1 ARG HB2 . . . . . . . . . c30643_6pv2 1 . 8 . 3645 . 1 1 1 ARG HB3 H 12.839 -3.205 5.488 . . . 1.0 . . . . . . . . . . . . A . 1 ARG HB3 . . . . . . . . . c30643_6pv2 1 . 8 . 3646 . 1 1 1 ARG HD2 H 9.875 -2.771 6.418 . . . 1.0 . . . . . . . . . . . . A . 1 ARG HD2 . . . . . . . . . c30643_6pv2 1 . 8 . 3647 . 1 1 1 ARG HD3 H 11.254 -2.679 7.511 . . . 1.0 . . . . . . . . . . . . A . 1 ARG HD3 . . . . . . . . . c30643_6pv2 1 . 8 . 3648 . 1 1 1 ARG HE H 10.479 -0.215 7.714 . . . 1.0 . . . . . . . . . . . . A . 1 ARG HE . . . . . . . . . c30643_6pv2 1 . 8 . 3649 . 1 1 1 ARG HG2 H 12.284 -0.977 6.133 . . . 1.0 . . . . . . . . . . . . A . 1 ARG HG2 . . . . . . . . . c30643_6pv2 1 . 8 . 3650 . 1 1 1 ARG HG3 H 10.883 -0.954 5.060 . . . 1.0 . . . . . . . . . . . . A . 1 ARG HG3 . . . . . . . . . c30643_6pv2 1 . 8 . 3651 . 1 1 1 ARG HH11 H 7.078 -2.275 8.288 . . . 1.0 . . . . . . . . . . . . A . 1 ARG HH11 . . . . . . . . . c30643_6pv2 1 . 8 . 3652 . 1 1 1 ARG HH12 H 8.368 -2.996 7.381 . . . 1.0 . . . . . . . . . . . . A . 1 ARG HH12 . . . . . . . . . c30643_6pv2 1 . 8 . 3653 . 1 1 1 ARG HH21 H 8.768 0.733 8.888 . . . 1.0 . . . . . . . . . . . . A . 1 ARG HH21 . . . . . . . . . c30643_6pv2 1 . 8 . 3654 . 1 1 1 ARG HH22 H 7.301 -0.162 9.136 . . . 1.0 . . . . . . . . . . . . A . 1 ARG HH22 . . . . . . . . . c30643_6pv2 1 . 8 . 3655 . 1 1 1 ARG N N 13.942 -1.314 3.925 . . . 1.0 . . . . . . . . . . . . A . 1 ARG N . . . . . . . . . c30643_6pv2 1 . 8 . 3656 . 1 1 1 ARG NE N 9.969 -1.045 7.579 . . . 1.0 . . . . . . . . . . . . A . 1 ARG NE . . . . . . . . . c30643_6pv2 1 . 8 . 3657 . 1 1 1 ARG NH1 N 8.004 -2.222 7.904 . . . 1.0 . . . . . . . . . . . . A . 1 ARG NH1 . . . . . . . . . c30643_6pv2 1 . 8 . 3658 . 1 1 1 ARG NH2 N 8.227 -0.104 8.755 . . . 1.0 . . . . . . . . . . . . A . 1 ARG NH2 . . . . . . . . . c30643_6pv2 1 . 8 . 3659 . 1 1 1 ARG O O 11.504 -0.291 2.964 . . . 1.0 . . . . . . . . . . . . A . 1 ARG O . . . . . . . . . c30643_6pv2 1 . 8 . 3660 . 1 1 2 PRO C C 8.857 -1.686 1.517 . . . 1.0 . . . . . . . . . . . . A . 2 PRO C . . . . . . . . . c30643_6pv2 1 . 8 . 3661 . 1 1 2 PRO CA C 10.217 -1.547 0.851 . . . 1.0 . . . . . . . . . . . . A . 2 PRO CA . . . . . . . . . c30643_6pv2 1 . 8 . 3662 . 1 1 2 PRO CB C 10.273 -2.388 -0.420 . . . 1.0 . . . . . . . . . . . . A . 2 PRO CB . . . . . . . . . c30643_6pv2 1 . 8 . 3663 . 1 1 2 PRO CD C 11.673 -3.459 1.210 . . . 1.0 . . . . . . . . . . . . A . 2 PRO CD . . . . . . . . . c30643_6pv2 1 . 8 . 3664 . 1 1 2 PRO CG C 10.763 -3.719 0.033 . . . 1.0 . . . . . . . . . . . . A . 2 PRO CG . . . . . . . . . c30643_6pv2 1 . 8 . 3665 . 1 1 2 PRO HA H 10.404 -0.510 0.618 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HA . . . . . . . . . c30643_6pv2 1 . 8 . 3666 . 1 1 2 PRO HB2 H 9.283 -2.454 -0.854 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HB2 . . . . . . . . . c30643_6pv2 1 . 8 . 3667 . 1 1 2 PRO HB3 H 10.952 -1.936 -1.127 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HB3 . . . . . . . . . c30643_6pv2 1 . 8 . 3668 . 1 1 2 PRO HD2 H 11.513 -4.197 1.981 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HD2 . . . . . . . . . c30643_6pv2 1 . 8 . 3669 . 1 1 2 PRO HD3 H 12.707 -3.462 0.894 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HD3 . . . . . . . . . c30643_6pv2 1 . 8 . 3670 . 1 1 2 PRO HG2 H 9.925 -4.332 0.336 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HG2 . . . . . . . . . c30643_6pv2 1 . 8 . 3671 . 1 1 2 PRO HG3 H 11.309 -4.200 -0.764 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HG3 . . . . . . . . . c30643_6pv2 1 . 8 . 3672 . 1 1 2 PRO N N 11.273 -2.118 1.678 . . . 1.0 . . . . . . . . . . . . A . 2 PRO N . . . . . . . . . c30643_6pv2 1 . 8 . 3673 . 1 1 2 PRO O O 8.598 -2.662 2.224 . . . 1.0 . . . . . . . . . . . . A . 2 PRO O . . . . . . . . . c30643_6pv2 1 . 8 . 3674 . 1 1 3 PHE C C 5.769 -1.633 0.995 . . . 1.0 . . . . . . . . . . . . A . 3 PHE C . . . . . . . . . c30643_6pv2 1 . 8 . 3675 . 1 1 3 PHE CA C 6.656 -0.744 1.852 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CA . . . . . . . . . c30643_6pv2 1 . 8 . 3676 . 1 1 3 PHE CB C 6.100 0.677 1.940 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CB . . . . . . . . . c30643_6pv2 1 . 8 . 3677 . 1 1 3 PHE CD1 C 7.880 2.401 2.349 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CD1 . . . . . . . . . c30643_6pv2 1 . 8 . 3678 . 1 1 3 PHE CD2 C 6.675 1.545 4.219 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CD2 . . . . . . . . . c30643_6pv2 1 . 8 . 3679 . 1 1 3 PHE CE1 C 8.622 3.206 3.192 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CE1 . . . . . . . . . c30643_6pv2 1 . 8 . 3680 . 1 1 3 PHE CE2 C 7.413 2.349 5.066 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CE2 . . . . . . . . . c30643_6pv2 1 . 8 . 3681 . 1 1 3 PHE CG C 6.899 1.561 2.853 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CG . . . . . . . . . c30643_6pv2 1 . 8 . 3682 . 1 1 3 PHE CZ C 8.388 3.180 4.551 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CZ . . . . . . . . . c30643_6pv2 1 . 8 . 3683 . 1 1 3 PHE H H 8.252 0.028 0.707 . . . 1.0 . . . . . . . . . . . . A . 3 PHE H . . . . . . . . . c30643_6pv2 1 . 8 . 3684 . 1 1 3 PHE HA H 6.719 -1.164 2.845 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HA . . . . . . . . . c30643_6pv2 1 . 8 . 3685 . 1 1 3 PHE HB2 H 6.103 1.121 0.957 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HB2 . . . . . . . . . c30643_6pv2 1 . 8 . 3686 . 1 1 3 PHE HB3 H 5.090 0.641 2.312 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HB3 . . . . . . . . . c30643_6pv2 1 . 8 . 3687 . 1 1 3 PHE HD1 H 8.064 2.423 1.284 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HD1 . . . . . . . . . c30643_6pv2 1 . 8 . 3688 . 1 1 3 PHE HD2 H 5.912 0.896 4.621 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HD2 . . . . . . . . . c30643_6pv2 1 . 8 . 3689 . 1 1 3 PHE HE1 H 9.383 3.857 2.787 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HE1 . . . . . . . . . c30643_6pv2 1 . 8 . 3690 . 1 1 3 PHE HE2 H 7.228 2.326 6.128 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HE2 . . . . . . . . . c30643_6pv2 1 . 8 . 3691 . 1 1 3 PHE HZ H 8.966 3.808 5.211 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HZ . . . . . . . . . c30643_6pv2 1 . 8 . 3692 . 1 1 3 PHE N N 7.993 -0.719 1.290 . . . 1.0 . . . . . . . . . . . . A . 3 PHE N . . . . . . . . . c30643_6pv2 1 . 8 . 3693 . 1 1 3 PHE O O 5.154 -1.180 0.034 . . . 1.0 . . . . . . . . . . . . A . 3 PHE O . . . . . . . . . c30643_6pv2 1 . 8 . 3694 . 1 1 4 NLE C C 3.679 -4.211 1.031 . . . 1.0 . . . . . . . . . . . . A . 4 NLE C . . . . . . . . . c30643_6pv2 1 . 8 . 3695 . 1 1 4 NLE CA C 5.080 -3.912 0.524 . . . 1.0 . . . . . . . . . . . . A . 4 NLE CA . . . . . . . . . c30643_6pv2 1 . 8 . 3696 . 1 1 4 NLE CB C 5.916 -5.196 0.517 . . . 1.0 . . . . . . . . . . . . A . 4 NLE CB . . . . . . . . . c30643_6pv2 1 . 8 . 3697 . 1 1 4 NLE CD C 6.239 -7.533 -0.335 . . . 1.0 . . . . . . . . . . . . A . 4 NLE CD . . . . . . . . . c30643_6pv2 1 . 8 . 3698 . 1 1 4 NLE CE C 5.678 -8.601 -1.246 . . . 1.0 . . . . . . . . . . . . A . 4 NLE CE . . . . . . . . . c30643_6pv2 1 . 8 . 3699 . 1 1 4 NLE CG C 5.362 -6.294 -0.373 . . . 1.0 . . . . . . . . . . . . A . 4 NLE CG . . . . . . . . . c30643_6pv2 1 . 8 . 3700 . 1 1 4 NLE H H 6.160 -3.179 2.183 . . . 1.0 . . . . . . . . . . . . A . 4 NLE H . . . . . . . . . c30643_6pv2 1 . 8 . 3701 . 1 1 4 NLE HA H 5.011 -3.530 -0.481 . . . 1.0 . . . . . . . . . . . . A . 4 NLE HA . . . . . . . . . c30643_6pv2 1 . 8 . 3702 . 1 1 4 NLE HB2 H 5.971 -5.576 1.525 . . . 1.0 . . . . . . . . . . . . A . 4 NLE HB2 . . . . . . . . . c30643_6pv2 1 . 8 . 3703 . 1 1 4 NLE HB3 H 6.915 -4.959 0.179 . . . 1.0 . . . . . . . . . . . . A . 4 NLE HB3 . . . . . . . . . c30643_6pv2 1 . 8 . 3704 . 1 1 4 NLE HD2 H 6.274 -7.919 0.673 . . . 1.0 . . . . . . . . . . . . A . 4 NLE HD2 . . . . . . . . . c30643_6pv2 1 . 8 . 3705 . 1 1 4 NLE HD3 H 7.235 -7.280 -0.670 . . . 1.0 . . . . . . . . . . . . A . 4 NLE HD3 . . . . . . . . . c30643_6pv2 1 . 8 . 3706 . 1 1 4 NLE HE1 H 6.318 -9.470 -1.220 . . . 1.0 . . . . . . . . . . . . A . 4 NLE HE1 . . . . . . . . . c30643_6pv2 1 . 8 . 3707 . 1 1 4 NLE HE2 H 5.628 -8.221 -2.257 . . . 1.0 . . . . . . . . . . . . A . 4 NLE HE2 . . . . . . . . . c30643_6pv2 1 . 8 . 3708 . 1 1 4 NLE HE3 H 4.687 -8.873 -0.914 . . . 1.0 . . . . . . . . . . . . A . 4 NLE HE3 . . . . . . . . . c30643_6pv2 1 . 8 . 3709 . 1 1 4 NLE HG2 H 5.310 -5.931 -1.390 . . . 1.0 . . . . . . . . . . . . A . 4 NLE HG2 . . . . . . . . . c30643_6pv2 1 . 8 . 3710 . 1 1 4 NLE HG3 H 4.371 -6.557 -0.032 . . . 1.0 . . . . . . . . . . . . A . 4 NLE HG3 . . . . . . . . . c30643_6pv2 1 . 8 . 3711 . 1 1 4 NLE N N 5.737 -2.906 1.343 . . . 1.0 . . . . . . . . . . . . A . 4 NLE N . . . . . . . . . c30643_6pv2 1 . 8 . 3712 . 1 1 4 NLE O O 3.467 -4.402 2.229 . . . 1.0 . . . . . . . . . . . . A . 4 NLE O . . . . . . . . . c30643_6pv2 1 . 8 . 3713 . 1 1 5 CYS C C 1.322 -6.134 0.696 . . . 1.0 . . . . . . . . . . . . A . 5 CYS C . . . . . . . . . c30643_6pv2 1 . 8 . 3714 . 1 1 5 CYS CA C 1.369 -4.632 0.432 . . . 1.0 . . . . . . . . . . . . A . 5 CYS CA . . . . . . . . . c30643_6pv2 1 . 8 . 3715 . 1 1 5 CYS CB C 0.417 -4.259 -0.709 . . . 1.0 . . . . . . . . . . . . A . 5 CYS CB . . . . . . . . . c30643_6pv2 1 . 8 . 3716 . 1 1 5 CYS H H 2.946 -3.986 -0.813 . . . 1.0 . . . . . . . . . . . . A . 5 CYS H . . . . . . . . . c30643_6pv2 1 . 8 . 3717 . 1 1 5 CYS HA H 1.071 -4.109 1.327 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HA . . . . . . . . . c30643_6pv2 1 . 8 . 3718 . 1 1 5 CYS HB2 H 0.422 -3.186 -0.838 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HB2 . . . . . . . . . c30643_6pv2 1 . 8 . 3719 . 1 1 5 CYS HB3 H 0.759 -4.725 -1.619 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HB3 . . . . . . . . . c30643_6pv2 1 . 8 . 3720 . 1 1 5 CYS N N 2.726 -4.237 0.111 . . . 1.0 . . . . . . . . . . . . A . 5 CYS N . . . . . . . . . c30643_6pv2 1 . 8 . 3721 . 1 1 5 CYS O O 1.962 -6.917 -0.009 . . . 1.0 . . . . . . . . . . . . A . 5 CYS O . . . . . . . . . c30643_6pv2 1 . 8 . 3722 . 1 1 5 CYS SG S -1.296 -4.769 -0.436 . . . 1.0 . . . . . . . . . . . . A . 5 CYS SG . . . . . . . . . c30643_6pv2 1 . 8 . 3723 . 1 1 6 THR C C -0.989 -8.346 2.200 . . . 1.0 . . . . . . . . . . . . A . 6 THR C . . . . . . . . . c30643_6pv2 1 . 8 . 3724 . 1 1 6 THR CA C 0.472 -7.928 2.094 . . . 1.0 . . . . . . . . . . . . A . 6 THR CA . . . . . . . . . c30643_6pv2 1 . 8 . 3725 . 1 1 6 THR CB C 1.194 -8.203 3.425 . . . 1.0 . . . . . . . . . . . . A . 6 THR CB . . . . . . . . . c30643_6pv2 1 . 8 . 3726 . 1 1 6 THR CG2 C 2.699 -8.281 3.222 . . . 1.0 . . . . . . . . . . . . A . 6 THR CG2 . . . . . . . . . c30643_6pv2 1 . 8 . 3727 . 1 1 6 THR H H 0.116 -5.857 2.258 . . . 1.0 . . . . . . . . . . . . A . 6 THR H . . . . . . . . . c30643_6pv2 1 . 8 . 3728 . 1 1 6 THR HA H 0.945 -8.516 1.324 . . . 1.0 . . . . . . . . . . . . A . 6 THR HA . . . . . . . . . c30643_6pv2 1 . 8 . 3729 . 1 1 6 THR HB H 0.849 -9.149 3.817 . . . 1.0 . . . . . . . . . . . . A . 6 THR HB . . . . . . . . . c30643_6pv2 1 . 8 . 3730 . 1 1 6 THR HG1 H 0.257 -7.501 5.017 . . . 1.0 . . . . . . . . . . . . A . 6 THR HG1 . . . . . . . . . c30643_6pv2 1 . 8 . 3731 . 1 1 6 THR HG21 H 3.056 -7.345 2.819 . . . 1.0 . . . . . . . . . . . . A . 6 THR HG21 . . . . . . . . . c30643_6pv2 1 . 8 . 3732 . 1 1 6 THR HG22 H 2.929 -9.080 2.533 . . . 1.0 . . . . . . . . . . . . A . 6 THR HG22 . . . . . . . . . c30643_6pv2 1 . 8 . 3733 . 1 1 6 THR HG23 H 3.180 -8.473 4.169 . . . 1.0 . . . . . . . . . . . . A . 6 THR HG23 . . . . . . . . . c30643_6pv2 1 . 8 . 3734 . 1 1 6 THR N N 0.587 -6.527 1.724 . . . 1.0 . . . . . . . . . . . . A . 6 THR N . . . . . . . . . c30643_6pv2 1 . 8 . 3735 . 1 1 6 THR O O -1.398 -9.000 3.162 . . . 1.0 . . . . . . . . . . . . A . 6 THR O . . . . . . . . . c30643_6pv2 1 . 8 . 3736 . 1 1 6 THR OG1 O 0.886 -7.165 4.368 . . . 1.0 . . . . . . . . . . . . A . 6 THR OG1 . . . . . . . . . c30643_6pv2 1 . 8 . 3737 . 1 1 7 TRP C C -3.471 -9.580 0.491 . . . 1.0 . . . . . . . . . . . . A . 7 TRP C . . . . . . . . . c30643_6pv2 1 . 8 . 3738 . 1 1 7 TRP CA C -3.196 -8.263 1.207 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CA . . . . . . . . . c30643_6pv2 1 . 8 . 3739 . 1 1 7 TRP CB C -3.973 -7.129 0.541 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CB . . . . . . . . . c30643_6pv2 1 . 8 . 3740 . 1 1 7 TRP CD1 C -6.398 -7.920 0.320 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CD1 . . . . . . . . . c30643_6pv2 1 . 8 . 3741 . 1 1 7 TRP CD2 C -6.094 -6.282 1.810 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CD2 . . . . . . . . . c30643_6pv2 1 . 8 . 3742 . 1 1 7 TRP CE2 C -7.460 -6.617 1.788 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CE2 . . . . . . . . . c30643_6pv2 1 . 8 . 3743 . 1 1 7 TRP CE3 C -5.660 -5.273 2.672 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CE3 . . . . . . . . . c30643_6pv2 1 . 8 . 3744 . 1 1 7 TRP CG C -5.433 -7.128 0.868 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CG . . . . . . . . . c30643_6pv2 1 . 8 . 3745 . 1 1 7 TRP CH2 C -7.943 -4.991 3.430 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CH2 . . . . . . . . . c30643_6pv2 1 . 8 . 3746 . 1 1 7 TRP CZ2 C -8.396 -5.977 2.596 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CZ2 . . . . . . . . . c30643_6pv2 1 . 8 . 3747 . 1 1 7 TRP CZ3 C -6.588 -4.637 3.472 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CZ3 . . . . . . . . . c30643_6pv2 1 . 8 . 3748 . 1 1 7 TRP H H -1.386 -7.493 0.438 . . . 1.0 . . . . . . . . . . . . A . 7 TRP H . . . . . . . . . c30643_6pv2 1 . 8 . 3749 . 1 1 7 TRP HA H -3.515 -8.352 2.234 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HA . . . . . . . . . c30643_6pv2 1 . 8 . 3750 . 1 1 7 TRP HB2 H -3.562 -6.182 0.856 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HB2 . . . . . . . . . c30643_6pv2 1 . 8 . 3751 . 1 1 7 TRP HB3 H -3.873 -7.219 -0.529 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HB3 . . . . . . . . . c30643_6pv2 1 . 8 . 3752 . 1 1 7 TRP HD1 H -6.211 -8.672 -0.431 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HD1 . . . . . . . . . c30643_6pv2 1 . 8 . 3753 . 1 1 7 TRP HE1 H -8.470 -8.058 0.640 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HE1 . . . . . . . . . c30643_6pv2 1 . 8 . 3754 . 1 1 7 TRP HE3 H -4.619 -4.988 2.716 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HE3 . . . . . . . . . c30643_6pv2 1 . 8 . 3755 . 1 1 7 TRP HH2 H -8.634 -4.464 4.071 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HH2 . . . . . . . . . c30643_6pv2 1 . 8 . 3756 . 1 1 7 TRP HZ2 H -9.443 -6.239 2.575 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HZ2 . . . . . . . . . c30643_6pv2 1 . 8 . 3757 . 1 1 7 TRP HZ3 H -6.271 -3.852 4.143 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HZ3 . . . . . . . . . c30643_6pv2 1 . 8 . 3758 . 1 1 7 TRP N N -1.775 -7.971 1.202 . . . 1.0 . . . . . . . . . . . . A . 7 TRP N . . . . . . . . . c30643_6pv2 1 . 8 . 3759 . 1 1 7 TRP NE1 N -7.621 -7.623 0.871 . . . 1.0 . . . . . . . . . . . . A . 7 TRP NE1 . . . . . . . . . c30643_6pv2 1 . 8 . 3760 . 1 1 7 TRP O O -3.854 -9.596 -0.682 . . . 1.0 . . . . . . . . . . . . A . 7 TRP O . . . . . . . . . c30643_6pv2 1 . 8 . 3761 . 1 1 8 ORN C C -1.369 -10.926 -2.908 . . . 1.0 . . . . . . . . . . . . A . 8 ORN C . . . . . . . . . c30643_6pv2 1 . 8 . 3762 . 1 1 8 ORN CA C -1.936 -12.072 -2.082 . . . 1.0 . . . . . . . . . . . . A . 8 ORN CA . . . . . . . . . c30643_6pv2 1 . 8 . 3763 . 1 1 8 ORN CB C -1.312 -12.046 -0.683 . . . 1.0 . . . . . . . . . . . . A . 8 ORN CB . . . . . . . . . c30643_6pv2 1 . 8 . 3764 . 1 1 8 ORN CD C -3.440 -12.035 0.667 . . . 1.0 . . . . . . . . . . . . A . 8 ORN CD . . . . . . . . . c30643_6pv2 1 . 8 . 3765 . 1 1 8 ORN CG C -2.131 -12.764 0.378 . . . 1.0 . . . . . . . . . . . . A . 8 ORN CG . . . . . . . . . c30643_6pv2 1 . 8 . 3766 . 1 1 8 ORN H H -2.147 -13.399 -3.672 . . . 1.0 . . . . . . . . . . . . A . 8 ORN H . . . . . . . . . c30643_6pv2 1 . 8 . 3767 . 1 1 8 ORN HA H -3.003 -11.937 -1.993 . . . 1.0 . . . . . . . . . . . . A . 8 ORN HA . . . . . . . . . c30643_6pv2 1 . 8 . 3768 . 1 1 8 ORN HB2 H -1.196 -11.017 -0.378 . . . 1.0 . . . . . . . . . . . . A . 8 ORN HB2 . . . . . . . . . c30643_6pv2 1 . 8 . 3769 . 1 1 8 ORN HB3 H -0.338 -12.509 -0.729 . . . 1.0 . . . . . . . . . . . . A . 8 ORN HB3 . . . . . . . . . c30643_6pv2 1 . 8 . 3770 . 1 1 8 ORN HD2 H -3.998 -12.604 1.397 . . . 1.0 . . . . . . . . . . . . A . 8 ORN HD2 . . . . . . . . . c30643_6pv2 1 . 8 . 3771 . 1 1 8 ORN HD3 H -4.010 -11.970 -0.246 . . . 1.0 . . . . . . . . . . . . A . 8 ORN HD3 . . . . . . . . . c30643_6pv2 1 . 8 . 3772 . 1 1 8 ORN HE1 H -2.877 -10.593 2.096 . . . 1.0 . . . . . . . . . . . . A . 8 ORN HE1 . . . . . . . . . c30643_6pv2 1 . 8 . 3773 . 1 1 8 ORN HG2 H -1.552 -12.822 1.288 . . . 1.0 . . . . . . . . . . . . A . 8 ORN HG2 . . . . . . . . . c30643_6pv2 1 . 8 . 3774 . 1 1 8 ORN HG3 H -2.356 -13.762 0.031 . . . 1.0 . . . . . . . . . . . . A . 8 ORN HG3 . . . . . . . . . c30643_6pv2 1 . 8 . 3775 . 1 1 8 ORN N N -1.689 -13.377 -2.739 . . . 1.0 . . . . . . . . . . . . A . 8 ORN N . . . . . . . . . c30643_6pv2 1 . 8 . 3776 . 1 1 8 ORN NE N -3.227 -10.683 1.184 . . . 1.0 . . . . . . . . . . . . A . 8 ORN NE . . . . . . . . . c30643_6pv2 1 . 8 . 3777 . 1 1 8 ORN O O -0.373 -11.083 -3.617 . . . 1.0 . . . . . . . . . . . . A . 8 ORN O . . . . . . . . . c30643_6pv2 1 . 8 . 3778 . 1 1 9 CYS C C -0.270 -8.094 -2.779 . . . 1.0 . . . . . . . . . . . . A . 9 CYS C . . . . . . . . . c30643_6pv2 1 . 8 . 3779 . 1 1 9 CYS CA C -1.556 -8.559 -3.449 . . . 1.0 . . . . . . . . . . . . A . 9 CYS CA . . . . . . . . . c30643_6pv2 1 . 8 . 3780 . 1 1 9 CYS CB C -2.636 -7.482 -3.341 . . . 1.0 . . . . . . . . . . . . A . 9 CYS CB . . . . . . . . . c30643_6pv2 1 . 8 . 3781 . 1 1 9 CYS H H -2.848 -9.744 -2.278 . . . 1.0 . . . . . . . . . . . . A . 9 CYS H . . . . . . . . . c30643_6pv2 1 . 8 . 3782 . 1 1 9 CYS HA H -1.363 -8.772 -4.489 . . . 1.0 . . . . . . . . . . . . A . 9 CYS HA . . . . . . . . . c30643_6pv2 1 . 8 . 3783 . 1 1 9 CYS HB2 H -3.500 -7.791 -3.909 . . . 1.0 . . . . . . . . . . . . A . 9 CYS HB2 . . . . . . . . . c30643_6pv2 1 . 8 . 3784 . 1 1 9 CYS HB3 H -2.916 -7.374 -2.305 . . . 1.0 . . . . . . . . . . . . A . 9 CYS HB3 . . . . . . . . . c30643_6pv2 1 . 8 . 3785 . 1 1 9 CYS N N -2.022 -9.776 -2.810 . . . 1.0 . . . . . . . . . . . . A . 9 CYS N . . . . . . . . . c30643_6pv2 1 . 8 . 3786 . 1 1 9 CYS O O -0.271 -7.764 -1.593 . . . 1.0 . . . . . . . . . . . . A . 9 CYS O . . . . . . . . . c30643_6pv2 1 . 8 . 3787 . 1 1 9 CYS SG S -2.142 -5.854 -3.945 . . . 1.0 . . . . . . . . . . . . A . 9 CYS SG . . . . . . . . . c30643_6pv2 1 . 8 . 3788 . 1 1 10 GLY C C 2.861 -6.720 -3.770 . . . 1.0 . . . . . . . . . . . . A . 10 GLY C . . . . . . . . . c30643_6pv2 1 . 8 . 3789 . 1 1 10 GLY CA C 2.106 -7.750 -2.961 . . . 1.0 . . . . . . . . . . . . A . 10 GLY CA . . . . . . . . . c30643_6pv2 1 . 8 . 3790 . 1 1 10 GLY H H 0.752 -8.269 -4.492 . . . 1.0 . . . . . . . . . . . . A . 10 GLY H . . . . . . . . . c30643_6pv2 1 . 8 . 3791 . 1 1 10 GLY HA2 H 1.957 -7.369 -1.962 . . . 1.0 . . . . . . . . . . . . A . 10 GLY HA2 . . . . . . . . . c30643_6pv2 1 . 8 . 3792 . 1 1 10 GLY HA3 H 2.696 -8.650 -2.907 . . . 1.0 . . . . . . . . . . . . A . 10 GLY HA3 . . . . . . . . . c30643_6pv2 1 . 8 . 3793 . 1 1 10 GLY N N 0.821 -8.074 -3.533 . . . 1.0 . . . . . . . . . . . . A . 10 GLY N . . . . . . . . . c30643_6pv2 1 . 8 . 3794 . 1 1 10 GLY O O 3.944 -6.995 -4.287 . . . 1.0 . . . . . . . . . . . . A . 10 GLY O . . . . . . . . . c30643_6pv2 1 . 8 . 3795 . 1 1 11 LYS C C 3.834 -3.679 -3.644 . . . 1.0 . . . . . . . . . . . . A . 11 LYS C . . . . . . . . . c30643_6pv2 1 . 8 . 3796 . 1 1 11 LYS CA C 2.908 -4.433 -4.596 . . . 1.0 . . . . . . . . . . . . A . 11 LYS CA . . . . . . . . . c30643_6pv2 1 . 8 . 3797 . 1 1 11 LYS CB C 1.825 -3.510 -5.164 . . . 1.0 . . . . . . . . . . . . A . 11 LYS CB . . . . . . . . . c30643_6pv2 1 . 8 . 3798 . 1 1 11 LYS CD C 1.167 -1.970 -7.021 . . . 1.0 . . . . . . . . . . . . A . 11 LYS CD . . . . . . . . . c30643_6pv2 1 . 8 . 3799 . 1 1 11 LYS CE C 1.634 -1.027 -8.119 . . . 1.0 . . . . . . . . . . . . A . 11 LYS CE . . . . . . . . . c30643_6pv2 1 . 8 . 3800 . 1 1 11 LYS CG C 2.322 -2.499 -6.186 . . . 1.0 . . . . . . . . . . . . A . 11 LYS CG . . . . . . . . . c30643_6pv2 1 . 8 . 3801 . 1 1 11 LYS H H 1.394 -5.408 -3.496 . . . 1.0 . . . . . . . . . . . . A . 11 LYS H . . . . . . . . . c30643_6pv2 1 . 8 . 3802 . 1 1 11 LYS HA H 3.493 -4.841 -5.408 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HA . . . . . . . . . c30643_6pv2 1 . 8 . 3803 . 1 1 11 LYS HB2 H 1.068 -4.115 -5.638 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HB2 . . . . . . . . . c30643_6pv2 1 . 8 . 3804 . 1 1 11 LYS HB3 H 1.372 -2.967 -4.347 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HB3 . . . . . . . . . c30643_6pv2 1 . 8 . 3805 . 1 1 11 LYS HD2 H 0.658 -2.805 -7.476 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HD2 . . . . . . . . . c30643_6pv2 1 . 8 . 3806 . 1 1 11 LYS HD3 H 0.482 -1.442 -6.374 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HD3 . . . . . . . . . c30643_6pv2 1 . 8 . 3807 . 1 1 11 LYS HE2 H 2.450 -1.494 -8.649 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HE2 . . . . . . . . . c30643_6pv2 1 . 8 . 3808 . 1 1 11 LYS HE3 H 0.814 -0.860 -8.802 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HE3 . . . . . . . . . c30643_6pv2 1 . 8 . 3809 . 1 1 11 LYS HG2 H 2.792 -1.676 -5.667 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HG2 . . . . . . . . . c30643_6pv2 1 . 8 . 3810 . 1 1 11 LYS HG3 H 3.038 -2.978 -6.837 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HG3 . . . . . . . . . c30643_6pv2 1 . 8 . 3811 . 1 1 11 LYS HZ1 H 1.328 0.749 -7.067 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HZ1 . . . . . . . . . c30643_6pv2 1 . 8 . 3812 . 1 1 11 LYS HZ2 H 2.387 0.901 -8.374 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HZ2 . . . . . . . . . c30643_6pv2 1 . 8 . 3813 . 1 1 11 LYS HZ3 H 2.905 0.149 -6.953 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HZ3 . . . . . . . . . c30643_6pv2 1 . 8 . 3814 . 1 1 11 LYS N N 2.278 -5.539 -3.890 . . . 1.0 . . . . . . . . . . . . A . 11 LYS N . . . . . . . . . c30643_6pv2 1 . 8 . 3815 . 1 1 11 LYS NZ N 2.095 0.282 -7.589 . . . 1.0 . . . . . . . . . . . . A . 11 LYS NZ . . . . . . . . . c30643_6pv2 1 . 8 . 3816 . 1 1 11 LYS O O 3.460 -3.389 -2.507 . . . 1.0 . . . . . . . . . . . . A . 11 LYS O . . . . . . . . . c30643_6pv2 1 . 8 . 3817 . 1 1 12 ARG C C 6.150 -1.267 -3.528 . . . 1.0 . . . . . . . . . . . . A . 12 ARG C . . . . . . . . . c30643_6pv2 1 . 8 . 3818 . 1 1 12 ARG CA C 6.051 -2.757 -3.252 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CA . . . . . . . . . c30643_6pv2 1 . 8 . 3819 . 1 1 12 ARG CB C 7.418 -3.413 -3.464 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CB . . . . . . . . . c30643_6pv2 1 . 8 . 3820 . 1 1 12 ARG CD C 8.828 -5.487 -3.287 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CD . . . . . . . . . c30643_6pv2 1 . 8 . 3821 . 1 1 12 ARG CG C 7.481 -4.850 -2.981 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CG . . . . . . . . . c30643_6pv2 1 . 8 . 3822 . 1 1 12 ARG CZ C 8.881 -7.955 -3.406 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CZ . . . . . . . . . c30643_6pv2 1 . 8 . 3823 . 1 1 12 ARG H H 5.264 -3.590 -5.035 . . . 1.0 . . . . . . . . . . . . A . 12 ARG H . . . . . . . . . c30643_6pv2 1 . 8 . 3824 . 1 1 12 ARG HA H 5.750 -2.898 -2.224 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HA . . . . . . . . . c30643_6pv2 1 . 8 . 3825 . 1 1 12 ARG HB2 H 7.651 -3.398 -4.518 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HB2 . . . . . . . . . c30643_6pv2 1 . 8 . 3826 . 1 1 12 ARG HB3 H 8.163 -2.842 -2.930 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HB3 . . . . . . . . . c30643_6pv2 1 . 8 . 3827 . 1 1 12 ARG HD2 H 8.947 -5.558 -4.358 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HD2 . . . . . . . . . c30643_6pv2 1 . 8 . 3828 . 1 1 12 ARG HD3 H 9.608 -4.862 -2.880 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HD3 . . . . . . . . . c30643_6pv2 1 . 8 . 3829 . 1 1 12 ARG HE H 9.075 -6.877 -1.732 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HE . . . . . . . . . c30643_6pv2 1 . 8 . 3830 . 1 1 12 ARG HG2 H 7.321 -4.867 -1.913 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HG2 . . . . . . . . . c30643_6pv2 1 . 8 . 3831 . 1 1 12 ARG HG3 H 6.703 -5.417 -3.471 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HG3 . . . . . . . . . c30643_6pv2 1 . 8 . 3832 . 1 1 12 ARG HH11 H 8.604 -7.048 -5.202 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH11 . . . . . . . . . c30643_6pv2 1 . 8 . 3833 . 1 1 12 ARG HH12 H 8.654 -8.782 -5.244 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH12 . . . . . . . . . c30643_6pv2 1 . 8 . 3834 . 1 1 12 ARG HH21 H 8.965 -9.976 -3.311 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH21 . . . . . . . . . c30643_6pv2 1 . 8 . 3835 . 1 1 12 ARG HH22 H 9.159 -9.155 -1.796 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH22 . . . . . . . . . c30643_6pv2 1 . 8 . 3836 . 1 1 12 ARG N N 5.045 -3.389 -4.100 . . . 1.0 . . . . . . . . . . . . A . 12 ARG N . . . . . . . . . c30643_6pv2 1 . 8 . 3837 . 1 1 12 ARG NE N 8.939 -6.823 -2.706 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NE . . . . . . . . . c30643_6pv2 1 . 8 . 3838 . 1 1 12 ARG NH1 N 8.699 -7.926 -4.722 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NH1 . . . . . . . . . c30643_6pv2 1 . 8 . 3839 . 1 1 12 ARG NH2 N 9.010 -9.121 -2.787 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NH2 . . . . . . . . . c30643_6pv2 1 . 8 . 3840 . 1 1 12 ARG O O 6.177 -0.843 -4.684 . . . 1.0 . . . . . . . . . . . . A . 12 ARG O . . . . . . . . . c30643_6pv2 1 . 8 . 3841 . 1 1 13 PHE C C 7.513 1.505 -1.885 . . . 1.0 . . . . . . . . . . . . A . 13 PHE C . . . . . . . . . c30643_6pv2 1 . 8 . 3842 . 1 1 13 PHE CA C 6.272 0.969 -2.579 . . . 1.0 . . . . . . . . . . . . A . 13 PHE CA . . . . . . . . . c30643_6pv2 1 . 8 . 3843 . 1 1 13 PHE CB C 5.018 1.593 -1.971 . . . 1.0 . . . . . . . . . . . . A . 13 PHE CB . . . . . . . . . c30643_6pv2 1 . 8 . 3844 . 1 1 13 PHE CD1 C 3.249 1.713 -3.729 . . . 1.0 . . . . . . . . . . . . A . 13 PHE CD1 . . . . . . . . . c30643_6pv2 1 . 8 . 3845 . 1 1 13 PHE CD2 C 3.093 0.005 -2.078 . . . 1.0 . . . . . . . . . . . . A . 13 PHE CD2 . . . . . . . . . c30643_6pv2 1 . 8 . 3846 . 1 1 13 PHE CE1 C 2.085 1.266 -4.310 . . . 1.0 . . . . . . . . . . . . A . 13 PHE CE1 . . . . . . . . . c30643_6pv2 1 . 8 . 3847 . 1 1 13 PHE CE2 C 1.928 -0.450 -2.655 . . . 1.0 . . . . . . . . . . . . A . 13 PHE CE2 . . . . . . . . . c30643_6pv2 1 . 8 . 3848 . 1 1 13 PHE CG C 3.764 1.088 -2.610 . . . 1.0 . . . . . . . . . . . . A . 13 PHE CG . . . . . . . . . c30643_6pv2 1 . 8 . 3849 . 1 1 13 PHE CZ C 1.466 0.127 -3.811 . . . 1.0 . . . . . . . . . . . . A . 13 PHE CZ . . . . . . . . . c30643_6pv2 1 . 8 . 3850 . 1 1 13 PHE H H 6.193 -0.882 -1.568 . . . 1.0 . . . . . . . . . . . . A . 13 PHE H . . . . . . . . . c30643_6pv2 1 . 8 . 3851 . 1 1 13 PHE HA H 6.316 1.220 -3.627 . . . 1.0 . . . . . . . . . . . . A . 13 PHE HA . . . . . . . . . c30643_6pv2 1 . 8 . 3852 . 1 1 13 PHE HB2 H 4.974 1.359 -0.917 . . . 1.0 . . . . . . . . . . . . A . 13 PHE HB2 . . . . . . . . . c30643_6pv2 1 . 8 . 3853 . 1 1 13 PHE HB3 H 5.053 2.663 -2.100 . . . 1.0 . . . . . . . . . . . . A . 13 PHE HB3 . . . . . . . . . c30643_6pv2 1 . 8 . 3854 . 1 1 13 PHE HD1 H 3.768 2.561 -4.147 . . . 1.0 . . . . . . . . . . . . A . 13 PHE HD1 . . . . . . . . . c30643_6pv2 1 . 8 . 3855 . 1 1 13 PHE HD2 H 3.491 -0.489 -1.205 . . . 1.0 . . . . . . . . . . . . A . 13 PHE HD2 . . . . . . . . . c30643_6pv2 1 . 8 . 3856 . 1 1 13 PHE HE1 H 1.692 1.762 -5.185 . . . 1.0 . . . . . . . . . . . . A . 13 PHE HE1 . . . . . . . . . c30643_6pv2 1 . 8 . 3857 . 1 1 13 PHE HE2 H 1.410 -1.295 -2.233 . . . 1.0 . . . . . . . . . . . . A . 13 PHE HE2 . . . . . . . . . c30643_6pv2 1 . 8 . 3858 . 1 1 13 PHE HZ H 0.568 -0.246 -4.277 . . . 1.0 . . . . . . . . . . . . A . 13 PHE HZ . . . . . . . . . c30643_6pv2 1 . 8 . 3859 . 1 1 13 PHE N N 6.207 -0.479 -2.466 . . . 1.0 . . . . . . . . . . . . A . 13 PHE N . . . . . . . . . c30643_6pv2 1 . 8 . 3860 . 1 1 13 PHE O O 8.011 0.911 -0.930 . . . 1.0 . . . . . . . . . . . . A . 13 PHE O . . . . . . . . . c30643_6pv2 1 . 8 . 3861 . 1 1 14 THR C C 8.785 4.239 -0.718 . . . 1.0 . . . . . . . . . . . . A . 14 THR C . . . . . . . . . c30643_6pv2 1 . 8 . 3862 . 1 1 14 THR CA C 9.188 3.256 -1.817 . . . 1.0 . . . . . . . . . . . . A . 14 THR CA . . . . . . . . . c30643_6pv2 1 . 8 . 3863 . 1 1 14 THR CB C 9.966 4.002 -2.920 . . . 1.0 . . . . . . . . . . . . A . 14 THR CB . . . . . . . . . c30643_6pv2 1 . 8 . 3864 . 1 1 14 THR CG2 C 11.374 4.355 -2.461 . . . 1.0 . . . . . . . . . . . . A . 14 THR CG2 . . . . . . . . . c30643_6pv2 1 . 8 . 3865 . 1 1 14 THR H H 7.584 3.028 -3.165 . . . 1.0 . . . . . . . . . . . . A . 14 THR H . . . . . . . . . c30643_6pv2 1 . 8 . 3866 . 1 1 14 THR HA H 9.824 2.491 -1.398 . . . 1.0 . . . . . . . . . . . . A . 14 THR HA . . . . . . . . . c30643_6pv2 1 . 8 . 3867 . 1 1 14 THR HB H 9.438 4.915 -3.160 . . . 1.0 . . . . . . . . . . . . A . 14 THR HB . . . . . . . . . c30643_6pv2 1 . 8 . 3868 . 1 1 14 THR HG1 H 10.476 2.345 -3.864 . . . 1.0 . . . . . . . . . . . . A . 14 THR HG1 . . . . . . . . . c30643_6pv2 1 . 8 . 3869 . 1 1 14 THR HG21 H 11.885 4.890 -3.247 . . . 1.0 . . . . . . . . . . . . A . 14 THR HG21 . . . . . . . . . c30643_6pv2 1 . 8 . 3870 . 1 1 14 THR HG22 H 11.915 3.450 -2.232 . . . 1.0 . . . . . . . . . . . . A . 14 THR HG22 . . . . . . . . . c30643_6pv2 1 . 8 . 3871 . 1 1 14 THR HG23 H 11.321 4.976 -1.578 . . . 1.0 . . . . . . . . . . . . A . 14 THR HG23 . . . . . . . . . c30643_6pv2 1 . 8 . 3872 . 1 1 14 THR N N 8.013 2.621 -2.382 . . . 1.0 . . . . . . . . . . . . A . 14 THR N . . . . . . . . . c30643_6pv2 1 . 8 . 3873 . 1 1 14 THR O O 9.614 4.683 0.077 . . . 1.0 . . . . . . . . . . . . A . 14 THR O . . . . . . . . . c30643_6pv2 1 . 8 . 3874 . 1 1 14 THR OG1 O 10.042 3.176 -4.090 . . . 1.0 . . . . . . . . . . . . A . 14 THR OG1 . . . . . . . . . c30643_6pv2 1 . 8 . 3875 . 1 1 15 ARG C C 5.749 4.989 0.999 . . . 1.0 . . . . . . . . . . . . A . 15 ARG C . . . . . . . . . c30643_6pv2 1 . 8 . 3876 . 1 1 15 ARG CA C 6.989 5.530 0.292 . . . 1.0 . . . . . . . . . . . . A . 15 ARG CA . . . . . . . . . c30643_6pv2 1 . 8 . 3877 . 1 1 15 ARG CB C 6.669 6.859 -0.400 . . . 1.0 . . . . . . . . . . . . A . 15 ARG CB . . . . . . . . . c30643_6pv2 1 . 8 . 3878 . 1 1 15 ARG CD C 7.544 8.910 -1.577 . . . 1.0 . . . . . . . . . . . . A . 15 ARG CD . . . . . . . . . c30643_6pv2 1 . 8 . 3879 . 1 1 15 ARG CG C 7.900 7.578 -0.934 . . . 1.0 . . . . . . . . . . . . A . 15 ARG CG . . . . . . . . . c30643_6pv2 1 . 8 . 3880 . 1 1 15 ARG CZ C 6.094 9.735 -3.396 . . . 1.0 . . . . . . . . . . . . A . 15 ARG CZ . . . . . . . . . c30643_6pv2 1 . 8 . 3881 . 1 1 15 ARG H H 6.875 4.141 -1.301 . . . 1.0 . . . . . . . . . . . . A . 15 ARG H . . . . . . . . . c30643_6pv2 1 . 8 . 3882 . 1 1 15 ARG HA H 7.762 5.693 1.025 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HA . . . . . . . . . c30643_6pv2 1 . 8 . 3883 . 1 1 15 ARG HB2 H 6.003 6.671 -1.230 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HB2 . . . . . . . . . c30643_6pv2 1 . 8 . 3884 . 1 1 15 ARG HB3 H 6.175 7.510 0.305 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HB3 . . . . . . . . . c30643_6pv2 1 . 8 . 3885 . 1 1 15 ARG HD2 H 6.988 9.504 -0.868 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HD2 . . . . . . . . . c30643_6pv2 1 . 8 . 3886 . 1 1 15 ARG HD3 H 8.458 9.423 -1.836 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HD3 . . . . . . . . . c30643_6pv2 1 . 8 . 3887 . 1 1 15 ARG HE H 6.698 7.838 -3.176 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HE . . . . . . . . . c30643_6pv2 1 . 8 . 3888 . 1 1 15 ARG HG2 H 8.581 7.757 -0.115 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HG2 . . . . . . . . . c30643_6pv2 1 . 8 . 3889 . 1 1 15 ARG HG3 H 8.378 6.949 -1.671 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HG3 . . . . . . . . . c30643_6pv2 1 . 8 . 3890 . 1 1 15 ARG HH11 H 6.624 11.149 -2.041 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HH11 . . . . . . . . . c30643_6pv2 1 . 8 . 3891 . 1 1 15 ARG HH12 H 5.631 11.710 -3.348 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HH12 . . . . . . . . . c30643_6pv2 1 . 8 . 3892 . 1 1 15 ARG HH21 H 5.409 8.576 -4.911 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HH21 . . . . . . . . . c30643_6pv2 1 . 8 . 3893 . 1 1 15 ARG HH22 H 4.943 10.245 -4.983 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HH22 . . . . . . . . . c30643_6pv2 1 . 8 . 3894 . 1 1 15 ARG N N 7.498 4.568 -0.675 . . . 1.0 . . . . . . . . . . . . A . 15 ARG N . . . . . . . . . c30643_6pv2 1 . 8 . 3895 . 1 1 15 ARG NE N 6.740 8.742 -2.786 . . . 1.0 . . . . . . . . . . . . A . 15 ARG NE . . . . . . . . . c30643_6pv2 1 . 8 . 3896 . 1 1 15 ARG NH1 N 6.119 10.962 -2.888 . . . 1.0 . . . . . . . . . . . . A . 15 ARG NH1 . . . . . . . . . c30643_6pv2 1 . 8 . 3897 . 1 1 15 ARG NH2 N 5.428 9.499 -4.519 . . . 1.0 . . . . . . . . . . . . A . 15 ARG NH2 . . . . . . . . . c30643_6pv2 1 . 8 . 3898 . 1 1 15 ARG O O 4.844 4.426 0.373 . . . 1.0 . . . . . . . . . . . . A . 15 ARG O . . . . . . . . . c30643_6pv2 1 . 8 . 3899 . 1 1 16 SER C C 3.315 5.339 2.817 . . . 1.0 . . . . . . . . . . . . A . 16 SER C . . . . . . . . . c30643_6pv2 1 . 8 . 3900 . 1 1 16 SER CA C 4.644 4.666 3.160 . . . 1.0 . . . . . . . . . . . . A . 16 SER CA . . . . . . . . . c30643_6pv2 1 . 8 . 3901 . 1 1 16 SER CB C 4.984 4.884 4.639 . . . 1.0 . . . . . . . . . . . . A . 16 SER CB . . . . . . . . . c30643_6pv2 1 . 8 . 3902 . 1 1 16 SER H H 6.463 5.666 2.739 . . . 1.0 . . . . . . . . . . . . A . 16 SER H . . . . . . . . . c30643_6pv2 1 . 8 . 3903 . 1 1 16 SER HA H 4.556 3.605 2.976 . . . 1.0 . . . . . . . . . . . . A . 16 SER HA . . . . . . . . . c30643_6pv2 1 . 8 . 3904 . 1 1 16 SER HB2 H 5.922 4.397 4.867 . . . 1.0 . . . . . . . . . . . . A . 16 SER HB2 . . . . . . . . . c30643_6pv2 1 . 8 . 3905 . 1 1 16 SER HB3 H 5.076 5.941 4.832 . . . 1.0 . . . . . . . . . . . . A . 16 SER HB3 . . . . . . . . . c30643_6pv2 1 . 8 . 3906 . 1 1 16 SER HG H 3.903 4.910 6.271 . . . 1.0 . . . . . . . . . . . . A . 16 SER HG . . . . . . . . . c30643_6pv2 1 . 8 . 3907 . 1 1 16 SER N N 5.724 5.172 2.318 . . . 1.0 . . . . . . . . . . . . A . 16 SER N . . . . . . . . . c30643_6pv2 1 . 8 . 3908 . 1 1 16 SER O O 2.250 4.726 2.927 . . . 1.0 . . . . . . . . . . . . A . 16 SER O . . . . . . . . . c30643_6pv2 1 . 8 . 3909 . 1 1 16 SER OG O 3.982 4.352 5.489 . . . 1.0 . . . . . . . . . . . . A . 16 SER OG . . . . . . . . . c30643_6pv2 1 . 8 . 3910 . 1 1 17 ASP C C 1.586 6.695 0.739 . . . 1.0 . . . . . . . . . . . . A . 17 ASP C . . . . . . . . . c30643_6pv2 1 . 8 . 3911 . 1 1 17 ASP CA C 2.193 7.334 1.975 . . . 1.0 . . . . . . . . . . . . A . 17 ASP CA . . . . . . . . . c30643_6pv2 1 . 8 . 3912 . 1 1 17 ASP CB C 2.518 8.803 1.687 . . . 1.0 . . . . . . . . . . . . A . 17 ASP CB . . . . . . . . . c30643_6pv2 1 . 8 . 3913 . 1 1 17 ASP CG C 2.813 9.603 2.938 . . . 1.0 . . . . . . . . . . . . A . 17 ASP CG . . . . . . . . . c30643_6pv2 1 . 8 . 3914 . 1 1 17 ASP H H 4.254 7.050 2.376 . . . 1.0 . . . . . . . . . . . . A . 17 ASP H . . . . . . . . . c30643_6pv2 1 . 8 . 3915 . 1 1 17 ASP HA H 1.473 7.283 2.777 . . . 1.0 . . . . . . . . . . . . A . 17 ASP HA . . . . . . . . . c30643_6pv2 1 . 8 . 3916 . 1 1 17 ASP HB2 H 3.380 8.852 1.043 . . . 1.0 . . . . . . . . . . . . A . 17 ASP HB2 . . . . . . . . . c30643_6pv2 1 . 8 . 3917 . 1 1 17 ASP HB3 H 1.678 9.254 1.184 . . . 1.0 . . . . . . . . . . . . A . 17 ASP HB3 . . . . . . . . . c30643_6pv2 1 . 8 . 3918 . 1 1 17 ASP N N 3.383 6.600 2.396 . . . 1.0 . . . . . . . . . . . . A . 17 ASP N . . . . . . . . . c30643_6pv2 1 . 8 . 3919 . 1 1 17 ASP O O 0.367 6.684 0.569 . . . 1.0 . . . . . . . . . . . . A . 17 ASP O . . . . . . . . . c30643_6pv2 1 . 8 . 3920 . 1 1 17 ASP OD1 O 1.870 10.182 3.519 . . . 1.0 . . . . . . . . . . . . A . 17 ASP OD1 . . . . . . . . . c30643_6pv2 1 . 8 . 3921 . 1 1 17 ASP OD2 O 3.985 9.653 3.357 . . . 1.0 . . . . . . . . . . . . A . 17 ASP OD2 . . . . . . . . . c30643_6pv2 1 . 8 . 3922 . 1 1 18 GLU C C 1.428 4.116 -1.010 . . . 1.0 . . . . . . . . . . . . A . 18 GLU C . . . . . . . . . c30643_6pv2 1 . 8 . 3923 . 1 1 18 GLU CA C 1.999 5.487 -1.328 . . . 1.0 . . . . . . . . . . . . A . 18 GLU CA . . . . . . . . . c30643_6pv2 1 . 8 . 3924 . 1 1 18 GLU CB C 3.141 5.373 -2.334 . . . 1.0 . . . . . . . . . . . . A . 18 GLU CB . . . . . . . . . c30643_6pv2 1 . 8 . 3925 . 1 1 18 GLU CD C 2.353 7.312 -3.738 . . . 1.0 . . . . . . . . . . . . A . 18 GLU CD . . . . . . . . . c30643_6pv2 1 . 8 . 3926 . 1 1 18 GLU CG C 3.511 6.698 -2.974 . . . 1.0 . . . . . . . . . . . . A . 18 GLU CG . . . . . . . . . c30643_6pv2 1 . 8 . 3927 . 1 1 18 GLU H H 3.401 6.192 0.080 . . . 1.0 . . . . . . . . . . . . A . 18 GLU H . . . . . . . . . c30643_6pv2 1 . 8 . 3928 . 1 1 18 GLU HA H 1.216 6.090 -1.761 . . . 1.0 . . . . . . . . . . . . A . 18 GLU HA . . . . . . . . . c30643_6pv2 1 . 8 . 3929 . 1 1 18 GLU HB2 H 4.014 4.984 -1.832 . . . 1.0 . . . . . . . . . . . . A . 18 GLU HB2 . . . . . . . . . c30643_6pv2 1 . 8 . 3930 . 1 1 18 GLU HB3 H 2.851 4.689 -3.117 . . . 1.0 . . . . . . . . . . . . A . 18 GLU HB3 . . . . . . . . . c30643_6pv2 1 . 8 . 3931 . 1 1 18 GLU HG2 H 3.815 7.387 -2.198 . . . 1.0 . . . . . . . . . . . . A . 18 GLU HG2 . . . . . . . . . c30643_6pv2 1 . 8 . 3932 . 1 1 18 GLU HG3 H 4.330 6.536 -3.658 . . . 1.0 . . . . . . . . . . . . A . 18 GLU HG3 . . . . . . . . . c30643_6pv2 1 . 8 . 3933 . 1 1 18 GLU N N 2.444 6.153 -0.115 . . . 1.0 . . . . . . . . . . . . A . 18 GLU N . . . . . . . . . c30643_6pv2 1 . 8 . 3934 . 1 1 18 GLU O O 0.482 3.672 -1.653 . . . 1.0 . . . . . . . . . . . . A . 18 GLU O . . . . . . . . . c30643_6pv2 1 . 8 . 3935 . 1 1 18 GLU OE1 O 1.751 8.284 -3.236 . . . 1.0 . . . . . . . . . . . . A . 18 GLU OE1 . . . . . . . . . c30643_6pv2 1 . 8 . 3936 . 1 1 18 GLU OE2 O 2.038 6.827 -4.842 . . . 1.0 . . . . . . . . . . . . A . 18 GLU OE2 . . . . . . . . . c30643_6pv2 1 . 8 . 3937 . 1 1 19 LEU C C 0.053 2.392 1.030 . . . 1.0 . . . . . . . . . . . . A . 19 LEU C . . . . . . . . . c30643_6pv2 1 . 8 . 3938 . 1 1 19 LEU CA C 1.447 2.180 0.449 . . . 1.0 . . . . . . . . . . . . A . 19 LEU CA . . . . . . . . . c30643_6pv2 1 . 8 . 3939 . 1 1 19 LEU CB C 2.359 1.526 1.490 . . . 1.0 . . . . . . . . . . . . A . 19 LEU CB . . . . . . . . . c30643_6pv2 1 . 8 . 3940 . 1 1 19 LEU CD1 C 1.566 -0.831 1.107 . . . 1.0 . . . . . . . . . . . . A . 19 LEU CD1 . . . . . . . . . c30643_6pv2 1 . 8 . 3941 . 1 1 19 LEU CD2 C 2.706 -0.233 3.251 . . . 1.0 . . . . . . . . . . . . A . 19 LEU CD2 . . . . . . . . . c30643_6pv2 1 . 8 . 3942 . 1 1 19 LEU CG C 1.789 0.262 2.143 . . . 1.0 . . . . . . . . . . . . A . 19 LEU CG . . . . . . . . . c30643_6pv2 1 . 8 . 3943 . 1 1 19 LEU H H 2.814 3.805 0.407 . . . 1.0 . . . . . . . . . . . . A . 19 LEU H . . . . . . . . . c30643_6pv2 1 . 8 . 3944 . 1 1 19 LEU HA H 1.366 1.527 -0.407 . . . 1.0 . . . . . . . . . . . . A . 19 LEU HA . . . . . . . . . c30643_6pv2 1 . 8 . 3945 . 1 1 19 LEU HB2 H 3.294 1.272 1.009 . . . 1.0 . . . . . . . . . . . . A . 19 LEU HB2 . . . . . . . . . c30643_6pv2 1 . 8 . 3946 . 1 1 19 LEU HB3 H 2.559 2.245 2.266 . . . 1.0 . . . . . . . . . . . . A . 19 LEU HB3 . . . . . . . . . c30643_6pv2 1 . 8 . 3947 . 1 1 19 LEU HD11 H 2.502 -1.062 0.621 . . . 1.0 . . . . . . . . . . . . A . 19 LEU HD11 . . . . . . . . . c30643_6pv2 1 . 8 . 3948 . 1 1 19 LEU HD12 H 0.850 -0.491 0.372 . . . 1.0 . . . . . . . . . . . . A . 19 LEU HD12 . . . . . . . . . c30643_6pv2 1 . 8 . 3949 . 1 1 19 LEU HD13 H 1.187 -1.717 1.595 . . . 1.0 . . . . . . . . . . . . A . 19 LEU HD13 . . . . . . . . . c30643_6pv2 1 . 8 . 3950 . 1 1 19 LEU HD21 H 2.941 0.585 3.917 . . . 1.0 . . . . . . . . . . . . A . 19 LEU HD21 . . . . . . . . . c30643_6pv2 1 . 8 . 3951 . 1 1 19 LEU HD22 H 3.615 -0.623 2.820 . . . 1.0 . . . . . . . . . . . . A . 19 LEU HD22 . . . . . . . . . c30643_6pv2 1 . 8 . 3952 . 1 1 19 LEU HD23 H 2.209 -1.015 3.805 . . . 1.0 . . . . . . . . . . . . A . 19 LEU HD23 . . . . . . . . . c30643_6pv2 1 . 8 . 3953 . 1 1 19 LEU HG H 0.831 0.499 2.585 . . . 1.0 . . . . . . . . . . . . A . 19 LEU HG . . . . . . . . . c30643_6pv2 1 . 8 . 3954 . 1 1 19 LEU N N 2.000 3.447 -0.013 . . . 1.0 . . . . . . . . . . . . A . 19 LEU N . . . . . . . . . c30643_6pv2 1 . 8 . 3955 . 1 1 19 LEU O O -0.877 1.659 0.705 . . . 1.0 . . . . . . . . . . . . A . 19 LEU O . . . . . . . . . c30643_6pv2 1 . 8 . 3956 . 1 1 20 GLN C C -2.378 4.137 1.373 . . . 1.0 . . . . . . . . . . . . A . 20 GLN C . . . . . . . . . c30643_6pv2 1 . 8 . 3957 . 1 1 20 GLN CA C -1.387 3.741 2.466 . . . 1.0 . . . . . . . . . . . . A . 20 GLN CA . . . . . . . . . c30643_6pv2 1 . 8 . 3958 . 1 1 20 GLN CB C -1.237 4.872 3.486 . . . 1.0 . . . . . . . . . . . . A . 20 GLN CB . . . . . . . . . c30643_6pv2 1 . 8 . 3959 . 1 1 20 GLN CD C -2.391 6.384 5.155 . . . 1.0 . . . . . . . . . . . . A . 20 GLN CD . . . . . . . . . c30643_6pv2 1 . 8 . 3960 . 1 1 20 GLN CG C -2.562 5.367 4.045 . . . 1.0 . . . . . . . . . . . . A . 20 GLN CG . . . . . . . . . c30643_6pv2 1 . 8 . 3961 . 1 1 20 GLN H H 0.698 3.945 2.120 . . . 1.0 . . . . . . . . . . . . A . 20 GLN H . . . . . . . . . c30643_6pv2 1 . 8 . 3962 . 1 1 20 GLN HA H -1.755 2.858 2.967 . . . 1.0 . . . . . . . . . . . . A . 20 GLN HA . . . . . . . . . c30643_6pv2 1 . 8 . 3963 . 1 1 20 GLN HB2 H -0.635 4.520 4.311 . . . 1.0 . . . . . . . . . . . . A . 20 GLN HB2 . . . . . . . . . c30643_6pv2 1 . 8 . 3964 . 1 1 20 GLN HB3 H -0.735 5.705 3.015 . . . 1.0 . . . . . . . . . . . . A . 20 GLN HB3 . . . . . . . . . c30643_6pv2 1 . 8 . 3965 . 1 1 20 GLN HE21 H -4.079 7.289 4.624 . . . 1.0 . . . . . . . . . . . . A . 20 GLN HE21 . . . . . . . . . c30643_6pv2 1 . 8 . 3966 . 1 1 20 GLN HE22 H -3.247 7.973 5.977 . . . 1.0 . . . . . . . . . . . . A . 20 GLN HE22 . . . . . . . . . c30643_6pv2 1 . 8 . 3967 . 1 1 20 GLN HG2 H -3.126 5.823 3.245 . . . 1.0 . . . . . . . . . . . . A . 20 GLN HG2 . . . . . . . . . c30643_6pv2 1 . 8 . 3968 . 1 1 20 GLN HG3 H -3.110 4.523 4.433 . . . 1.0 . . . . . . . . . . . . A . 20 GLN HG3 . . . . . . . . . c30643_6pv2 1 . 8 . 3969 . 1 1 20 GLN N N -0.090 3.409 1.878 . . . 1.0 . . . . . . . . . . . . A . 20 GLN N . . . . . . . . . c30643_6pv2 1 . 8 . 3970 . 1 1 20 GLN NE2 N -3.332 7.309 5.263 . . . 1.0 . . . . . . . . . . . . A . 20 GLN NE2 . . . . . . . . . c30643_6pv2 1 . 8 . 3971 . 1 1 20 GLN O O -3.540 3.711 1.378 . . . 1.0 . . . . . . . . . . . . A . 20 GLN O . . . . . . . . . c30643_6pv2 1 . 8 . 3972 . 1 1 20 GLN OE1 O -1.415 6.344 5.904 . . . 1.0 . . . . . . . . . . . . A . 20 GLN OE1 . . . . . . . . . c30643_6pv2 1 . 8 . 3973 . 1 1 21 ARG C C -3.206 4.098 -1.428 . . . 1.0 . . . . . . . . . . . . A . 21 ARG C . . . . . . . . . c30643_6pv2 1 . 8 . 3974 . 1 1 21 ARG CA C -2.663 5.340 -0.737 . . . 1.0 . . . . . . . . . . . . A . 21 ARG CA . . . . . . . . . c30643_6pv2 1 . 8 . 3975 . 1 1 21 ARG CB C -1.757 6.119 -1.694 . . . 1.0 . . . . . . . . . . . . A . 21 ARG CB . . . . . . . . . c30643_6pv2 1 . 8 . 3976 . 1 1 21 ARG CD C -1.442 7.323 -3.859 . . . 1.0 . . . . . . . . . . . . A . 21 ARG CD . . . . . . . . . c30643_6pv2 1 . 8 . 3977 . 1 1 21 ARG CG C -2.442 6.624 -2.951 . . . 1.0 . . . . . . . . . . . . A . 21 ARG CG . . . . . . . . . c30643_6pv2 1 . 8 . 3978 . 1 1 21 ARG CZ C -1.417 8.346 -6.104 . . . 1.0 . . . . . . . . . . . . A . 21 ARG CZ . . . . . . . . . c30643_6pv2 1 . 8 . 3979 . 1 1 21 ARG H H -0.985 5.312 0.554 . . . 1.0 . . . . . . . . . . . . A . 21 ARG H . . . . . . . . . c30643_6pv2 1 . 8 . 3980 . 1 1 21 ARG HA H -3.483 5.967 -0.425 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HA . . . . . . . . . c30643_6pv2 1 . 8 . 3981 . 1 1 21 ARG HB2 H -1.354 6.972 -1.171 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HB2 . . . . . . . . . c30643_6pv2 1 . 8 . 3982 . 1 1 21 ARG HB3 H -0.942 5.480 -1.993 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HB3 . . . . . . . . . c30643_6pv2 1 . 8 . 3983 . 1 1 21 ARG HD2 H -0.957 8.109 -3.301 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HD2 . . . . . . . . . c30643_6pv2 1 . 8 . 3984 . 1 1 21 ARG HD3 H -0.705 6.603 -4.180 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HD3 . . . . . . . . . c30643_6pv2 1 . 8 . 3985 . 1 1 21 ARG HE H -3.058 7.986 -5.021 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HE . . . . . . . . . c30643_6pv2 1 . 8 . 3986 . 1 1 21 ARG HG2 H -2.874 5.787 -3.479 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HG2 . . . . . . . . . c30643_6pv2 1 . 8 . 3987 . 1 1 21 ARG HG3 H -3.218 7.321 -2.675 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HG3 . . . . . . . . . c30643_6pv2 1 . 8 . 3988 . 1 1 21 ARG HH11 H 0.425 7.821 -5.409 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HH11 . . . . . . . . . c30643_6pv2 1 . 8 . 3989 . 1 1 21 ARG HH12 H 0.400 8.567 -6.976 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HH12 . . . . . . . . . c30643_6pv2 1 . 8 . 3990 . 1 1 21 ARG HH21 H -3.084 8.980 -7.071 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HH21 . . . . . . . . . c30643_6pv2 1 . 8 . 3991 . 1 1 21 ARG HH22 H -1.593 9.233 -7.920 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HH22 . . . . . . . . . c30643_6pv2 1 . 8 . 3992 . 1 1 21 ARG N N -1.895 4.954 0.441 . . . 1.0 . . . . . . . . . . . . A . 21 ARG N . . . . . . . . . c30643_6pv2 1 . 8 . 3993 . 1 1 21 ARG NE N -2.079 7.906 -5.037 . . . 1.0 . . . . . . . . . . . . A . 21 ARG NE . . . . . . . . . c30643_6pv2 1 . 8 . 3994 . 1 1 21 ARG NH1 N -0.092 8.238 -6.169 . . . 1.0 . . . . . . . . . . . . A . 21 ARG NH1 . . . . . . . . . c30643_6pv2 1 . 8 . 3995 . 1 1 21 ARG NH2 N -2.085 8.896 -7.112 . . . 1.0 . . . . . . . . . . . . A . 21 ARG NH2 . . . . . . . . . c30643_6pv2 1 . 8 . 3996 . 1 1 21 ARG O O -4.413 3.963 -1.644 . . . 1.0 . . . . . . . . . . . . A . 21 ARG O . . . . . . . . . c30643_6pv2 1 . 8 . 3997 . 1 1 22 HIS C C -3.658 1.145 -1.534 . . . 1.0 . . . . . . . . . . . . A . 22 HIS C . . . . . . . . . c30643_6pv2 1 . 8 . 3998 . 1 1 22 HIS CA C -2.642 1.923 -2.370 . . . 1.0 . . . . . . . . . . . . A . 22 HIS CA . . . . . . . . . c30643_6pv2 1 . 8 . 3999 . 1 1 22 HIS CB C -1.370 1.096 -2.584 . . . 1.0 . . . . . . . . . . . . A . 22 HIS CB . . . . . . . . . c30643_6pv2 1 . 8 . 4000 . 1 1 22 HIS CD2 C -1.847 -1.399 -2.159 . . . 1.0 . . . . . . . . . . . . A . 22 HIS CD2 . . . . . . . . . c30643_6pv2 1 . 8 . 4001 . 1 1 22 HIS CE1 C -2.042 -2.098 -4.211 . . . 1.0 . . . . . . . . . . . . A . 22 HIS CE1 . . . . . . . . . c30643_6pv2 1 . 8 . 4002 . 1 1 22 HIS CG C -1.629 -0.327 -2.960 . . . 1.0 . . . . . . . . . . . . A . 22 HIS CG . . . . . . . . . c30643_6pv2 1 . 8 . 4003 . 1 1 22 HIS H H -1.353 3.360 -1.531 . . . 1.0 . . . . . . . . . . . . A . 22 HIS H . . . . . . . . . c30643_6pv2 1 . 8 . 4004 . 1 1 22 HIS HA H -3.081 2.144 -3.331 . . . 1.0 . . . . . . . . . . . . A . 22 HIS HA . . . . . . . . . c30643_6pv2 1 . 8 . 4005 . 1 1 22 HIS HB2 H -0.787 1.547 -3.372 . . . 1.0 . . . . . . . . . . . . A . 22 HIS HB2 . . . . . . . . . c30643_6pv2 1 . 8 . 4006 . 1 1 22 HIS HB3 H -0.791 1.099 -1.670 . . . 1.0 . . . . . . . . . . . . A . 22 HIS HB3 . . . . . . . . . c30643_6pv2 1 . 8 . 4007 . 1 1 22 HIS HD1 H -1.627 -0.251 -5.082 . . . 1.0 . . . . . . . . . . . . A . 22 HIS HD1 . . . . . . . . . c30643_6pv2 1 . 8 . 4008 . 1 1 22 HIS HD2 H -1.790 -1.417 -1.082 . . . 1.0 . . . . . . . . . . . . A . 22 HIS HD2 . . . . . . . . . c30643_6pv2 1 . 8 . 4009 . 1 1 22 HIS HE1 H -2.192 -2.738 -5.065 . . . 1.0 . . . . . . . . . . . . A . 22 HIS HE1 . . . . . . . . . c30643_6pv2 1 . 8 . 4010 . 1 1 22 HIS N N -2.299 3.182 -1.737 . . . 1.0 . . . . . . . . . . . . A . 22 HIS N . . . . . . . . . c30643_6pv2 1 . 8 . 4011 . 1 1 22 HIS ND1 N -1.743 -0.788 -4.266 . . . 1.0 . . . . . . . . . . . . A . 22 HIS ND1 . . . . . . . . . c30643_6pv2 1 . 8 . 4012 . 1 1 22 HIS NE2 N -2.110 -2.481 -2.961 . . . 1.0 . . . . . . . . . . . . A . 22 HIS NE2 . . . . . . . . . c30643_6pv2 1 . 8 . 4013 . 1 1 22 HIS O O -4.628 0.623 -2.065 . . . 1.0 . . . . . . . . . . . . A . 22 HIS O . . . . . . . . . c30643_6pv2 1 . 8 . 4014 . 1 1 23 LYS C C -5.752 0.859 0.577 . . . 1.0 . . . . . . . . . . . . A . 23 LYS C . . . . . . . . . c30643_6pv2 1 . 8 . 4015 . 1 1 23 LYS CA C -4.317 0.358 0.680 . . . 1.0 . . . . . . . . . . . . A . 23 LYS CA . . . . . . . . . c30643_6pv2 1 . 8 . 4016 . 1 1 23 LYS CB C -3.836 0.480 2.125 . . . 1.0 . . . . . . . . . . . . A . 23 LYS CB . . . . . . . . . c30643_6pv2 1 . 8 . 4017 . 1 1 23 LYS CD C -2.787 -1.798 2.304 . . . 1.0 . . . . . . . . . . . . A . 23 LYS CD . . . . . . . . . c30643_6pv2 1 . 8 . 4018 . 1 1 23 LYS CE C -1.547 -2.572 2.712 . . . 1.0 . . . . . . . . . . . . A . 23 LYS CE . . . . . . . . . c30643_6pv2 1 . 8 . 4019 . 1 1 23 LYS CG C -2.568 -0.299 2.427 . . . 1.0 . . . . . . . . . . . . A . 23 LYS CG . . . . . . . . . c30643_6pv2 1 . 8 . 4020 . 1 1 23 LYS H H -2.637 1.534 0.139 . . . 1.0 . . . . . . . . . . . . A . 23 LYS H . . . . . . . . . c30643_6pv2 1 . 8 . 4021 . 1 1 23 LYS HA H -4.297 -0.680 0.393 . . . 1.0 . . . . . . . . . . . . A . 23 LYS HA . . . . . . . . . c30643_6pv2 1 . 8 . 4022 . 1 1 23 LYS HB2 H -3.649 1.522 2.339 . . . 1.0 . . . . . . . . . . . . A . 23 LYS HB2 . . . . . . . . . c30643_6pv2 1 . 8 . 4023 . 1 1 23 LYS HB3 H -4.615 0.122 2.779 . . . 1.0 . . . . . . . . . . . . A . 23 LYS HB3 . . . . . . . . . c30643_6pv2 1 . 8 . 4024 . 1 1 23 LYS HD2 H -3.606 -2.085 2.947 . . . 1.0 . . . . . . . . . . . . A . 23 LYS HD2 . . . . . . . . . c30643_6pv2 1 . 8 . 4025 . 1 1 23 LYS HD3 H -3.030 -2.034 1.281 . . . 1.0 . . . . . . . . . . . . A . 23 LYS HD3 . . . . . . . . . c30643_6pv2 1 . 8 . 4026 . 1 1 23 LYS HE2 H -1.723 -3.625 2.552 . . . 1.0 . . . . . . . . . . . . A . 23 LYS HE2 . . . . . . . . . c30643_6pv2 1 . 8 . 4027 . 1 1 23 LYS HE3 H -0.719 -2.248 2.097 . . . 1.0 . . . . . . . . . . . . A . 23 LYS HE3 . . . . . . . . . c30643_6pv2 1 . 8 . 4028 . 1 1 23 LYS HG2 H -1.797 -0.003 1.731 . . . 1.0 . . . . . . . . . . . . A . 23 LYS HG2 . . . . . . . . . c30643_6pv2 1 . 8 . 4029 . 1 1 23 LYS HG3 H -2.251 -0.073 3.434 . . . 1.0 . . . . . . . . . . . . A . 23 LYS HG3 . . . . . . . . . c30643_6pv2 1 . 8 . 4030 . 1 1 23 LYS HZ1 H -1.058 -1.335 4.324 . . . 1.0 . . . . . . . . . . . . A . 23 LYS HZ1 . . . . . . . . . c30643_6pv2 1 . 8 . 4031 . 1 1 23 LYS HZ2 H -0.337 -2.862 4.387 . . . 1.0 . . . . . . . . . . . . A . 23 LYS HZ2 . . . . . . . . . c30643_6pv2 1 . 8 . 4032 . 1 1 23 LYS HZ3 H -1.977 -2.689 4.750 . . . 1.0 . . . . . . . . . . . . A . 23 LYS HZ3 . . . . . . . . . c30643_6pv2 1 . 8 . 4033 . 1 1 23 LYS N N -3.430 1.085 -0.226 . . . 1.0 . . . . . . . . . . . . A . 23 LYS N . . . . . . . . . c30643_6pv2 1 . 8 . 4034 . 1 1 23 LYS NZ N -1.204 -2.348 4.140 . . . 1.0 . . . . . . . . . . . . A . 23 LYS NZ . . . . . . . . . c30643_6pv2 1 . 8 . 4035 . 1 1 23 LYS O O -6.700 0.097 0.789 . . . 1.0 . . . . . . . . . . . . A . 23 LYS O . . . . . . . . . c30643_6pv2 1 . 8 . 4036 . 1 1 24 ARG C C -8.013 2.088 -1.080 . . . 1.0 . . . . . . . . . . . . A . 24 ARG C . . . . . . . . . c30643_6pv2 1 . 8 . 4037 . 1 1 24 ARG CA C -7.244 2.714 0.086 . . . 1.0 . . . . . . . . . . . . A . 24 ARG CA . . . . . . . . . c30643_6pv2 1 . 8 . 4038 . 1 1 24 ARG CB C -7.167 4.231 -0.085 . . . 1.0 . . . . . . . . . . . . A . 24 ARG CB . . . . . . . . . c30643_6pv2 1 . 8 . 4039 . 1 1 24 ARG CD C -6.819 6.477 0.982 . . . 1.0 . . . . . . . . . . . . A . 24 ARG CD . . . . . . . . . c30643_6pv2 1 . 8 . 4040 . 1 1 24 ARG CG C -6.815 4.970 1.194 . . . 1.0 . . . . . . . . . . . . A . 24 ARG CG . . . . . . . . . c30643_6pv2 1 . 8 . 4041 . 1 1 24 ARG CZ C -8.666 8.114 0.842 . . . 1.0 . . . . . . . . . . . . A . 24 ARG CZ . . . . . . . . . c30643_6pv2 1 . 8 . 4042 . 1 1 24 ARG H H -5.114 2.699 0.066 . . . 1.0 . . . . . . . . . . . . A . 24 ARG H . . . . . . . . . c30643_6pv2 1 . 8 . 4043 . 1 1 24 ARG HA H -7.783 2.500 0.997 . . . 1.0 . . . . . . . . . . . . A . 24 ARG HA . . . . . . . . . c30643_6pv2 1 . 8 . 4044 . 1 1 24 ARG HB2 H -6.415 4.460 -0.825 . . . 1.0 . . . . . . . . . . . . A . 24 ARG HB2 . . . . . . . . . c30643_6pv2 1 . 8 . 4045 . 1 1 24 ARG HB3 H -8.123 4.592 -0.432 . . . 1.0 . . . . . . . . . . . . A . 24 ARG HB3 . . . . . . . . . c30643_6pv2 1 . 8 . 4046 . 1 1 24 ARG HD2 H -6.599 6.962 1.921 . . . 1.0 . . . . . . . . . . . . A . 24 ARG HD2 . . . . . . . . . c30643_6pv2 1 . 8 . 4047 . 1 1 24 ARG HD3 H -6.054 6.729 0.262 . . . 1.0 . . . . . . . . . . . . A . 24 ARG HD3 . . . . . . . . . c30643_6pv2 1 . 8 . 4048 . 1 1 24 ARG HE H -8.584 6.386 -0.160 . . . 1.0 . . . . . . . . . . . . A . 24 ARG HE . . . . . . . . . c30643_6pv2 1 . 8 . 4049 . 1 1 24 ARG HG2 H -7.541 4.721 1.953 . . . 1.0 . . . . . . . . . . . . A . 24 ARG HG2 . . . . . . . . . c30643_6pv2 1 . 8 . 4050 . 1 1 24 ARG HG3 H -5.832 4.662 1.518 . . . 1.0 . . . . . . . . . . . . A . 24 ARG HG3 . . . . . . . . . c30643_6pv2 1 . 8 . 4051 . 1 1 24 ARG HH11 H -8.488 9.774 1.994 . . . 1.0 . . . . . . . . . . . . A . 24 ARG HH11 . . . . . . . . . c30643_6pv2 1 . 8 . 4052 . 1 1 24 ARG HH12 H -7.199 8.627 2.150 . . . 1.0 . . . . . . . . . . . . A . 24 ARG HH12 . . . . . . . . . c30643_6pv2 1 . 8 . 4053 . 1 1 24 ARG HH21 H -10.253 9.346 0.572 . . . 1.0 . . . . . . . . . . . . A . 24 ARG HH21 . . . . . . . . . c30643_6pv2 1 . 8 . 4054 . 1 1 24 ARG HH22 H -10.284 7.879 -0.356 . . . 1.0 . . . . . . . . . . . . A . 24 ARG HH22 . . . . . . . . . c30643_6pv2 1 . 8 . 4055 . 1 1 24 ARG N N -5.912 2.134 0.228 . . . 1.0 . . . . . . . . . . . . A . 24 ARG N . . . . . . . . . c30643_6pv2 1 . 8 . 4056 . 1 1 24 ARG NE N -8.110 6.957 0.488 . . . 1.0 . . . . . . . . . . . . A . 24 ARG NE . . . . . . . . . c30643_6pv2 1 . 8 . 4057 . 1 1 24 ARG NH1 N -8.070 8.902 1.731 . . . 1.0 . . . . . . . . . . . . A . 24 ARG NH1 . . . . . . . . . c30643_6pv2 1 . 8 . 4058 . 1 1 24 ARG NH2 N -9.827 8.476 0.312 . . . 1.0 . . . . . . . . . . . . A . 24 ARG NH2 . . . . . . . . . c30643_6pv2 1 . 8 . 4059 . 1 1 24 ARG O O -9.204 2.353 -1.255 . . . 1.0 . . . . . . . . . . . . A . 24 ARG O . . . . . . . . . c30643_6pv2 1 . 8 . 4060 . 1 1 25 THR C C -8.634 -0.738 -2.389 . . . 1.0 . . . . . . . . . . . . A . 25 THR C . . . . . . . . . c30643_6pv2 1 . 8 . 4061 . 1 1 25 THR CA C -8.007 0.541 -2.948 . . . 1.0 . . . . . . . . . . . . A . 25 THR CA . . . . . . . . . c30643_6pv2 1 . 8 . 4062 . 1 1 25 THR CB C -7.048 0.205 -4.125 . . . 1.0 . . . . . . . . . . . . A . 25 THR CB . . . . . . . . . c30643_6pv2 1 . 8 . 4063 . 1 1 25 THR CG2 C -6.251 -1.067 -3.864 . . . 1.0 . . . . . . . . . . . . A . 25 THR CG2 . . . . . . . . . c30643_6pv2 1 . 8 . 4064 . 1 1 25 THR H H -6.372 1.147 -1.746 . . . 1.0 . . . . . . . . . . . . A . 25 THR H . . . . . . . . . c30643_6pv2 1 . 8 . 4065 . 1 1 25 THR HA H -8.796 1.173 -3.326 . . . 1.0 . . . . . . . . . . . . A . 25 THR HA . . . . . . . . . c30643_6pv2 1 . 8 . 4066 . 1 1 25 THR HB H -6.356 1.025 -4.252 . . . 1.0 . . . . . . . . . . . . A . 25 THR HB . . . . . . . . . c30643_6pv2 1 . 8 . 4067 . 1 1 25 THR HG1 H -8.146 0.893 -5.613 . . . 1.0 . . . . . . . . . . . . A . 25 THR HG1 . . . . . . . . . c30643_6pv2 1 . 8 . 4068 . 1 1 25 THR HG21 H -5.627 -1.283 -4.719 . . . 1.0 . . . . . . . . . . . . A . 25 THR HG21 . . . . . . . . . c30643_6pv2 1 . 8 . 4069 . 1 1 25 THR HG22 H -6.931 -1.888 -3.697 . . . 1.0 . . . . . . . . . . . . A . 25 THR HG22 . . . . . . . . . c30643_6pv2 1 . 8 . 4070 . 1 1 25 THR HG23 H -5.631 -0.930 -2.991 . . . 1.0 . . . . . . . . . . . . A . 25 THR HG23 . . . . . . . . . c30643_6pv2 1 . 8 . 4071 . 1 1 25 THR N N -7.339 1.266 -1.879 . . . 1.0 . . . . . . . . . . . . A . 25 THR N . . . . . . . . . c30643_6pv2 1 . 8 . 4072 . 1 1 25 THR O O -9.649 -1.220 -2.895 . . . 1.0 . . . . . . . . . . . . A . 25 THR O . . . . . . . . . c30643_6pv2 1 . 8 . 4073 . 1 1 25 THR OG1 O -7.797 0.036 -5.336 . . . 1.0 . . . . . . . . . . . . A . 25 THR OG1 . . . . . . . . . c30643_6pv2 1 . 8 . 4074 . 1 1 26 HIS C C -9.678 -2.075 0.282 . . . 1.0 . . . . . . . . . . . . A . 26 HIS C . . . . . . . . . c30643_6pv2 1 . 8 . 4075 . 1 1 26 HIS CA C -8.560 -2.460 -0.672 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CA . . . . . . . . . c30643_6pv2 1 . 8 . 4076 . 1 1 26 HIS CB C -7.458 -3.201 0.093 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CB . . . . . . . . . c30643_6pv2 1 . 8 . 4077 . 1 1 26 HIS CD2 C -5.069 -3.474 -0.863 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CD2 . . . . . . . . . c30643_6pv2 1 . 8 . 4078 . 1 1 26 HIS CE1 C -5.406 -5.132 -2.236 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CE1 . . . . . . . . . c30643_6pv2 1 . 8 . 4079 . 1 1 26 HIS CG C -6.386 -3.791 -0.773 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CG . . . . . . . . . c30643_6pv2 1 . 8 . 4080 . 1 1 26 HIS H H -7.240 -0.831 -0.950 . . . 1.0 . . . . . . . . . . . . A . 26 HIS H . . . . . . . . . c30643_6pv2 1 . 8 . 4081 . 1 1 26 HIS HA H -8.959 -3.107 -1.437 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HA . . . . . . . . . c30643_6pv2 1 . 8 . 4082 . 1 1 26 HIS HB2 H -6.981 -2.512 0.775 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HB2 . . . . . . . . . c30643_6pv2 1 . 8 . 4083 . 1 1 26 HIS HB3 H -7.905 -4.003 0.661 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HB3 . . . . . . . . . c30643_6pv2 1 . 8 . 4084 . 1 1 26 HIS HD1 H -7.439 -5.311 -1.817 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HD1 . . . . . . . . . c30643_6pv2 1 . 8 . 4085 . 1 1 26 HIS HD2 H -4.556 -2.700 -0.314 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HD2 . . . . . . . . . c30643_6pv2 1 . 8 . 4086 . 1 1 26 HIS HE1 H -5.241 -5.913 -2.962 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HE1 . . . . . . . . . c30643_6pv2 1 . 8 . 4087 . 1 1 26 HIS N N -8.041 -1.266 -1.320 . . . 1.0 . . . . . . . . . . . . A . 26 HIS N . . . . . . . . . c30643_6pv2 1 . 8 . 4088 . 1 1 26 HIS ND1 N -6.587 -4.849 -1.654 . . . 1.0 . . . . . . . . . . . . A . 26 HIS ND1 . . . . . . . . . c30643_6pv2 1 . 8 . 4089 . 1 1 26 HIS NE2 N -4.485 -4.324 -1.780 . . . 1.0 . . . . . . . . . . . . A . 26 HIS NE2 . . . . . . . . . c30643_6pv2 1 . 8 . 4090 . 1 1 26 HIS O O -10.734 -2.709 0.316 . . . 1.0 . . . . . . . . . . . . A . 26 HIS O . . . . . . . . . c30643_6pv2 1 . 8 . 4091 . 1 1 27 THR C C -10.109 0.937 2.329 . . . 1.0 . . . . . . . . . . . . A . 27 THR C . . . . . . . . . c30643_6pv2 1 . 8 . 4092 . 1 1 27 THR CA C -10.438 -0.510 1.967 . . . 1.0 . . . . . . . . . . . . A . 27 THR CA . . . . . . . . . c30643_6pv2 1 . 8 . 4093 . 1 1 27 THR CB C -10.542 -1.386 3.241 . . . 1.0 . . . . . . . . . . . . A . 27 THR CB . . . . . . . . . c30643_6pv2 1 . 8 . 4094 . 1 1 27 THR CG2 C -9.290 -1.276 4.101 . . . 1.0 . . . . . . . . . . . . A . 27 THR CG2 . . . . . . . . . c30643_6pv2 1 . 8 . 4095 . 1 1 27 THR H H -8.567 -0.572 0.993 . . . 1.0 . . . . . . . . . . . . A . 27 THR H . . . . . . . . . c30643_6pv2 1 . 8 . 4096 . 1 1 27 THR HA H -11.392 -0.533 1.462 . . . 1.0 . . . . . . . . . . . . A . 27 THR HA . . . . . . . . . c30643_6pv2 1 . 8 . 4097 . 1 1 27 THR HB H -10.656 -2.415 2.934 . . . 1.0 . . . . . . . . . . . . A . 27 THR HB . . . . . . . . . c30643_6pv2 1 . 8 . 4098 . 1 1 27 THR HG1 H -12.485 -1.369 3.599 . . . 1.0 . . . . . . . . . . . . A . 27 THR HG1 . . . . . . . . . c30643_6pv2 1 . 8 . 4099 . 1 1 27 THR HG21 H -9.397 -1.902 4.976 . . . 1.0 . . . . . . . . . . . . A . 27 THR HG21 . . . . . . . . . c30643_6pv2 1 . 8 . 4100 . 1 1 27 THR HG22 H -9.155 -0.250 4.409 . . . 1.0 . . . . . . . . . . . . A . 27 THR HG22 . . . . . . . . . c30643_6pv2 1 . 8 . 4101 . 1 1 27 THR HG23 H -8.431 -1.596 3.530 . . . 1.0 . . . . . . . . . . . . A . 27 THR HG23 . . . . . . . . . c30643_6pv2 1 . 8 . 4102 . 1 1 27 THR N N -9.442 -1.023 1.050 . . . 1.0 . . . . . . . . . . . . A . 27 THR N . . . . . . . . . c30643_6pv2 1 . 8 . 4103 . 1 1 27 THR O O -8.938 1.322 2.381 . . . 1.0 . . . . . . . . . . . . A . 27 THR O . . . . . . . . . c30643_6pv2 1 . 8 . 4104 . 1 1 27 THR OG1 O -11.690 -1.009 4.013 . . . 1.0 . . . . . . . . . . . . A . 27 THR OG1 . . . . . . . . . c30643_6pv2 1 . 8 . 4105 . 1 1 28 GLY C C -11.942 3.982 2.042 . . . 1.0 . . . . . . . . . . . . A . 28 GLY C . . . . . . . . . c30643_6pv2 1 . 8 . 4106 . 1 1 28 GLY CA C -10.948 3.144 2.810 . . . 1.0 . . . . . . . . . . . . A . 28 GLY CA . . . . . . . . . c30643_6pv2 1 . 8 . 4107 . 1 1 28 GLY H H -12.046 1.357 2.559 . . . 1.0 . . . . . . . . . . . . A . 28 GLY H . . . . . . . . . c30643_6pv2 1 . 8 . 4108 . 1 1 28 GLY HA2 H -11.067 3.331 3.867 . . . 1.0 . . . . . . . . . . . . A . 28 GLY HA2 . . . . . . . . . c30643_6pv2 1 . 8 . 4109 . 1 1 28 GLY HA3 H -9.950 3.423 2.512 . . . 1.0 . . . . . . . . . . . . A . 28 GLY HA3 . . . . . . . . . c30643_6pv2 1 . 8 . 4110 . 1 1 28 GLY N N -11.140 1.733 2.556 . . . 1.0 . . . . . . . . . . . . A . 28 GLY N . . . . . . . . . c30643_6pv2 1 . 8 . 4111 . 1 1 28 GLY O O -11.571 4.942 1.364 . . . 1.0 . . . . . . . . . . . . A . 28 GLY O . . . . . . . . . c30643_6pv2 1 . 8 . 4112 . 1 1 29 GLU C C -14.705 5.553 2.160 . . . 1.0 . . . . . . . . . . . . A . 29 GLU C . . . . . . . . . c30643_6pv2 1 . 8 . 4113 . 1 1 29 GLU CA C -14.274 4.289 1.423 . . . 1.0 . . . . . . . . . . . . A . 29 GLU CA . . . . . . . . . c30643_6pv2 1 . 8 . 4114 . 1 1 29 GLU CB C -15.469 3.347 1.244 . . . 1.0 . . . . . . . . . . . . A . 29 GLU CB . . . . . . . . . c30643_6pv2 1 . 8 . 4115 . 1 1 29 GLU CD C -16.330 1.155 0.346 . . . 1.0 . . . . . . . . . . . . A . 29 GLU CD . . . . . . . . . c30643_6pv2 1 . 8 . 4116 . 1 1 29 GLU CG C -15.156 2.106 0.424 . . . 1.0 . . . . . . . . . . . . A . 29 GLU CG . . . . . . . . . c30643_6pv2 1 . 8 . 4117 . 1 1 29 GLU H H -13.439 2.877 2.752 . . . 1.0 . . . . . . . . . . . . A . 29 GLU H . . . . . . . . . c30643_6pv2 1 . 8 . 4118 . 1 1 29 GLU HA H -13.891 4.563 0.452 . . . 1.0 . . . . . . . . . . . . A . 29 GLU HA . . . . . . . . . c30643_6pv2 1 . 8 . 4119 . 1 1 29 GLU HB2 H -15.813 3.032 2.218 . . . 1.0 . . . . . . . . . . . . A . 29 GLU HB2 . . . . . . . . . c30643_6pv2 1 . 8 . 4120 . 1 1 29 GLU HB3 H -16.265 3.885 0.752 . . . 1.0 . . . . . . . . . . . . A . 29 GLU HB3 . . . . . . . . . c30643_6pv2 1 . 8 . 4121 . 1 1 29 GLU HG2 H -14.893 2.409 -0.578 . . . 1.0 . . . . . . . . . . . . A . 29 GLU HG2 . . . . . . . . . c30643_6pv2 1 . 8 . 4122 . 1 1 29 GLU HG3 H -14.321 1.589 0.872 . . . 1.0 . . . . . . . . . . . . A . 29 GLU HG3 . . . . . . . . . c30643_6pv2 1 . 8 . 4123 . 1 1 29 GLU N N -13.209 3.615 2.150 . . . 1.0 . . . . . . . . . . . . A . 29 GLU N . . . . . . . . . c30643_6pv2 1 . 8 . 4124 . 1 1 29 GLU O O -15.797 5.613 2.726 . . . 1.0 . . . . . . . . . . . . A . 29 GLU O . . . . . . . . . c30643_6pv2 1 . 8 . 4125 . 1 1 29 GLU OE1 O -16.494 0.328 1.266 . . . 1.0 . . . . . . . . . . . . A . 29 GLU OE1 . . . . . . . . . c30643_6pv2 1 . 8 . 4126 . 1 1 29 GLU OE2 O -17.097 1.231 -0.636 . . . 1.0 . . . . . . . . . . . . A . 29 GLU OE2 . . . . . . . . . c30643_6pv2 1 . 8 . 4127 . 1 1 30 LYS C C -15.133 8.638 2.116 . . . 1.0 . . . . . . . . . . . . A . 30 LYS C . . . . . . . . . c30643_6pv2 1 . 8 . 4128 . 1 1 30 LYS CA C -14.084 7.809 2.843 . . . 1.0 . . . . . . . . . . . . A . 30 LYS CA . . . . . . . . . c30643_6pv2 1 . 8 . 4129 . 1 1 30 LYS CB C -12.783 8.609 2.973 . . . 1.0 . . . . . . . . . . . . A . 30 LYS CB . . . . . . . . . c30643_6pv2 1 . 8 . 4130 . 1 1 30 LYS CD C -12.074 7.464 5.109 . . . 1.0 . . . . . . . . . . . . A . 30 LYS CD . . . . . . . . . c30643_6pv2 1 . 8 . 4131 . 1 1 30 LYS CE C -12.381 8.675 5.976 . . . 1.0 . . . . . . . . . . . . A . 30 LYS CE . . . . . . . . . c30643_6pv2 1 . 8 . 4132 . 1 1 30 LYS CG C -11.669 7.864 3.697 . . . 1.0 . . . . . . . . . . . . A . 30 LYS CG . . . . . . . . . c30643_6pv2 1 . 8 . 4133 . 1 1 30 LYS H H -13.005 6.452 1.635 . . . 1.0 . . . . . . . . . . . . A . 30 LYS H . . . . . . . . . c30643_6pv2 1 . 8 . 4134 . 1 1 30 LYS HA H -14.451 7.570 3.830 . . . 1.0 . . . . . . . . . . . . A . 30 LYS HA . . . . . . . . . c30643_6pv2 1 . 8 . 4135 . 1 1 30 LYS HB2 H -12.431 8.860 1.984 . . . 1.0 . . . . . . . . . . . . A . 30 LYS HB2 . . . . . . . . . c30643_6pv2 1 . 8 . 4136 . 1 1 30 LYS HB3 H -12.987 9.521 3.513 . . . 1.0 . . . . . . . . . . . . A . 30 LYS HB3 . . . . . . . . . c30643_6pv2 1 . 8 . 4137 . 1 1 30 LYS HD2 H -12.954 6.842 5.058 . . . 1.0 . . . . . . . . . . . . A . 30 LYS HD2 . . . . . . . . . c30643_6pv2 1 . 8 . 4138 . 1 1 30 LYS HD3 H -11.266 6.907 5.560 . . . 1.0 . . . . . . . . . . . . A . 30 LYS HD3 . . . . . . . . . c30643_6pv2 1 . 8 . 4139 . 1 1 30 LYS HE2 H -11.508 9.309 6.008 . . . 1.0 . . . . . . . . . . . . A . 30 LYS HE2 . . . . . . . . . c30643_6pv2 1 . 8 . 4140 . 1 1 30 LYS HE3 H -13.204 9.218 5.533 . . . 1.0 . . . . . . . . . . . . A . 30 LYS HE3 . . . . . . . . . c30643_6pv2 1 . 8 . 4141 . 1 1 30 LYS HG2 H -11.426 6.972 3.139 . . . 1.0 . . . . . . . . . . . . A . 30 LYS HG2 . . . . . . . . . c30643_6pv2 1 . 8 . 4142 . 1 1 30 LYS HG3 H -10.799 8.503 3.749 . . . 1.0 . . . . . . . . . . . . A . 30 LYS HG3 . . . . . . . . . c30643_6pv2 1 . 8 . 4143 . 1 1 30 LYS HZ1 H -13.559 7.635 7.347 . . . 1.0 . . . . . . . . . . . . A . 30 LYS HZ1 . . . . . . . . . c30643_6pv2 1 . 8 . 4144 . 1 1 30 LYS HZ2 H -13.011 9.128 7.911 . . . 1.0 . . . . . . . . . . . . A . 30 LYS HZ2 . . . . . . . . . c30643_6pv2 1 . 8 . 4145 . 1 1 30 LYS HZ3 H -11.947 7.815 7.830 . . . 1.0 . . . . . . . . . . . . A . 30 LYS HZ3 . . . . . . . . . c30643_6pv2 1 . 8 . 4146 . 1 1 30 LYS N N -13.838 6.556 2.142 . . . 1.0 . . . . . . . . . . . . A . 30 LYS N . . . . . . . . . c30643_6pv2 1 . 8 . 4147 . 1 1 30 LYS NZ N -12.750 8.285 7.362 . . . 1.0 . . . . . . . . . . . . A . 30 LYS NZ . . . . . . . . . c30643_6pv2 1 . 8 . 4148 . 1 1 30 LYS O O -14.815 9.421 1.222 . . . 1.0 . . . . . . . . . . . . A . 30 LYS O . . . . . . . . . c30643_6pv2 1 . 8 . 4149 . 1 1 31 NH2 HN1 H -16.558 7.814 3.213 . . . 1.0 . . . . . . . . . . . . A . 31 NH2 HN1 . . . . . . . . . c30643_6pv2 1 . 8 . 4150 . 1 1 31 NH2 HN2 H -17.086 8.968 2.035 . . . 1.0 . . . . . . . . . . . . A . 31 NH2 HN2 . . . . . . . . . c30643_6pv2 1 . 8 . 4151 . 1 1 31 NH2 N N -16.384 8.456 2.491 . . . 1.0 . . . . . . . . . . . . A . 31 NH2 N . . . . . . . . . c30643_6pv2 1 . 8 . 4152 . 2 2 1 ZN ZN Zn -2.557 -4.304 -2.301 . . . 1.0 . . . . . . . . . . . . A . 101 ZN ZN . . . . . . . . . c30643_6pv2 1 . 9 . 4153 . 1 1 1 ARG C C 11.728 -0.930 2.540 . . . 1.0 . . . . . . . . . . . . A . 1 ARG C . . . . . . . . . c30643_6pv2 1 . 9 . 4154 . 1 1 1 ARG CA C 12.743 -1.321 3.608 . . . 1.0 . . . . . . . . . . . . A . 1 ARG CA . . . . . . . . . c30643_6pv2 1 . 9 . 4155 . 1 1 1 ARG CB C 12.007 -1.660 4.913 . . . 1.0 . . . . . . . . . . . . A . 1 ARG CB . . . . . . . . . c30643_6pv2 1 . 9 . 4156 . 1 1 1 ARG CD C 10.301 -0.956 6.631 . . . 1.0 . . . . . . . . . . . . A . 1 ARG CD . . . . . . . . . c30643_6pv2 1 . 9 . 4157 . 1 1 1 ARG CG C 11.202 -0.502 5.490 . . . 1.0 . . . . . . . . . . . . A . 1 ARG CG . . . . . . . . . c30643_6pv2 1 . 9 . 4158 . 1 1 1 ARG CZ C 8.276 0.085 7.599 . . . 1.0 . . . . . . . . . . . . A . 1 ARG CZ . . . . . . . . . c30643_6pv2 1 . 9 . 4159 . 1 1 1 ARG H1 H 13.207 0.645 4.101 . . . 1.0 . . . . . . . . . . . . A . 1 ARG H1 . . . . . . . . . c30643_6pv2 1 . 9 . 4160 . 1 1 1 ARG H2 H 14.236 -0.034 2.947 . . . 1.0 . . . . . . . . . . . . A . 1 ARG H2 . . . . . . . . . c30643_6pv2 1 . 9 . 4161 . 1 1 1 ARG H3 H 14.385 -0.474 4.571 . . . 1.0 . . . . . . . . . . . . A . 1 ARG H3 . . . . . . . . . c30643_6pv2 1 . 9 . 4162 . 1 1 1 ARG HA H 13.289 -2.188 3.269 . . . 1.0 . . . . . . . . . . . . A . 1 ARG HA . . . . . . . . . c30643_6pv2 1 . 9 . 4163 . 1 1 1 ARG HB2 H 11.331 -2.482 4.727 . . . 1.0 . . . . . . . . . . . . A . 1 ARG HB2 . . . . . . . . . c30643_6pv2 1 . 9 . 4164 . 1 1 1 ARG HB3 H 12.733 -1.967 5.651 . . . 1.0 . . . . . . . . . . . . A . 1 ARG HB3 . . . . . . . . . c30643_6pv2 1 . 9 . 4165 . 1 1 1 ARG HD2 H 9.602 -1.684 6.252 . . . 1.0 . . . . . . . . . . . . A . 1 ARG HD2 . . . . . . . . . c30643_6pv2 1 . 9 . 4166 . 1 1 1 ARG HD3 H 10.911 -1.408 7.398 . . . 1.0 . . . . . . . . . . . . A . 1 ARG HD3 . . . . . . . . . c30643_6pv2 1 . 9 . 4167 . 1 1 1 ARG HE H 10.036 1.006 7.340 . . . 1.0 . . . . . . . . . . . . A . 1 ARG HE . . . . . . . . . c30643_6pv2 1 . 9 . 4168 . 1 1 1 ARG HG2 H 11.883 0.250 5.860 . . . 1.0 . . . . . . . . . . . . A . 1 ARG HG2 . . . . . . . . . c30643_6pv2 1 . 9 . 4169 . 1 1 1 ARG HG3 H 10.589 -0.080 4.708 . . . 1.0 . . . . . . . . . . . . A . 1 ARG HG3 . . . . . . . . . c30643_6pv2 1 . 9 . 4170 . 1 1 1 ARG HH11 H 6.623 -1.081 7.709 . . . 1.0 . . . . . . . . . . . . A . 1 ARG HH11 . . . . . . . . . c30643_6pv2 1 . 9 . 4171 . 1 1 1 ARG HH12 H 8.007 -1.829 6.977 . . . 1.0 . . . . . . . . . . . . A . 1 ARG HH12 . . . . . . . . . c30643_6pv2 1 . 9 . 4172 . 1 1 1 ARG HH21 H 8.199 1.996 8.280 . . . 1.0 . . . . . . . . . . . . A . 1 ARG HH21 . . . . . . . . . c30643_6pv2 1 . 9 . 4173 . 1 1 1 ARG HH22 H 6.725 1.094 8.426 . . . 1.0 . . . . . . . . . . . . A . 1 ARG HH22 . . . . . . . . . c30643_6pv2 1 . 9 . 4174 . 1 1 1 ARG N N 13.710 -0.221 3.822 . . . 1.0 . . . . . . . . . . . . A . 1 ARG N . . . . . . . . . c30643_6pv2 1 . 9 . 4175 . 1 1 1 ARG NE N 9.553 0.157 7.216 . . . 1.0 . . . . . . . . . . . . A . 1 ARG NE . . . . . . . . . c30643_6pv2 1 . 9 . 4176 . 1 1 1 ARG NH1 N 7.582 -1.032 7.417 . . . 1.0 . . . . . . . . . . . . A . 1 ARG NH1 . . . . . . . . . c30643_6pv2 1 . 9 . 4177 . 1 1 1 ARG NH2 N 7.688 1.140 8.149 . . . 1.0 . . . . . . . . . . . . A . 1 ARG NH2 . . . . . . . . . c30643_6pv2 1 . 9 . 4178 . 1 1 1 ARG O O 11.268 0.213 2.505 . . . 1.0 . . . . . . . . . . . . A . 1 ARG O . . . . . . . . . c30643_6pv2 1 . 9 . 4179 . 1 1 2 PRO C C 8.947 -1.803 1.278 . . . 1.0 . . . . . . . . . . . . A . 2 PRO C . . . . . . . . . c30643_6pv2 1 . 9 . 4180 . 1 1 2 PRO CA C 10.328 -1.629 0.656 . . . 1.0 . . . . . . . . . . . . A . 2 PRO CA . . . . . . . . . c30643_6pv2 1 . 9 . 4181 . 1 1 2 PRO CB C 10.589 -2.699 -0.400 . . . 1.0 . . . . . . . . . . . . A . 2 PRO CB . . . . . . . . . c30643_6pv2 1 . 9 . 4182 . 1 1 2 PRO CD C 11.989 -3.199 1.493 . . . 1.0 . . . . . . . . . . . . A . 2 PRO CD . . . . . . . . . c30643_6pv2 1 . 9 . 4183 . 1 1 2 PRO CG C 11.226 -3.822 0.348 . . . 1.0 . . . . . . . . . . . . A . 2 PRO CG . . . . . . . . . c30643_6pv2 1 . 9 . 4184 . 1 1 2 PRO HA H 10.406 -0.647 0.213 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HA . . . . . . . . . c30643_6pv2 1 . 9 . 4185 . 1 1 2 PRO HB2 H 9.651 -3.001 -0.846 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HB2 . . . . . . . . . c30643_6pv2 1 . 9 . 4186 . 1 1 2 PRO HB3 H 11.248 -2.307 -1.161 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HB3 . . . . . . . . . c30643_6pv2 1 . 9 . 4187 . 1 1 2 PRO HD2 H 11.856 -3.781 2.394 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HD2 . . . . . . . . . c30643_6pv2 1 . 9 . 4188 . 1 1 2 PRO HD3 H 13.038 -3.119 1.248 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HD3 . . . . . . . . . c30643_6pv2 1 . 9 . 4189 . 1 1 2 PRO HG2 H 10.462 -4.488 0.726 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HG2 . . . . . . . . . c30643_6pv2 1 . 9 . 4190 . 1 1 2 PRO HG3 H 11.899 -4.359 -0.304 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HG3 . . . . . . . . . c30643_6pv2 1 . 9 . 4191 . 1 1 2 PRO N N 11.380 -1.860 1.638 . . . 1.0 . . . . . . . . . . . . A . 2 PRO N . . . . . . . . . c30643_6pv2 1 . 9 . 4192 . 1 1 2 PRO O O 8.693 -2.775 1.988 . . . 1.0 . . . . . . . . . . . . A . 2 PRO O . . . . . . . . . c30643_6pv2 1 . 9 . 4193 . 1 1 3 PHE C C 5.818 -1.795 0.794 . . . 1.0 . . . . . . . . . . . . A . 3 PHE C . . . . . . . . . c30643_6pv2 1 . 9 . 4194 . 1 1 3 PHE CA C 6.733 -0.889 1.602 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CA . . . . . . . . . c30643_6pv2 1 . 9 . 4195 . 1 1 3 PHE CB C 6.178 0.531 1.700 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CB . . . . . . . . . c30643_6pv2 1 . 9 . 4196 . 1 1 3 PHE CD1 C 7.969 2.250 2.063 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CD1 . . . . . . . . . c30643_6pv2 1 . 9 . 4197 . 1 1 3 PHE CD2 C 6.836 1.365 3.961 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CD2 . . . . . . . . . c30643_6pv2 1 . 9 . 4198 . 1 1 3 PHE CE1 C 8.744 3.041 2.889 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CE1 . . . . . . . . . c30643_6pv2 1 . 9 . 4199 . 1 1 3 PHE CE2 C 7.606 2.155 4.792 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CE2 . . . . . . . . . c30643_6pv2 1 . 9 . 4200 . 1 1 3 PHE CG C 7.007 1.406 2.591 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CG . . . . . . . . . c30643_6pv2 1 . 9 . 4201 . 1 1 3 PHE CZ C 8.561 2.993 4.255 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CZ . . . . . . . . . c30643_6pv2 1 . 9 . 4202 . 1 1 3 PHE H H 8.297 -0.138 0.395 . . . 1.0 . . . . . . . . . . . . A . 3 PHE H . . . . . . . . . c30643_6pv2 1 . 9 . 4203 . 1 1 3 PHE HA H 6.824 -1.295 2.599 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HA . . . . . . . . . c30643_6pv2 1 . 9 . 4204 . 1 1 3 PHE HB2 H 6.155 0.976 0.717 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HB2 . . . . . . . . . c30643_6pv2 1 . 9 . 4205 . 1 1 3 PHE HB3 H 5.178 0.499 2.101 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HB3 . . . . . . . . . c30643_6pv2 1 . 9 . 4206 . 1 1 3 PHE HD1 H 8.112 2.290 0.993 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HD1 . . . . . . . . . c30643_6pv2 1 . 9 . 4207 . 1 1 3 PHE HD2 H 6.086 0.711 4.382 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HD2 . . . . . . . . . c30643_6pv2 1 . 9 . 4208 . 1 1 3 PHE HE1 H 9.490 3.696 2.466 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HE1 . . . . . . . . . c30643_6pv2 1 . 9 . 4209 . 1 1 3 PHE HE2 H 7.459 2.116 5.861 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HE2 . . . . . . . . . c30643_6pv2 1 . 9 . 4210 . 1 1 3 PHE HZ H 9.166 3.610 4.903 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HZ . . . . . . . . . c30643_6pv2 1 . 9 . 4211 . 1 1 3 PHE N N 8.061 -0.863 1.013 . . . 1.0 . . . . . . . . . . . . A . 3 PHE N . . . . . . . . . c30643_6pv2 1 . 9 . 4212 . 1 1 3 PHE O O 5.227 -1.383 -0.199 . . . 1.0 . . . . . . . . . . . . A . 3 PHE O . . . . . . . . . c30643_6pv2 1 . 9 . 4213 . 1 1 4 NLE C C 3.587 -4.208 1.011 . . . 1.0 . . . . . . . . . . . . A . 4 NLE C . . . . . . . . . c30643_6pv2 1 . 9 . 4214 . 1 1 4 NLE CA C 5.013 -4.068 0.498 . . . 1.0 . . . . . . . . . . . . A . 4 NLE CA . . . . . . . . . c30643_6pv2 1 . 9 . 4215 . 1 1 4 NLE CB C 5.757 -5.401 0.634 . . . 1.0 . . . . . . . . . . . . A . 4 NLE CB . . . . . . . . . c30643_6pv2 1 . 9 . 4216 . 1 1 4 NLE CD C 5.979 -7.811 -0.030 . . . 1.0 . . . . . . . . . . . . A . 4 NLE CD . . . . . . . . . c30643_6pv2 1 . 9 . 4217 . 1 1 4 NLE CE C 5.399 -8.915 -0.887 . . . 1.0 . . . . . . . . . . . . A . 4 NLE CE . . . . . . . . . c30643_6pv2 1 . 9 . 4218 . 1 1 4 NLE CG C 5.174 -6.531 -0.200 . . . 1.0 . . . . . . . . . . . . A . 4 NLE CG . . . . . . . . . c30643_6pv2 1 . 9 . 4219 . 1 1 4 NLE H H 6.158 -3.271 2.082 . . . 1.0 . . . . . . . . . . . . A . 4 NLE H . . . . . . . . . c30643_6pv2 1 . 9 . 4220 . 1 1 4 NLE HA H 4.984 -3.783 -0.542 . . . 1.0 . . . . . . . . . . . . A . 4 NLE HA . . . . . . . . . c30643_6pv2 1 . 9 . 4221 . 1 1 4 NLE HB2 H 5.733 -5.703 1.671 . . . 1.0 . . . . . . . . . . . . A . 4 NLE HB2 . . . . . . . . . c30643_6pv2 1 . 9 . 4222 . 1 1 4 NLE HB3 H 6.785 -5.258 0.338 . . . 1.0 . . . . . . . . . . . . A . 4 NLE HB3 . . . . . . . . . c30643_6pv2 1 . 9 . 4223 . 1 1 4 NLE HD2 H 5.945 -8.119 1.004 . . . 1.0 . . . . . . . . . . . . A . 4 NLE HD2 . . . . . . . . . c30643_6pv2 1 . 9 . 4224 . 1 1 4 NLE HD3 H 7.001 -7.636 -0.332 . . . 1.0 . . . . . . . . . . . . A . 4 NLE HD3 . . . . . . . . . c30643_6pv2 1 . 9 . 4225 . 1 1 4 NLE HE1 H 4.385 -9.114 -0.579 . . . 1.0 . . . . . . . . . . . . A . 4 NLE HE1 . . . . . . . . . c30643_6pv2 1 . 9 . 4226 . 1 1 4 NLE HE2 H 5.993 -9.810 -0.772 . . . 1.0 . . . . . . . . . . . . A . 4 NLE HE2 . . . . . . . . . c30643_6pv2 1 . 9 . 4227 . 1 1 4 NLE HE3 H 5.407 -8.608 -1.922 . . . 1.0 . . . . . . . . . . . . A . 4 NLE HE3 . . . . . . . . . c30643_6pv2 1 . 9 . 4228 . 1 1 4 NLE HG2 H 5.186 -6.244 -1.241 . . . 1.0 . . . . . . . . . . . . A . 4 NLE HG2 . . . . . . . . . c30643_6pv2 1 . 9 . 4229 . 1 1 4 NLE HG3 H 4.158 -6.713 0.116 . . . 1.0 . . . . . . . . . . . . A . 4 NLE HG3 . . . . . . . . . c30643_6pv2 1 . 9 . 4230 . 1 1 4 NLE N N 5.731 -3.038 1.229 . . . 1.0 . . . . . . . . . . . . A . 4 NLE N . . . . . . . . . c30643_6pv2 1 . 9 . 4231 . 1 1 4 NLE O O 3.355 -4.249 2.223 . . . 1.0 . . . . . . . . . . . . A . 4 NLE O . . . . . . . . . c30643_6pv2 1 . 9 . 4232 . 1 1 5 CYS C C 1.096 -5.900 1.013 . . . 1.0 . . . . . . . . . . . . A . 5 CYS C . . . . . . . . . c30643_6pv2 1 . 9 . 4233 . 1 1 5 CYS CA C 1.248 -4.503 0.426 . . . 1.0 . . . . . . . . . . . . A . 5 CYS CA . . . . . . . . . c30643_6pv2 1 . 9 . 4234 . 1 1 5 CYS CB C 0.351 -4.336 -0.804 . . . 1.0 . . . . . . . . . . . . A . 5 CYS CB . . . . . . . . . c30643_6pv2 1 . 9 . 4235 . 1 1 5 CYS H H 2.883 -4.118 -0.856 . . . 1.0 . . . . . . . . . . . . A . 5 CYS H . . . . . . . . . c30643_6pv2 1 . 9 . 4236 . 1 1 5 CYS HA H 0.957 -3.781 1.172 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HA . . . . . . . . . c30643_6pv2 1 . 9 . 4237 . 1 1 5 CYS HB2 H 0.376 -3.303 -1.121 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HB2 . . . . . . . . . c30643_6pv2 1 . 9 . 4238 . 1 1 5 CYS HB3 H 0.724 -4.959 -1.600 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HB3 . . . . . . . . . c30643_6pv2 1 . 9 . 4239 . 1 1 5 CYS N N 2.637 -4.257 0.085 . . . 1.0 . . . . . . . . . . . . A . 5 CYS N . . . . . . . . . c30643_6pv2 1 . 9 . 4240 . 1 1 5 CYS O O 1.767 -6.842 0.587 . . . 1.0 . . . . . . . . . . . . A . 5 CYS O . . . . . . . . . c30643_6pv2 1 . 9 . 4241 . 1 1 5 CYS SG S -1.379 -4.778 -0.516 . . . 1.0 . . . . . . . . . . . . A . 5 CYS SG . . . . . . . . . c30643_6pv2 1 . 9 . 4242 . 1 1 6 THR C C -1.394 -7.785 2.537 . . . 1.0 . . . . . . . . . . . . A . 6 THR C . . . . . . . . . c30643_6pv2 1 . 9 . 4243 . 1 1 6 THR CA C 0.035 -7.282 2.693 . . . 1.0 . . . . . . . . . . . . A . 6 THR CA . . . . . . . . . c30643_6pv2 1 . 9 . 4244 . 1 1 6 THR CB C 0.372 -7.126 4.182 . . . 1.0 . . . . . . . . . . . . A . 6 THR CB . . . . . . . . . c30643_6pv2 1 . 9 . 4245 . 1 1 6 THR CG2 C 1.878 -7.120 4.400 . . . 1.0 . . . . . . . . . . . . A . 6 THR CG2 . . . . . . . . . c30643_6pv2 1 . 9 . 4246 . 1 1 6 THR H H -0.290 -5.244 2.282 . . . 1.0 . . . . . . . . . . . . A . 6 THR H . . . . . . . . . c30643_6pv2 1 . 9 . 4247 . 1 1 6 THR HA H 0.711 -8.006 2.266 . . . 1.0 . . . . . . . . . . . . A . 6 THR HA . . . . . . . . . c30643_6pv2 1 . 9 . 4248 . 1 1 6 THR HB H -0.053 -7.958 4.724 . . . 1.0 . . . . . . . . . . . . A . 6 THR HB . . . . . . . . . c30643_6pv2 1 . 9 . 4249 . 1 1 6 THR HG1 H -0.685 -6.082 5.491 . . . 1.0 . . . . . . . . . . . . A . 6 THR HG1 . . . . . . . . . c30643_6pv2 1 . 9 . 4250 . 1 1 6 THR HG21 H 2.293 -8.062 4.072 . . . 1.0 . . . . . . . . . . . . A . 6 THR HG21 . . . . . . . . . c30643_6pv2 1 . 9 . 4251 . 1 1 6 THR HG22 H 2.089 -6.978 5.448 . . . 1.0 . . . . . . . . . . . . A . 6 THR HG22 . . . . . . . . . c30643_6pv2 1 . 9 . 4252 . 1 1 6 THR HG23 H 2.320 -6.315 3.831 . . . 1.0 . . . . . . . . . . . . A . 6 THR HG23 . . . . . . . . . c30643_6pv2 1 . 9 . 4253 . 1 1 6 THR N N 0.230 -6.024 2.002 . . . 1.0 . . . . . . . . . . . . A . 6 THR N . . . . . . . . . c30643_6pv2 1 . 9 . 4254 . 1 1 6 THR O O -1.929 -8.464 3.417 . . . 1.0 . . . . . . . . . . . . A . 6 THR O . . . . . . . . . c30643_6pv2 1 . 9 . 4255 . 1 1 6 THR OG1 O -0.196 -5.903 4.677 . . . 1.0 . . . . . . . . . . . . A . 6 THR OG1 . . . . . . . . . c30643_6pv2 1 . 9 . 4256 . 1 1 7 TRP C C -3.359 -9.053 0.183 . . . 1.0 . . . . . . . . . . . . A . 7 TRP C . . . . . . . . . c30643_6pv2 1 . 9 . 4257 . 1 1 7 TRP CA C -3.369 -7.878 1.151 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CA . . . . . . . . . c30643_6pv2 1 . 9 . 4258 . 1 1 7 TRP CB C -4.183 -6.717 0.581 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CB . . . . . . . . . c30643_6pv2 1 . 9 . 4259 . 1 1 7 TRP CD1 C -6.548 -7.633 0.231 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CD1 . . . . . . . . . c30643_6pv2 1 . 9 . 4260 . 1 1 7 TRP CD2 C -6.379 -6.086 1.836 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CD2 . . . . . . . . . c30643_6pv2 1 . 9 . 4261 . 1 1 7 TRP CE2 C -7.720 -6.497 1.754 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CE2 . . . . . . . . . c30643_6pv2 1 . 9 . 4262 . 1 1 7 TRP CE3 C -6.026 -5.116 2.775 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CE3 . . . . . . . . . c30643_6pv2 1 . 9 . 4263 . 1 1 7 TRP CG C -5.647 -6.826 0.859 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CG . . . . . . . . . c30643_6pv2 1 . 9 . 4264 . 1 1 7 TRP CH2 C -8.337 -5.019 3.488 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CH2 . . . . . . . . . c30643_6pv2 1 . 9 . 4265 . 1 1 7 TRP CZ2 C -8.711 -5.970 2.578 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CZ2 . . . . . . . . . c30643_6pv2 1 . 9 . 4266 . 1 1 7 TRP CZ3 C -7.008 -4.591 3.592 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CZ3 . . . . . . . . . c30643_6pv2 1 . 9 . 4267 . 1 1 7 TRP H H -1.530 -6.932 0.735 . . . 1.0 . . . . . . . . . . . . A . 7 TRP H . . . . . . . . . c30643_6pv2 1 . 9 . 4268 . 1 1 7 TRP HA H -3.809 -8.195 2.083 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HA . . . . . . . . . c30643_6pv2 1 . 9 . 4269 . 1 1 7 TRP HB2 H -3.832 -5.794 1.012 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HB2 . . . . . . . . . c30643_6pv2 1 . 9 . 4270 . 1 1 7 TRP HB3 H -4.049 -6.682 -0.487 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HB3 . . . . . . . . . c30643_6pv2 1 . 9 . 4271 . 1 1 7 TRP HD1 H -6.299 -8.316 -0.564 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HD1 . . . . . . . . . c30643_6pv2 1 . 9 . 4272 . 1 1 7 TRP HE1 H -8.617 -7.913 0.488 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HE1 . . . . . . . . . c30643_6pv2 1 . 9 . 4273 . 1 1 7 TRP HE3 H -5.004 -4.776 2.866 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HE3 . . . . . . . . . c30643_6pv2 1 . 9 . 4274 . 1 1 7 TRP HH2 H -9.073 -4.581 4.145 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HH2 . . . . . . . . . c30643_6pv2 1 . 9 . 4275 . 1 1 7 TRP HZ2 H -9.740 -6.291 2.512 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HZ2 . . . . . . . . . c30643_6pv2 1 . 9 . 4276 . 1 1 7 TRP HZ3 H -6.755 -3.838 4.323 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HZ3 . . . . . . . . . c30643_6pv2 1 . 9 . 4277 . 1 1 7 TRP N N -2.009 -7.458 1.414 . . . 1.0 . . . . . . . . . . . . A . 7 TRP N . . . . . . . . . c30643_6pv2 1 . 9 . 4278 . 1 1 7 TRP NE1 N -7.799 -7.446 0.768 . . . 1.0 . . . . . . . . . . . . A . 7 TRP NE1 . . . . . . . . . c30643_6pv2 1 . 9 . 4279 . 1 1 7 TRP O O -3.706 -8.915 -0.990 . . . 1.0 . . . . . . . . . . . . A . 7 TRP O . . . . . . . . . c30643_6pv2 1 . 9 . 4280 . 1 1 8 ORN C C -1.432 -10.851 -3.494 . . . 1.0 . . . . . . . . . . . . A . 8 ORN C . . . . . . . . . c30643_6pv2 1 . 9 . 4281 . 1 1 8 ORN CA C -2.079 -12.155 -3.044 . . . 1.0 . . . . . . . . . . . . A . 8 ORN CA . . . . . . . . . c30643_6pv2 1 . 9 . 4282 . 1 1 8 ORN CB C -1.396 -12.668 -1.770 . . . 1.0 . . . . . . . . . . . . A . 8 ORN CB . . . . . . . . . c30643_6pv2 1 . 9 . 4283 . 1 1 8 ORN CD C -2.832 -11.424 -0.114 . . . 1.0 . . . . . . . . . . . . A . 8 ORN CD . . . . . . . . . c30643_6pv2 1 . 9 . 4284 . 1 1 8 ORN CG C -1.417 -11.670 -0.622 . . . 1.0 . . . . . . . . . . . . A . 8 ORN CG . . . . . . . . . c30643_6pv2 1 . 9 . 4285 . 1 1 8 ORN H H -0.987 -13.331 -4.366 . . . 1.0 . . . . . . . . . . . . A . 8 ORN H . . . . . . . . . c30643_6pv2 1 . 9 . 4286 . 1 1 8 ORN HA H -3.123 -11.974 -2.841 . . . 1.0 . . . . . . . . . . . . A . 8 ORN HA . . . . . . . . . c30643_6pv2 1 . 9 . 4287 . 1 1 8 ORN HB2 H -0.368 -12.905 -1.996 . . . 1.0 . . . . . . . . . . . . A . 8 ORN HB2 . . . . . . . . . c30643_6pv2 1 . 9 . 4288 . 1 1 8 ORN HB3 H -1.900 -13.566 -1.445 . . . 1.0 . . . . . . . . . . . . A . 8 ORN HB3 . . . . . . . . . c30643_6pv2 1 . 9 . 4289 . 1 1 8 ORN HD2 H -3.133 -12.261 0.500 . . . 1.0 . . . . . . . . . . . . A . 8 ORN HD2 . . . . . . . . . c30643_6pv2 1 . 9 . 4290 . 1 1 8 ORN HD3 H -3.497 -11.342 -0.958 . . . 1.0 . . . . . . . . . . . . A . 8 ORN HD3 . . . . . . . . . c30643_6pv2 1 . 9 . 4291 . 1 1 8 ORN HE1 H -2.639 -10.236 1.611 . . . 1.0 . . . . . . . . . . . . A . 8 ORN HE1 . . . . . . . . . c30643_6pv2 1 . 9 . 4292 . 1 1 8 ORN HG2 H -1.000 -10.735 -0.966 . . . 1.0 . . . . . . . . . . . . A . 8 ORN HG2 . . . . . . . . . c30643_6pv2 1 . 9 . 4293 . 1 1 8 ORN HG3 H -0.817 -12.057 0.188 . . . 1.0 . . . . . . . . . . . . A . 8 ORN HG3 . . . . . . . . . c30643_6pv2 1 . 9 . 4294 . 1 1 8 ORN N N -1.983 -13.165 -4.120 . . . 1.0 . . . . . . . . . . . . A . 8 ORN N . . . . . . . . . c30643_6pv2 1 . 9 . 4295 . 1 1 8 ORN NE N -2.920 -10.201 0.672 . . . 1.0 . . . . . . . . . . . . A . 8 ORN NE . . . . . . . . . c30643_6pv2 1 . 9 . 4296 . 1 1 8 ORN O O -0.363 -10.861 -4.106 . . . 1.0 . . . . . . . . . . . . A . 8 ORN O . . . . . . . . . c30643_6pv2 1 . 9 . 4297 . 1 1 9 CYS C C -0.404 -8.021 -2.705 . . . 1.0 . . . . . . . . . . . . A . 9 CYS C . . . . . . . . . c30643_6pv2 1 . 9 . 4298 . 1 1 9 CYS CA C -1.582 -8.430 -3.584 . . . 1.0 . . . . . . . . . . . . A . 9 CYS CA . . . . . . . . . c30643_6pv2 1 . 9 . 4299 . 1 1 9 CYS CB C -2.700 -7.395 -3.490 . . . 1.0 . . . . . . . . . . . . A . 9 CYS CB . . . . . . . . . c30643_6pv2 1 . 9 . 4300 . 1 1 9 CYS H H -2.911 -9.788 -2.666 . . . 1.0 . . . . . . . . . . . . A . 9 CYS H . . . . . . . . . c30643_6pv2 1 . 9 . 4301 . 1 1 9 CYS HA H -1.249 -8.498 -4.609 . . . 1.0 . . . . . . . . . . . . A . 9 CYS HA . . . . . . . . . c30643_6pv2 1 . 9 . 4302 . 1 1 9 CYS HB2 H -3.537 -7.721 -4.087 . . . 1.0 . . . . . . . . . . . . A . 9 CYS HB2 . . . . . . . . . c30643_6pv2 1 . 9 . 4303 . 1 1 9 CYS HB3 H -3.013 -7.310 -2.459 . . . 1.0 . . . . . . . . . . . . A . 9 CYS HB3 . . . . . . . . . c30643_6pv2 1 . 9 . 4304 . 1 1 9 CYS N N -2.078 -9.734 -3.187 . . . 1.0 . . . . . . . . . . . . A . 9 CYS N . . . . . . . . . c30643_6pv2 1 . 9 . 4305 . 1 1 9 CYS O O -0.542 -7.885 -1.487 . . . 1.0 . . . . . . . . . . . . A . 9 CYS O . . . . . . . . . c30643_6pv2 1 . 9 . 4306 . 1 1 9 CYS SG S -2.232 -5.746 -4.058 . . . 1.0 . . . . . . . . . . . . A . 9 CYS SG . . . . . . . . . c30643_6pv2 1 . 9 . 4307 . 1 1 10 GLY C C 2.846 -6.544 -3.375 . . . 1.0 . . . . . . . . . . . . A . 10 GLY C . . . . . . . . . c30643_6pv2 1 . 9 . 4308 . 1 1 10 GLY CA C 1.941 -7.476 -2.595 . . . 1.0 . . . . . . . . . . . . A . 10 GLY CA . . . . . . . . . c30643_6pv2 1 . 9 . 4309 . 1 1 10 GLY H H 0.792 -7.927 -4.303 . . . 1.0 . . . . . . . . . . . . A . 10 GLY H . . . . . . . . . c30643_6pv2 1 . 9 . 4310 . 1 1 10 GLY HA2 H 1.653 -6.995 -1.672 . . . 1.0 . . . . . . . . . . . . A . 10 GLY HA2 . . . . . . . . . c30643_6pv2 1 . 9 . 4311 . 1 1 10 GLY HA3 H 2.484 -8.377 -2.363 . . . 1.0 . . . . . . . . . . . . A . 10 GLY HA3 . . . . . . . . . c30643_6pv2 1 . 9 . 4312 . 1 1 10 GLY N N 0.750 -7.829 -3.329 . . . 1.0 . . . . . . . . . . . . A . 10 GLY N . . . . . . . . . c30643_6pv2 1 . 9 . 4313 . 1 1 10 GLY O O 4.033 -6.824 -3.547 . . . 1.0 . . . . . . . . . . . . A . 10 GLY O . . . . . . . . . c30643_6pv2 1 . 9 . 4314 . 1 1 11 LYS C C 4.002 -3.728 -3.548 . . . 1.0 . . . . . . . . . . . . A . 11 LYS C . . . . . . . . . c30643_6pv2 1 . 9 . 4315 . 1 1 11 LYS CA C 3.081 -4.425 -4.543 . . . 1.0 . . . . . . . . . . . . A . 11 LYS CA . . . . . . . . . c30643_6pv2 1 . 9 . 4316 . 1 1 11 LYS CB C 2.185 -3.396 -5.238 . . . 1.0 . . . . . . . . . . . . A . 11 LYS CB . . . . . . . . . c30643_6pv2 1 . 9 . 4317 . 1 1 11 LYS CD C 0.879 -2.758 -7.286 . . . 1.0 . . . . . . . . . . . . A . 11 LYS CD . . . . . . . . . c30643_6pv2 1 . 9 . 4318 . 1 1 11 LYS CE C 0.510 -3.148 -8.711 . . . 1.0 . . . . . . . . . . . . A . 11 LYS CE . . . . . . . . . c30643_6pv2 1 . 9 . 4319 . 1 1 11 LYS CG C 1.624 -3.873 -6.568 . . . 1.0 . . . . . . . . . . . . A . 11 LYS CG . . . . . . . . . c30643_6pv2 1 . 9 . 4320 . 1 1 11 LYS H H 1.316 -5.332 -3.796 . . . 1.0 . . . . . . . . . . . . A . 11 LYS H . . . . . . . . . c30643_6pv2 1 . 9 . 4321 . 1 1 11 LYS HA H 3.691 -4.917 -5.287 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HA . . . . . . . . . c30643_6pv2 1 . 9 . 4322 . 1 1 11 LYS HB2 H 1.354 -3.161 -4.588 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HB2 . . . . . . . . . c30643_6pv2 1 . 9 . 4323 . 1 1 11 LYS HB3 H 2.757 -2.497 -5.415 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HB3 . . . . . . . . . c30643_6pv2 1 . 9 . 4324 . 1 1 11 LYS HD2 H -0.026 -2.536 -6.739 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HD2 . . . . . . . . . c30643_6pv2 1 . 9 . 4325 . 1 1 11 LYS HD3 H 1.508 -1.880 -7.313 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HD3 . . . . . . . . . c30643_6pv2 1 . 9 . 4326 . 1 1 11 LYS HE2 H 0.047 -2.302 -9.193 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HE2 . . . . . . . . . c30643_6pv2 1 . 9 . 4327 . 1 1 11 LYS HE3 H 1.413 -3.411 -9.241 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HE3 . . . . . . . . . c30643_6pv2 1 . 9 . 4328 . 1 1 11 LYS HG2 H 2.440 -4.209 -7.191 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HG2 . . . . . . . . . c30643_6pv2 1 . 9 . 4329 . 1 1 11 LYS HG3 H 0.944 -4.690 -6.388 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HG3 . . . . . . . . . c30643_6pv2 1 . 9 . 4330 . 1 1 11 LYS HZ1 H -1.293 -4.083 -8.224 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HZ1 . . . . . . . . . c30643_6pv2 1 . 9 . 4331 . 1 1 11 LYS HZ2 H 0.014 -5.147 -8.349 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HZ2 . . . . . . . . . c30643_6pv2 1 . 9 . 4332 . 1 1 11 LYS HZ3 H -0.689 -4.506 -9.744 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HZ3 . . . . . . . . . c30643_6pv2 1 . 9 . 4333 . 1 1 11 LYS N N 2.286 -5.449 -3.873 . . . 1.0 . . . . . . . . . . . . A . 11 LYS N . . . . . . . . . c30643_6pv2 1 . 9 . 4334 . 1 1 11 LYS NZ N -0.428 -4.300 -8.758 . . . 1.0 . . . . . . . . . . . . A . 11 LYS NZ . . . . . . . . . c30643_6pv2 1 . 9 . 4335 . 1 1 11 LYS O O 3.630 -3.508 -2.397 . . . 1.0 . . . . . . . . . . . . A . 11 LYS O . . . . . . . . . c30643_6pv2 1 . 9 . 4336 . 1 1 12 ARG C C 6.379 -1.299 -3.524 . . . 1.0 . . . . . . . . . . . . A . 12 ARG C . . . . . . . . . c30643_6pv2 1 . 9 . 4337 . 1 1 12 ARG CA C 6.186 -2.757 -3.134 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CA . . . . . . . . . c30643_6pv2 1 . 9 . 4338 . 1 1 12 ARG CB C 7.522 -3.502 -3.190 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CB . . . . . . . . . c30643_6pv2 1 . 9 . 4339 . 1 1 12 ARG CD C 8.787 -5.626 -2.698 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CD . . . . . . . . . c30643_6pv2 1 . 9 . 4340 . 1 1 12 ARG CG C 7.432 -4.935 -2.693 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CG . . . . . . . . . c30643_6pv2 1 . 9 . 4341 . 1 1 12 ARG CZ C 9.681 -7.602 -1.516 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CZ . . . . . . . . . c30643_6pv2 1 . 9 . 4342 . 1 1 12 ARG H H 5.433 -3.576 -4.930 . . . 1.0 . . . . . . . . . . . . A . 12 ARG H . . . . . . . . . c30643_6pv2 1 . 9 . 4343 . 1 1 12 ARG HA H 5.807 -2.792 -2.122 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HA . . . . . . . . . c30643_6pv2 1 . 9 . 4344 . 1 1 12 ARG HB2 H 7.867 -3.521 -4.212 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HB2 . . . . . . . . . c30643_6pv2 1 . 9 . 4345 . 1 1 12 ARG HB3 H 8.243 -2.976 -2.583 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HB3 . . . . . . . . . c30643_6pv2 1 . 9 . 4346 . 1 1 12 ARG HD2 H 9.155 -5.665 -3.712 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HD2 . . . . . . . . . c30643_6pv2 1 . 9 . 4347 . 1 1 12 ARG HD3 H 9.472 -5.057 -2.086 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HD3 . . . . . . . . . c30643_6pv2 1 . 9 . 4348 . 1 1 12 ARG HE H 7.845 -7.462 -2.305 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HE . . . . . . . . . c30643_6pv2 1 . 9 . 4349 . 1 1 12 ARG HG2 H 7.050 -4.929 -1.683 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HG2 . . . . . . . . . c30643_6pv2 1 . 9 . 4350 . 1 1 12 ARG HG3 H 6.755 -5.484 -3.330 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HG3 . . . . . . . . . c30643_6pv2 1 . 9 . 4351 . 1 1 12 ARG HH11 H 11.019 -6.098 -1.752 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH11 . . . . . . . . . c30643_6pv2 1 . 9 . 4352 . 1 1 12 ARG HH12 H 11.599 -7.475 -0.876 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH12 . . . . . . . . . c30643_6pv2 1 . 9 . 4353 . 1 1 12 ARG HH21 H 10.224 -9.292 -0.534 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH21 . . . . . . . . . c30643_6pv2 1 . 9 . 4354 . 1 1 12 ARG HH22 H 8.609 -9.284 -1.161 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH22 . . . . . . . . . c30643_6pv2 1 . 9 . 4355 . 1 1 12 ARG N N 5.204 -3.397 -3.994 . . . 1.0 . . . . . . . . . . . . A . 12 ARG N . . . . . . . . . c30643_6pv2 1 . 9 . 4356 . 1 1 12 ARG NE N 8.698 -6.986 -2.171 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NE . . . . . . . . . c30643_6pv2 1 . 9 . 4357 . 1 1 12 ARG NH1 N 10.861 -7.011 -1.369 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NH1 . . . . . . . . . c30643_6pv2 1 . 9 . 4358 . 1 1 12 ARG NH2 N 9.488 -8.823 -1.030 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NH2 . . . . . . . . . c30643_6pv2 1 . 9 . 4359 . 1 1 12 ARG O O 6.570 -0.978 -4.699 . . . 1.0 . . . . . . . . . . . . A . 12 ARG O . . . . . . . . . c30643_6pv2 1 . 9 . 4360 . 1 1 13 PHE C C 7.645 1.558 -2.027 . . . 1.0 . . . . . . . . . . . . A . 13 PHE C . . . . . . . . . c30643_6pv2 1 . 9 . 4361 . 1 1 13 PHE CA C 6.415 1.003 -2.737 . . . 1.0 . . . . . . . . . . . . A . 13 PHE CA . . . . . . . . . c30643_6pv2 1 . 9 . 4362 . 1 1 13 PHE CB C 5.146 1.670 -2.209 . . . 1.0 . . . . . . . . . . . . A . 13 PHE CB . . . . . . . . . c30643_6pv2 1 . 9 . 4363 . 1 1 13 PHE CD1 C 3.426 1.628 -4.032 . . . 1.0 . . . . . . . . . . . . A . 13 PHE CD1 . . . . . . . . . c30643_6pv2 1 . 9 . 4364 . 1 1 13 PHE CD2 C 3.183 0.112 -2.210 . . . 1.0 . . . . . . . . . . . . A . 13 PHE CD2 . . . . . . . . . c30643_6pv2 1 . 9 . 4365 . 1 1 13 PHE CE1 C 2.271 1.134 -4.602 . . . 1.0 . . . . . . . . . . . . A . 13 PHE CE1 . . . . . . . . . c30643_6pv2 1 . 9 . 4366 . 1 1 13 PHE CE2 C 2.027 -0.386 -2.774 . . . 1.0 . . . . . . . . . . . . A . 13 PHE CE2 . . . . . . . . . c30643_6pv2 1 . 9 . 4367 . 1 1 13 PHE CG C 3.894 1.124 -2.830 . . . 1.0 . . . . . . . . . . . . A . 13 PHE CG . . . . . . . . . c30643_6pv2 1 . 9 . 4368 . 1 1 13 PHE CZ C 1.587 0.103 -3.985 . . . 1.0 . . . . . . . . . . . . A . 13 PHE CZ . . . . . . . . . c30643_6pv2 1 . 9 . 4369 . 1 1 13 PHE H H 6.198 -0.767 -1.615 . . . 1.0 . . . . . . . . . . . . A . 13 PHE H . . . . . . . . . c30643_6pv2 1 . 9 . 4370 . 1 1 13 PHE HA H 6.500 1.189 -3.796 . . . 1.0 . . . . . . . . . . . . A . 13 PHE HA . . . . . . . . . c30643_6pv2 1 . 9 . 4371 . 1 1 13 PHE HB2 H 5.081 1.519 -1.140 . . . 1.0 . . . . . . . . . . . . A . 13 PHE HB2 . . . . . . . . . c30643_6pv2 1 . 9 . 4372 . 1 1 13 PHE HB3 H 5.189 2.728 -2.418 . . . 1.0 . . . . . . . . . . . . A . 13 PHE HB3 . . . . . . . . . c30643_6pv2 1 . 9 . 4373 . 1 1 13 PHE HD1 H 3.972 2.419 -4.522 . . . 1.0 . . . . . . . . . . . . A . 13 PHE HD1 . . . . . . . . . c30643_6pv2 1 . 9 . 4374 . 1 1 13 PHE HD2 H 3.540 -0.287 -1.272 . . . 1.0 . . . . . . . . . . . . A . 13 PHE HD2 . . . . . . . . . c30643_6pv2 1 . 9 . 4375 . 1 1 13 PHE HE1 H 1.915 1.536 -5.540 . . . 1.0 . . . . . . . . . . . . A . 13 PHE HE1 . . . . . . . . . c30643_6pv2 1 . 9 . 4376 . 1 1 13 PHE HE2 H 1.481 -1.174 -2.280 . . . 1.0 . . . . . . . . . . . . A . 13 PHE HE2 . . . . . . . . . c30643_6pv2 1 . 9 . 4377 . 1 1 13 PHE HZ H 0.690 -0.294 -4.434 . . . 1.0 . . . . . . . . . . . . A . 13 PHE HZ . . . . . . . . . c30643_6pv2 1 . 9 . 4378 . 1 1 13 PHE N N 6.321 -0.431 -2.530 . . . 1.0 . . . . . . . . . . . . A . 13 PHE N . . . . . . . . . c30643_6pv2 1 . 9 . 4379 . 1 1 13 PHE O O 8.282 0.860 -1.232 . . . 1.0 . . . . . . . . . . . . A . 13 PHE O . . . . . . . . . c30643_6pv2 1 . 9 . 4380 . 1 1 14 THR C C 8.806 4.352 -0.586 . . . 1.0 . . . . . . . . . . . . A . 14 THR C . . . . . . . . . c30643_6pv2 1 . 9 . 4381 . 1 1 14 THR CA C 9.164 3.432 -1.750 . . . 1.0 . . . . . . . . . . . . A . 14 THR CA . . . . . . . . . c30643_6pv2 1 . 9 . 4382 . 1 1 14 THR CB C 9.945 4.233 -2.809 . . . 1.0 . . . . . . . . . . . . A . 14 THR CB . . . . . . . . . c30643_6pv2 1 . 9 . 4383 . 1 1 14 THR CG2 C 10.829 3.319 -3.644 . . . 1.0 . . . . . . . . . . . . A . 14 THR CG2 . . . . . . . . . c30643_6pv2 1 . 9 . 4384 . 1 1 14 THR H H 7.436 3.313 -2.965 . . . 1.0 . . . . . . . . . . . . A . 14 THR H . . . . . . . . . c30643_6pv2 1 . 9 . 4385 . 1 1 14 THR HA H 9.809 2.647 -1.381 . . . 1.0 . . . . . . . . . . . . A . 14 THR HA . . . . . . . . . c30643_6pv2 1 . 9 . 4386 . 1 1 14 THR HB H 10.575 4.948 -2.297 . . . 1.0 . . . . . . . . . . . . A . 14 THR HB . . . . . . . . . c30643_6pv2 1 . 9 . 4387 . 1 1 14 THR HG1 H 8.136 4.903 -3.301 . . . 1.0 . . . . . . . . . . . . A . 14 THR HG1 . . . . . . . . . c30643_6pv2 1 . 9 . 4388 . 1 1 14 THR HG21 H 10.217 2.587 -4.145 . . . 1.0 . . . . . . . . . . . . A . 14 THR HG21 . . . . . . . . . c30643_6pv2 1 . 9 . 4389 . 1 1 14 THR HG22 H 11.539 2.817 -3.004 . . . 1.0 . . . . . . . . . . . . A . 14 THR HG22 . . . . . . . . . c30643_6pv2 1 . 9 . 4390 . 1 1 14 THR HG23 H 11.361 3.905 -4.378 . . . 1.0 . . . . . . . . . . . . A . 14 THR HG23 . . . . . . . . . c30643_6pv2 1 . 9 . 4391 . 1 1 14 THR N N 7.988 2.801 -2.330 . . . 1.0 . . . . . . . . . . . . A . 14 THR N . . . . . . . . . c30643_6pv2 1 . 9 . 4392 . 1 1 14 THR O O 9.668 4.738 0.200 . . . 1.0 . . . . . . . . . . . . A . 14 THR O . . . . . . . . . c30643_6pv2 1 . 9 . 4393 . 1 1 14 THR OG1 O 9.038 4.949 -3.666 . . . 1.0 . . . . . . . . . . . . A . 14 THR OG1 . . . . . . . . . c30643_6pv2 1 . 9 . 4394 . 1 1 15 ARG C C 5.811 5.026 1.221 . . . 1.0 . . . . . . . . . . . . A . 15 ARG C . . . . . . . . . c30643_6pv2 1 . 9 . 4395 . 1 1 15 ARG CA C 7.075 5.591 0.580 . . . 1.0 . . . . . . . . . . . . A . 15 ARG CA . . . . . . . . . c30643_6pv2 1 . 9 . 4396 . 1 1 15 ARG CB C 6.807 7.001 0.034 . . . 1.0 . . . . . . . . . . . . A . 15 ARG CB . . . . . . . . . c30643_6pv2 1 . 9 . 4397 . 1 1 15 ARG CD C 7.687 9.011 -1.209 . . . 1.0 . . . . . . . . . . . . A . 15 ARG CD . . . . . . . . . c30643_6pv2 1 . 9 . 4398 . 1 1 15 ARG CG C 7.976 7.593 -0.741 . . . 1.0 . . . . . . . . . . . . A . 15 ARG CG . . . . . . . . . c30643_6pv2 1 . 9 . 4399 . 1 1 15 ARG CZ C 7.376 11.259 -0.231 . . . 1.0 . . . . . . . . . . . . A . 15 ARG CZ . . . . . . . . . c30643_6pv2 1 . 9 . 4400 . 1 1 15 ARG H H 6.888 4.391 -1.155 . . . 1.0 . . . . . . . . . . . . A . 15 ARG H . . . . . . . . . c30643_6pv2 1 . 9 . 4401 . 1 1 15 ARG HA H 7.855 5.641 1.325 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HA . . . . . . . . . c30643_6pv2 1 . 9 . 4402 . 1 1 15 ARG HB2 H 5.953 6.964 -0.621 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HB2 . . . . . . . . . c30643_6pv2 1 . 9 . 4403 . 1 1 15 ARG HB3 H 6.586 7.660 0.862 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HB3 . . . . . . . . . c30643_6pv2 1 . 9 . 4404 . 1 1 15 ARG HD2 H 8.488 9.332 -1.858 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HD2 . . . . . . . . . c30643_6pv2 1 . 9 . 4405 . 1 1 15 ARG HD3 H 6.759 9.012 -1.758 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HD3 . . . . . . . . . c30643_6pv2 1 . 9 . 4406 . 1 1 15 ARG HE H 7.673 9.578 0.816 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HE . . . . . . . . . c30643_6pv2 1 . 9 . 4407 . 1 1 15 ARG HG2 H 8.846 7.608 -0.102 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HG2 . . . . . . . . . c30643_6pv2 1 . 9 . 4408 . 1 1 15 ARG HG3 H 8.174 6.972 -1.603 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HG3 . . . . . . . . . c30643_6pv2 1 . 9 . 4409 . 1 1 15 ARG HH11 H 7.260 11.211 -2.257 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HH11 . . . . . . . . . c30643_6pv2 1 . 9 . 4410 . 1 1 15 ARG HH12 H 7.073 12.779 -1.541 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HH12 . . . . . . . . . c30643_6pv2 1 . 9 . 4411 . 1 1 15 ARG HH21 H 7.417 11.638 1.758 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HH21 . . . . . . . . . c30643_6pv2 1 . 9 . 4412 . 1 1 15 ARG HH22 H 7.159 13.022 0.747 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HH22 . . . . . . . . . c30643_6pv2 1 . 9 . 4413 . 1 1 15 ARG N N 7.535 4.714 -0.487 . . . 1.0 . . . . . . . . . . . . A . 15 ARG N . . . . . . . . . c30643_6pv2 1 . 9 . 4414 . 1 1 15 ARG NE N 7.580 9.948 -0.092 . . . 1.0 . . . . . . . . . . . . A . 15 ARG NE . . . . . . . . . c30643_6pv2 1 . 9 . 4415 . 1 1 15 ARG NH1 N 7.225 11.793 -1.439 . . . 1.0 . . . . . . . . . . . . A . 15 ARG NH1 . . . . . . . . . c30643_6pv2 1 . 9 . 4416 . 1 1 15 ARG NH2 N 7.314 12.035 0.843 . . . 1.0 . . . . . . . . . . . . A . 15 ARG NH2 . . . . . . . . . c30643_6pv2 1 . 9 . 4417 . 1 1 15 ARG O O 4.961 4.436 0.543 . . . 1.0 . . . . . . . . . . . . A . 15 ARG O . . . . . . . . . c30643_6pv2 1 . 9 . 4418 . 1 1 16 SER C C 3.249 5.292 2.770 . . . 1.0 . . . . . . . . . . . . A . 16 SER C . . . . . . . . . c30643_6pv2 1 . 9 . 4419 . 1 1 16 SER CA C 4.560 4.714 3.298 . . . 1.0 . . . . . . . . . . . . A . 16 SER CA . . . . . . . . . c30643_6pv2 1 . 9 . 4420 . 1 1 16 SER CB C 4.724 5.074 4.776 . . . 1.0 . . . . . . . . . . . . A . 16 SER CB . . . . . . . . . c30643_6pv2 1 . 9 . 4421 . 1 1 16 SER H H 6.425 5.670 3.012 . . . 1.0 . . . . . . . . . . . . A . 16 SER H . . . . . . . . . c30643_6pv2 1 . 9 . 4422 . 1 1 16 SER HA H 4.534 3.639 3.200 . . . 1.0 . . . . . . . . . . . . A . 16 SER HA . . . . . . . . . c30643_6pv2 1 . 9 . 4423 . 1 1 16 SER HB2 H 4.639 6.143 4.899 . . . 1.0 . . . . . . . . . . . . A . 16 SER HB2 . . . . . . . . . c30643_6pv2 1 . 9 . 4424 . 1 1 16 SER HB3 H 3.951 4.583 5.348 . . . 1.0 . . . . . . . . . . . . A . 16 SER HB3 . . . . . . . . . c30643_6pv2 1 . 9 . 4425 . 1 1 16 SER HG H 6.618 5.384 5.188 . . . 1.0 . . . . . . . . . . . . A . 16 SER HG . . . . . . . . . c30643_6pv2 1 . 9 . 4426 . 1 1 16 SER N N 5.703 5.204 2.535 . . . 1.0 . . . . . . . . . . . . A . 16 SER N . . . . . . . . . c30643_6pv2 1 . 9 . 4427 . 1 1 16 SER O O 2.217 4.626 2.800 . . . 1.0 . . . . . . . . . . . . A . 16 SER O . . . . . . . . . c30643_6pv2 1 . 9 . 4428 . 1 1 16 SER OG O 5.986 4.657 5.266 . . . 1.0 . . . . . . . . . . . . A . 16 SER OG . . . . . . . . . c30643_6pv2 1 . 9 . 4429 . 1 1 17 ASP C C 1.632 6.497 0.480 . . . 1.0 . . . . . . . . . . . . A . 17 ASP C . . . . . . . . . c30643_6pv2 1 . 9 . 4430 . 1 1 17 ASP CA C 2.117 7.193 1.743 . . . 1.0 . . . . . . . . . . . . A . 17 ASP CA . . . . . . . . . c30643_6pv2 1 . 9 . 4431 . 1 1 17 ASP CB C 2.404 8.665 1.452 . . . 1.0 . . . . . . . . . . . . A . 17 ASP CB . . . . . . . . . c30643_6pv2 1 . 9 . 4432 . 1 1 17 ASP CG C 1.169 9.421 1.003 . . . 1.0 . . . . . . . . . . . . A . 17 ASP CG . . . . . . . . . c30643_6pv2 1 . 9 . 4433 . 1 1 17 ASP H H 4.158 7.003 2.281 . . . 1.0 . . . . . . . . . . . . A . 17 ASP H . . . . . . . . . c30643_6pv2 1 . 9 . 4434 . 1 1 17 ASP HA H 1.342 7.129 2.491 . . . 1.0 . . . . . . . . . . . . A . 17 ASP HA . . . . . . . . . c30643_6pv2 1 . 9 . 4435 . 1 1 17 ASP HB2 H 2.782 9.135 2.348 . . . 1.0 . . . . . . . . . . . . A . 17 ASP HB2 . . . . . . . . . c30643_6pv2 1 . 9 . 4436 . 1 1 17 ASP HB3 H 3.149 8.735 0.676 . . . 1.0 . . . . . . . . . . . . A . 17 ASP HB3 . . . . . . . . . c30643_6pv2 1 . 9 . 4437 . 1 1 17 ASP N N 3.302 6.526 2.277 . . . 1.0 . . . . . . . . . . . . A . 17 ASP N . . . . . . . . . c30643_6pv2 1 . 9 . 4438 . 1 1 17 ASP O O 0.429 6.388 0.248 . . . 1.0 . . . . . . . . . . . . A . 17 ASP O . . . . . . . . . c30643_6pv2 1 . 9 . 4439 . 1 1 17 ASP OD1 O 0.927 9.505 -0.219 . . . 1.0 . . . . . . . . . . . . A . 17 ASP OD1 . . . . . . . . . c30643_6pv2 1 . 9 . 4440 . 1 1 17 ASP OD2 O 0.435 9.938 1.872 . . . 1.0 . . . . . . . . . . . . A . 17 ASP OD2 . . . . . . . . . c30643_6pv2 1 . 9 . 4441 . 1 1 18 GLU C C 1.466 4.011 -1.151 . . . 1.0 . . . . . . . . . . . . A . 18 GLU C . . . . . . . . . c30643_6pv2 1 . 9 . 4442 . 1 1 18 GLU CA C 2.241 5.260 -1.530 . . . 1.0 . . . . . . . . . . . . A . 18 GLU CA . . . . . . . . . c30643_6pv2 1 . 9 . 4443 . 1 1 18 GLU CB C 3.504 4.846 -2.288 . . . 1.0 . . . . . . . . . . . . A . 18 GLU CB . . . . . . . . . c30643_6pv2 1 . 9 . 4444 . 1 1 18 GLU CD C 5.539 5.509 -3.612 . . . 1.0 . . . . . . . . . . . . A . 18 GLU CD . . . . . . . . . c30643_6pv2 1 . 9 . 4445 . 1 1 18 GLU CG C 4.337 5.996 -2.824 . . . 1.0 . . . . . . . . . . . . A . 18 GLU CG . . . . . . . . . c30643_6pv2 1 . 9 . 4446 . 1 1 18 GLU H H 3.512 6.150 -0.096 . . . 1.0 . . . . . . . . . . . . A . 18 GLU H . . . . . . . . . c30643_6pv2 1 . 9 . 4447 . 1 1 18 GLU HA H 1.626 5.882 -2.162 . . . 1.0 . . . . . . . . . . . . A . 18 GLU HA . . . . . . . . . c30643_6pv2 1 . 9 . 4448 . 1 1 18 GLU HB2 H 4.127 4.275 -1.621 . . . 1.0 . . . . . . . . . . . . A . 18 GLU HB2 . . . . . . . . . c30643_6pv2 1 . 9 . 4449 . 1 1 18 GLU HB3 H 3.217 4.221 -3.121 . . . 1.0 . . . . . . . . . . . . A . 18 GLU HB3 . . . . . . . . . c30643_6pv2 1 . 9 . 4450 . 1 1 18 GLU HG2 H 3.720 6.604 -3.470 . . . 1.0 . . . . . . . . . . . . A . 18 GLU HG2 . . . . . . . . . c30643_6pv2 1 . 9 . 4451 . 1 1 18 GLU HG3 H 4.685 6.587 -1.994 . . . 1.0 . . . . . . . . . . . . A . 18 GLU HG3 . . . . . . . . . c30643_6pv2 1 . 9 . 4452 . 1 1 18 GLU N N 2.574 6.011 -0.325 . . . 1.0 . . . . . . . . . . . . A . 18 GLU N . . . . . . . . . c30643_6pv2 1 . 9 . 4453 . 1 1 18 GLU O O 0.431 3.695 -1.741 . . . 1.0 . . . . . . . . . . . . A . 18 GLU O . . . . . . . . . c30643_6pv2 1 . 9 . 4454 . 1 1 18 GLU OE1 O 6.497 5.002 -2.995 . . . 1.0 . . . . . . . . . . . . A . 18 GLU OE1 . . . . . . . . . c30643_6pv2 1 . 9 . 4455 . 1 1 18 GLU OE2 O 5.537 5.641 -4.852 . . . 1.0 . . . . . . . . . . . . A . 18 GLU OE2 . . . . . . . . . c30643_6pv2 1 . 9 . 4456 . 1 1 19 LEU C C 0.001 2.376 0.977 . . . 1.0 . . . . . . . . . . . . A . 19 LEU C . . . . . . . . . c30643_6pv2 1 . 9 . 4457 . 1 1 19 LEU CA C 1.360 2.092 0.340 . . . 1.0 . . . . . . . . . . . . A . 19 LEU CA . . . . . . . . . c30643_6pv2 1 . 9 . 4458 . 1 1 19 LEU CB C 2.284 1.392 1.339 . . . 1.0 . . . . . . . . . . . . A . 19 LEU CB . . . . . . . . . c30643_6pv2 1 . 9 . 4459 . 1 1 19 LEU CD1 C 1.315 -0.897 0.962 . . . 1.0 . . . . . . . . . . . . A . 19 LEU CD1 . . . . . . . . . c30643_6pv2 1 . 9 . 4460 . 1 1 19 LEU CD2 C 2.687 -0.437 2.998 . . . 1.0 . . . . . . . . . . . . A . 19 LEU CD2 . . . . . . . . . c30643_6pv2 1 . 9 . 4461 . 1 1 19 LEU CG C 1.697 0.145 2.004 . . . 1.0 . . . . . . . . . . . . A . 19 LEU CG . . . . . . . . . c30643_6pv2 1 . 9 . 4462 . 1 1 19 LEU H H 2.806 3.636 0.285 . . . 1.0 . . . . . . . . . . . . A . 19 LEU H . . . . . . . . . c30643_6pv2 1 . 9 . 4463 . 1 1 19 LEU HA H 1.211 1.445 -0.510 . . . 1.0 . . . . . . . . . . . . A . 19 LEU HA . . . . . . . . . c30643_6pv2 1 . 9 . 4464 . 1 1 19 LEU HB2 H 3.189 1.108 0.821 . . . 1.0 . . . . . . . . . . . . A . 19 LEU HB2 . . . . . . . . . c30643_6pv2 1 . 9 . 4465 . 1 1 19 LEU HB3 H 2.540 2.097 2.112 . . . 1.0 . . . . . . . . . . . . A . 19 LEU HB3 . . . . . . . . . c30643_6pv2 1 . 9 . 4466 . 1 1 19 LEU HD11 H 0.898 -1.760 1.455 . . . 1.0 . . . . . . . . . . . . A . 19 LEU HD11 . . . . . . . . . c30643_6pv2 1 . 9 . 4467 . 1 1 19 LEU HD12 H 2.193 -1.190 0.405 . . . 1.0 . . . . . . . . . . . . A . 19 LEU HD12 . . . . . . . . . c30643_6pv2 1 . 9 . 4468 . 1 1 19 LEU HD13 H 0.582 -0.480 0.286 . . . 1.0 . . . . . . . . . . . . A . 19 LEU HD13 . . . . . . . . . c30643_6pv2 1 . 9 . 4469 . 1 1 19 LEU HD21 H 2.992 0.332 3.693 . . . 1.0 . . . . . . . . . . . . A . 19 LEU HD21 . . . . . . . . . c30643_6pv2 1 . 9 . 4470 . 1 1 19 LEU HD22 H 3.553 -0.810 2.470 . . . 1.0 . . . . . . . . . . . . A . 19 LEU HD22 . . . . . . . . . c30643_6pv2 1 . 9 . 4471 . 1 1 19 LEU HD23 H 2.219 -1.246 3.539 . . . 1.0 . . . . . . . . . . . . A . 19 LEU HD23 . . . . . . . . . c30643_6pv2 1 . 9 . 4472 . 1 1 19 LEU HG H 0.801 0.422 2.544 . . . 1.0 . . . . . . . . . . . . A . 19 LEU HG . . . . . . . . . c30643_6pv2 1 . 9 . 4473 . 1 1 19 LEU N N 1.979 3.316 -0.143 . . . 1.0 . . . . . . . . . . . . A . 19 LEU N . . . . . . . . . c30643_6pv2 1 . 9 . 4474 . 1 1 19 LEU O O -0.959 1.650 0.742 . . . 1.0 . . . . . . . . . . . . A . 19 LEU O . . . . . . . . . c30643_6pv2 1 . 9 . 4475 . 1 1 20 GLN C C -2.383 4.193 1.404 . . . 1.0 . . . . . . . . . . . . A . 20 GLN C . . . . . . . . . c30643_6pv2 1 . 9 . 4476 . 1 1 20 GLN CA C -1.324 3.809 2.430 . . . 1.0 . . . . . . . . . . . . A . 20 GLN CA . . . . . . . . . c30643_6pv2 1 . 9 . 4477 . 1 1 20 GLN CB C -1.086 4.957 3.408 . . . 1.0 . . . . . . . . . . . . A . 20 GLN CB . . . . . . . . . c30643_6pv2 1 . 9 . 4478 . 1 1 20 GLN CD C -1.262 3.564 5.496 . . . 1.0 . . . . . . . . . . . . A . 20 GLN CD . . . . . . . . . c30643_6pv2 1 . 9 . 4479 . 1 1 20 GLN CG C -0.406 4.523 4.694 . . . 1.0 . . . . . . . . . . . . A . 20 GLN CG . . . . . . . . . c30643_6pv2 1 . 9 . 4480 . 1 1 20 GLN H H 0.732 3.972 1.932 . . . 1.0 . . . . . . . . . . . . A . 20 GLN H . . . . . . . . . c30643_6pv2 1 . 9 . 4481 . 1 1 20 GLN HA H -1.674 2.950 2.981 . . . 1.0 . . . . . . . . . . . . A . 20 GLN HA . . . . . . . . . c30643_6pv2 1 . 9 . 4482 . 1 1 20 GLN HB2 H -0.466 5.700 2.930 . . . 1.0 . . . . . . . . . . . . A . 20 GLN HB2 . . . . . . . . . c30643_6pv2 1 . 9 . 4483 . 1 1 20 GLN HB3 H -2.037 5.401 3.661 . . . 1.0 . . . . . . . . . . . . A . 20 GLN HB3 . . . . . . . . . c30643_6pv2 1 . 9 . 4484 . 1 1 20 GLN HE21 H -0.430 2.011 4.583 . . . 1.0 . . . . . . . . . . . . A . 20 GLN HE21 . . . . . . . . . c30643_6pv2 1 . 9 . 4485 . 1 1 20 GLN HE22 H -1.647 1.631 5.751 . . . 1.0 . . . . . . . . . . . . A . 20 GLN HE22 . . . . . . . . . c30643_6pv2 1 . 9 . 4486 . 1 1 20 GLN HG2 H 0.526 4.035 4.449 . . . 1.0 . . . . . . . . . . . . A . 20 GLN HG2 . . . . . . . . . c30643_6pv2 1 . 9 . 4487 . 1 1 20 GLN HG3 H -0.208 5.397 5.297 . . . 1.0 . . . . . . . . . . . . A . 20 GLN HG3 . . . . . . . . . c30643_6pv2 1 . 9 . 4488 . 1 1 20 GLN N N -0.074 3.431 1.776 . . . 1.0 . . . . . . . . . . . . A . 20 GLN N . . . . . . . . . c30643_6pv2 1 . 9 . 4489 . 1 1 20 GLN NE2 N -1.093 2.273 5.254 . . . 1.0 . . . . . . . . . . . . A . 20 GLN NE2 . . . . . . . . . c30643_6pv2 1 . 9 . 4490 . 1 1 20 GLN O O -3.534 3.751 1.487 . . . 1.0 . . . . . . . . . . . . A . 20 GLN O . . . . . . . . . c30643_6pv2 1 . 9 . 4491 . 1 1 20 GLN OE1 O -2.069 3.981 6.325 . . . 1.0 . . . . . . . . . . . . A . 20 GLN OE1 . . . . . . . . . c30643_6pv2 1 . 9 . 4492 . 1 1 21 ARG C C -3.324 4.129 -1.400 . . . 1.0 . . . . . . . . . . . . A . 21 ARG C . . . . . . . . . c30643_6pv2 1 . 9 . 4493 . 1 1 21 ARG CA C -2.858 5.378 -0.665 . . . 1.0 . . . . . . . . . . . . A . 21 ARG CA . . . . . . . . . c30643_6pv2 1 . 9 . 4494 . 1 1 21 ARG CB C -2.129 6.327 -1.620 . . . 1.0 . . . . . . . . . . . . A . 21 ARG CB . . . . . . . . . c30643_6pv2 1 . 9 . 4495 . 1 1 21 ARG CD C -2.083 7.496 -3.838 . . . 1.0 . . . . . . . . . . . . A . 21 ARG CD . . . . . . . . . c30643_6pv2 1 . 9 . 4496 . 1 1 21 ARG CG C -2.867 6.575 -2.921 . . . 1.0 . . . . . . . . . . . . A . 21 ARG CG . . . . . . . . . c30643_6pv2 1 . 9 . 4497 . 1 1 21 ARG CZ C -2.326 8.404 -6.124 . . . 1.0 . . . . . . . . . . . . A . 21 ARG CZ . . . . . . . . . c30643_6pv2 1 . 9 . 4498 . 1 1 21 ARG H H -1.063 5.358 0.458 . . . 1.0 . . . . . . . . . . . . A . 21 ARG H . . . . . . . . . c30643_6pv2 1 . 9 . 4499 . 1 1 21 ARG HA H -3.718 5.882 -0.251 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HA . . . . . . . . . c30643_6pv2 1 . 9 . 4500 . 1 1 21 ARG HB2 H -1.990 7.277 -1.126 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HB2 . . . . . . . . . c30643_6pv2 1 . 9 . 4501 . 1 1 21 ARG HB3 H -1.163 5.910 -1.854 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HB3 . . . . . . . . . c30643_6pv2 1 . 9 . 4502 . 1 1 21 ARG HD2 H -2.119 8.498 -3.439 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HD2 . . . . . . . . . c30643_6pv2 1 . 9 . 4503 . 1 1 21 ARG HD3 H -1.057 7.161 -3.875 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HD3 . . . . . . . . . c30643_6pv2 1 . 9 . 4504 . 1 1 21 ARG HE H -3.247 6.769 -5.428 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HE . . . . . . . . . c30643_6pv2 1 . 9 . 4505 . 1 1 21 ARG HG2 H -3.023 5.631 -3.421 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HG2 . . . . . . . . . c30643_6pv2 1 . 9 . 4506 . 1 1 21 ARG HG3 H -3.821 7.028 -2.699 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HG3 . . . . . . . . . c30643_6pv2 1 . 9 . 4507 . 1 1 21 ARG HH11 H -1.136 9.522 -4.914 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HH11 . . . . . . . . . c30643_6pv2 1 . 9 . 4508 . 1 1 21 ARG HH12 H -1.287 10.094 -6.544 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HH12 . . . . . . . . . c30643_6pv2 1 . 9 . 4509 . 1 1 21 ARG HH21 H -3.441 7.520 -7.570 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HH21 . . . . . . . . . c30643_6pv2 1 . 9 . 4510 . 1 1 21 ARG HH22 H -2.608 8.963 -8.051 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HH22 . . . . . . . . . c30643_6pv2 1 . 9 . 4511 . 1 1 21 ARG N N -1.981 5.003 0.435 . . . 1.0 . . . . . . . . . . . . A . 21 ARG N . . . . . . . . . c30643_6pv2 1 . 9 . 4512 . 1 1 21 ARG NE N -2.631 7.501 -5.192 . . . 1.0 . . . . . . . . . . . . A . 21 ARG NE . . . . . . . . . c30643_6pv2 1 . 9 . 4513 . 1 1 21 ARG NH1 N -1.520 9.423 -5.838 . . . 1.0 . . . . . . . . . . . . A . 21 ARG NH1 . . . . . . . . . c30643_6pv2 1 . 9 . 4514 . 1 1 21 ARG NH2 N -2.831 8.286 -7.345 . . . 1.0 . . . . . . . . . . . . A . 21 ARG NH2 . . . . . . . . . c30643_6pv2 1 . 9 . 4515 . 1 1 21 ARG O O -4.509 3.973 -1.694 . . . 1.0 . . . . . . . . . . . . A . 21 ARG O . . . . . . . . . c30643_6pv2 1 . 9 . 4516 . 1 1 22 HIS C C -3.723 1.180 -1.494 . . . 1.0 . . . . . . . . . . . . A . 22 HIS C . . . . . . . . . c30643_6pv2 1 . 9 . 4517 . 1 1 22 HIS CA C -2.688 1.962 -2.307 . . . 1.0 . . . . . . . . . . . . A . 22 HIS CA . . . . . . . . . c30643_6pv2 1 . 9 . 4518 . 1 1 22 HIS CB C -1.401 1.143 -2.485 . . . 1.0 . . . . . . . . . . . . A . 22 HIS CB . . . . . . . . . c30643_6pv2 1 . 9 . 4519 . 1 1 22 HIS CD2 C -1.905 -1.354 -2.136 . . . 1.0 . . . . . . . . . . . . A . 22 HIS CD2 . . . . . . . . . c30643_6pv2 1 . 9 . 4520 . 1 1 22 HIS CE1 C -2.006 -2.013 -4.207 . . . 1.0 . . . . . . . . . . . . A . 22 HIS CE1 . . . . . . . . . c30643_6pv2 1 . 9 . 4521 . 1 1 22 HIS CG C -1.642 -0.271 -2.901 . . . 1.0 . . . . . . . . . . . . A . 22 HIS CG . . . . . . . . . c30643_6pv2 1 . 9 . 4522 . 1 1 22 HIS H H -1.454 3.419 -1.410 . . . 1.0 . . . . . . . . . . . . A . 22 HIS H . . . . . . . . . c30643_6pv2 1 . 9 . 4523 . 1 1 22 HIS HA H -3.103 2.180 -3.279 . . . 1.0 . . . . . . . . . . . . A . 22 HIS HA . . . . . . . . . c30643_6pv2 1 . 9 . 4524 . 1 1 22 HIS HB2 H -0.785 1.609 -3.239 . . . 1.0 . . . . . . . . . . . . A . 22 HIS HB2 . . . . . . . . . c30643_6pv2 1 . 9 . 4525 . 1 1 22 HIS HB3 H -0.862 1.126 -1.550 . . . 1.0 . . . . . . . . . . . . A . 22 HIS HB3 . . . . . . . . . c30643_6pv2 1 . 9 . 4526 . 1 1 22 HIS HD1 H -1.543 -0.153 -5.023 . . . 1.0 . . . . . . . . . . . . A . 22 HIS HD1 . . . . . . . . . c30643_6pv2 1 . 9 . 4527 . 1 1 22 HIS HD2 H -1.904 -1.392 -1.058 . . . 1.0 . . . . . . . . . . . . A . 22 HIS HD2 . . . . . . . . . c30643_6pv2 1 . 9 . 4528 . 1 1 22 HIS HE1 H -2.118 -2.636 -5.080 . . . 1.0 . . . . . . . . . . . . A . 22 HIS HE1 . . . . . . . . . c30643_6pv2 1 . 9 . 4529 . 1 1 22 HIS N N -2.384 3.228 -1.662 . . . 1.0 . . . . . . . . . . . . A . 22 HIS N . . . . . . . . . c30643_6pv2 1 . 9 . 4530 . 1 1 22 HIS ND1 N -1.698 -0.705 -4.222 . . . 1.0 . . . . . . . . . . . . A . 22 HIS ND1 . . . . . . . . . c30643_6pv2 1 . 9 . 4531 . 1 1 22 HIS NE2 N -2.137 -2.417 -2.969 . . . 1.0 . . . . . . . . . . . . A . 22 HIS NE2 . . . . . . . . . c30643_6pv2 1 . 9 . 4532 . 1 1 22 HIS O O -4.712 0.694 -2.038 . . . 1.0 . . . . . . . . . . . . A . 22 HIS O . . . . . . . . . c30643_6pv2 1 . 9 . 4533 . 1 1 23 LYS C C -5.814 0.870 0.651 . . . 1.0 . . . . . . . . . . . . A . 23 LYS C . . . . . . . . . c30643_6pv2 1 . 9 . 4534 . 1 1 23 LYS CA C -4.384 0.342 0.704 . . . 1.0 . . . . . . . . . . . . A . 23 LYS CA . . . . . . . . . c30643_6pv2 1 . 9 . 4535 . 1 1 23 LYS CB C -3.869 0.403 2.144 . . . 1.0 . . . . . . . . . . . . A . 23 LYS CB . . . . . . . . . c30643_6pv2 1 . 9 . 4536 . 1 1 23 LYS CD C -2.940 -1.929 2.339 . . . 1.0 . . . . . . . . . . . . A . 23 LYS CD . . . . . . . . . c30643_6pv2 1 . 9 . 4537 . 1 1 23 LYS CE C -1.765 -2.763 2.822 . . . 1.0 . . . . . . . . . . . . A . 23 LYS CE . . . . . . . . . c30643_6pv2 1 . 9 . 4538 . 1 1 23 LYS CG C -2.633 -0.442 2.409 . . . 1.0 . . . . . . . . . . . . A . 23 LYS CG . . . . . . . . . c30643_6pv2 1 . 9 . 4539 . 1 1 23 LYS H H -2.701 1.522 0.187 . . . 1.0 . . . . . . . . . . . . A . 23 LYS H . . . . . . . . . c30643_6pv2 1 . 9 . 4540 . 1 1 23 LYS HA H -4.387 -0.685 0.380 . . . 1.0 . . . . . . . . . . . . A . 23 LYS HA . . . . . . . . . c30643_6pv2 1 . 9 . 4541 . 1 1 23 LYS HB2 H -3.630 1.428 2.379 . . . 1.0 . . . . . . . . . . . . A . 23 LYS HB2 . . . . . . . . . c30643_6pv2 1 . 9 . 4542 . 1 1 23 LYS HB3 H -4.654 0.068 2.805 . . . 1.0 . . . . . . . . . . . . A . 23 LYS HB3 . . . . . . . . . c30643_6pv2 1 . 9 . 4543 . 1 1 23 LYS HD2 H -3.797 -2.139 2.960 . . . 1.0 . . . . . . . . . . . . A . 23 LYS HD2 . . . . . . . . . c30643_6pv2 1 . 9 . 4544 . 1 1 23 LYS HD3 H -3.160 -2.195 1.317 . . . 1.0 . . . . . . . . . . . . A . 23 LYS HD3 . . . . . . . . . c30643_6pv2 1 . 9 . 4545 . 1 1 23 LYS HE2 H -2.021 -3.808 2.728 . . . 1.0 . . . . . . . . . . . . A . 23 LYS HE2 . . . . . . . . . c30643_6pv2 1 . 9 . 4546 . 1 1 23 LYS HE3 H -0.909 -2.546 2.200 . . . 1.0 . . . . . . . . . . . . A . 23 LYS HE3 . . . . . . . . . c30643_6pv2 1 . 9 . 4547 . 1 1 23 LYS HG2 H -1.884 -0.208 1.668 . . . 1.0 . . . . . . . . . . . . A . 23 LYS HG2 . . . . . . . . . c30643_6pv2 1 . 9 . 4548 . 1 1 23 LYS HG3 H -2.252 -0.208 3.392 . . . 1.0 . . . . . . . . . . . . A . 23 LYS HG3 . . . . . . . . . c30643_6pv2 1 . 9 . 4549 . 1 1 23 LYS HZ1 H -1.135 -1.481 4.350 . . . 1.0 . . . . . . . . . . . . A . 23 LYS HZ1 . . . . . . . . . c30643_6pv2 1 . 9 . 4550 . 1 1 23 LYS HZ2 H -0.634 -3.083 4.550 . . . 1.0 . . . . . . . . . . . . A . 23 LYS HZ2 . . . . . . . . . c30643_6pv2 1 . 9 . 4551 . 1 1 23 LYS HZ3 H -2.241 -2.656 4.854 . . . 1.0 . . . . . . . . . . . . A . 23 LYS HZ3 . . . . . . . . . c30643_6pv2 1 . 9 . 4552 . 1 1 23 LYS N N -3.496 1.085 -0.190 . . . 1.0 . . . . . . . . . . . . A . 23 LYS N . . . . . . . . . c30643_6pv2 1 . 9 . 4553 . 1 1 23 LYS NZ N -1.420 -2.475 4.242 . . . 1.0 . . . . . . . . . . . . A . 23 LYS NZ . . . . . . . . . c30643_6pv2 1 . 9 . 4554 . 1 1 23 LYS O O -6.767 0.127 0.914 . . . 1.0 . . . . . . . . . . . . A . 23 LYS O . . . . . . . . . c30643_6pv2 1 . 9 . 4555 . 1 1 24 ARG C C -8.144 2.035 -0.848 . . . 1.0 . . . . . . . . . . . . A . 24 ARG C . . . . . . . . . c30643_6pv2 1 . 9 . 4556 . 1 1 24 ARG CA C -7.299 2.735 0.214 . . . 1.0 . . . . . . . . . . . . A . 24 ARG CA . . . . . . . . . c30643_6pv2 1 . 9 . 4557 . 1 1 24 ARG CB C -7.226 4.237 -0.068 . . . 1.0 . . . . . . . . . . . . A . 24 ARG CB . . . . . . . . . c30643_6pv2 1 . 9 . 4558 . 1 1 24 ARG CD C -6.747 6.521 0.883 . . . 1.0 . . . . . . . . . . . . A . 24 ARG CD . . . . . . . . . c30643_6pv2 1 . 9 . 4559 . 1 1 24 ARG CG C -6.526 5.023 1.028 . . . 1.0 . . . . . . . . . . . . A . 24 ARG CG . . . . . . . . . c30643_6pv2 1 . 9 . 4560 . 1 1 24 ARG CZ C -5.872 8.296 -0.587 . . . 1.0 . . . . . . . . . . . . A . 24 ARG CZ . . . . . . . . . c30643_6pv2 1 . 9 . 4561 . 1 1 24 ARG H H -5.178 2.688 0.085 . . . 1.0 . . . . . . . . . . . . A . 24 ARG H . . . . . . . . . c30643_6pv2 1 . 9 . 4562 . 1 1 24 ARG HA H -7.774 2.587 1.173 . . . 1.0 . . . . . . . . . . . . A . 24 ARG HA . . . . . . . . . c30643_6pv2 1 . 9 . 4563 . 1 1 24 ARG HB2 H -6.692 4.394 -0.993 . . . 1.0 . . . . . . . . . . . . A . 24 ARG HB2 . . . . . . . . . c30643_6pv2 1 . 9 . 4564 . 1 1 24 ARG HB3 H -8.230 4.622 -0.172 . . . 1.0 . . . . . . . . . . . . A . 24 ARG HB3 . . . . . . . . . c30643_6pv2 1 . 9 . 4565 . 1 1 24 ARG HD2 H -7.803 6.723 0.977 . . . 1.0 . . . . . . . . . . . . A . 24 ARG HD2 . . . . . . . . . c30643_6pv2 1 . 9 . 4566 . 1 1 24 ARG HD3 H -6.215 7.026 1.677 . . . 1.0 . . . . . . . . . . . . A . 24 ARG HD3 . . . . . . . . . c30643_6pv2 1 . 9 . 4567 . 1 1 24 ARG HE H -6.302 6.428 -1.174 . . . 1.0 . . . . . . . . . . . . A . 24 ARG HE . . . . . . . . . c30643_6pv2 1 . 9 . 4568 . 1 1 24 ARG HG2 H -6.912 4.705 1.985 . . . 1.0 . . . . . . . . . . . . A . 24 ARG HG2 . . . . . . . . . c30643_6pv2 1 . 9 . 4569 . 1 1 24 ARG HG3 H -5.467 4.819 0.982 . . . 1.0 . . . . . . . . . . . . A . 24 ARG HG3 . . . . . . . . . c30643_6pv2 1 . 9 . 4570 . 1 1 24 ARG HH11 H -5.486 10.075 0.312 . . . 1.0 . . . . . . . . . . . . A . 24 ARG HH11 . . . . . . . . . c30643_6pv2 1 . 9 . 4571 . 1 1 24 ARG HH12 H -6.032 8.816 1.370 . . . 1.0 . . . . . . . . . . . . A . 24 ARG HH12 . . . . . . . . . c30643_6pv2 1 . 9 . 4572 . 1 1 24 ARG HH21 H -5.577 8.084 -2.583 . . . 1.0 . . . . . . . . . . . . A . 24 ARG HH21 . . . . . . . . . c30643_6pv2 1 . 9 . 4573 . 1 1 24 ARG HH22 H -5.216 9.658 -1.942 . . . 1.0 . . . . . . . . . . . . A . 24 ARG HH22 . . . . . . . . . c30643_6pv2 1 . 9 . 4574 . 1 1 24 ARG N N -5.971 2.141 0.296 . . . 1.0 . . . . . . . . . . . . A . 24 ARG N . . . . . . . . . c30643_6pv2 1 . 9 . 4575 . 1 1 24 ARG NE N -6.282 7.041 -0.403 . . . 1.0 . . . . . . . . . . . . A . 24 ARG NE . . . . . . . . . c30643_6pv2 1 . 9 . 4576 . 1 1 24 ARG NH1 N -5.792 9.129 0.447 . . . 1.0 . . . . . . . . . . . . A . 24 ARG NH1 . . . . . . . . . c30643_6pv2 1 . 9 . 4577 . 1 1 24 ARG NH2 N -5.528 8.714 -1.800 . . . 1.0 . . . . . . . . . . . . A . 24 ARG NH2 . . . . . . . . . c30643_6pv2 1 . 9 . 4578 . 1 1 24 ARG O O -9.368 1.987 -0.739 . . . 1.0 . . . . . . . . . . . . A . 24 ARG O . . . . . . . . . c30643_6pv2 1 . 9 . 4579 . 1 1 25 THR C C -8.760 -0.570 -2.411 . . . 1.0 . . . . . . . . . . . . A . 25 THR C . . . . . . . . . c30643_6pv2 1 . 9 . 4580 . 1 1 25 THR CA C -8.203 0.761 -2.912 . . . 1.0 . . . . . . . . . . . . A . 25 THR CA . . . . . . . . . c30643_6pv2 1 . 9 . 4581 . 1 1 25 THR CB C -7.316 0.523 -4.155 . . . 1.0 . . . . . . . . . . . . A . 25 THR CB . . . . . . . . . c30643_6pv2 1 . 9 . 4582 . 1 1 25 THR CG2 C -6.779 1.842 -4.693 . . . 1.0 . . . . . . . . . . . . A . 25 THR CG2 . . . . . . . . . c30643_6pv2 1 . 9 . 4583 . 1 1 25 THR H H -6.507 1.497 -1.874 . . . 1.0 . . . . . . . . . . . . A . 25 THR H . . . . . . . . . c30643_6pv2 1 . 9 . 4584 . 1 1 25 THR HA H -9.032 1.389 -3.208 . . . 1.0 . . . . . . . . . . . . A . 25 THR HA . . . . . . . . . c30643_6pv2 1 . 9 . 4585 . 1 1 25 THR HB H -7.919 0.062 -4.921 . . . 1.0 . . . . . . . . . . . . A . 25 THR HB . . . . . . . . . c30643_6pv2 1 . 9 . 4586 . 1 1 25 THR HG1 H -5.631 0.091 -3.206 . . . 1.0 . . . . . . . . . . . . A . 25 THR HG1 . . . . . . . . . c30643_6pv2 1 . 9 . 4587 . 1 1 25 THR HG21 H -7.604 2.475 -4.984 . . . 1.0 . . . . . . . . . . . . A . 25 THR HG21 . . . . . . . . . c30643_6pv2 1 . 9 . 4588 . 1 1 25 THR HG22 H -6.151 1.652 -5.549 . . . 1.0 . . . . . . . . . . . . A . 25 THR HG22 . . . . . . . . . c30643_6pv2 1 . 9 . 4589 . 1 1 25 THR HG23 H -6.201 2.336 -3.925 . . . 1.0 . . . . . . . . . . . . A . 25 THR HG23 . . . . . . . . . c30643_6pv2 1 . 9 . 4590 . 1 1 25 THR N N -7.488 1.456 -1.850 . . . 1.0 . . . . . . . . . . . . A . 25 THR N . . . . . . . . . c30643_6pv2 1 . 9 . 4591 . 1 1 25 THR O O -9.750 -1.080 -2.937 . . . 1.0 . . . . . . . . . . . . A . 25 THR O . . . . . . . . . c30643_6pv2 1 . 9 . 4592 . 1 1 25 THR OG1 O -6.219 -0.346 -3.842 . . . 1.0 . . . . . . . . . . . . A . 25 THR OG1 . . . . . . . . . c30643_6pv2 1 . 9 . 4593 . 1 1 26 HIS C C -9.714 -1.991 0.245 . . . 1.0 . . . . . . . . . . . . A . 26 HIS C . . . . . . . . . c30643_6pv2 1 . 9 . 4594 . 1 1 26 HIS CA C -8.628 -2.345 -0.756 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CA . . . . . . . . . c30643_6pv2 1 . 9 . 4595 . 1 1 26 HIS CB C -7.520 -3.104 -0.022 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CB . . . . . . . . . c30643_6pv2 1 . 9 . 4596 . 1 1 26 HIS CD2 C -5.137 -3.399 -0.954 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CD2 . . . . . . . . . c30643_6pv2 1 . 9 . 4597 . 1 1 26 HIS CE1 C -5.489 -5.007 -2.380 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CE1 . . . . . . . . . c30643_6pv2 1 . 9 . 4598 . 1 1 26 HIS CG C -6.461 -3.686 -0.898 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CG . . . . . . . . . c30643_6pv2 1 . 9 . 4599 . 1 1 26 HIS H H -7.302 -0.715 -1.044 . . . 1.0 . . . . . . . . . . . . A . 26 HIS H . . . . . . . . . c30643_6pv2 1 . 9 . 4600 . 1 1 26 HIS HA H -9.046 -2.974 -1.525 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HA . . . . . . . . . c30643_6pv2 1 . 9 . 4601 . 1 1 26 HIS HB2 H -7.034 -2.430 0.667 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HB2 . . . . . . . . . c30643_6pv2 1 . 9 . 4602 . 1 1 26 HIS HB3 H -7.965 -3.914 0.537 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HB3 . . . . . . . . . c30643_6pv2 1 . 9 . 4603 . 1 1 26 HIS HD1 H -7.535 -5.148 -2.009 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HD1 . . . . . . . . . c30643_6pv2 1 . 9 . 4604 . 1 1 26 HIS HD2 H -4.615 -2.659 -0.369 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HD2 . . . . . . . . . c30643_6pv2 1 . 9 . 4605 . 1 1 26 HIS HE1 H -5.329 -5.769 -3.127 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HE1 . . . . . . . . . c30643_6pv2 1 . 9 . 4606 . 1 1 26 HIS N N -8.124 -1.130 -1.385 . . . 1.0 . . . . . . . . . . . . A . 26 HIS N . . . . . . . . . c30643_6pv2 1 . 9 . 4607 . 1 1 26 HIS ND1 N -6.674 -4.712 -1.814 . . . 1.0 . . . . . . . . . . . . A . 26 HIS ND1 . . . . . . . . . c30643_6pv2 1 . 9 . 4608 . 1 1 26 HIS NE2 N -4.560 -4.235 -1.883 . . . 1.0 . . . . . . . . . . . . A . 26 HIS NE2 . . . . . . . . . c30643_6pv2 1 . 9 . 4609 . 1 1 26 HIS O O -10.705 -2.707 0.390 . . . 1.0 . . . . . . . . . . . . A . 26 HIS O . . . . . . . . . c30643_6pv2 1 . 9 . 4610 . 1 1 27 THR C C -11.799 -0.112 1.374 . . . 1.0 . . . . . . . . . . . . A . 27 THR C . . . . . . . . . c30643_6pv2 1 . 9 . 4611 . 1 1 27 THR CA C -10.428 -0.430 1.965 . . . 1.0 . . . . . . . . . . . . A . 27 THR CA . . . . . . . . . c30643_6pv2 1 . 9 . 4612 . 1 1 27 THR CB C -9.873 0.810 2.697 . . . 1.0 . . . . . . . . . . . . A . 27 THR CB . . . . . . . . . c30643_6pv2 1 . 9 . 4613 . 1 1 27 THR CG2 C -10.724 1.148 3.912 . . . 1.0 . . . . . . . . . . . . A . 27 THR CG2 . . . . . . . . . c30643_6pv2 1 . 9 . 4614 . 1 1 27 THR H H -8.710 -0.343 0.742 . . . 1.0 . . . . . . . . . . . . A . 27 THR H . . . . . . . . . c30643_6pv2 1 . 9 . 4615 . 1 1 27 THR HA H -10.536 -1.228 2.684 . . . 1.0 . . . . . . . . . . . . A . 27 THR HA . . . . . . . . . c30643_6pv2 1 . 9 . 4616 . 1 1 27 THR HB H -9.887 1.651 2.018 . . . 1.0 . . . . . . . . . . . . A . 27 THR HB . . . . . . . . . c30643_6pv2 1 . 9 . 4617 . 1 1 27 THR HG1 H -7.972 0.369 2.345 . . . 1.0 . . . . . . . . . . . . A . 27 THR HG1 . . . . . . . . . c30643_6pv2 1 . 9 . 4618 . 1 1 27 THR HG21 H -10.329 2.030 4.394 . . . 1.0 . . . . . . . . . . . . A . 27 THR HG21 . . . . . . . . . c30643_6pv2 1 . 9 . 4619 . 1 1 27 THR HG22 H -10.704 0.320 4.606 . . . 1.0 . . . . . . . . . . . . A . 27 THR HG22 . . . . . . . . . c30643_6pv2 1 . 9 . 4620 . 1 1 27 THR HG23 H -11.742 1.332 3.601 . . . 1.0 . . . . . . . . . . . . A . 27 THR HG23 . . . . . . . . . c30643_6pv2 1 . 9 . 4621 . 1 1 27 THR N N -9.509 -0.878 0.934 . . . 1.0 . . . . . . . . . . . . A . 27 THR N . . . . . . . . . c30643_6pv2 1 . 9 . 4622 . 1 1 27 THR O O -12.831 -0.389 1.989 . . . 1.0 . . . . . . . . . . . . A . 27 THR O . . . . . . . . . c30643_6pv2 1 . 9 . 4623 . 1 1 27 THR OG1 O -8.520 0.563 3.115 . . . 1.0 . . . . . . . . . . . . A . 27 THR OG1 . . . . . . . . . c30643_6pv2 1 . 9 . 4624 . 1 1 28 GLY C C -12.860 1.312 -1.869 . . . 1.0 . . . . . . . . . . . . A . 28 GLY C . . . . . . . . . c30643_6pv2 1 . 9 . 4625 . 1 1 28 GLY CA C -13.061 0.763 -0.474 . . . 1.0 . . . . . . . . . . . . A . 28 GLY CA . . . . . . . . . c30643_6pv2 1 . 9 . 4626 . 1 1 28 GLY H H -10.962 0.651 -0.277 . . . 1.0 . . . . . . . . . . . . A . 28 GLY H . . . . . . . . . c30643_6pv2 1 . 9 . 4627 . 1 1 28 GLY HA2 H -13.659 -0.135 -0.533 . . . 1.0 . . . . . . . . . . . . A . 28 GLY HA2 . . . . . . . . . c30643_6pv2 1 . 9 . 4628 . 1 1 28 GLY HA3 H -13.586 1.496 0.118 . . . 1.0 . . . . . . . . . . . . A . 28 GLY HA3 . . . . . . . . . c30643_6pv2 1 . 9 . 4629 . 1 1 28 GLY N N -11.810 0.448 0.174 . . . 1.0 . . . . . . . . . . . . A . 28 GLY N . . . . . . . . . c30643_6pv2 1 . 9 . 4630 . 1 1 28 GLY O O -11.752 1.268 -2.407 . . . 1.0 . . . . . . . . . . . . A . 28 GLY O . . . . . . . . . c30643_6pv2 1 . 9 . 4631 . 1 1 29 GLU C C -14.747 3.644 -3.863 . . . 1.0 . . . . . . . . . . . . A . 29 GLU C . . . . . . . . . c30643_6pv2 1 . 9 . 4632 . 1 1 29 GLU CA C -13.881 2.394 -3.787 . . . 1.0 . . . . . . . . . . . . A . 29 GLU CA . . . . . . . . . c30643_6pv2 1 . 9 . 4633 . 1 1 29 GLU CB C -14.347 1.359 -4.817 . . . 1.0 . . . . . . . . . . . . A . 29 GLU CB . . . . . . . . . c30643_6pv2 1 . 9 . 4634 . 1 1 29 GLU CD C -14.607 0.784 -7.256 . . . 1.0 . . . . . . . . . . . . A . 29 GLU CD . . . . . . . . . c30643_6pv2 1 . 9 . 4635 . 1 1 29 GLU CG C -14.366 1.879 -6.244 . . . 1.0 . . . . . . . . . . . . A . 29 GLU CG . . . . . . . . . c30643_6pv2 1 . 9 . 4636 . 1 1 29 GLU H H -14.780 1.826 -1.966 . . . 1.0 . . . . . . . . . . . . A . 29 GLU H . . . . . . . . . c30643_6pv2 1 . 9 . 4637 . 1 1 29 GLU HA H -12.859 2.667 -3.995 . . . 1.0 . . . . . . . . . . . . A . 29 GLU HA . . . . . . . . . c30643_6pv2 1 . 9 . 4638 . 1 1 29 GLU HB2 H -13.688 0.504 -4.775 . . . 1.0 . . . . . . . . . . . . A . 29 GLU HB2 . . . . . . . . . c30643_6pv2 1 . 9 . 4639 . 1 1 29 GLU HB3 H -15.347 1.042 -4.561 . . . 1.0 . . . . . . . . . . . . A . 29 GLU HB3 . . . . . . . . . c30643_6pv2 1 . 9 . 4640 . 1 1 29 GLU HG2 H -15.153 2.612 -6.334 . . . 1.0 . . . . . . . . . . . . A . 29 GLU HG2 . . . . . . . . . c30643_6pv2 1 . 9 . 4641 . 1 1 29 GLU HG3 H -13.415 2.346 -6.457 . . . 1.0 . . . . . . . . . . . . A . 29 GLU HG3 . . . . . . . . . c30643_6pv2 1 . 9 . 4642 . 1 1 29 GLU N N -13.930 1.827 -2.451 . . . 1.0 . . . . . . . . . . . . A . 29 GLU N . . . . . . . . . c30643_6pv2 1 . 9 . 4643 . 1 1 29 GLU O O -14.445 4.580 -4.603 . . . 1.0 . . . . . . . . . . . . A . 29 GLU O . . . . . . . . . c30643_6pv2 1 . 9 . 4644 . 1 1 29 GLU OE1 O -15.748 0.284 -7.330 . . . 1.0 . . . . . . . . . . . . A . 29 GLU OE1 . . . . . . . . . c30643_6pv2 1 . 9 . 4645 . 1 1 29 GLU OE2 O -13.661 0.422 -7.987 . . . 1.0 . . . . . . . . . . . . A . 29 GLU OE2 . . . . . . . . . c30643_6pv2 1 . 9 . 4646 . 1 1 30 LYS C C -16.013 6.024 -2.529 . . . 1.0 . . . . . . . . . . . . A . 30 LYS C . . . . . . . . . c30643_6pv2 1 . 9 . 4647 . 1 1 30 LYS CA C -16.732 4.782 -3.045 . . . 1.0 . . . . . . . . . . . . A . 30 LYS CA . . . . . . . . . c30643_6pv2 1 . 9 . 4648 . 1 1 30 LYS CB C -17.929 4.449 -2.157 . . . 1.0 . . . . . . . . . . . . A . 30 LYS CB . . . . . . . . . c30643_6pv2 1 . 9 . 4649 . 1 1 30 LYS CD C -19.786 2.819 -1.670 . . . 1.0 . . . . . . . . . . . . A . 30 LYS CD . . . . . . . . . c30643_6pv2 1 . 9 . 4650 . 1 1 30 LYS CE C -20.735 3.914 -1.203 . . . 1.0 . . . . . . . . . . . . A . 30 LYS CE . . . . . . . . . c30643_6pv2 1 . 9 . 4651 . 1 1 30 LYS CG C -18.794 3.325 -2.705 . . . 1.0 . . . . . . . . . . . . A . 30 LYS CG . . . . . . . . . c30643_6pv2 1 . 9 . 4652 . 1 1 30 LYS H H -16.016 2.865 -2.534 . . . 1.0 . . . . . . . . . . . . A . 30 LYS H . . . . . . . . . c30643_6pv2 1 . 9 . 4653 . 1 1 30 LYS HA H -17.078 4.970 -4.051 . . . 1.0 . . . . . . . . . . . . A . 30 LYS HA . . . . . . . . . c30643_6pv2 1 . 9 . 4654 . 1 1 30 LYS HB2 H -17.569 4.155 -1.182 . . . 1.0 . . . . . . . . . . . . A . 30 LYS HB2 . . . . . . . . . c30643_6pv2 1 . 9 . 4655 . 1 1 30 LYS HB3 H -18.544 5.331 -2.055 . . . 1.0 . . . . . . . . . . . . A . 30 LYS HB3 . . . . . . . . . c30643_6pv2 1 . 9 . 4656 . 1 1 30 LYS HD2 H -20.365 2.019 -2.104 . . . 1.0 . . . . . . . . . . . . A . 30 LYS HD2 . . . . . . . . . c30643_6pv2 1 . 9 . 4657 . 1 1 30 LYS HD3 H -19.238 2.445 -0.820 . . . 1.0 . . . . . . . . . . . . A . 30 LYS HD3 . . . . . . . . . c30643_6pv2 1 . 9 . 4658 . 1 1 30 LYS HE2 H -20.158 4.706 -0.752 . . . 1.0 . . . . . . . . . . . . A . 30 LYS HE2 . . . . . . . . . c30643_6pv2 1 . 9 . 4659 . 1 1 30 LYS HE3 H -21.268 4.301 -2.059 . . . 1.0 . . . . . . . . . . . . A . 30 LYS HE3 . . . . . . . . . c30643_6pv2 1 . 9 . 4660 . 1 1 30 LYS HG2 H -19.340 3.690 -3.562 . . . 1.0 . . . . . . . . . . . . A . 30 LYS HG2 . . . . . . . . . c30643_6pv2 1 . 9 . 4661 . 1 1 30 LYS HG3 H -18.154 2.508 -3.006 . . . 1.0 . . . . . . . . . . . . A . 30 LYS HG3 . . . . . . . . . c30643_6pv2 1 . 9 . 4662 . 1 1 30 LYS HZ1 H -22.302 2.659 -0.633 . . . 1.0 . . . . . . . . . . . . A . 30 LYS HZ1 . . . . . . . . . c30643_6pv2 1 . 9 . 4663 . 1 1 30 LYS HZ2 H -22.341 4.179 0.103 . . . 1.0 . . . . . . . . . . . . A . 30 LYS HZ2 . . . . . . . . . c30643_6pv2 1 . 9 . 4664 . 1 1 30 LYS HZ3 H -21.224 3.019 0.621 . . . 1.0 . . . . . . . . . . . . A . 30 LYS HZ3 . . . . . . . . . c30643_6pv2 1 . 9 . 4665 . 1 1 30 LYS N N -15.824 3.649 -3.090 . . . 1.0 . . . . . . . . . . . . A . 30 LYS N . . . . . . . . . c30643_6pv2 1 . 9 . 4666 . 1 1 30 LYS NZ N -21.718 3.408 -0.209 . . . 1.0 . . . . . . . . . . . . A . 30 LYS NZ . . . . . . . . . c30643_6pv2 1 . 9 . 4667 . 1 1 30 LYS O O -15.805 6.989 -3.266 . . . 1.0 . . . . . . . . . . . . A . 30 LYS O . . . . . . . . . c30643_6pv2 1 . 9 . 4668 . 1 1 31 NH2 HN1 H -15.828 5.193 -0.739 . . . 1.0 . . . . . . . . . . . . A . 31 NH2 HN1 . . . . . . . . . c30643_6pv2 1 . 9 . 4669 . 1 1 31 NH2 HN2 H -15.158 6.776 -0.907 . . . 1.0 . . . . . . . . . . . . A . 31 NH2 HN2 . . . . . . . . . c30643_6pv2 1 . 9 . 4670 . 1 1 31 NH2 N N -15.628 5.997 -1.266 . . . 1.0 . . . . . . . . . . . . A . 31 NH2 N . . . . . . . . . c30643_6pv2 1 . 9 . 4671 . 2 2 1 ZN ZN Zn -2.625 -4.247 -2.369 . . . 1.0 . . . . . . . . . . . . A . 101 ZN ZN . . . . . . . . . c30643_6pv2 1 . 10 . 4672 . 1 1 1 ARG C C 11.903 -0.953 2.713 . . . 1.0 . . . . . . . . . . . . A . 1 ARG C . . . . . . . . . c30643_6pv2 1 . 10 . 4673 . 1 1 1 ARG CA C 13.092 -1.440 3.533 . . . 1.0 . . . . . . . . . . . . A . 1 ARG CA . . . . . . . . . c30643_6pv2 1 . 10 . 4674 . 1 1 1 ARG CB C 12.587 -2.162 4.788 . . . 1.0 . . . . . . . . . . . . A . 1 ARG CB . . . . . . . . . c30643_6pv2 1 . 10 . 4675 . 1 1 1 ARG CD C 13.143 -3.321 6.947 . . . 1.0 . . . . . . . . . . . . A . 1 ARG CD . . . . . . . . . c30643_6pv2 1 . 10 . 4676 . 1 1 1 ARG CG C 13.694 -2.722 5.663 . . . 1.0 . . . . . . . . . . . . A . 1 ARG CG . . . . . . . . . c30643_6pv2 1 . 10 . 4677 . 1 1 1 ARG CZ C 13.999 -4.367 9.013 . . . 1.0 . . . . . . . . . . . . A . 1 ARG CZ . . . . . . . . . c30643_6pv2 1 . 10 . 4678 . 1 1 1 ARG H1 H 14.295 0.187 3.054 . . . 1.0 . . . . . . . . . . . . A . 1 ARG H1 . . . . . . . . . c30643_6pv2 1 . 10 . 4679 . 1 1 1 ARG H2 H 14.775 -0.625 4.455 . . . 1.0 . . . . . . . . . . . . A . 1 ARG H2 . . . . . . . . . c30643_6pv2 1 . 10 . 4680 . 1 1 1 ARG H3 H 13.418 0.386 4.484 . . . 1.0 . . . . . . . . . . . . A . 1 ARG H3 . . . . . . . . . c30643_6pv2 1 . 10 . 4681 . 1 1 1 ARG HA H 13.677 -2.124 2.938 . . . 1.0 . . . . . . . . . . . . A . 1 ARG HA . . . . . . . . . c30643_6pv2 1 . 10 . 4682 . 1 1 1 ARG HB2 H 12.009 -1.468 5.377 . . . 1.0 . . . . . . . . . . . . A . 1 ARG HB2 . . . . . . . . . c30643_6pv2 1 . 10 . 4683 . 1 1 1 ARG HB3 H 11.949 -2.979 4.483 . . . 1.0 . . . . . . . . . . . . A . 1 ARG HB3 . . . . . . . . . c30643_6pv2 1 . 10 . 4684 . 1 1 1 ARG HD2 H 12.623 -2.550 7.496 . . . 1.0 . . . . . . . . . . . . A . 1 ARG HD2 . . . . . . . . . c30643_6pv2 1 . 10 . 4685 . 1 1 1 ARG HD3 H 12.450 -4.111 6.695 . . . 1.0 . . . . . . . . . . . . A . 1 ARG HD3 . . . . . . . . . c30643_6pv2 1 . 10 . 4686 . 1 1 1 ARG HE H 15.113 -3.874 7.425 . . . 1.0 . . . . . . . . . . . . A . 1 ARG HE . . . . . . . . . c30643_6pv2 1 . 10 . 4687 . 1 1 1 ARG HG2 H 14.219 -3.489 5.114 . . . 1.0 . . . . . . . . . . . . A . 1 ARG HG2 . . . . . . . . . c30643_6pv2 1 . 10 . 4688 . 1 1 1 ARG HG3 H 14.378 -1.925 5.913 . . . 1.0 . . . . . . . . . . . . A . 1 ARG HG3 . . . . . . . . . c30643_6pv2 1 . 10 . 4689 . 1 1 1 ARG HH11 H 12.627 -4.733 10.460 . . . 1.0 . . . . . . . . . . . . A . 1 ARG HH11 . . . . . . . . . c30643_6pv2 1 . 10 . 4690 . 1 1 1 ARG HH12 H 12.009 -3.979 9.027 . . . 1.0 . . . . . . . . . . . . A . 1 ARG HH12 . . . . . . . . . c30643_6pv2 1 . 10 . 4691 . 1 1 1 ARG HH21 H 15.942 -4.871 9.314 . . . 1.0 . . . . . . . . . . . . A . 1 ARG HH21 . . . . . . . . . c30643_6pv2 1 . 10 . 4692 . 1 1 1 ARG HH22 H 14.866 -5.245 10.624 . . . 1.0 . . . . . . . . . . . . A . 1 ARG HH22 . . . . . . . . . c30643_6pv2 1 . 10 . 4693 . 1 1 1 ARG N N 13.955 -0.295 3.911 . . . 1.0 . . . . . . . . . . . . A . 1 ARG N . . . . . . . . . c30643_6pv2 1 . 10 . 4694 . 1 1 1 ARG NE N 14.202 -3.869 7.793 . . . 1.0 . . . . . . . . . . . . A . 1 ARG NE . . . . . . . . . c30643_6pv2 1 . 10 . 4695 . 1 1 1 ARG NH1 N 12.781 -4.359 9.542 . . . 1.0 . . . . . . . . . . . . A . 1 ARG NH1 . . . . . . . . . c30643_6pv2 1 . 10 . 4696 . 1 1 1 ARG NH2 N 15.017 -4.867 9.705 . . . 1.0 . . . . . . . . . . . . A . 1 ARG NH2 . . . . . . . . . c30643_6pv2 1 . 10 . 4697 . 1 1 1 ARG O O 11.272 0.042 3.064 . . . 1.0 . . . . . . . . . . . . A . 1 ARG O . . . . . . . . . c30643_6pv2 1 . 10 . 4698 . 1 1 2 PRO C C 9.116 -1.594 1.452 . . . 1.0 . . . . . . . . . . . . A . 2 PRO C . . . . . . . . . c30643_6pv2 1 . 10 . 4699 . 1 1 2 PRO CA C 10.439 -1.279 0.767 . . . 1.0 . . . . . . . . . . . . A . 2 PRO CA . . . . . . . . . c30643_6pv2 1 . 10 . 4700 . 1 1 2 PRO CB C 10.612 -2.143 -0.482 . . . 1.0 . . . . . . . . . . . . A . 2 PRO CB . . . . . . . . . c30643_6pv2 1 . 10 . 4701 . 1 1 2 PRO CD C 12.321 -2.796 1.061 . . . 1.0 . . . . . . . . . . . . A . 2 PRO CD . . . . . . . . . c30643_6pv2 1 . 10 . 4702 . 1 1 2 PRO CG C 11.418 -3.310 -0.030 . . . 1.0 . . . . . . . . . . . . A . 2 PRO CG . . . . . . . . . c30643_6pv2 1 . 10 . 4703 . 1 1 2 PRO HA H 10.460 -0.234 0.494 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HA . . . . . . . . . c30643_6pv2 1 . 10 . 4704 . 1 1 2 PRO HB2 H 9.641 -2.450 -0.847 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HB2 . . . . . . . . . c30643_6pv2 1 . 10 . 4705 . 1 1 2 PRO HB3 H 11.128 -1.579 -1.244 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HB3 . . . . . . . . . c30643_6pv2 1 . 10 . 4706 . 1 1 2 PRO HD2 H 12.460 -3.550 1.820 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HD2 . . . . . . . . . c30643_6pv2 1 . 10 . 4707 . 1 1 2 PRO HD3 H 13.272 -2.490 0.652 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HD3 . . . . . . . . . c30643_6pv2 1 . 10 . 4708 . 1 1 2 PRO HG2 H 10.763 -4.079 0.355 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HG2 . . . . . . . . . c30643_6pv2 1 . 10 . 4709 . 1 1 2 PRO HG3 H 12.002 -3.692 -0.852 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HG3 . . . . . . . . . c30643_6pv2 1 . 10 . 4710 . 1 1 2 PRO N N 11.586 -1.636 1.600 . . . 1.0 . . . . . . . . . . . . A . 2 PRO N . . . . . . . . . c30643_6pv2 1 . 10 . 4711 . 1 1 2 PRO O O 8.997 -2.577 2.192 . . . 1.0 . . . . . . . . . . . . A . 2 PRO O . . . . . . . . . c30643_6pv2 1 . 10 . 4712 . 1 1 3 PHE C C 5.964 -1.834 0.929 . . . 1.0 . . . . . . . . . . . . A . 3 PHE C . . . . . . . . . c30643_6pv2 1 . 10 . 4713 . 1 1 3 PHE CA C 6.814 -0.917 1.794 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CA . . . . . . . . . c30643_6pv2 1 . 10 . 4714 . 1 1 3 PHE CB C 6.146 0.450 1.953 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CB . . . . . . . . . c30643_6pv2 1 . 10 . 4715 . 1 1 3 PHE CD1 C 7.804 2.304 2.238 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CD1 . . . . . . . . . c30643_6pv2 1 . 10 . 4716 . 1 1 3 PHE CD2 C 6.792 1.385 4.190 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CD2 . . . . . . . . . c30643_6pv2 1 . 10 . 4717 . 1 1 3 PHE CE1 C 8.527 3.181 3.023 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CE1 . . . . . . . . . c30643_6pv2 1 . 10 . 4718 . 1 1 3 PHE CE2 C 7.512 2.260 4.980 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CE2 . . . . . . . . . c30643_6pv2 1 . 10 . 4719 . 1 1 3 PHE CG C 6.931 1.399 2.812 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CG . . . . . . . . . c30643_6pv2 1 . 10 . 4720 . 1 1 3 PHE CZ C 8.382 3.147 4.408 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CZ . . . . . . . . . c30643_6pv2 1 . 10 . 4721 . 1 1 3 PHE H H 8.279 -0.018 0.570 . . . 1.0 . . . . . . . . . . . . A . 3 PHE H . . . . . . . . . c30643_6pv2 1 . 10 . 4722 . 1 1 3 PHE HA H 6.939 -1.367 2.769 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HA . . . . . . . . . c30643_6pv2 1 . 10 . 4723 . 1 1 3 PHE HB2 H 6.027 0.902 0.981 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HB2 . . . . . . . . . c30643_6pv2 1 . 10 . 4724 . 1 1 3 PHE HB3 H 5.178 0.319 2.402 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HB3 . . . . . . . . . c30643_6pv2 1 . 10 . 4725 . 1 1 3 PHE HD1 H 7.919 2.322 1.164 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HD1 . . . . . . . . . c30643_6pv2 1 . 10 . 4726 . 1 1 3 PHE HD2 H 6.113 0.681 4.649 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HD2 . . . . . . . . . c30643_6pv2 1 . 10 . 4727 . 1 1 3 PHE HE1 H 9.206 3.881 2.562 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HE1 . . . . . . . . . c30643_6pv2 1 . 10 . 4728 . 1 1 3 PHE HE2 H 7.396 2.239 6.053 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HE2 . . . . . . . . . c30643_6pv2 1 . 10 . 4729 . 1 1 3 PHE HZ H 8.946 3.827 5.030 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HZ . . . . . . . . . c30643_6pv2 1 . 10 . 4730 . 1 1 3 PHE N N 8.127 -0.760 1.197 . . . 1.0 . . . . . . . . . . . . A . 3 PHE N . . . . . . . . . c30643_6pv2 1 . 10 . 4731 . 1 1 3 PHE O O 5.564 -1.465 -0.168 . . . 1.0 . . . . . . . . . . . . A . 3 PHE O . . . . . . . . . c30643_6pv2 1 . 10 . 4732 . 1 1 4 NLE C C 3.559 -4.170 1.108 . . . 1.0 . . . . . . . . . . . . A . 4 NLE C . . . . . . . . . c30643_6pv2 1 . 10 . 4733 . 1 1 4 NLE CA C 5.001 -4.036 0.642 . . . 1.0 . . . . . . . . . . . . A . 4 NLE CA . . . . . . . . . c30643_6pv2 1 . 10 . 4734 . 1 1 4 NLE CB C 5.719 -5.384 0.762 . . . 1.0 . . . . . . . . . . . . A . 4 NLE CB . . . . . . . . . c30643_6pv2 1 . 10 . 4735 . 1 1 4 NLE CD C 5.773 -7.835 0.207 . . . 1.0 . . . . . . . . . . . . A . 4 NLE CD . . . . . . . . . c30643_6pv2 1 . 10 . 4736 . 1 1 4 NLE CE C 5.069 -8.947 -0.538 . . . 1.0 . . . . . . . . . . . . A . 4 NLE CE . . . . . . . . . c30643_6pv2 1 . 10 . 4737 . 1 1 4 NLE CG C 5.052 -6.515 -0.008 . . . 1.0 . . . . . . . . . . . . A . 4 NLE CG . . . . . . . . . c30643_6pv2 1 . 10 . 4738 . 1 1 4 NLE H H 5.989 -3.244 2.331 . . . 1.0 . . . . . . . . . . . . A . 4 NLE H . . . . . . . . . c30643_6pv2 1 . 10 . 4739 . 1 1 4 NLE HA H 5.008 -3.723 -0.391 . . . 1.0 . . . . . . . . . . . . A . 4 NLE HA . . . . . . . . . c30643_6pv2 1 . 10 . 4740 . 1 1 4 NLE HB2 H 5.757 -5.662 1.804 . . . 1.0 . . . . . . . . . . . . A . 4 NLE HB2 . . . . . . . . . c30643_6pv2 1 . 10 . 4741 . 1 1 4 NLE HB3 H 6.728 -5.276 0.394 . . . 1.0 . . . . . . . . . . . . A . 4 NLE HB3 . . . . . . . . . c30643_6pv2 1 . 10 . 4742 . 1 1 4 NLE HD2 H 5.783 -8.074 1.261 . . . 1.0 . . . . . . . . . . . . A . 4 NLE HD2 . . . . . . . . . c30643_6pv2 1 . 10 . 4743 . 1 1 4 NLE HD3 H 6.784 -7.757 -0.164 . . . 1.0 . . . . . . . . . . . . A . 4 NLE HD3 . . . . . . . . . c30643_6pv2 1 . 10 . 4744 . 1 1 4 NLE HE1 H 4.054 -9.037 -0.177 . . . 1.0 . . . . . . . . . . . . A . 4 NLE HE1 . . . . . . . . . c30643_6pv2 1 . 10 . 4745 . 1 1 4 NLE HE2 H 5.592 -9.879 -0.376 . . . 1.0 . . . . . . . . . . . . A . 4 NLE HE2 . . . . . . . . . c30643_6pv2 1 . 10 . 4746 . 1 1 4 NLE HE3 H 5.057 -8.721 -1.594 . . . 1.0 . . . . . . . . . . . . A . 4 NLE HE3 . . . . . . . . . c30643_6pv2 1 . 10 . 4747 . 1 1 4 NLE HG2 H 5.064 -6.276 -1.061 . . . 1.0 . . . . . . . . . . . . A . 4 NLE HG2 . . . . . . . . . c30643_6pv2 1 . 10 . 4748 . 1 1 4 NLE HG3 H 4.032 -6.615 0.330 . . . 1.0 . . . . . . . . . . . . A . 4 NLE HG3 . . . . . . . . . c30643_6pv2 1 . 10 . 4749 . 1 1 4 NLE N N 5.708 -3.031 1.419 . . . 1.0 . . . . . . . . . . . . A . 4 NLE N . . . . . . . . . c30643_6pv2 1 . 10 . 4750 . 1 1 4 NLE O O 3.287 -4.198 2.310 . . . 1.0 . . . . . . . . . . . . A . 4 NLE O . . . . . . . . . c30643_6pv2 1 . 10 . 4751 . 1 1 5 CYS C C 1.065 -5.896 0.991 . . . 1.0 . . . . . . . . . . . . A . 5 CYS C . . . . . . . . . c30643_6pv2 1 . 10 . 4752 . 1 1 5 CYS CA C 1.242 -4.476 0.463 . . . 1.0 . . . . . . . . . . . . A . 5 CYS CA . . . . . . . . . c30643_6pv2 1 . 10 . 4753 . 1 1 5 CYS CB C 0.368 -4.257 -0.773 . . . 1.0 . . . . . . . . . . . . A . 5 CYS CB . . . . . . . . . c30643_6pv2 1 . 10 . 4754 . 1 1 5 CYS H H 2.911 -4.103 -0.783 . . . 1.0 . . . . . . . . . . . . A . 5 CYS H . . . . . . . . . c30643_6pv2 1 . 10 . 4755 . 1 1 5 CYS HA H 0.946 -3.781 1.232 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HA . . . . . . . . . c30643_6pv2 1 . 10 . 4756 . 1 1 5 CYS HB2 H 0.407 -3.214 -1.053 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HB2 . . . . . . . . . c30643_6pv2 1 . 10 . 4757 . 1 1 5 CYS HB3 H 0.746 -4.856 -1.584 . . . 1.0 . . . . . . . . . . . . A . 5 CYS HB3 . . . . . . . . . c30643_6pv2 1 . 10 . 4758 . 1 1 5 CYS N N 2.640 -4.231 0.154 . . . 1.0 . . . . . . . . . . . . A . 5 CYS N . . . . . . . . . c30643_6pv2 1 . 10 . 4759 . 1 1 5 CYS O O 1.604 -6.850 0.428 . . . 1.0 . . . . . . . . . . . . A . 5 CYS O . . . . . . . . . c30643_6pv2 1 . 10 . 4760 . 1 1 5 CYS SG S -1.368 -4.691 -0.521 . . . 1.0 . . . . . . . . . . . . A . 5 CYS SG . . . . . . . . . c30643_6pv2 1 . 10 . 4761 . 1 1 6 THR C C -1.291 -7.846 2.512 . . . 1.0 . . . . . . . . . . . . A . 6 THR C . . . . . . . . . c30643_6pv2 1 . 10 . 4762 . 1 1 6 THR CA C 0.126 -7.317 2.716 . . . 1.0 . . . . . . . . . . . . A . 6 THR CA . . . . . . . . . c30643_6pv2 1 . 10 . 4763 . 1 1 6 THR CB C 0.430 -7.219 4.221 . . . 1.0 . . . . . . . . . . . . A . 6 THR CB . . . . . . . . . c30643_6pv2 1 . 10 . 4764 . 1 1 6 THR CG2 C 1.930 -7.219 4.473 . . . 1.0 . . . . . . . . . . . . A . 6 THR CG2 . . . . . . . . . c30643_6pv2 1 . 10 . 4765 . 1 1 6 THR H H -0.115 -5.239 2.458 . . . 1.0 . . . . . . . . . . . . A . 6 THR H . . . . . . . . . c30643_6pv2 1 . 10 . 4766 . 1 1 6 THR HA H 0.824 -8.012 2.277 . . . 1.0 . . . . . . . . . . . . A . 6 THR HA . . . . . . . . . c30643_6pv2 1 . 10 . 4767 . 1 1 6 THR HB H -0.005 -8.073 4.718 . . . 1.0 . . . . . . . . . . . . A . 6 THR HB . . . . . . . . . c30643_6pv2 1 . 10 . 4768 . 1 1 6 THR HG1 H 0.550 -5.377 4.928 . . . 1.0 . . . . . . . . . . . . A . 6 THR HG1 . . . . . . . . . c30643_6pv2 1 . 10 . 4769 . 1 1 6 THR HG21 H 2.118 -7.125 5.532 . . . 1.0 . . . . . . . . . . . . A . 6 THR HG21 . . . . . . . . . c30643_6pv2 1 . 10 . 4770 . 1 1 6 THR HG22 H 2.384 -6.390 3.951 . . . 1.0 . . . . . . . . . . . . A . 6 THR HG22 . . . . . . . . . c30643_6pv2 1 . 10 . 4771 . 1 1 6 THR HG23 H 2.354 -8.146 4.116 . . . 1.0 . . . . . . . . . . . . A . 6 THR HG23 . . . . . . . . . c30643_6pv2 1 . 10 . 4772 . 1 1 6 THR N N 0.318 -6.029 2.074 . . . 1.0 . . . . . . . . . . . . A . 6 THR N . . . . . . . . . c30643_6pv2 1 . 10 . 4773 . 1 1 6 THR O O -1.748 -8.722 3.249 . . . 1.0 . . . . . . . . . . . . A . 6 THR O . . . . . . . . . c30643_6pv2 1 . 10 . 4774 . 1 1 6 THR OG1 O -0.150 -6.021 4.756 . . . 1.0 . . . . . . . . . . . . A . 6 THR OG1 . . . . . . . . . c30643_6pv2 1 . 10 . 4775 . 1 1 7 TRP C C -3.358 -8.880 0.218 . . . 1.0 . . . . . . . . . . . . A . 7 TRP C . . . . . . . . . c30643_6pv2 1 . 10 . 4776 . 1 1 7 TRP CA C -3.345 -7.746 1.239 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CA . . . . . . . . . c30643_6pv2 1 . 10 . 4777 . 1 1 7 TRP CB C -4.173 -6.566 0.733 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CB . . . . . . . . . c30643_6pv2 1 . 10 . 4778 . 1 1 7 TRP CD1 C -6.456 -7.586 0.178 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CD1 . . . . . . . . . c30643_6pv2 1 . 10 . 4779 . 1 1 7 TRP CD2 C -6.490 -6.092 1.841 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CD2 . . . . . . . . . c30643_6pv2 1 . 10 . 4780 . 1 1 7 TRP CE2 C -7.799 -6.567 1.642 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CE2 . . . . . . . . . c30643_6pv2 1 . 10 . 4781 . 1 1 7 TRP CE3 C -6.260 -5.140 2.835 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CE3 . . . . . . . . . c30643_6pv2 1 . 10 . 4782 . 1 1 7 TRP CG C -5.648 -6.757 0.898 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CG . . . . . . . . . c30643_6pv2 1 . 10 . 4783 . 1 1 7 TRP CH2 C -8.623 -5.186 3.373 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CH2 . . . . . . . . . c30643_6pv2 1 . 10 . 4784 . 1 1 7 TRP CZ2 C -8.876 -6.121 2.405 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CZ2 . . . . . . . . . c30643_6pv2 1 . 10 . 4785 . 1 1 7 TRP CZ3 C -7.329 -4.695 3.590 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CZ3 . . . . . . . . . c30643_6pv2 1 . 10 . 4786 . 1 1 7 TRP H H -1.560 -6.660 0.922 . . . 1.0 . . . . . . . . . . . . A . 7 TRP H . . . . . . . . . c30643_6pv2 1 . 10 . 4787 . 1 1 7 TRP HA H -3.772 -8.103 2.164 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HA . . . . . . . . . c30643_6pv2 1 . 10 . 4788 . 1 1 7 TRP HB2 H -3.891 -5.677 1.273 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HB2 . . . . . . . . . c30643_6pv2 1 . 10 . 4789 . 1 1 7 TRP HB3 H -3.971 -6.419 -0.317 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HB3 . . . . . . . . . c30643_6pv2 1 . 10 . 4790 . 1 1 7 TRP HD1 H -6.112 -8.227 -0.619 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HD1 . . . . . . . . . c30643_6pv2 1 . 10 . 4791 . 1 1 7 TRP HE1 H -8.519 -7.980 0.265 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HE1 . . . . . . . . . c30643_6pv2 1 . 10 . 4792 . 1 1 7 TRP HE3 H -5.269 -4.751 3.015 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HE3 . . . . . . . . . c30643_6pv2 1 . 10 . 4793 . 1 1 7 TRP HH2 H -9.428 -4.810 3.986 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HH2 . . . . . . . . . c30643_6pv2 1 . 10 . 4794 . 1 1 7 TRP HZ2 H -9.879 -6.492 2.249 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HZ2 . . . . . . . . . c30643_6pv2 1 . 10 . 4795 . 1 1 7 TRP HZ3 H -7.172 -3.957 4.362 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HZ3 . . . . . . . . . c30643_6pv2 1 . 10 . 4796 . 1 1 7 TRP N N -1.980 -7.330 1.505 . . . 1.0 . . . . . . . . . . . . A . 7 TRP N . . . . . . . . . c30643_6pv2 1 . 10 . 4797 . 1 1 7 TRP NE1 N -7.752 -7.482 0.622 . . . 1.0 . . . . . . . . . . . . A . 7 TRP NE1 . . . . . . . . . c30643_6pv2 1 . 10 . 4798 . 1 1 7 TRP O O -3.569 -8.658 -0.973 . . . 1.0 . . . . . . . . . . . . A . 7 TRP O . . . . . . . . . c30643_6pv2 1 . 10 . 4799 . 1 1 8 ORN C C -1.799 -10.834 -3.690 . . . 1.0 . . . . . . . . . . . . A . 8 ORN C . . . . . . . . . c30643_6pv2 1 . 10 . 4800 . 1 1 8 ORN CA C -2.474 -12.074 -3.106 . . . 1.0 . . . . . . . . . . . . A . 8 ORN CA . . . . . . . . . c30643_6pv2 1 . 10 . 4801 . 1 1 8 ORN CB C -1.718 -12.558 -1.861 . . . 1.0 . . . . . . . . . . . . A . 8 ORN CB . . . . . . . . . c30643_6pv2 1 . 10 . 4802 . 1 1 8 ORN CD C -3.072 -11.286 -0.157 . . . 1.0 . . . . . . . . . . . . A . 8 ORN CD . . . . . . . . . c30643_6pv2 1 . 10 . 4803 . 1 1 8 ORN CG C -1.683 -11.541 -0.730 . . . 1.0 . . . . . . . . . . . . A . 8 ORN CG . . . . . . . . . c30643_6pv2 1 . 10 . 4804 . 1 1 8 ORN H H -1.564 -13.396 -4.428 . . . 1.0 . . . . . . . . . . . . A . 8 ORN H . . . . . . . . . c30643_6pv2 1 . 10 . 4805 . 1 1 8 ORN HA H -3.486 -11.822 -2.831 . . . 1.0 . . . . . . . . . . . . A . 8 ORN HA . . . . . . . . . c30643_6pv2 1 . 10 . 4806 . 1 1 8 ORN HB2 H -0.701 -12.790 -2.139 . . . 1.0 . . . . . . . . . . . . A . 8 ORN HB2 . . . . . . . . . c30643_6pv2 1 . 10 . 4807 . 1 1 8 ORN HB3 H -2.196 -13.453 -1.491 . . . 1.0 . . . . . . . . . . . . A . 8 ORN HB3 . . . . . . . . . c30643_6pv2 1 . 10 . 4808 . 1 1 8 ORN HD2 H -3.367 -12.142 0.432 . . . 1.0 . . . . . . . . . . . . A . 8 ORN HD2 . . . . . . . . . c30643_6pv2 1 . 10 . 4809 . 1 1 8 ORN HD3 H -3.767 -11.156 -0.971 . . . 1.0 . . . . . . . . . . . . A . 8 ORN HD3 . . . . . . . . . c30643_6pv2 1 . 10 . 4810 . 1 1 8 ORN HE1 H -2.940 -10.206 1.645 . . . 1.0 . . . . . . . . . . . . A . 8 ORN HE1 . . . . . . . . . c30643_6pv2 1 . 10 . 4811 . 1 1 8 ORN HG2 H -1.284 -10.611 -1.111 . . . 1.0 . . . . . . . . . . . . A . 8 ORN HG2 . . . . . . . . . c30643_6pv2 1 . 10 . 4812 . 1 1 8 ORN HG3 H -1.043 -11.913 0.056 . . . 1.0 . . . . . . . . . . . . A . 8 ORN HG3 . . . . . . . . . c30643_6pv2 1 . 10 . 4813 . 1 1 8 ORN N N -2.526 -13.149 -4.120 . . . 1.0 . . . . . . . . . . . . A . 8 ORN N . . . . . . . . . c30643_6pv2 1 . 10 . 4814 . 1 1 8 ORN NE N -3.106 -10.095 0.685 . . . 1.0 . . . . . . . . . . . . A . 8 ORN NE . . . . . . . . . c30643_6pv2 1 . 10 . 4815 . 1 1 8 ORN O O -0.941 -10.936 -4.568 . . . 1.0 . . . . . . . . . . . . A . 8 ORN O . . . . . . . . . c30643_6pv2 1 . 10 . 4816 . 1 1 9 CYS C C -0.425 -8.075 -2.765 . . . 1.0 . . . . . . . . . . . . A . 9 CYS C . . . . . . . . . c30643_6pv2 1 . 10 . 4817 . 1 1 9 CYS CA C -1.628 -8.411 -3.643 . . . 1.0 . . . . . . . . . . . . A . 9 CYS CA . . . . . . . . . c30643_6pv2 1 . 10 . 4818 . 1 1 9 CYS CB C -2.683 -7.308 -3.554 . . . 1.0 . . . . . . . . . . . . A . 9 CYS CB . . . . . . . . . c30643_6pv2 1 . 10 . 4819 . 1 1 9 CYS H H -2.942 -9.649 -2.557 . . . 1.0 . . . . . . . . . . . . A . 9 CYS H . . . . . . . . . c30643_6pv2 1 . 10 . 4820 . 1 1 9 CYS HA H -1.307 -8.516 -4.667 . . . 1.0 . . . . . . . . . . . . A . 9 CYS HA . . . . . . . . . c30643_6pv2 1 . 10 . 4821 . 1 1 9 CYS HB2 H -3.524 -7.576 -4.174 . . . 1.0 . . . . . . . . . . . . A . 9 CYS HB2 . . . . . . . . . c30643_6pv2 1 . 10 . 4822 . 1 1 9 CYS HB3 H -3.013 -7.227 -2.528 . . . 1.0 . . . . . . . . . . . . A . 9 CYS HB3 . . . . . . . . . c30643_6pv2 1 . 10 . 4823 . 1 1 9 CYS N N -2.212 -9.668 -3.218 . . . 1.0 . . . . . . . . . . . . A . 9 CYS N . . . . . . . . . c30643_6pv2 1 . 10 . 4824 . 1 1 9 CYS O O -0.518 -8.116 -1.537 . . . 1.0 . . . . . . . . . . . . A . 9 CYS O . . . . . . . . . c30643_6pv2 1 . 10 . 4825 . 1 1 9 CYS SG S -2.118 -5.678 -4.079 . . . 1.0 . . . . . . . . . . . . A . 9 CYS SG . . . . . . . . . c30643_6pv2 1 . 10 . 4826 . 1 1 10 GLY C C 2.812 -6.478 -3.333 . . . 1.0 . . . . . . . . . . . . A . 10 GLY C . . . . . . . . . c30643_6pv2 1 . 10 . 4827 . 1 1 10 GLY CA C 1.907 -7.474 -2.640 . . . 1.0 . . . . . . . . . . . . A . 10 GLY CA . . . . . . . . . c30643_6pv2 1 . 10 . 4828 . 1 1 10 GLY H H 0.714 -7.708 -4.370 . . . 1.0 . . . . . . . . . . . . A . 10 GLY H . . . . . . . . . c30643_6pv2 1 . 10 . 4829 . 1 1 10 GLY HA2 H 1.629 -7.079 -1.675 . . . 1.0 . . . . . . . . . . . . A . 10 GLY HA2 . . . . . . . . . c30643_6pv2 1 . 10 . 4830 . 1 1 10 GLY HA3 H 2.448 -8.396 -2.497 . . . 1.0 . . . . . . . . . . . . A . 10 GLY HA3 . . . . . . . . . c30643_6pv2 1 . 10 . 4831 . 1 1 10 GLY N N 0.701 -7.756 -3.390 . . . 1.0 . . . . . . . . . . . . A . 10 GLY N . . . . . . . . . c30643_6pv2 1 . 10 . 4832 . 1 1 10 GLY O O 4.027 -6.668 -3.385 . . . 1.0 . . . . . . . . . . . . A . 10 GLY O . . . . . . . . . c30643_6pv2 1 . 10 . 4833 . 1 1 11 LYS C C 3.962 -3.702 -3.575 . . . 1.0 . . . . . . . . . . . . A . 11 LYS C . . . . . . . . . c30643_6pv2 1 . 10 . 4834 . 1 1 11 LYS CA C 2.989 -4.373 -4.542 . . . 1.0 . . . . . . . . . . . . A . 11 LYS CA . . . . . . . . . c30643_6pv2 1 . 10 . 4835 . 1 1 11 LYS CB C 2.058 -3.318 -5.147 . . . 1.0 . . . . . . . . . . . . A . 11 LYS CB . . . . . . . . . c30643_6pv2 1 . 10 . 4836 . 1 1 11 LYS CD C 0.494 -2.693 -7.010 . . . 1.0 . . . . . . . . . . . . A . 11 LYS CD . . . . . . . . . c30643_6pv2 1 . 10 . 4837 . 1 1 11 LYS CE C -0.330 -3.200 -8.184 . . . 1.0 . . . . . . . . . . . . A . 11 LYS CE . . . . . . . . . c30643_6pv2 1 . 10 . 4838 . 1 1 11 LYS CG C 1.221 -3.830 -6.307 . . . 1.0 . . . . . . . . . . . . A . 11 LYS CG . . . . . . . . . c30643_6pv2 1 . 10 . 4839 . 1 1 11 LYS H H 1.248 -5.339 -3.818 . . . 1.0 . . . . . . . . . . . . A . 11 LYS H . . . . . . . . . c30643_6pv2 1 . 10 . 4840 . 1 1 11 LYS HA H 3.555 -4.837 -5.334 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HA . . . . . . . . . c30643_6pv2 1 . 10 . 4841 . 1 1 11 LYS HB2 H 1.385 -2.966 -4.378 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HB2 . . . . . . . . . c30643_6pv2 1 . 10 . 4842 . 1 1 11 LYS HB3 H 2.653 -2.488 -5.499 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HB3 . . . . . . . . . c30643_6pv2 1 . 10 . 4843 . 1 1 11 LYS HD2 H -0.163 -2.208 -6.306 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HD2 . . . . . . . . . c30643_6pv2 1 . 10 . 4844 . 1 1 11 LYS HD3 H 1.224 -1.984 -7.374 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HD3 . . . . . . . . . c30643_6pv2 1 . 10 . 4845 . 1 1 11 LYS HE2 H 0.323 -3.717 -8.870 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HE2 . . . . . . . . . c30643_6pv2 1 . 10 . 4846 . 1 1 11 LYS HE3 H -1.074 -3.889 -7.811 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HE3 . . . . . . . . . c30643_6pv2 1 . 10 . 4847 . 1 1 11 LYS HG2 H 1.870 -4.324 -7.015 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HG2 . . . . . . . . . c30643_6pv2 1 . 10 . 4848 . 1 1 11 LYS HG3 H 0.493 -4.533 -5.931 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HG3 . . . . . . . . . c30643_6pv2 1 . 10 . 4849 . 1 1 11 LYS HZ1 H -1.561 -2.473 -9.706 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HZ1 . . . . . . . . . c30643_6pv2 1 . 10 . 4850 . 1 1 11 LYS HZ2 H -0.314 -1.418 -9.275 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HZ2 . . . . . . . . . c30643_6pv2 1 . 10 . 4851 . 1 1 11 LYS HZ3 H -1.659 -1.592 -8.265 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HZ3 . . . . . . . . . c30643_6pv2 1 . 10 . 4852 . 1 1 11 LYS N N 2.221 -5.418 -3.871 . . . 1.0 . . . . . . . . . . . . A . 11 LYS N . . . . . . . . . c30643_6pv2 1 . 10 . 4853 . 1 1 11 LYS NZ N -1.013 -2.095 -8.908 . . . 1.0 . . . . . . . . . . . . A . 11 LYS NZ . . . . . . . . . c30643_6pv2 1 . 10 . 4854 . 1 1 11 LYS O O 3.653 -3.519 -2.396 . . . 1.0 . . . . . . . . . . . . A . 11 LYS O . . . . . . . . . c30643_6pv2 1 . 10 . 4855 . 1 1 12 ARG C C 6.156 -1.185 -3.560 . . . 1.0 . . . . . . . . . . . . A . 12 ARG C . . . . . . . . . c30643_6pv2 1 . 10 . 4856 . 1 1 12 ARG CA C 6.153 -2.678 -3.278 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CA . . . . . . . . . c30643_6pv2 1 . 10 . 4857 . 1 1 12 ARG CB C 7.545 -3.249 -3.562 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CB . . . . . . . . . c30643_6pv2 1 . 10 . 4858 . 1 1 12 ARG CD C 9.064 -5.245 -3.645 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CD . . . . . . . . . c30643_6pv2 1 . 10 . 4859 . 1 1 12 ARG CG C 7.671 -4.738 -3.299 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CG . . . . . . . . . c30643_6pv2 1 . 10 . 4860 . 1 1 12 ARG CZ C 9.818 -5.844 -5.923 . . . 1.0 . . . . . . . . . . . . A . 12 ARG CZ . . . . . . . . . c30643_6pv2 1 . 10 . 4861 . 1 1 12 ARG H H 5.327 -3.538 -5.025 . . . 1.0 . . . . . . . . . . . . A . 12 ARG H . . . . . . . . . c30643_6pv2 1 . 10 . 4862 . 1 1 12 ARG HA H 5.909 -2.835 -2.236 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HA . . . . . . . . . c30643_6pv2 1 . 10 . 4863 . 1 1 12 ARG HB2 H 7.786 -3.071 -4.600 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HB2 . . . . . . . . . c30643_6pv2 1 . 10 . 4864 . 1 1 12 ARG HB3 H 8.265 -2.735 -2.943 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HB3 . . . . . . . . . c30643_6pv2 1 . 10 . 4865 . 1 1 12 ARG HD2 H 9.781 -4.778 -2.983 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HD2 . . . . . . . . . c30643_6pv2 1 . 10 . 4866 . 1 1 12 ARG HD3 H 9.090 -6.314 -3.505 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HD3 . . . . . . . . . c30643_6pv2 1 . 10 . 4867 . 1 1 12 ARG HE H 9.370 -3.991 -5.308 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HE . . . . . . . . . c30643_6pv2 1 . 10 . 4868 . 1 1 12 ARG HG2 H 7.477 -4.927 -2.254 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HG2 . . . . . . . . . c30643_6pv2 1 . 10 . 4869 . 1 1 12 ARG HG3 H 6.945 -5.263 -3.902 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HG3 . . . . . . . . . c30643_6pv2 1 . 10 . 4870 . 1 1 12 ARG HH11 H 9.778 -7.409 -4.634 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH11 . . . . . . . . . c30643_6pv2 1 . 10 . 4871 . 1 1 12 ARG HH12 H 10.253 -7.794 -6.253 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH12 . . . . . . . . . c30643_6pv2 1 . 10 . 4872 . 1 1 12 ARG HH21 H 10.380 -6.148 -7.845 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH21 . . . . . . . . . c30643_6pv2 1 . 10 . 4873 . 1 1 12 ARG HH22 H 10.006 -4.504 -7.426 . . . 1.0 . . . . . . . . . . . . A . 12 ARG HH22 . . . . . . . . . c30643_6pv2 1 . 10 . 4874 . 1 1 12 ARG N N 5.139 -3.348 -4.082 . . . 1.0 . . . . . . . . . . . . A . 12 ARG N . . . . . . . . . c30643_6pv2 1 . 10 . 4875 . 1 1 12 ARG NE N 9.428 -4.936 -5.028 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NE . . . . . . . . . c30643_6pv2 1 . 10 . 4876 . 1 1 12 ARG NH1 N 9.960 -7.116 -5.575 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NH1 . . . . . . . . . c30643_6pv2 1 . 10 . 4877 . 1 1 12 ARG NH2 N 10.088 -5.469 -7.164 . . . 1.0 . . . . . . . . . . . . A . 12 ARG NH2 . . . . . . . . . c30643_6pv2 1 . 10 . 4878 . 1 1 12 ARG O O 5.972 -0.757 -4.703 . . . 1.0 . . . . . . . . . . . . A . 12 ARG O . . . . . . . . . c30643_6pv2 1 . 10 . 4879 . 1 1 13 PHE C C 7.621 1.596 -1.908 . . . 1.0 . . . . . . . . . . . . A . 13 PHE C . . . . . . . . . c30643_6pv2 1 . 10 . 4880 . 1 1 13 PHE CA C 6.396 1.047 -2.625 . . . 1.0 . . . . . . . . . . . . A . 13 PHE CA . . . . . . . . . c30643_6pv2 1 . 10 . 4881 . 1 1 13 PHE CB C 5.128 1.642 -2.012 . . . 1.0 . . . . . . . . . . . . A . 13 PHE CB . . . . . . . . . c30643_6pv2 1 . 10 . 4882 . 1 1 13 PHE CD1 C 3.315 1.658 -3.738 . . . 1.0 . . . . . . . . . . . . A . 13 PHE CD1 . . . . . . . . . c30643_6pv2 1 . 10 . 4883 . 1 1 13 PHE CD2 C 3.241 0.000 -2.028 . . . 1.0 . . . . . . . . . . . . A . 13 PHE CD2 . . . . . . . . . c30643_6pv2 1 . 10 . 4884 . 1 1 13 PHE CE1 C 2.157 1.144 -4.287 . . . 1.0 . . . . . . . . . . . . A . 13 PHE CE1 . . . . . . . . . c30643_6pv2 1 . 10 . 4885 . 1 1 13 PHE CE2 C 2.086 -0.517 -2.572 . . . 1.0 . . . . . . . . . . . . A . 13 PHE CE2 . . . . . . . . . c30643_6pv2 1 . 10 . 4886 . 1 1 13 PHE CG C 3.868 1.092 -2.605 . . . 1.0 . . . . . . . . . . . . A . 13 PHE CG . . . . . . . . . c30643_6pv2 1 . 10 . 4887 . 1 1 13 PHE CZ C 1.544 0.056 -3.703 . . . 1.0 . . . . . . . . . . . . A . 13 PHE CZ . . . . . . . . . c30643_6pv2 1 . 10 . 4888 . 1 1 13 PHE H H 6.487 -0.810 -1.631 . . . 1.0 . . . . . . . . . . . . A . 13 PHE H . . . . . . . . . c30643_6pv2 1 . 10 . 4889 . 1 1 13 PHE HA H 6.443 1.307 -3.671 . . . 1.0 . . . . . . . . . . . . A . 13 PHE HA . . . . . . . . . c30643_6pv2 1 . 10 . 4890 . 1 1 13 PHE HB2 H 5.116 1.432 -0.954 . . . 1.0 . . . . . . . . . . . . A . 13 PHE HB2 . . . . . . . . . c30643_6pv2 1 . 10 . 4891 . 1 1 13 PHE HB3 H 5.130 2.711 -2.165 . . . 1.0 . . . . . . . . . . . . A . 13 PHE HB3 . . . . . . . . . c30643_6pv2 1 . 10 . 4892 . 1 1 13 PHE HD1 H 3.797 2.509 -4.194 . . . 1.0 . . . . . . . . . . . . A . 13 PHE HD1 . . . . . . . . . c30643_6pv2 1 . 10 . 4893 . 1 1 13 PHE HD2 H 3.669 -0.449 -1.145 . . . 1.0 . . . . . . . . . . . . A . 13 PHE HD2 . . . . . . . . . c30643_6pv2 1 . 10 . 4894 . 1 1 13 PHE HE1 H 1.734 1.591 -5.171 . . . 1.0 . . . . . . . . . . . . A . 13 PHE HE1 . . . . . . . . . c30643_6pv2 1 . 10 . 4895 . 1 1 13 PHE HE2 H 1.607 -1.369 -2.111 . . . 1.0 . . . . . . . . . . . . A . 13 PHE HE2 . . . . . . . . . c30643_6pv2 1 . 10 . 4896 . 1 1 13 PHE HZ H 0.637 -0.346 -4.129 . . . 1.0 . . . . . . . . . . . . A . 13 PHE HZ . . . . . . . . . c30643_6pv2 1 . 10 . 4897 . 1 1 13 PHE N N 6.364 -0.401 -2.516 . . . 1.0 . . . . . . . . . . . . A . 13 PHE N . . . . . . . . . c30643_6pv2 1 . 10 . 4898 . 1 1 13 PHE O O 8.069 1.038 -0.906 . . . 1.0 . . . . . . . . . . . . A . 13 PHE O . . . . . . . . . c30643_6pv2 1 . 10 . 4899 . 1 1 14 THR C C 8.877 4.294 -0.717 . . . 1.0 . . . . . . . . . . . . A . 14 THR C . . . . . . . . . c30643_6pv2 1 . 10 . 4900 . 1 1 14 THR CA C 9.321 3.327 -1.816 . . . 1.0 . . . . . . . . . . . . A . 14 THR CA . . . . . . . . . c30643_6pv2 1 . 10 . 4901 . 1 1 14 THR CB C 10.143 4.086 -2.880 . . . 1.0 . . . . . . . . . . . . A . 14 THR CB . . . . . . . . . c30643_6pv2 1 . 10 . 4902 . 1 1 14 THR CG2 C 11.474 4.566 -2.315 . . . 1.0 . . . . . . . . . . . . A . 14 THR CG2 . . . . . . . . . c30643_6pv2 1 . 10 . 4903 . 1 1 14 THR H H 7.789 3.064 -3.251 . . . 1.0 . . . . . . . . . . . . A . 14 THR H . . . . . . . . . c30643_6pv2 1 . 10 . 4904 . 1 1 14 THR HA H 9.943 2.558 -1.381 . . . 1.0 . . . . . . . . . . . . A . 14 THR HA . . . . . . . . . c30643_6pv2 1 . 10 . 4905 . 1 1 14 THR HB H 9.575 4.946 -3.209 . . . 1.0 . . . . . . . . . . . . A . 14 THR HB . . . . . . . . . c30643_6pv2 1 . 10 . 4906 . 1 1 14 THR HG1 H 9.809 2.456 -3.945 . . . 1.0 . . . . . . . . . . . . A . 14 THR HG1 . . . . . . . . . c30643_6pv2 1 . 10 . 4907 . 1 1 14 THR HG21 H 12.027 5.082 -3.086 . . . 1.0 . . . . . . . . . . . . A . 14 THR HG21 . . . . . . . . . c30643_6pv2 1 . 10 . 4908 . 1 1 14 THR HG22 H 12.047 3.719 -1.970 . . . 1.0 . . . . . . . . . . . . A . 14 THR HG22 . . . . . . . . . c30643_6pv2 1 . 10 . 4909 . 1 1 14 THR HG23 H 11.294 5.239 -1.490 . . . 1.0 . . . . . . . . . . . . A . 14 THR HG23 . . . . . . . . . c30643_6pv2 1 . 10 . 4910 . 1 1 14 THR N N 8.166 2.684 -2.426 . . . 1.0 . . . . . . . . . . . . A . 14 THR N . . . . . . . . . c30643_6pv2 1 . 10 . 4911 . 1 1 14 THR O O 9.681 4.747 0.101 . . . 1.0 . . . . . . . . . . . . A . 14 THR O . . . . . . . . . c30643_6pv2 1 . 10 . 4912 . 1 1 14 THR OG1 O 10.388 3.227 -4.000 . . . 1.0 . . . . . . . . . . . . A . 14 THR OG1 . . . . . . . . . c30643_6pv2 1 . 10 . 4913 . 1 1 15 ARG C C 5.803 4.980 0.946 . . . 1.0 . . . . . . . . . . . . A . 15 ARG C . . . . . . . . . c30643_6pv2 1 . 10 . 4914 . 1 1 15 ARG CA C 7.043 5.548 0.257 . . . 1.0 . . . . . . . . . . . . A . 15 ARG CA . . . . . . . . . c30643_6pv2 1 . 10 . 4915 . 1 1 15 ARG CB C 6.709 6.853 -0.471 . . . 1.0 . . . . . . . . . . . . A . 15 ARG CB . . . . . . . . . c30643_6pv2 1 . 10 . 4916 . 1 1 15 ARG CD C 7.554 8.763 -1.882 . . . 1.0 . . . . . . . . . . . . A . 15 ARG CD . . . . . . . . . c30643_6pv2 1 . 10 . 4917 . 1 1 15 ARG CG C 7.926 7.521 -1.091 . . . 1.0 . . . . . . . . . . . . A . 15 ARG CG . . . . . . . . . c30643_6pv2 1 . 10 . 4918 . 1 1 15 ARG CZ C 6.372 9.357 -3.963 . . . 1.0 . . . . . . . . . . . . A . 15 ARG CZ . . . . . . . . . c30643_6pv2 1 . 10 . 4919 . 1 1 15 ARG H H 6.981 4.146 -1.321 . . . 1.0 . . . . . . . . . . . . A . 15 ARG H . . . . . . . . . c30643_6pv2 1 . 10 . 4920 . 1 1 15 ARG HA H 7.800 5.743 1.003 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HA . . . . . . . . . c30643_6pv2 1 . 10 . 4921 . 1 1 15 ARG HB2 H 6.002 6.641 -1.258 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HB2 . . . . . . . . . c30643_6pv2 1 . 10 . 4922 . 1 1 15 ARG HB3 H 6.262 7.541 0.227 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HB3 . . . . . . . . . c30643_6pv2 1 . 10 . 4923 . 1 1 15 ARG HD2 H 6.950 9.404 -1.260 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HD2 . . . . . . . . . c30643_6pv2 1 . 10 . 4924 . 1 1 15 ARG HD3 H 8.459 9.282 -2.158 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HD3 . . . . . . . . . c30643_6pv2 1 . 10 . 4925 . 1 1 15 ARG HE H 6.619 7.484 -3.273 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HE . . . . . . . . . c30643_6pv2 1 . 10 . 4926 . 1 1 15 ARG HG2 H 8.609 7.799 -0.305 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HG2 . . . . . . . . . c30643_6pv2 1 . 10 . 4927 . 1 1 15 ARG HG3 H 8.409 6.816 -1.754 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HG3 . . . . . . . . . c30643_6pv2 1 . 10 . 4928 . 1 1 15 ARG HH11 H 7.099 10.935 -2.921 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HH11 . . . . . . . . . c30643_6pv2 1 . 10 . 4929 . 1 1 15 ARG HH12 H 6.269 11.335 -4.390 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HH12 . . . . . . . . . c30643_6pv2 1 . 10 . 4930 . 1 1 15 ARG HH21 H 5.516 8.008 -5.219 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HH21 . . . . . . . . . c30643_6pv2 1 . 10 . 4931 . 1 1 15 ARG HH22 H 5.371 9.674 -5.699 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HH22 . . . . . . . . . c30643_6pv2 1 . 10 . 4932 . 1 1 15 ARG N N 7.587 4.589 -0.689 . . . 1.0 . . . . . . . . . . . . A . 15 ARG N . . . . . . . . . c30643_6pv2 1 . 10 . 4933 . 1 1 15 ARG NE N 6.806 8.443 -3.094 . . . 1.0 . . . . . . . . . . . . A . 15 ARG NE . . . . . . . . . c30643_6pv2 1 . 10 . 4934 . 1 1 15 ARG NH1 N 6.599 10.645 -3.740 . . . 1.0 . . . . . . . . . . . . A . 15 ARG NH1 . . . . . . . . . c30643_6pv2 1 . 10 . 4935 . 1 1 15 ARG NH2 N 5.699 8.984 -5.047 . . . 1.0 . . . . . . . . . . . . A . 15 ARG NH2 . . . . . . . . . c30643_6pv2 1 . 10 . 4936 . 1 1 15 ARG O O 4.923 4.399 0.302 . . . 1.0 . . . . . . . . . . . . A . 15 ARG O . . . . . . . . . c30643_6pv2 1 . 10 . 4937 . 1 1 16 SER C C 3.331 5.212 2.770 . . . 1.0 . . . . . . . . . . . . A . 16 SER C . . . . . . . . . c30643_6pv2 1 . 10 . 4938 . 1 1 16 SER CA C 4.684 4.580 3.083 . . . 1.0 . . . . . . . . . . . . A . 16 SER CA . . . . . . . . . c30643_6pv2 1 . 10 . 4939 . 1 1 16 SER CB C 5.029 4.752 4.562 . . . 1.0 . . . . . . . . . . . . A . 16 SER CB . . . . . . . . . c30643_6pv2 1 . 10 . 4940 . 1 1 16 SER H H 6.446 5.679 2.706 . . . 1.0 . . . . . . . . . . . . A . 16 SER H . . . . . . . . . c30643_6pv2 1 . 10 . 4941 . 1 1 16 SER HA H 4.632 3.524 2.858 . . . 1.0 . . . . . . . . . . . . A . 16 SER HA . . . . . . . . . c30643_6pv2 1 . 10 . 4942 . 1 1 16 SER HB2 H 4.133 4.648 5.154 . . . 1.0 . . . . . . . . . . . . A . 16 SER HB2 . . . . . . . . . c30643_6pv2 1 . 10 . 4943 . 1 1 16 SER HB3 H 5.744 3.997 4.855 . . . 1.0 . . . . . . . . . . . . A . 16 SER HB3 . . . . . . . . . c30643_6pv2 1 . 10 . 4944 . 1 1 16 SER HG H 4.979 6.552 5.342 . . . 1.0 . . . . . . . . . . . . A . 16 SER HG . . . . . . . . . c30643_6pv2 1 . 10 . 4945 . 1 1 16 SER N N 5.748 5.149 2.265 . . . 1.0 . . . . . . . . . . . . A . 16 SER N . . . . . . . . . c30643_6pv2 1 . 10 . 4946 . 1 1 16 SER O O 2.290 4.564 2.906 . . . 1.0 . . . . . . . . . . . . A . 16 SER O . . . . . . . . . c30643_6pv2 1 . 10 . 4947 . 1 1 16 SER OG O 5.590 6.030 4.806 . . . 1.0 . . . . . . . . . . . . A . 16 SER OG . . . . . . . . . c30643_6pv2 1 . 10 . 4948 . 1 1 17 ASP C C 1.553 6.565 0.689 . . . 1.0 . . . . . . . . . . . . A . 17 ASP C . . . . . . . . . c30643_6pv2 1 . 10 . 4949 . 1 1 17 ASP CA C 2.120 7.163 1.968 . . . 1.0 . . . . . . . . . . . . A . 17 ASP CA . . . . . . . . . c30643_6pv2 1 . 10 . 4950 . 1 1 17 ASP CB C 2.368 8.662 1.781 . . . 1.0 . . . . . . . . . . . . A . 17 ASP CB . . . . . . . . . c30643_6pv2 1 . 10 . 4951 . 1 1 17 ASP CG C 1.105 9.418 1.406 . . . 1.0 . . . . . . . . . . . . A . 17 ASP CG . . . . . . . . . c30643_6pv2 1 . 10 . 4952 . 1 1 17 ASP H H 4.202 6.954 2.317 . . . 1.0 . . . . . . . . . . . . A . 17 ASP H . . . . . . . . . c30643_6pv2 1 . 10 . 4953 . 1 1 17 ASP HA H 1.401 7.023 2.761 . . . 1.0 . . . . . . . . . . . . A . 17 ASP HA . . . . . . . . . c30643_6pv2 1 . 10 . 4954 . 1 1 17 ASP HB2 H 2.752 9.074 2.701 . . . 1.0 . . . . . . . . . . . . A . 17 ASP HB2 . . . . . . . . . c30643_6pv2 1 . 10 . 4955 . 1 1 17 ASP HB3 H 3.095 8.804 0.998 . . . 1.0 . . . . . . . . . . . . A . 17 ASP HB3 . . . . . . . . . c30643_6pv2 1 . 10 . 4956 . 1 1 17 ASP N N 3.347 6.472 2.353 . . . 1.0 . . . . . . . . . . . . A . 17 ASP N . . . . . . . . . c30643_6pv2 1 . 10 . 4957 . 1 1 17 ASP O O 0.342 6.524 0.496 . . . 1.0 . . . . . . . . . . . . A . 17 ASP O . . . . . . . . . c30643_6pv2 1 . 10 . 4958 . 1 1 17 ASP OD1 O 0.246 9.631 2.287 . . . 1.0 . . . . . . . . . . . . A . 17 ASP OD1 . . . . . . . . . c30643_6pv2 1 . 10 . 4959 . 1 1 17 ASP OD2 O 0.971 9.820 0.232 . . . 1.0 . . . . . . . . . . . . A . 17 ASP OD2 . . . . . . . . . c30643_6pv2 1 . 10 . 4960 . 1 1 18 GLU C C 1.350 4.094 -1.057 . . . 1.0 . . . . . . . . . . . . A . 18 GLU C . . . . . . . . . c30643_6pv2 1 . 10 . 4961 . 1 1 18 GLU CA C 2.014 5.415 -1.395 . . . 1.0 . . . . . . . . . . . . A . 18 GLU CA . . . . . . . . . c30643_6pv2 1 . 10 . 4962 . 1 1 18 GLU CB C 3.194 5.176 -2.334 . . . 1.0 . . . . . . . . . . . . A . 18 GLU CB . . . . . . . . . c30643_6pv2 1 . 10 . 4963 . 1 1 18 GLU CD C 4.890 6.171 -3.897 . . . 1.0 . . . . . . . . . . . . A . 18 GLU CD . . . . . . . . . c30643_6pv2 1 . 10 . 4964 . 1 1 18 GLU CG C 3.802 6.448 -2.884 . . . 1.0 . . . . . . . . . . . . A . 18 GLU CG . . . . . . . . . c30643_6pv2 1 . 10 . 4965 . 1 1 18 GLU H H 3.391 6.164 0.018 . . . 1.0 . . . . . . . . . . . . A . 18 GLU H . . . . . . . . . c30643_6pv2 1 . 10 . 4966 . 1 1 18 GLU HA H 1.294 6.051 -1.887 . . . 1.0 . . . . . . . . . . . . A . 18 GLU HA . . . . . . . . . c30643_6pv2 1 . 10 . 4967 . 1 1 18 GLU HB2 H 3.962 4.645 -1.794 . . . 1.0 . . . . . . . . . . . . A . 18 GLU HB2 . . . . . . . . . c30643_6pv2 1 . 10 . 4968 . 1 1 18 GLU HB3 H 2.863 4.570 -3.164 . . . 1.0 . . . . . . . . . . . . A . 18 GLU HB3 . . . . . . . . . c30643_6pv2 1 . 10 . 4969 . 1 1 18 GLU HG2 H 3.025 7.028 -3.360 . . . 1.0 . . . . . . . . . . . . A . 18 GLU HG2 . . . . . . . . . c30643_6pv2 1 . 10 . 4970 . 1 1 18 GLU HG3 H 4.224 7.011 -2.067 . . . 1.0 . . . . . . . . . . . . A . 18 GLU HG3 . . . . . . . . . c30643_6pv2 1 . 10 . 4971 . 1 1 18 GLU N N 2.437 6.081 -0.175 . . . 1.0 . . . . . . . . . . . . A . 18 GLU N . . . . . . . . . c30643_6pv2 1 . 10 . 4972 . 1 1 18 GLU O O 0.345 3.726 -1.659 . . . 1.0 . . . . . . . . . . . . A . 18 GLU O . . . . . . . . . c30643_6pv2 1 . 10 . 4973 . 1 1 18 GLU OE1 O 6.017 5.836 -3.482 . . . 1.0 . . . . . . . . . . . . A . 18 GLU OE1 . . . . . . . . . c30643_6pv2 1 . 10 . 4974 . 1 1 18 GLU OE2 O 4.632 6.315 -5.109 . . . 1.0 . . . . . . . . . . . . A . 18 GLU OE2 . . . . . . . . . c30643_6pv2 1 . 10 . 4975 . 1 1 19 LEU C C -0.028 2.378 1.019 . . . 1.0 . . . . . . . . . . . . A . 19 LEU C . . . . . . . . . c30643_6pv2 1 . 10 . 4976 . 1 1 19 LEU CA C 1.340 2.141 0.389 . . . 1.0 . . . . . . . . . . . . A . 19 LEU CA . . . . . . . . . c30643_6pv2 1 . 10 . 4977 . 1 1 19 LEU CB C 2.274 1.457 1.390 . . . 1.0 . . . . . . . . . . . . A . 19 LEU CB . . . . . . . . . c30643_6pv2 1 . 10 . 4978 . 1 1 19 LEU CD1 C 1.303 -0.829 1.019 . . . 1.0 . . . . . . . . . . . . A . 19 LEU CD1 . . . . . . . . . c30643_6pv2 1 . 10 . 4979 . 1 1 19 LEU CD2 C 2.703 -0.384 3.035 . . . 1.0 . . . . . . . . . . . . A . 19 LEU CD2 . . . . . . . . . c30643_6pv2 1 . 10 . 4980 . 1 1 19 LEU CG C 1.698 0.206 2.060 . . . 1.0 . . . . . . . . . . . . A . 19 LEU CG . . . . . . . . . c30643_6pv2 1 . 10 . 4981 . 1 1 19 LEU H H 2.747 3.724 0.329 . . . 1.0 . . . . . . . . . . . . A . 19 LEU H . . . . . . . . . c30643_6pv2 1 . 10 . 4982 . 1 1 19 LEU HA H 1.217 1.498 -0.468 . . . 1.0 . . . . . . . . . . . . A . 19 LEU HA . . . . . . . . . c30643_6pv2 1 . 10 . 4983 . 1 1 19 LEU HB2 H 3.179 1.179 0.870 . . . 1.0 . . . . . . . . . . . . A . 19 LEU HB2 . . . . . . . . . c30643_6pv2 1 . 10 . 4984 . 1 1 19 LEU HB3 H 2.526 2.169 2.159 . . . 1.0 . . . . . . . . . . . . A . 19 LEU HB3 . . . . . . . . . c30643_6pv2 1 . 10 . 4985 . 1 1 19 LEU HD11 H 0.883 -1.691 1.512 . . . 1.0 . . . . . . . . . . . . A . 19 LEU HD11 . . . . . . . . . c30643_6pv2 1 . 10 . 4986 . 1 1 19 LEU HD12 H 2.175 -1.126 0.456 . . . 1.0 . . . . . . . . . . . . A . 19 LEU HD12 . . . . . . . . . c30643_6pv2 1 . 10 . 4987 . 1 1 19 LEU HD13 H 0.568 -0.403 0.350 . . . 1.0 . . . . . . . . . . . . A . 19 LEU HD13 . . . . . . . . . c30643_6pv2 1 . 10 . 4988 . 1 1 19 LEU HD21 H 2.229 -1.167 3.607 . . . 1.0 . . . . . . . . . . . . A . 19 LEU HD21 . . . . . . . . . c30643_6pv2 1 . 10 . 4989 . 1 1 19 LEU HD22 H 3.056 0.389 3.703 . . . 1.0 . . . . . . . . . . . . A . 19 LEU HD22 . . . . . . . . . c30643_6pv2 1 . 10 . 4990 . 1 1 19 LEU HD23 H 3.535 -0.797 2.487 . . . 1.0 . . . . . . . . . . . . A . 19 LEU HD23 . . . . . . . . . c30643_6pv2 1 . 10 . 4991 . 1 1 19 LEU HG H 0.810 0.478 2.616 . . . 1.0 . . . . . . . . . . . . A . 19 LEU HG . . . . . . . . . c30643_6pv2 1 . 10 . 4992 . 1 1 19 LEU N N 1.916 3.394 -0.079 . . . 1.0 . . . . . . . . . . . . A . 19 LEU N . . . . . . . . . c30643_6pv2 1 . 10 . 4993 . 1 1 19 LEU O O -0.975 1.648 0.740 . . . 1.0 . . . . . . . . . . . . A . 19 LEU O . . . . . . . . . c30643_6pv2 1 . 10 . 4994 . 1 1 20 GLN C C -2.436 4.107 1.414 . . . 1.0 . . . . . . . . . . . . A . 20 GLN C . . . . . . . . . c30643_6pv2 1 . 10 . 4995 . 1 1 20 GLN CA C -1.407 3.748 2.480 . . . 1.0 . . . . . . . . . . . . A . 20 GLN CA . . . . . . . . . c30643_6pv2 1 . 10 . 4996 . 1 1 20 GLN CB C -1.243 4.919 3.446 . . . 1.0 . . . . . . . . . . . . A . 20 GLN CB . . . . . . . . . c30643_6pv2 1 . 10 . 4997 . 1 1 20 GLN CD C -2.407 6.602 4.930 . . . 1.0 . . . . . . . . . . . . A . 20 GLN CD . . . . . . . . . c30643_6pv2 1 . 10 . 4998 . 1 1 20 GLN CG C -2.561 5.394 4.036 . . . 1.0 . . . . . . . . . . . . A . 20 GLN CG . . . . . . . . . c30643_6pv2 1 . 10 . 4999 . 1 1 20 GLN H H 0.671 3.926 2.078 . . . 1.0 . . . . . . . . . . . . A . 20 GLN H . . . . . . . . . c30643_6pv2 1 . 10 . 5000 . 1 1 20 GLN HA H -1.753 2.884 3.026 . . . 1.0 . . . . . . . . . . . . A . 20 GLN HA . . . . . . . . . c30643_6pv2 1 . 10 . 5001 . 1 1 20 GLN HB2 H -0.598 4.617 4.257 . . . 1.0 . . . . . . . . . . . . A . 20 GLN HB2 . . . . . . . . . c30643_6pv2 1 . 10 . 5002 . 1 1 20 GLN HB3 H -0.789 5.745 2.921 . . . 1.0 . . . . . . . . . . . . A . 20 GLN HB3 . . . . . . . . . c30643_6pv2 1 . 10 . 5003 . 1 1 20 GLN HE21 H -3.973 6.022 6.001 . . . 1.0 . . . . . . . . . . . . A . 20 GLN HE21 . . . . . . . . . c30643_6pv2 1 . 10 . 5004 . 1 1 20 GLN HE22 H -3.206 7.485 6.516 . . . 1.0 . . . . . . . . . . . . A . 20 GLN HE22 . . . . . . . . . c30643_6pv2 1 . 10 . 5005 . 1 1 20 GLN HG2 H -3.228 5.651 3.226 . . . 1.0 . . . . . . . . . . . . A . 20 GLN HG2 . . . . . . . . . c30643_6pv2 1 . 10 . 5006 . 1 1 20 GLN HG3 H -2.993 4.591 4.612 . . . 1.0 . . . . . . . . . . . . A . 20 GLN HG3 . . . . . . . . . c30643_6pv2 1 . 10 . 5007 . 1 1 20 GLN N N -0.131 3.400 1.861 . . . 1.0 . . . . . . . . . . . . A . 20 GLN N . . . . . . . . . c30643_6pv2 1 . 10 . 5008 . 1 1 20 GLN NE2 N -3.282 6.716 5.912 . . . 1.0 . . . . . . . . . . . . A . 20 GLN NE2 . . . . . . . . . c30643_6pv2 1 . 10 . 5009 . 1 1 20 GLN O O -3.562 3.601 1.420 . . . 1.0 . . . . . . . . . . . . A . 20 GLN O . . . . . . . . . c30643_6pv2 1 . 10 . 5010 . 1 1 20 GLN OE1 O -1.520 7.432 4.733 . . . 1.0 . . . . . . . . . . . . A . 20 GLN OE1 . . . . . . . . . c30643_6pv2 1 . 10 . 5011 . 1 1 21 ARG C C -3.340 4.163 -1.393 . . . 1.0 . . . . . . . . . . . . A . 21 ARG C . . . . . . . . . c30643_6pv2 1 . 10 . 5012 . 1 1 21 ARG CA C -2.888 5.387 -0.607 . . . 1.0 . . . . . . . . . . . . A . 21 ARG CA . . . . . . . . . c30643_6pv2 1 . 10 . 5013 . 1 1 21 ARG CB C -2.140 6.356 -1.521 . . . 1.0 . . . . . . . . . . . . A . 21 ARG CB . . . . . . . . . c30643_6pv2 1 . 10 . 5014 . 1 1 21 ARG CD C -2.110 7.693 -3.628 . . . 1.0 . . . . . . . . . . . . A . 21 ARG CD . . . . . . . . . c30643_6pv2 1 . 10 . 5015 . 1 1 21 ARG CG C -2.960 6.856 -2.692 . . . 1.0 . . . . . . . . . . . . A . 21 ARG CG . . . . . . . . . c30643_6pv2 1 . 10 . 5016 . 1 1 21 ARG CZ C -2.750 7.697 -6.005 . . . 1.0 . . . . . . . . . . . . A . 21 ARG CZ . . . . . . . . . c30643_6pv2 1 . 10 . 5017 . 1 1 21 ARG H H -1.129 5.362 0.570 . . . 1.0 . . . . . . . . . . . . A . 21 ARG H . . . . . . . . . c30643_6pv2 1 . 10 . 5018 . 1 1 21 ARG HA H -3.754 5.881 -0.197 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HA . . . . . . . . . c30643_6pv2 1 . 10 . 5019 . 1 1 21 ARG HB2 H -1.829 7.212 -0.940 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HB2 . . . . . . . . . c30643_6pv2 1 . 10 . 5020 . 1 1 21 ARG HB3 H -1.265 5.861 -1.909 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HB3 . . . . . . . . . c30643_6pv2 1 . 10 . 5021 . 1 1 21 ARG HD2 H -1.722 8.538 -3.080 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HD2 . . . . . . . . . c30643_6pv2 1 . 10 . 5022 . 1 1 21 ARG HD3 H -1.287 7.092 -3.982 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HD3 . . . . . . . . . c30643_6pv2 1 . 10 . 5023 . 1 1 21 ARG HE H -3.487 8.929 -4.612 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HE . . . . . . . . . c30643_6pv2 1 . 10 . 5024 . 1 1 21 ARG HG2 H -3.356 6.011 -3.233 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HG2 . . . . . . . . . c30643_6pv2 1 . 10 . 5025 . 1 1 21 ARG HG3 H -3.772 7.463 -2.319 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HG3 . . . . . . . . . c30643_6pv2 1 . 10 . 5026 . 1 1 21 ARG HH11 H -1.470 6.212 -5.489 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HH11 . . . . . . . . . c30643_6pv2 1 . 10 . 5027 . 1 1 21 ARG HH12 H -1.885 6.283 -7.171 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HH12 . . . . . . . . . c30643_6pv2 1 . 10 . 5028 . 1 1 21 ARG HH21 H -4.019 9.036 -6.837 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HH21 . . . . . . . . . c30643_6pv2 1 . 10 . 5029 . 1 1 21 ARG HH22 H -3.332 7.881 -7.934 . . . 1.0 . . . . . . . . . . . . A . 21 ARG HH22 . . . . . . . . . c30643_6pv2 1 . 10 . 5030 . 1 1 21 ARG N N -2.032 4.979 0.498 . . . 1.0 . . . . . . . . . . . . A . 21 ARG N . . . . . . . . . c30643_6pv2 1 . 10 . 5031 . 1 1 21 ARG NE N -2.869 8.181 -4.772 . . . 1.0 . . . . . . . . . . . . A . 21 ARG NE . . . . . . . . . c30643_6pv2 1 . 10 . 5032 . 1 1 21 ARG NH1 N -1.973 6.647 -6.240 . . . 1.0 . . . . . . . . . . . . A . 21 ARG NH1 . . . . . . . . . c30643_6pv2 1 . 10 . 5033 . 1 1 21 ARG NH2 N -3.420 8.249 -7.005 . . . 1.0 . . . . . . . . . . . . A . 21 ARG NH2 . . . . . . . . . c30643_6pv2 1 . 10 . 5034 . 1 1 21 ARG O O -4.516 4.029 -1.733 . . . 1.0 . . . . . . . . . . . . A . 21 ARG O . . . . . . . . . c30643_6pv2 1 . 10 . 5035 . 1 1 22 HIS C C -3.691 1.189 -1.552 . . . 1.0 . . . . . . . . . . . . A . 22 HIS C . . . . . . . . . c30643_6pv2 1 . 10 . 5036 . 1 1 22 HIS CA C -2.680 2.021 -2.335 . . . 1.0 . . . . . . . . . . . . A . 22 HIS CA . . . . . . . . . c30643_6pv2 1 . 10 . 5037 . 1 1 22 HIS CB C -1.386 1.223 -2.555 . . . 1.0 . . . . . . . . . . . . A . 22 HIS CB . . . . . . . . . c30643_6pv2 1 . 10 . 5038 . 1 1 22 HIS CD2 C -1.850 -1.284 -2.185 . . . 1.0 . . . . . . . . . . . . A . 22 HIS CD2 . . . . . . . . . c30643_6pv2 1 . 10 . 5039 . 1 1 22 HIS CE1 C -2.054 -1.936 -4.248 . . . 1.0 . . . . . . . . . . . . A . 22 HIS CE1 . . . . . . . . . c30643_6pv2 1 . 10 . 5040 . 1 1 22 HIS CG C -1.628 -0.196 -2.963 . . . 1.0 . . . . . . . . . . . . A . 22 HIS CG . . . . . . . . . c30643_6pv2 1 . 10 . 5041 . 1 1 22 HIS H H -1.475 3.445 -1.357 . . . 1.0 . . . . . . . . . . . . A . 22 HIS H . . . . . . . . . c30643_6pv2 1 . 10 . 5042 . 1 1 22 HIS HA H -3.105 2.268 -3.294 . . . 1.0 . . . . . . . . . . . . A . 22 HIS HA . . . . . . . . . c30643_6pv2 1 . 10 . 5043 . 1 1 22 HIS HB2 H -0.802 1.698 -3.327 . . . 1.0 . . . . . . . . . . . . A . 22 HIS HB2 . . . . . . . . . c30643_6pv2 1 . 10 . 5044 . 1 1 22 HIS HB3 H -0.818 1.212 -1.635 . . . 1.0 . . . . . . . . . . . . A . 22 HIS HB3 . . . . . . . . . c30643_6pv2 1 . 10 . 5045 . 1 1 22 HIS HD1 H -1.631 -0.077 -5.085 . . . 1.0 . . . . . . . . . . . . A . 22 HIS HD1 . . . . . . . . . c30643_6pv2 1 . 10 . 5046 . 1 1 22 HIS HD2 H -1.795 -1.325 -1.108 . . . 1.0 . . . . . . . . . . . . A . 22 HIS HD2 . . . . . . . . . c30643_6pv2 1 . 10 . 5047 . 1 1 22 HIS HE1 H -2.217 -2.557 -5.114 . . . 1.0 . . . . . . . . . . . . A . 22 HIS HE1 . . . . . . . . . c30643_6pv2 1 . 10 . 5048 . 1 1 22 HIS N N -2.396 3.264 -1.645 . . . 1.0 . . . . . . . . . . . . A . 22 HIS N . . . . . . . . . c30643_6pv2 1 . 10 . 5049 . 1 1 22 HIS ND1 N -1.748 -0.628 -4.279 . . . 1.0 . . . . . . . . . . . . A . 22 HIS ND1 . . . . . . . . . c30643_6pv2 1 . 10 . 5050 . 1 1 22 HIS NE2 N -2.122 -2.345 -3.010 . . . 1.0 . . . . . . . . . . . . A . 22 HIS NE2 . . . . . . . . . c30643_6pv2 1 . 10 . 5051 . 1 1 22 HIS O O -4.654 0.687 -2.118 . . . 1.0 . . . . . . . . . . . . A . 22 HIS O . . . . . . . . . c30643_6pv2 1 . 10 . 5052 . 1 1 23 LYS C C -5.778 0.802 0.569 . . . 1.0 . . . . . . . . . . . . A . 23 LYS C . . . . . . . . . c30643_6pv2 1 . 10 . 5053 . 1 1 23 LYS CA C -4.358 0.255 0.590 . . . 1.0 . . . . . . . . . . . . A . 23 LYS CA . . . . . . . . . c30643_6pv2 1 . 10 . 5054 . 1 1 23 LYS CB C -3.851 0.194 2.030 . . . 1.0 . . . . . . . . . . . . A . 23 LYS CB . . . . . . . . . c30643_6pv2 1 . 10 . 5055 . 1 1 23 LYS CD C -2.312 -0.876 3.694 . . . 1.0 . . . . . . . . . . . . A . 23 LYS CD . . . . . . . . . c30643_6pv2 1 . 10 . 5056 . 1 1 23 LYS CE C -1.210 -1.900 3.902 . . . 1.0 . . . . . . . . . . . . A . 23 LYS CE . . . . . . . . . c30643_6pv2 1 . 10 . 5057 . 1 1 23 LYS CG C -2.646 -0.710 2.223 . . . 1.0 . . . . . . . . . . . . A . 23 LYS CG . . . . . . . . . c30643_6pv2 1 . 10 . 5058 . 1 1 23 LYS H H -2.689 1.490 0.153 . . . 1.0 . . . . . . . . . . . . A . 23 LYS H . . . . . . . . . c30643_6pv2 1 . 10 . 5059 . 1 1 23 LYS HA H -4.372 -0.744 0.187 . . . 1.0 . . . . . . . . . . . . A . 23 LYS HA . . . . . . . . . c30643_6pv2 1 . 10 . 5060 . 1 1 23 LYS HB2 H -3.578 1.191 2.344 . . . 1.0 . . . . . . . . . . . . A . 23 LYS HB2 . . . . . . . . . c30643_6pv2 1 . 10 . 5061 . 1 1 23 LYS HB3 H -4.647 -0.168 2.661 . . . 1.0 . . . . . . . . . . . . A . 23 LYS HB3 . . . . . . . . . c30643_6pv2 1 . 10 . 5062 . 1 1 23 LYS HD2 H -1.985 0.075 4.088 . . . 1.0 . . . . . . . . . . . . A . 23 LYS HD2 . . . . . . . . . c30643_6pv2 1 . 10 . 5063 . 1 1 23 LYS HD3 H -3.199 -1.201 4.219 . . . 1.0 . . . . . . . . . . . . A . 23 LYS HD3 . . . . . . . . . c30643_6pv2 1 . 10 . 5064 . 1 1 23 LYS HE2 H -1.516 -2.836 3.459 . . . 1.0 . . . . . . . . . . . . A . 23 LYS HE2 . . . . . . . . . c30643_6pv2 1 . 10 . 5065 . 1 1 23 LYS HE3 H -0.312 -1.547 3.415 . . . 1.0 . . . . . . . . . . . . A . 23 LYS HE3 . . . . . . . . . c30643_6pv2 1 . 10 . 5066 . 1 1 23 LYS HG2 H -2.861 -1.680 1.801 . . . 1.0 . . . . . . . . . . . . A . 23 LYS HG2 . . . . . . . . . c30643_6pv2 1 . 10 . 5067 . 1 1 23 LYS HG3 H -1.795 -0.276 1.718 . . . 1.0 . . . . . . . . . . . . A . 23 LYS HG3 . . . . . . . . . c30643_6pv2 1 . 10 . 5068 . 1 1 23 LYS HZ1 H -1.779 -2.443 5.835 . . . 1.0 . . . . . . . . . . . . A . 23 LYS HZ1 . . . . . . . . . c30643_6pv2 1 . 10 . 5069 . 1 1 23 LYS HZ2 H -0.598 -1.238 5.786 . . . 1.0 . . . . . . . . . . . . A . 23 LYS HZ2 . . . . . . . . . c30643_6pv2 1 . 10 . 5070 . 1 1 23 LYS HZ3 H -0.182 -2.842 5.457 . . . 1.0 . . . . . . . . . . . . A . 23 LYS HZ3 . . . . . . . . . c30643_6pv2 1 . 10 . 5071 . 1 1 23 LYS N N -3.471 1.050 -0.251 . . . 1.0 . . . . . . . . . . . . A . 23 LYS N . . . . . . . . . c30643_6pv2 1 . 10 . 5072 . 1 1 23 LYS NZ N -0.923 -2.121 5.345 . . . 1.0 . . . . . . . . . . . . A . 23 LYS NZ . . . . . . . . . c30643_6pv2 1 . 10 . 5073 . 1 1 23 LYS O O -6.738 0.074 0.833 . . . 1.0 . . . . . . . . . . . . A . 23 LYS O . . . . . . . . . c30643_6pv2 1 . 10 . 5074 . 1 1 24 ARG C C -8.008 2.180 -1.061 . . . 1.0 . . . . . . . . . . . . A . 24 ARG C . . . . . . . . . c30643_6pv2 1 . 10 . 5075 . 1 1 24 ARG CA C -7.222 2.700 0.144 . . . 1.0 . . . . . . . . . . . . A . 24 ARG CA . . . . . . . . . c30643_6pv2 1 . 10 . 5076 . 1 1 24 ARG CB C -7.093 4.222 0.102 . . . 1.0 . . . . . . . . . . . . A . 24 ARG CB . . . . . . . . . c30643_6pv2 1 . 10 . 5077 . 1 1 24 ARG CD C -6.524 6.330 1.359 . . . 1.0 . . . . . . . . . . . . A . 24 ARG CD . . . . . . . . . c30643_6pv2 1 . 10 . 5078 . 1 1 24 ARG CG C -6.635 4.815 1.425 . . . 1.0 . . . . . . . . . . . . A . 24 ARG CG . . . . . . . . . c30643_6pv2 1 . 10 . 5079 . 1 1 24 ARG CZ C -8.032 8.272 1.168 . . . 1.0 . . . . . . . . . . . . A . 24 ARG CZ . . . . . . . . . c30643_6pv2 1 . 10 . 5080 . 1 1 24 ARG H H -5.107 2.614 0.037 . . . 1.0 . . . . . . . . . . . . A . 24 ARG H . . . . . . . . . c30643_6pv2 1 . 10 . 5081 . 1 1 24 ARG HA H -7.761 2.428 1.040 . . . 1.0 . . . . . . . . . . . . A . 24 ARG HA . . . . . . . . . c30643_6pv2 1 . 10 . 5082 . 1 1 24 ARG HB2 H -6.374 4.492 -0.658 . . . 1.0 . . . . . . . . . . . . A . 24 ARG HB2 . . . . . . . . . c30643_6pv2 1 . 10 . 5083 . 1 1 24 ARG HB3 H -8.051 4.648 -0.151 . . . 1.0 . . . . . . . . . . . . A . 24 ARG HB3 . . . . . . . . . c30643_6pv2 1 . 10 . 5084 . 1 1 24 ARG HD2 H -6.177 6.693 2.314 . . . 1.0 . . . . . . . . . . . . A . 24 ARG HD2 . . . . . . . . . c30643_6pv2 1 . 10 . 5085 . 1 1 24 ARG HD3 H -5.807 6.593 0.595 . . . 1.0 . . . . . . . . . . . . A . 24 ARG HD3 . . . . . . . . . c30643_6pv2 1 . 10 . 5086 . 1 1 24 ARG HE H -8.526 6.384 0.718 . . . 1.0 . . . . . . . . . . . . A . 24 ARG HE . . . . . . . . . c30643_6pv2 1 . 10 . 5087 . 1 1 24 ARG HG2 H -7.350 4.551 2.190 . . . 1.0 . . . . . . . . . . . . A . 24 ARG HG2 . . . . . . . . . c30643_6pv2 1 . 10 . 5088 . 1 1 24 ARG HG3 H -5.669 4.402 1.677 . . . 1.0 . . . . . . . . . . . . A . 24 ARG HG3 . . . . . . . . . c30643_6pv2 1 . 10 . 5089 . 1 1 24 ARG HH11 H -6.189 8.709 1.896 . . . 1.0 . . . . . . . . . . . . A . 24 ARG HH11 . . . . . . . . . c30643_6pv2 1 . 10 . 5090 . 1 1 24 ARG HH12 H -7.257 10.064 1.712 . . . 1.0 . . . . . . . . . . . . A . 24 ARG HH12 . . . . . . . . . c30643_6pv2 1 . 10 . 5091 . 1 1 24 ARG HH21 H -9.387 9.754 0.916 . . . 1.0 . . . . . . . . . . . . A . 24 ARG HH21 . . . . . . . . . c30643_6pv2 1 . 10 . 5092 . 1 1 24 ARG HH22 H -9.934 8.164 0.480 . . . 1.0 . . . . . . . . . . . . A . 24 ARG HH22 . . . . . . . . . c30643_6pv2 1 . 10 . 5093 . 1 1 24 ARG N N -5.912 2.077 0.230 . . . 1.0 . . . . . . . . . . . . A . 24 ARG N . . . . . . . . . c30643_6pv2 1 . 10 . 5094 . 1 1 24 ARG NE N -7.801 6.965 1.048 . . . 1.0 . . . . . . . . . . . . A . 24 ARG NE . . . . . . . . . c30643_6pv2 1 . 10 . 5095 . 1 1 24 ARG NH1 N -7.084 9.079 1.632 . . . 1.0 . . . . . . . . . . . . A . 24 ARG NH1 . . . . . . . . . c30643_6pv2 1 . 10 . 5096 . 1 1 24 ARG NH2 N -9.211 8.770 0.827 . . . 1.0 . . . . . . . . . . . . A . 24 ARG NH2 . . . . . . . . . c30643_6pv2 1 . 10 . 5097 . 1 1 24 ARG O O -9.182 2.502 -1.223 . . . 1.0 . . . . . . . . . . . . A . 24 ARG O . . . . . . . . . c30643_6pv2 1 . 10 . 5098 . 1 1 25 THR C C -8.721 -0.584 -2.430 . . . 1.0 . . . . . . . . . . . . A . 25 THR C . . . . . . . . . c30643_6pv2 1 . 10 . 5099 . 1 1 25 THR CA C -8.077 0.688 -2.973 . . . 1.0 . . . . . . . . . . . . A . 25 THR CA . . . . . . . . . c30643_6pv2 1 . 10 . 5100 . 1 1 25 THR CB C -7.158 0.336 -4.164 . . . 1.0 . . . . . . . . . . . . A . 25 THR CB . . . . . . . . . c30643_6pv2 1 . 10 . 5101 . 1 1 25 THR CG2 C -6.518 1.589 -4.743 . . . 1.0 . . . . . . . . . . . . A . 25 THR CG2 . . . . . . . . . c30643_6pv2 1 . 10 . 5102 . 1 1 25 THR H H -6.398 1.238 -1.801 . . . 1.0 . . . . . . . . . . . . A . 25 THR H . . . . . . . . . c30643_6pv2 1 . 10 . 5103 . 1 1 25 THR HA H -8.856 1.349 -3.327 . . . 1.0 . . . . . . . . . . . . A . 25 THR HA . . . . . . . . . c30643_6pv2 1 . 10 . 5104 . 1 1 25 THR HB H -7.758 -0.128 -4.932 . . . 1.0 . . . . . . . . . . . . A . 25 THR HB . . . . . . . . . c30643_6pv2 1 . 10 . 5105 . 1 1 25 THR HG1 H -5.426 -0.099 -3.310 . . . 1.0 . . . . . . . . . . . . A . 25 THR HG1 . . . . . . . . . c30643_6pv2 1 . 10 . 5106 . 1 1 25 THR HG21 H -7.290 2.266 -5.079 . . . 1.0 . . . . . . . . . . . . A . 25 THR HG21 . . . . . . . . . c30643_6pv2 1 . 10 . 5107 . 1 1 25 THR HG22 H -5.887 1.319 -5.578 . . . 1.0 . . . . . . . . . . . . A . 25 THR HG22 . . . . . . . . . c30643_6pv2 1 . 10 . 5108 . 1 1 25 THR HG23 H -5.921 2.073 -3.983 . . . 1.0 . . . . . . . . . . . . A . 25 THR HG23 . . . . . . . . . c30643_6pv2 1 . 10 . 5109 . 1 1 25 THR N N -7.367 1.371 -1.900 . . . 1.0 . . . . . . . . . . . . A . 25 THR N . . . . . . . . . c30643_6pv2 1 . 10 . 5110 . 1 1 25 THR O O -9.793 -0.995 -2.875 . . . 1.0 . . . . . . . . . . . . A . 25 THR O . . . . . . . . . c30643_6pv2 1 . 10 . 5111 . 1 1 25 THR OG1 O -6.136 -0.583 -3.755 . . . 1.0 . . . . . . . . . . . . A . 25 THR OG1 . . . . . . . . . c30643_6pv2 1 . 10 . 5112 . 1 1 26 HIS C C -9.619 -1.895 0.291 . . . 1.0 . . . . . . . . . . . . A . 26 HIS C . . . . . . . . . c30643_6pv2 1 . 10 . 5113 . 1 1 26 HIS CA C -8.623 -2.359 -0.762 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CA . . . . . . . . . c30643_6pv2 1 . 10 . 5114 . 1 1 26 HIS CB C -7.534 -3.190 -0.071 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CB . . . . . . . . . c30643_6pv2 1 . 10 . 5115 . 1 1 26 HIS CD2 C -5.135 -3.414 -1.002 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CD2 . . . . . . . . . c30643_6pv2 1 . 10 . 5116 . 1 1 26 HIS CE1 C -5.442 -4.989 -2.473 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CE1 . . . . . . . . . c30643_6pv2 1 . 10 . 5117 . 1 1 26 HIS CG C -6.456 -3.725 -0.965 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CG . . . . . . . . . c30643_6pv2 1 . 10 . 5118 . 1 1 26 HIS H H -7.187 -0.856 -1.167 . . . 1.0 . . . . . . . . . . . . A . 26 HIS H . . . . . . . . . c30643_6pv2 1 . 10 . 5119 . 1 1 26 HIS HA H -9.133 -2.967 -1.492 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HA . . . . . . . . . c30643_6pv2 1 . 10 . 5120 . 1 1 26 HIS HB2 H -7.055 -2.575 0.675 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HB2 . . . . . . . . . c30643_6pv2 1 . 10 . 5121 . 1 1 26 HIS HB3 H -8.002 -4.032 0.420 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HB3 . . . . . . . . . c30643_6pv2 1 . 10 . 5122 . 1 1 26 HIS HD1 H -7.488 -5.176 -2.126 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HD1 . . . . . . . . . c30643_6pv2 1 . 10 . 5123 . 1 1 26 HIS HD2 H -4.632 -2.683 -0.390 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HD2 . . . . . . . . . c30643_6pv2 1 . 10 . 5124 . 1 1 26 HIS HE1 H -5.260 -5.732 -3.233 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HE1 . . . . . . . . . c30643_6pv2 1 . 10 . 5125 . 1 1 26 HIS N N -8.065 -1.196 -1.443 . . . 1.0 . . . . . . . . . . . . A . 26 HIS N . . . . . . . . . c30643_6pv2 1 . 10 . 5126 . 1 1 26 HIS ND1 N -6.640 -4.728 -1.912 . . . 1.0 . . . . . . . . . . . . A . 26 HIS ND1 . . . . . . . . . c30643_6pv2 1 . 10 . 5127 . 1 1 26 HIS NE2 N -4.530 -4.215 -1.945 . . . 1.0 . . . . . . . . . . . . A . 26 HIS NE2 . . . . . . . . . c30643_6pv2 1 . 10 . 5128 . 1 1 26 HIS O O -10.397 -2.680 0.834 . . . 1.0 . . . . . . . . . . . . A . 26 HIS O . . . . . . . . . c30643_6pv2 1 . 10 . 5129 . 1 1 27 THR C C -10.275 -0.583 2.924 . . . 1.0 . . . . . . . . . . . . A . 27 THR C . . . . . . . . . c30643_6pv2 1 . 10 . 5130 . 1 1 27 THR CA C -10.378 0.084 1.561 . . . 1.0 . . . . . . . . . . . . A . 27 THR CA . . . . . . . . . c30643_6pv2 1 . 10 . 5131 . 1 1 27 THR CB C -11.858 0.219 1.121 . . . 1.0 . . . . . . . . . . . . A . 27 THR CB . . . . . . . . . c30643_6pv2 1 . 10 . 5132 . 1 1 27 THR CG2 C -11.984 1.206 -0.028 . . . 1.0 . . . . . . . . . . . . A . 27 THR CG2 . . . . . . . . . c30643_6pv2 1 . 10 . 5133 . 1 1 27 THR H H -8.891 -0.058 0.075 . . . 1.0 . . . . . . . . . . . . A . 27 THR H . . . . . . . . . c30643_6pv2 1 . 10 . 5134 . 1 1 27 THR HA H -9.984 1.088 1.663 . . . 1.0 . . . . . . . . . . . . A . 27 THR HA . . . . . . . . . c30643_6pv2 1 . 10 . 5135 . 1 1 27 THR HB H -12.424 0.597 1.957 . . . 1.0 . . . . . . . . . . . . A . 27 THR HB . . . . . . . . . c30643_6pv2 1 . 10 . 5136 . 1 1 27 THR HG1 H -11.771 -1.749 0.911 . . . 1.0 . . . . . . . . . . . . A . 27 THR HG1 . . . . . . . . . c30643_6pv2 1 . 10 . 5137 . 1 1 27 THR HG21 H -13.015 1.266 -0.341 . . . 1.0 . . . . . . . . . . . . A . 27 THR HG21 . . . . . . . . . c30643_6pv2 1 . 10 . 5138 . 1 1 27 THR HG22 H -11.376 0.873 -0.857 . . . 1.0 . . . . . . . . . . . . A . 27 THR HG22 . . . . . . . . . c30643_6pv2 1 . 10 . 5139 . 1 1 27 THR HG23 H -11.649 2.181 0.295 . . . 1.0 . . . . . . . . . . . . A . 27 THR HG23 . . . . . . . . . c30643_6pv2 1 . 10 . 5140 . 1 1 27 THR N N -9.551 -0.592 0.566 . . . 1.0 . . . . . . . . . . . . A . 27 THR N . . . . . . . . . c30643_6pv2 1 . 10 . 5141 . 1 1 27 THR O O -11.281 -0.921 3.548 . . . 1.0 . . . . . . . . . . . . A . 27 THR O . . . . . . . . . c30643_6pv2 1 . 10 . 5142 . 1 1 27 THR OG1 O -12.411 -1.046 0.723 . . . 1.0 . . . . . . . . . . . . A . 27 THR OG1 . . . . . . . . . c30643_6pv2 1 . 10 . 5143 . 1 1 28 GLY C C -9.390 -0.446 5.774 . . . 1.0 . . . . . . . . . . . . A . 28 GLY C . . . . . . . . . c30643_6pv2 1 . 10 . 5144 . 1 1 28 GLY CA C -8.796 -1.322 4.692 . . . 1.0 . . . . . . . . . . . . A . 28 GLY CA . . . . . . . . . c30643_6pv2 1 . 10 . 5145 . 1 1 28 GLY H H -8.281 -0.527 2.803 . . . 1.0 . . . . . . . . . . . . A . 28 GLY H . . . . . . . . . c30643_6pv2 1 . 10 . 5146 . 1 1 28 GLY HA2 H -9.241 -2.305 4.747 . . . 1.0 . . . . . . . . . . . . A . 28 GLY HA2 . . . . . . . . . c30643_6pv2 1 . 10 . 5147 . 1 1 28 GLY HA3 H -7.733 -1.406 4.853 . . . 1.0 . . . . . . . . . . . . A . 28 GLY HA3 . . . . . . . . . c30643_6pv2 1 . 10 . 5148 . 1 1 28 GLY N N -9.037 -0.771 3.374 . . . 1.0 . . . . . . . . . . . . A . 28 GLY N . . . . . . . . . c30643_6pv2 1 . 10 . 5149 . 1 1 28 GLY O O -9.392 0.782 5.654 . . . 1.0 . . . . . . . . . . . . A . 28 GLY O . . . . . . . . . c30643_6pv2 1 . 10 . 5150 . 1 1 29 GLU C C -9.664 0.329 8.834 . . . 1.0 . . . . . . . . . . . . A . 29 GLU C . . . . . . . . . c30643_6pv2 1 . 10 . 5151 . 1 1 29 GLU CA C -10.622 -0.328 7.848 . . . 1.0 . . . . . . . . . . . . A . 29 GLU CA . . . . . . . . . c30643_6pv2 1 . 10 . 5152 . 1 1 29 GLU CB C -11.585 -1.259 8.580 . . . 1.0 . . . . . . . . . . . . A . 29 GLU CB . . . . . . . . . c30643_6pv2 1 . 10 . 5153 . 1 1 29 GLU CD C -13.624 -1.471 10.032 . . . 1.0 . . . . . . . . . . . . A . 29 GLU CD . . . . . . . . . c30643_6pv2 1 . 10 . 5154 . 1 1 29 GLU CG C -12.603 -0.531 9.436 . . . 1.0 . . . . . . . . . . . . A . 29 GLU CG . . . . . . . . . c30643_6pv2 1 . 10 . 5155 . 1 1 29 GLU H H -9.770 -2.027 6.930 . . . 1.0 . . . . . . . . . . . . A . 29 GLU H . . . . . . . . . c30643_6pv2 1 . 10 . 5156 . 1 1 29 GLU HA H -11.192 0.445 7.354 . . . 1.0 . . . . . . . . . . . . A . 29 GLU HA . . . . . . . . . c30643_6pv2 1 . 10 . 5157 . 1 1 29 GLU HB2 H -12.116 -1.855 7.853 . . . 1.0 . . . . . . . . . . . . A . 29 GLU HB2 . . . . . . . . . c30643_6pv2 1 . 10 . 5158 . 1 1 29 GLU HB3 H -11.015 -1.917 9.221 . . . 1.0 . . . . . . . . . . . . A . 29 GLU HB3 . . . . . . . . . c30643_6pv2 1 . 10 . 5159 . 1 1 29 GLU HG2 H -12.086 -0.027 10.241 . . . 1.0 . . . . . . . . . . . . A . 29 GLU HG2 . . . . . . . . . c30643_6pv2 1 . 10 . 5160 . 1 1 29 GLU HG3 H -13.117 0.197 8.825 . . . 1.0 . . . . . . . . . . . . A . 29 GLU HG3 . . . . . . . . . c30643_6pv2 1 . 10 . 5161 . 1 1 29 GLU N N -9.896 -1.060 6.828 . . . 1.0 . . . . . . . . . . . . A . 29 GLU N . . . . . . . . . c30643_6pv2 1 . 10 . 5162 . 1 1 29 GLU O O -9.081 -0.334 9.695 . . . 1.0 . . . . . . . . . . . . A . 29 GLU O . . . . . . . . . c30643_6pv2 1 . 10 . 5163 . 1 1 29 GLU OE1 O -13.466 -1.853 11.211 . . . 1.0 . . . . . . . . . . . . A . 29 GLU OE1 . . . . . . . . . c30643_6pv2 1 . 10 . 5164 . 1 1 29 GLU OE2 O -14.594 -1.828 9.329 . . . 1.0 . . . . . . . . . . . . A . 29 GLU OE2 . . . . . . . . . c30643_6pv2 1 . 10 . 5165 . 1 1 30 LYS C C -9.545 3.320 10.425 . . . 1.0 . . . . . . . . . . . . A . 30 LYS C . . . . . . . . . c30643_6pv2 1 . 10 . 5166 . 1 1 30 LYS CA C -8.664 2.409 9.584 . . . 1.0 . . . . . . . . . . . . A . 30 LYS CA . . . . . . . . . c30643_6pv2 1 . 10 . 5167 . 1 1 30 LYS CB C -7.633 3.238 8.810 . . . 1.0 . . . . . . . . . . . . A . 30 LYS CB . . . . . . . . . c30643_6pv2 1 . 10 . 5168 . 1 1 30 LYS CD C -5.702 1.689 9.235 . . . 1.0 . . . . . . . . . . . . A . 30 LYS CD . . . . . . . . . c30643_6pv2 1 . 10 . 5169 . 1 1 30 LYS CE C -4.457 1.051 8.643 . . . 1.0 . . . . . . . . . . . . A . 30 LYS CE . . . . . . . . . c30643_6pv2 1 . 10 . 5170 . 1 1 30 LYS CG C -6.521 2.416 8.180 . . . 1.0 . . . . . . . . . . . . A . 30 LYS CG . . . . . . . . . c30643_6pv2 1 . 10 . 5171 . 1 1 30 LYS H H -9.918 2.084 7.921 . . . 1.0 . . . . . . . . . . . . A . 30 LYS H . . . . . . . . . c30643_6pv2 1 . 10 . 5172 . 1 1 30 LYS HA H -8.150 1.721 10.239 . . . 1.0 . . . . . . . . . . . . A . 30 LYS HA . . . . . . . . . c30643_6pv2 1 . 10 . 5173 . 1 1 30 LYS HB2 H -8.140 3.775 8.023 . . . 1.0 . . . . . . . . . . . . A . 30 LYS HB2 . . . . . . . . . c30643_6pv2 1 . 10 . 5174 . 1 1 30 LYS HB3 H -7.184 3.951 9.485 . . . 1.0 . . . . . . . . . . . . A . 30 LYS HB3 . . . . . . . . . c30643_6pv2 1 . 10 . 5175 . 1 1 30 LYS HD2 H -5.403 2.398 9.994 . . . 1.0 . . . . . . . . . . . . A . 30 LYS HD2 . . . . . . . . . c30643_6pv2 1 . 10 . 5176 . 1 1 30 LYS HD3 H -6.312 0.919 9.681 . . . 1.0 . . . . . . . . . . . . A . 30 LYS HD3 . . . . . . . . . c30643_6pv2 1 . 10 . 5177 . 1 1 30 LYS HE2 H -3.852 1.824 8.195 . . . 1.0 . . . . . . . . . . . . A . 30 LYS HE2 . . . . . . . . . c30643_6pv2 1 . 10 . 5178 . 1 1 30 LYS HE3 H -3.900 0.577 9.437 . . . 1.0 . . . . . . . . . . . . A . 30 LYS HE3 . . . . . . . . . c30643_6pv2 1 . 10 . 5179 . 1 1 30 LYS HG2 H -6.957 1.687 7.513 . . . 1.0 . . . . . . . . . . . . A . 30 LYS HG2 . . . . . . . . . c30643_6pv2 1 . 10 . 5180 . 1 1 30 LYS HG3 H -5.871 3.074 7.622 . . . 1.0 . . . . . . . . . . . . A . 30 LYS HG3 . . . . . . . . . c30643_6pv2 1 . 10 . 5181 . 1 1 30 LYS HZ1 H -5.326 0.471 6.836 . . . 1.0 . . . . . . . . . . . . A . 30 LYS HZ1 . . . . . . . . . c30643_6pv2 1 . 10 . 5182 . 1 1 30 LYS HZ2 H -5.347 -0.731 8.022 . . . 1.0 . . . . . . . . . . . . A . 30 LYS HZ2 . . . . . . . . . c30643_6pv2 1 . 10 . 5183 . 1 1 30 LYS HZ3 H -3.908 -0.368 7.214 . . . 1.0 . . . . . . . . . . . . A . 30 LYS HZ3 . . . . . . . . . c30643_6pv2 1 . 10 . 5184 . 1 1 30 LYS N N -9.484 1.631 8.676 . . . 1.0 . . . . . . . . . . . . A . 30 LYS N . . . . . . . . . c30643_6pv2 1 . 10 . 5185 . 1 1 30 LYS NZ N -4.784 0.035 7.607 . . . 1.0 . . . . . . . . . . . . A . 30 LYS NZ . . . . . . . . . c30643_6pv2 1 . 10 . 5186 . 1 1 30 LYS O O -9.717 3.109 11.624 . . . 1.0 . . . . . . . . . . . . A . 30 LYS O . . . . . . . . . c30643_6pv2 1 . 10 . 5187 . 1 1 31 NH2 HN1 H -9.923 4.442 8.833 . . . 1.0 . . . . . . . . . . . . A . 31 NH2 HN1 . . . . . . . . . c30643_6pv2 1 . 10 . 5188 . 1 1 31 NH2 HN2 H -10.676 4.945 10.306 . . . 1.0 . . . . . . . . . . . . A . 31 NH2 HN2 . . . . . . . . . c30643_6pv2 1 . 10 . 5189 . 1 1 31 NH2 N N -10.103 4.337 9.793 . . . 1.0 . . . . . . . . . . . . A . 31 NH2 N . . . . . . . . . c30643_6pv2 1 . 10 . 5190 . 2 2 1 ZN ZN Zn -2.584 -4.181 -2.403 . . . 1.0 . . . . . . . . . . . . A . 101 ZN ZN . . . . . . . . . c30643_6pv2 1 stop_ save_ save_constraint_statistics _Constraint_stat_list.Sf_framecode constraint_statistics _Constraint_stat_list.Sf_category constraint_statistics _Constraint_stat_list.Entry_ID c30643_6pv2 _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 6pv2.mr . . 'MR format' 1 comment 'Not applicable' 'Not applicable' 0 c30643_6pv2 1 1 6pv2.mr . . XPLOR/CNS 2 distance NOE ambi 452 c30643_6pv2 1 1 6pv2.mr . . XPLOR/CNS 3 distance 'hydrogen bond' simple 28 c30643_6pv2 1 1 6pv2.mr . . XPLOR/CNS 4 'dihedral angle' 'Not applicable' 'Not applicable' 6 c30643_6pv2 1 1 6pv2.mr . . 'MR format' 5 'nomenclature mapping' 'Not applicable' 'Not applicable' 0 c30643_6pv2 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 c30643_6pv2 _Gen_dist_constraint_list.ID 1 _Gen_dist_constraint_list.Constraint_type NOE _Gen_dist_constraint_list.Details 'Generated by Wattos' _Gen_dist_constraint_list.Constraint_file_ID 1 _Gen_dist_constraint_list.Block_ID 2 loop_ _Gen_dist_constraint_software.Software_ID _Gen_dist_constraint_software.Software_label _Gen_dist_constraint_software.Method_ID _Gen_dist_constraint_software.Method_label _Gen_dist_constraint_software.Entry_ID _Gen_dist_constraint_software.Gen_dist_constraint_list_ID . . . . c30643_6pv2 1 stop_ loop_ _Gen_dist_constraint.ID _Gen_dist_constraint.Member_ID _Gen_dist_constraint.Member_logic_code _Gen_dist_constraint.Assembly_atom_ID_1 _Gen_dist_constraint.Entity_assembly_ID_1 _Gen_dist_constraint.Entity_ID_1 _Gen_dist_constraint.Comp_index_ID_1 _Gen_dist_constraint.Seq_ID_1 _Gen_dist_constraint.Comp_ID_1 _Gen_dist_constraint.Atom_ID_1 _Gen_dist_constraint.Atom_type_1 _Gen_dist_constraint.Atom_isotope_number_1 _Gen_dist_constraint.Resonance_ID_1 _Gen_dist_constraint.Assembly_atom_ID_2 _Gen_dist_constraint.Entity_assembly_ID_2 _Gen_dist_constraint.Entity_ID_2 _Gen_dist_constraint.Comp_index_ID_2 _Gen_dist_constraint.Seq_ID_2 _Gen_dist_constraint.Comp_ID_2 _Gen_dist_constraint.Atom_ID_2 _Gen_dist_constraint.Atom_type_2 _Gen_dist_constraint.Atom_isotope_number_2 _Gen_dist_constraint.Resonance_ID_2 _Gen_dist_constraint.Intensity_val _Gen_dist_constraint.Intensity_lower_val_err _Gen_dist_constraint.Intensity_upper_val_err _Gen_dist_constraint.Distance_val _Gen_dist_constraint.Distance_lower_bound_val _Gen_dist_constraint.Distance_upper_bound_val _Gen_dist_constraint.Contribution_fractional_val _Gen_dist_constraint.Spectral_peak_ID _Gen_dist_constraint.Spectral_peak_list_ID _Gen_dist_constraint.PDB_record_ID_1 _Gen_dist_constraint.PDB_model_num_1 _Gen_dist_constraint.PDB_strand_ID_1 _Gen_dist_constraint.PDB_ins_code_1 _Gen_dist_constraint.PDB_residue_no_1 _Gen_dist_constraint.PDB_residue_name_1 _Gen_dist_constraint.PDB_atom_name_1 _Gen_dist_constraint.PDB_record_ID_2 _Gen_dist_constraint.PDB_model_num_2 _Gen_dist_constraint.PDB_strand_ID_2 _Gen_dist_constraint.PDB_ins_code_2 _Gen_dist_constraint.PDB_residue_no_2 _Gen_dist_constraint.PDB_residue_name_2 _Gen_dist_constraint.PDB_atom_name_2 _Gen_dist_constraint.Auth_entity_assembly_ID_1 _Gen_dist_constraint.Auth_asym_ID_1 _Gen_dist_constraint.Auth_chain_ID_1 _Gen_dist_constraint.Auth_seq_ID_1 _Gen_dist_constraint.Auth_comp_ID_1 _Gen_dist_constraint.Auth_atom_ID_1 _Gen_dist_constraint.Auth_alt_ID_1 _Gen_dist_constraint.Auth_atom_name_1 _Gen_dist_constraint.Auth_entity_assembly_ID_2 _Gen_dist_constraint.Auth_asym_ID_2 _Gen_dist_constraint.Auth_chain_ID_2 _Gen_dist_constraint.Auth_seq_ID_2 _Gen_dist_constraint.Auth_comp_ID_2 _Gen_dist_constraint.Auth_atom_ID_2 _Gen_dist_constraint.Auth_alt_ID_2 _Gen_dist_constraint.Auth_atom_name_2 _Gen_dist_constraint.Entry_ID _Gen_dist_constraint.Gen_dist_constraint_list_ID 1 1 OR . 1 1 22 22 HIS HB2 H . . . 1 1 22 22 HIS HB3 H . . . . . 1.703 1.341 2.065 . . . . . A . 22 HIS HB2 . . A . 22 HIS HB3 . . . 22 . HB1 . . . . . 22 . HB2 . . c30643_6pv2 1 1 2 OR . 1 1 23 23 LYS HE2 H . . . 1 1 23 23 LYS HE3 H . . . . . 1.703 1.341 2.065 . . . . . A . 23 LYS HE2 . . A . 23 LYS HE3 . . . 23 . HE1 . . . . . 23 . HE2 . . c30643_6pv2 1 2 1 OR . 1 1 15 15 ARG HB3 H . . . 1 1 15 15 ARG HG2 H . . . . . 1.954 1.477 2.431 . . . . . A . 15 ARG HB3 . . A . 15 ARG HG2 . . . 15 . HB2 . . . . . 15 . HG1 . . c30643_6pv2 1 2 2 OR . 1 1 15 15 ARG HB2 H . . . 1 1 15 15 ARG HG2 H . . . . . 1.954 1.477 2.431 . . . . . A . 15 ARG HB2 . . A . 15 ARG HG2 . . . 15 . HB1 . . . . . 15 . HG1 . . c30643_6pv2 1 2 3 OR . 1 1 15 15 ARG HG3 H . . . 1 1 15 15 ARG HB2 H . . . . . 1.954 1.477 2.431 . . . . . A . 15 ARG HG3 . . A . 15 ARG HB2 . . . 15 . HG2 . . . . . 15 . HB1 . . c30643_6pv2 1 2 4 OR . 1 1 15 15 ARG HG3 H . . . 1 1 15 15 ARG HB3 H . . . . . 1.954 1.477 2.431 . . . . . A . 15 ARG HG3 . . A . 15 ARG HB3 . . . 15 . HG2 . . . . . 15 . HB2 . . c30643_6pv2 1 3 1 OR . 1 1 21 21 ARG HB2 H . . . 1 1 22 22 HIS H H . . . . . 2.310 1.643 2.977 . . . . . A . 21 ARG HB2 . . A . 22 HIS H . . . 21 . HB1 . . . . . 22 . HN . . c30643_6pv2 1 3 2 OR . 1 1 21 21 ARG HB2 H . . . 1 1 21 21 ARG H H . . . . . 2.310 1.643 2.977 . . . . . A . 21 ARG HB2 . . A . 21 ARG H . . . 21 . HB1 . . . . . 21 . HN . . c30643_6pv2 1 4 1 OR . 1 1 13 13 PHE HE1 H . . . 1 1 5 5 CYS HB2 H . . . . . 2.397 1.679 3.115 . . . . . A . 13 PHE HE1 . . A . 5 CYS HB2 . . . 13 . HE1 . . . . . 5 . HB1 . . c30643_6pv2 1 4 2 OR . 1 1 13 13 PHE HE2 H . . . 1 1 5 5 CYS HB2 H . . . . . 2.397 1.679 3.115 . . . . . A . 13 PHE HE2 . . A . 5 CYS HB2 . . . 13 . HE2 . . . . . 5 . HB1 . . c30643_6pv2 1 4 3 OR . 1 1 22 22 HIS HB2 H . . . 1 1 13 13 PHE HE2 H . . . . . 2.397 1.679 3.115 . . . . . A . 22 HIS HB2 . . A . 13 PHE HE2 . . . 22 . HB1 . . . . . 13 . HE2 . . c30643_6pv2 1 4 4 OR . 1 1 22 22 HIS HB2 H . . . 1 1 13 13 PHE HE1 H . . . . . 2.397 1.679 3.115 . . . . . A . 22 HIS HB2 . . A . 13 PHE HE1 . . . 22 . HB1 . . . . . 13 . HE1 . . c30643_6pv2 1 5 1 OR . 1 1 24 24 ARG HA H . . . 1 1 24 24 ARG HB2 H . . . . . 2.476 1.710 3.242 . . . . . A . 24 ARG HA . . A . 24 ARG HB2 . . . 24 . HA . . . . . 24 . HB1 . . c30643_6pv2 1 5 2 OR . 1 1 24 24 ARG HB3 H . . . 1 1 24 24 ARG HA H . . . . . 2.476 1.710 3.242 . . . . . A . 24 ARG HB3 . . A . 24 ARG HA . . . 24 . HB2 . . . . . 24 . HA . . c30643_6pv2 1 6 1 OR . 1 1 30 30 LYS H H . . . 1 1 30 30 LYS HA H . . . . . 2.491 1.715 3.267 . . . . . A . 30 LYS H . . A . 30 LYS HA . . . 30 . HN . . . . . 30 . HA . . c30643_6pv2 1 6 2 OR . 1 1 29 29 GLU HA H . . . 1 1 30 30 LYS H H . . . . . 2.491 1.715 3.267 . . . . . A . 29 GLU HA . . A . 30 LYS H . . . 29 . HA . . . . . 30 . HN . . c30643_6pv2 1 7 1 OR . 1 1 21 21 ARG H H . . . 1 1 20 20 GLN HA H . . . . . 2.523 1.727 3.319 . . . . . A . 21 ARG H . . A . 20 GLN HA . . . 21 . HN . . . . . 20 . HA . . c30643_6pv2 1 7 2 OR . 1 1 22 22 HIS H H . . . 1 1 18 18 GLU HA H . . . . . 2.523 1.727 3.319 . . . . . A . 22 HIS H . . A . 18 GLU HA . . . 22 . HN . . . . . 18 . HA . . c30643_6pv2 1 7 3 OR . 1 1 21 21 ARG H H . . . 1 1 18 18 GLU HA H . . . . . 2.523 1.727 3.319 . . . . . A . 21 ARG H . . A . 18 GLU HA . . . 21 . HN . . . . . 18 . HA . . c30643_6pv2 1 8 1 OR . 1 1 11 11 LYS H H . . . 1 1 11 11 LYS HA H . . . . . 2.551 1.737 3.365 . . . . . A . 11 LYS H . . A . 11 LYS HA . . . 11 . HN . . . . . 11 . HA . . c30643_6pv2 1 8 2 OR . 1 1 10 10 GLY HA2 H . . . 1 1 11 11 LYS H H . . . . . 2.551 1.737 3.365 . . . . . A . 10 GLY HA2 . . A . 11 LYS H . . . 10 . HA1 . . . . . 11 . HN . . c30643_6pv2 1 9 1 OR . 1 1 13 13 PHE HE1 H . . . 1 1 11 11 LYS HG3 H . . . . . 2.554 1.739 3.369 . . . . . A . 13 PHE HE1 . . A . 11 LYS HG3 . . . 13 . HE1 . . . . . 11 . HG2 . . c30643_6pv2 1 9 2 OR . 1 1 13 13 PHE HE2 H . . . 1 1 19 19 LEU HB2 H . . . . . 2.554 1.739 3.369 . . . . . A . 13 PHE HE2 . . A . 19 LEU HB2 . . . 13 . HE2 . . . . . 19 . HB1 . . c30643_6pv2 1 9 3 OR . 1 1 13 13 PHE HE2 H . . . 1 1 11 11 LYS HG3 H . . . . . 2.554 1.739 3.369 . . . . . A . 13 PHE HE2 . . A . 11 LYS HG3 . . . 13 . HE2 . . . . . 11 . HG2 . . c30643_6pv2 1 9 4 OR . 1 1 13 13 PHE HE2 H . . . 1 1 11 11 LYS HG2 H . . . . . 2.554 1.739 3.369 . . . . . A . 13 PHE HE2 . . A . 11 LYS HG2 . . . 13 . HE2 . . . . . 11 . HG1 . . c30643_6pv2 1 9 5 OR . 1 1 13 13 PHE HE1 H . . . 1 1 11 11 LYS HG2 H . . . . . 2.554 1.739 3.369 . . . . . A . 13 PHE HE1 . . A . 11 LYS HG2 . . . 13 . HE1 . . . . . 11 . HG1 . . c30643_6pv2 1 9 6 OR . 1 1 13 13 PHE HE1 H . . . 1 1 19 19 LEU HB2 H . . . . . 2.554 1.739 3.369 . . . . . A . 13 PHE HE1 . . A . 19 LEU HB2 . . . 13 . HE1 . . . . . 19 . HB1 . . c30643_6pv2 1 10 1 OR . 1 1 2 2 PRO HB2 H . . . 1 1 13 13 PHE H H . . . . . 2.564 1.742 3.386 . . . . . A . 2 PRO HB2 . . A . 13 PHE H . . . 2 . HB1 . . . . . 13 . HN . . c30643_6pv2 1 10 2 OR . 1 1 23 23 LYS H H . . . 1 1 23 23 LYS HD2 H . . . . . 2.564 1.742 3.386 . . . . . A . 23 LYS H . . A . 23 LYS HD2 . . . 23 . HN . . . . . 23 . HD1 . . c30643_6pv2 1 10 3 OR . 1 1 23 23 LYS HD3 H . . . 1 1 23 23 LYS H H . . . . . 2.564 1.742 3.386 . . . . . A . 23 LYS HD3 . . A . 23 LYS H . . . 23 . HD2 . . . . . 23 . HN . . c30643_6pv2 1 11 1 OR . 1 1 30 30 LYS HA H . . . 1 1 30 30 LYS HB3 H . . . . . 2.588 1.751 3.425 . . . . . A . 30 LYS HA . . A . 30 LYS HB3 . . . 30 . HA . . . . . 30 . HB2 . . c30643_6pv2 1 11 2 OR . 1 1 1 1 ARG HA H . . . 1 1 1 1 ARG HB2 H . . . . . 2.588 1.751 3.425 . . . . . A . 1 ARG HA . . A . 1 ARG HB2 . . . 1 . HA . . . . . 1 . HB1 . . c30643_6pv2 1 11 3 OR . 1 1 1 1 ARG HB3 H . . . 1 1 1 1 ARG HA H . . . . . 2.588 1.751 3.425 . . . . . A . 1 ARG HB3 . . A . 1 ARG HA . . . 1 . HB2 . . . . . 1 . HA . . c30643_6pv2 1 12 1 OR . 1 1 11 11 LYS HA H . . . 1 1 12 12 ARG HG2 H . . . . . 2.628 1.765 3.491 . . . . . A . 11 LYS HA . . A . 12 ARG HG2 . . . 11 . HA . . . . . 12 . HG1 . . c30643_6pv2 1 12 2 OR . 1 1 11 11 LYS HA H . . . 1 1 11 11 LYS HD2 H . . . . . 2.628 1.765 3.491 . . . . . A . 11 LYS HA . . A . 11 LYS HD2 . . . 11 . HA . . . . . 11 . HD1 . . c30643_6pv2 1 12 3 OR . 1 1 11 11 LYS HA H . . . 1 1 11 11 LYS HD3 H . . . . . 2.628 1.765 3.491 . . . . . A . 11 LYS HA . . A . 11 LYS HD3 . . . 11 . HA . . . . . 11 . HD2 . . c30643_6pv2 1 13 1 OR . 1 1 19 19 LEU HB3 H . . . 1 1 3 3 PHE HD1 H . . . . . 2.695 1.787 3.603 . . . . . A . 19 LEU HB3 . . A . 3 PHE HD1 . . . 19 . HB2 . . . . . 3 . HD1 . . c30643_6pv2 1 13 2 OR . 1 1 19 19 LEU HB3 H . . . 1 1 3 3 PHE HD2 H . . . . . 2.695 1.787 3.603 . . . . . A . 19 LEU HB3 . . A . 3 PHE HD2 . . . 19 . HB2 . . . . . 3 . HD2 . . c30643_6pv2 1 13 3 OR . 1 1 19 19 LEU HB3 H . . . 1 1 13 13 PHE HD2 H . . . . . 2.695 1.787 3.603 . . . . . A . 19 LEU HB3 . . A . 13 PHE HD2 . . . 19 . HB2 . . . . . 13 . HD2 . . c30643_6pv2 1 13 4 OR . 1 1 19 19 LEU HB3 H . . . 1 1 13 13 PHE HD1 H . . . . . 2.695 1.787 3.603 . . . . . A . 19 LEU HB3 . . A . 13 PHE HD1 . . . 19 . HB2 . . . . . 13 . HD1 . . c30643_6pv2 1 14 1 OR . 1 1 20 20 GLN H H . . . 1 1 20 20 GLN HG2 H . . . . . 2.723 1.796 3.650 . . . . . A . 20 GLN H . . A . 20 GLN HG2 . . . 20 . HN . . . . . 20 . HG1 . . c30643_6pv2 1 14 2 OR . 1 1 20 20 GLN HG3 H . . . 1 1 20 20 GLN H H . . . . . 2.723 1.796 3.650 . . . . . A . 20 GLN HG3 . . A . 20 GLN H . . . 20 . HG2 . . . . . 20 . HN . . c30643_6pv2 1 15 1 OR . 1 1 17 17 ASP HA H . . . 1 1 17 17 ASP H H . . . . . 2.737 1.801 3.673 . . . . . A . 17 ASP HA . . A . 17 ASP H . . . 17 . HA . . . . . 17 . HN . . c30643_6pv2 1 15 2 OR . 1 1 7 7 TRP HA H . . . 1 1 7 7 TRP H H . . . . . 2.737 1.801 3.673 . . . . . A . 7 TRP HA . . A . 7 TRP H . . . 7 . HA . . . . . 7 . HN . . c30643_6pv2 1 16 1 OR . 1 1 20 20 GLN HA H . . . 1 1 20 20 GLN HG3 H . . . . . 2.819 1.825 3.813 . . . . . A . 20 GLN HA . . A . 20 GLN HG3 . . . 20 . HA . . . . . 20 . HG2 . . c30643_6pv2 1 16 2 OR . 1 1 20 20 GLN HA H . . . 1 1 20 20 GLN HG2 H . . . . . 2.819 1.825 3.813 . . . . . A . 20 GLN HA . . A . 20 GLN HG2 . . . 20 . HA . . . . . 20 . HG1 . . c30643_6pv2 1 17 1 OR . 1 1 24 24 ARG HB2 H . . . 1 1 25 25 THR H H . . . . . 2.858 1.837 3.879 . . . . . A . 24 ARG HB2 . . A . 25 THR H . . . 24 . HB1 . . . . . 25 . HN . . c30643_6pv2 1 17 2 OR . 1 1 21 21 ARG H H . . . 1 1 21 21 ARG HB3 H . . . . . 2.858 1.837 3.879 . . . . . A . 21 ARG H . . A . 21 ARG HB3 . . . 21 . HN . . . . . 21 . HB2 . . c30643_6pv2 1 18 1 OR . 1 1 22 22 HIS H H . . . 1 1 19 19 LEU HA H . . . . . 2.866 1.839 3.893 . . . . . A . 22 HIS H . . A . 19 LEU HA . . . 22 . HN . . . . . 19 . HA . . c30643_6pv2 1 18 2 OR . 1 1 21 21 ARG H H . . . 1 1 19 19 LEU HA H . . . . . 2.866 1.839 3.893 . . . . . A . 21 ARG H . . A . 19 LEU HA . . . 21 . HN . . . . . 19 . HA . . c30643_6pv2 1 19 1 OR . 1 1 4 4 NLE H H . . . 1 1 19 19 LEU MD2 H . . . . . 2.899 1.848 3.950 . . . . . A . 4 NLE H . . A . 19 LEU MD2 . . . 4 . HN . . . . . 19 . HD21 . . c30643_6pv2 1 19 2 OR . 1 1 4 4 NLE H H . . . 1 1 4 4 NLE HG2 H . . . . . 2.899 1.848 3.950 . . . . . A . 4 NLE H . . A . 4 NLE HG2 . . . 4 . HN . . . . . 4 . HG1 . . c30643_6pv2 1 19 3 OR . 1 1 4 4 NLE HG3 H . . . 1 1 4 4 NLE H H . . . . . 2.899 1.848 3.950 . . . . . A . 4 NLE HG3 . . A . 4 NLE H . . . 4 . HG2 . . . . . 4 . HN . . c30643_6pv2 1 20 1 OR . 1 1 26 26 HIS HB2 H . . . 1 1 7 7 TRP HH2 H . . . . . 2.946 1.861 4.031 . . . . . A . 26 HIS HB2 . . A . 7 TRP HH2 . . . 26 . HB1 . . . . . 7 . HH2 . . c30643_6pv2 1 20 2 OR . 1 1 12 12 ARG HE H . . . 1 1 12 12 ARG HB2 H . . . . . 2.946 1.861 4.031 . . . . . A . 12 ARG HE . . A . 12 ARG HB2 . . . 12 . HE . . . . . 12 . HB1 . . c30643_6pv2 1 20 3 OR . 1 1 12 12 ARG HB3 H . . . 1 1 12 12 ARG HE H . . . . . 2.946 1.861 4.031 . . . . . A . 12 ARG HB3 . . A . 12 ARG HE . . . 12 . HB2 . . . . . 12 . HE . . c30643_6pv2 1 21 1 OR . 1 1 22 22 HIS H H . . . 1 1 21 21 ARG HG3 H . . . . . 2.978 1.869 4.087 . . . . . A . 22 HIS H . . A . 21 ARG HG3 . . . 22 . HN . . . . . 21 . HG2 . . c30643_6pv2 1 21 2 OR . 1 1 22 22 HIS H H . . . 1 1 21 21 ARG HG2 H . . . . . 2.978 1.869 4.087 . . . . . A . 22 HIS H . . A . 21 ARG HG2 . . . 22 . HN . . . . . 21 . HG1 . . c30643_6pv2 1 21 3 OR . 1 1 21 21 ARG H H . . . 1 1 21 21 ARG HG2 H . . . . . 2.978 1.869 4.087 . . . . . A . 21 ARG H . . A . 21 ARG HG2 . . . 21 . HN . . . . . 21 . HG1 . . c30643_6pv2 1 21 4 OR . 1 1 21 21 ARG H H . . . 1 1 21 21 ARG HG3 H . . . . . 2.978 1.869 4.087 . . . . . A . 21 ARG H . . A . 21 ARG HG3 . . . 21 . HN . . . . . 21 . HG2 . . c30643_6pv2 1 22 1 OR . 1 1 5 5 CYS HB2 H . . . 1 1 23 23 LYS H H . . . . . 3.023 1.880 4.166 . . . . . A . 5 CYS HB2 . . A . 23 LYS H . . . 5 . HB1 . . . . . 23 . HN . . c30643_6pv2 1 22 2 OR . 1 1 5 5 CYS HB2 H . . . 1 1 7 7 TRP H H . . . . . 3.023 1.880 4.166 . . . . . A . 5 CYS HB2 . . A . 7 TRP H . . . 5 . HB1 . . . . . 7 . HN . . c30643_6pv2 1 22 3 OR . 1 1 22 22 HIS HB2 H . . . 1 1 23 23 LYS H H . . . . . 3.023 1.880 4.166 . . . . . A . 22 HIS HB2 . . A . 23 LYS H . . . 22 . HB1 . . . . . 23 . HN . . c30643_6pv2 1 23 1 OR . 1 1 22 22 HIS H H . . . 1 1 21 21 ARG HA H . . . . . 3.031 1.883 4.179 . . . . . A . 22 HIS H . . A . 21 ARG HA . . . 22 . HN . . . . . 21 . HA . . c30643_6pv2 1 23 2 OR . 1 1 21 21 ARG H H . . . 1 1 21 21 ARG HA H . . . . . 3.031 1.883 4.179 . . . . . A . 21 ARG H . . A . 21 ARG HA . . . 21 . HN . . . . . 21 . HA . . c30643_6pv2 1 23 3 OR . 1 1 21 21 ARG H H . . . 1 1 20 20 GLN HA H . . . . . 3.031 1.883 4.179 . . . . . A . 21 ARG H . . A . 20 GLN HA . . . 21 . HN . . . . . 20 . HA . . c30643_6pv2 1 24 1 OR . 1 1 25 25 THR H H . . . 1 1 23 23 LYS HB2 H . . . . . 3.072 1.892 4.252 . . . . . A . 25 THR H . . A . 23 LYS HB2 . . . 25 . HN . . . . . 23 . HB1 . . c30643_6pv2 1 24 2 OR . 1 1 25 25 THR H H . . . 1 1 23 23 LYS HB3 H . . . . . 3.072 1.892 4.252 . . . . . A . 25 THR H . . A . 23 LYS HB3 . . . 25 . HN . . . . . 23 . HB2 . . c30643_6pv2 1 24 3 OR . 1 1 21 21 ARG H H . . . 1 1 23 23 LYS HB2 H . . . . . 3.072 1.892 4.252 . . . . . A . 21 ARG H . . A . 23 LYS HB2 . . . 21 . HN . . . . . 23 . HB1 . . c30643_6pv2 1 24 4 OR . 1 1 22 22 HIS H H . . . 1 1 23 23 LYS HB2 H . . . . . 3.072 1.892 4.252 . . . . . A . 22 HIS H . . A . 23 LYS HB2 . . . 22 . HN . . . . . 23 . HB1 . . c30643_6pv2 1 24 5 OR . 1 1 21 21 ARG H H . . . 1 1 23 23 LYS HB3 H . . . . . 3.072 1.892 4.252 . . . . . A . 21 ARG H . . A . 23 LYS HB3 . . . 21 . HN . . . . . 23 . HB2 . . c30643_6pv2 1 24 6 OR . 1 1 22 22 HIS H H . . . 1 1 23 23 LYS HB3 H . . . . . 3.072 1.892 4.252 . . . . . A . 22 HIS H . . A . 23 LYS HB3 . . . 22 . HN . . . . . 23 . HB2 . . c30643_6pv2 1 25 1 OR . 1 1 13 13 PHE H H . . . 1 1 19 19 LEU MD1 H . . . . . 3.124 1.904 4.344 . . . . . A . 13 PHE H . . A . 19 LEU MD1 . . . 13 . HN . . . . . 19 . HD11 . . c30643_6pv2 1 25 2 OR . 1 1 23 23 LYS H H . . . 1 1 19 19 LEU MD1 H . . . . . 3.124 1.904 4.344 . . . . . A . 23 LYS H . . A . 19 LEU MD1 . . . 23 . HN . . . . . 19 . HD11 . . c30643_6pv2 1 26 1 OR . 1 1 19 19 LEU H H . . . 1 1 20 20 GLN HB2 H . . . . . 3.137 1.907 4.367 . . . . . A . 19 LEU H . . A . 20 GLN HB2 . . . 19 . HN . . . . . 20 . HB1 . . c30643_6pv2 1 26 2 OR . 1 1 19 19 LEU H H . . . 1 1 20 20 GLN HB3 H . . . . . 3.137 1.907 4.367 . . . . . A . 19 LEU H . . A . 20 GLN HB3 . . . 19 . HN . . . . . 20 . HB2 . . c30643_6pv2 1 26 3 OR . 1 1 18 18 GLU HG2 H . . . 1 1 19 19 LEU H H . . . . . 3.137 1.907 4.367 . . . . . A . 18 GLU HG2 . . A . 19 LEU H . . . 18 . HG1 . . . . . 19 . HN . . c30643_6pv2 1 27 1 OR . 1 1 23 23 LYS HE3 H . . . 1 1 7 7 TRP HE3 H . . . . . 3.139 1.907 4.371 . . . . . A . 23 LYS HE3 . . A . 7 TRP HE3 . . . 23 . HE2 . . . . . 7 . HE3 . . c30643_6pv2 1 27 2 OR . 1 1 3 3 PHE HB2 H . . . 1 1 3 3 PHE HE2 H . . . . . 3.139 1.907 4.371 . . . . . A . 3 PHE HB2 . . A . 3 PHE HE2 . . . 3 . HB1 . . . . . 3 . HE2 . . c30643_6pv2 1 27 3 OR . 1 1 3 3 PHE HB2 H . . . 1 1 3 3 PHE HE1 H . . . . . 3.139 1.907 4.371 . . . . . A . 3 PHE HB2 . . A . 3 PHE HE1 . . . 3 . HB1 . . . . . 3 . HE1 . . c30643_6pv2 1 28 1 OR . 1 1 2 2 PRO HB2 H . . . 1 1 3 3 PHE HD2 H . . . . . 3.281 1.935 4.627 . . . . . A . 2 PRO HB2 . . A . 3 PHE HD2 . . . 2 . HB1 . . . . . 3 . HD2 . . c30643_6pv2 1 28 2 OR . 1 1 2 2 PRO HB2 H . . . 1 1 3 3 PHE HD1 H . . . . . 3.281 1.935 4.627 . . . . . A . 2 PRO HB2 . . A . 3 PHE HD1 . . . 2 . HB1 . . . . . 3 . HD1 . . c30643_6pv2 1 28 3 OR . 1 1 15 15 ARG HG3 H . . . 1 1 3 3 PHE HD1 H . . . . . 3.281 1.935 4.627 . . . . . A . 15 ARG HG3 . . A . 3 PHE HD1 . . . 15 . HG2 . . . . . 3 . HD1 . . c30643_6pv2 1 28 4 OR . 1 1 13 13 PHE HD2 H . . . 1 1 4 4 NLE HB3 H . . . . . 3.281 1.935 4.627 . . . . . A . 13 PHE HD2 . . A . 4 NLE HB3 . . . 13 . HD2 . . . . . 4 . HB2 . . c30643_6pv2 1 28 5 OR . 1 1 13 13 PHE HD1 H . . . 1 1 4 4 NLE HB3 H . . . . . 3.281 1.935 4.627 . . . . . A . 13 PHE HD1 . . A . 4 NLE HB3 . . . 13 . HD1 . . . . . 4 . HB2 . . c30643_6pv2 1 28 6 OR . 1 1 15 15 ARG HG3 H . . . 1 1 3 3 PHE HD2 H . . . . . 3.281 1.935 4.627 . . . . . A . 15 ARG HG3 . . A . 3 PHE HD2 . . . 15 . HG2 . . . . . 3 . HD2 . . c30643_6pv2 1 28 7 OR . 1 1 2 2 PRO HB2 H . . . 1 1 12 12 ARG HE H . . . . . 3.281 1.935 4.627 . . . . . A . 2 PRO HB2 . . A . 12 ARG HE . . . 2 . HB1 . . . . . 12 . HE . . c30643_6pv2 1 28 8 OR . 1 1 12 12 ARG HE H . . . 1 1 4 4 NLE HB3 H . . . . . 3.281 1.935 4.627 . . . . . A . 12 ARG HE . . A . 4 NLE HB3 . . . 12 . HE . . . . . 4 . HB2 . . c30643_6pv2 1 29 1 OR . 1 1 25 25 THR MG H . . . 1 1 24 24 ARG H H . . . . . 3.334 1.945 4.723 . . . . . A . 25 THR MG . . A . 24 ARG H . . . 25 . HG21 . . . . . 24 . HN . . c30643_6pv2 1 29 2 OR . 1 1 27 27 THR MG H . . . 1 1 7 7 TRP HZ3 H . . . . . 3.334 1.945 4.723 . . . . . A . 27 THR MG . . A . 7 TRP HZ3 . . . 27 . HG21 . . . . . 7 . HZ3 . . c30643_6pv2 1 30 1 OR . 1 1 7 7 TRP H H . . . 1 1 7 7 TRP HE3 H . . . . . 3.358 1.948 4.768 . . . . . A . 7 TRP H . . A . 7 TRP HE3 . . . 7 . HN . . . . . 7 . HE3 . . c30643_6pv2 1 30 2 OR . 1 1 17 17 ASP H H . . . 1 1 3 3 PHE HE2 H . . . . . 3.358 1.948 4.768 . . . . . A . 17 ASP H . . A . 3 PHE HE2 . . . 17 . HN . . . . . 3 . HE2 . . c30643_6pv2 1 30 3 OR . 1 1 17 17 ASP H H . . . 1 1 3 3 PHE HE1 H . . . . . 3.358 1.948 4.768 . . . . . A . 17 ASP H . . A . 3 PHE HE1 . . . 17 . HN . . . . . 3 . HE1 . . c30643_6pv2 1 31 1 OR . 1 1 25 25 THR MG H . . . 1 1 26 26 HIS H H . . . . . 3.377 1.951 4.803 . . . . . A . 25 THR MG . . A . 26 HIS H . . . 25 . HG21 . . . . . 26 . HN . . c30643_6pv2 1 31 2 OR . 1 1 27 27 THR MG H . . . 1 1 26 26 HIS H H . . . . . 3.377 1.951 4.803 . . . . . A . 27 THR MG . . A . 26 HIS H . . . 27 . HG21 . . . . . 26 . HN . . c30643_6pv2 1 32 1 OR . 1 1 21 21 ARG H H . . . 1 1 19 19 LEU MD1 H . . . . . 3.397 1.954 4.840 . . . . . A . 21 ARG H . . A . 19 LEU MD1 . . . 21 . HN . . . . . 19 . HD11 . . c30643_6pv2 1 32 2 OR . 1 1 22 22 HIS H H . . . 1 1 19 19 LEU MD1 H . . . . . 3.397 1.954 4.840 . . . . . A . 22 HIS H . . A . 19 LEU MD1 . . . 22 . HN . . . . . 19 . HD11 . . c30643_6pv2 1 33 1 OR . 1 1 7 7 TRP H H . . . 1 1 9 9 CYS HB2 H . . . . . 3.418 1.958 4.878 . . . . . A . 7 TRP H . . A . 9 CYS HB2 . . . 7 . HN . . . . . 9 . HB1 . . c30643_6pv2 1 33 2 OR . 1 1 23 23 LYS H H . . . 1 1 19 19 LEU HA H . . . . . 3.418 1.958 4.878 . . . . . A . 23 LYS H . . A . 19 LEU HA . . . 23 . HN . . . . . 19 . HA . . c30643_6pv2 1 34 1 OR . 1 1 11 11 LYS H H . . . 1 1 9 9 CYS HA H . . . . . 3.462 1.964 4.960 . . . . . A . 11 LYS H . . A . 9 CYS HA . . . 11 . HN . . . . . 9 . HA . . c30643_6pv2 1 34 2 OR . 1 1 9 9 CYS HA H . . . 1 1 26 26 HIS HE1 H . . . . . 3.462 1.964 4.960 . . . . . A . 9 CYS HA . . A . 26 HIS HE1 . . . 9 . HA . . . . . 26 . HE1 . . c30643_6pv2 1 35 1 OR . 1 1 7 7 TRP H H . . . 1 1 26 26 HIS HD2 H . . . . . 3.485 1.966 5.004 . . . . . A . 7 TRP H . . A . 26 HIS HD2 . . . 7 . HN . . . . . 26 . HD2 . . c30643_6pv2 1 35 2 OR . 1 1 23 23 LYS H H . . . 1 1 26 26 HIS HD2 H . . . . . 3.485 1.966 5.004 . . . . . A . 23 LYS H . . A . 26 HIS HD2 . . . 23 . HN . . . . . 26 . HD2 . . c30643_6pv2 1 36 1 OR . 1 1 12 12 ARG HA H . . . 1 1 12 12 ARG HG3 H . . . . . 3.640 1.984 5.296 . . . . . A . 12 ARG HA . . A . 12 ARG HG3 . . . 12 . HA . . . . . 12 . HG2 . . c30643_6pv2 1 36 2 OR . 1 1 4 4 NLE HB3 H . . . 1 1 12 12 ARG HA H . . . . . 3.640 1.984 5.296 . . . . . A . 4 NLE HB3 . . A . 12 ARG HA . . . 4 . HB2 . . . . . 12 . HA . . c30643_6pv2 1 37 1 OR . 1 1 26 26 HIS HE1 H . . . 1 1 22 22 HIS HD2 H . . . . . 3.698 1.989 5.407 . . . . . A . 26 HIS HE1 . . A . 22 HIS HD2 . . . 26 . HE1 . . . . . 22 . HD2 . . c30643_6pv2 1 37 2 OR . 1 1 11 11 LYS H H . . . 1 1 22 22 HIS HD2 H . . . . . 3.698 1.989 5.407 . . . . . A . 11 LYS H . . A . 22 HIS HD2 . . . 11 . HN . . . . . 22 . HD2 . . c30643_6pv2 1 38 1 OR . 1 1 22 22 HIS H H . . . 1 1 21 21 ARG HA H . . . . . 3.708 1.990 5.426 . . . . . A . 22 HIS H . . A . 21 ARG HA . . . 22 . HN . . . . . 21 . HA . . c30643_6pv2 1 38 2 OR . 1 1 21 21 ARG H H . . . 1 1 21 21 ARG HA H . . . . . 3.708 1.990 5.426 . . . . . A . 21 ARG H . . A . 21 ARG HA . . . 21 . HN . . . . . 21 . HA . . c30643_6pv2 1 39 1 OR . 1 1 25 25 THR H H . . . 1 1 22 22 HIS HD2 H . . . . . 3.709 1.990 5.428 . . . . . A . 25 THR H . . A . 22 HIS HD2 . . . 25 . HN . . . . . 22 . HD2 . . c30643_6pv2 1 39 2 OR . 1 1 22 22 HIS H H . . . 1 1 22 22 HIS HD2 H . . . . . 3.709 1.990 5.428 . . . . . A . 22 HIS H . . A . 22 HIS HD2 . . . 22 . HN . . . . . 22 . HD2 . . c30643_6pv2 1 40 1 . . 1 1 17 17 ASP HB2 H . . . 1 1 17 17 ASP HB3 H . . . . . 1.569 1.261 1.877 . . . . . A . 17 ASP HB2 . . A . 17 ASP HB3 . . . 17 . HB1 . . . . . 17 . HB2 . . c30643_6pv2 1 41 1 . . 1 1 21 21 ARG HD2 H . . . 1 1 21 21 ARG HD3 H . . . . . 1.680 1.327 2.033 . . . . . A . 21 ARG HD2 . . A . 21 ARG HD3 . . . 21 . HD1 . . . . . 21 . HD2 . . c30643_6pv2 1 42 1 OR . 1 1 18 18 GLU HG2 H . . . 1 1 18 18 GLU HB2 H . . . . . 1.732 1.357 2.107 . . . . . A . 18 GLU HG2 . . A . 18 GLU HB2 . . . 18 . HG1 . . . . . 18 . HB1 . . c30643_6pv2 1 42 2 OR . 1 1 18 18 GLU HG2 H . . . 1 1 18 18 GLU HB3 H . . . . . 1.732 1.357 2.107 . . . . . A . 18 GLU HG2 . . A . 18 GLU HB3 . . . 18 . HG1 . . . . . 18 . HB2 . . c30643_6pv2 1 43 1 . . 1 1 16 16 SER HB2 H . . . 1 1 16 16 SER HB3 H . . . . . 1.763 1.374 2.152 . . . . . A . 16 SER HB2 . . A . 16 SER HB3 . . . 16 . HB1 . . . . . 16 . HB2 . . c30643_6pv2 1 44 1 . . 1 1 5 5 CYS HB2 H . . . 1 1 5 5 CYS HB3 H . . . . . 1.821 1.407 2.235 . . . . . A . 5 CYS HB2 . . A . 5 CYS HB3 . . . 5 . HB1 . . . . . 5 . HB2 . . c30643_6pv2 1 45 1 . . 1 1 8 8 ORN HD2 H . . . 1 1 8 8 ORN HD3 H . . . . . 1.839 1.416 2.262 . . . . . A . 8 ORN HD2 . . A . 8 ORN HD3 . . . 8 . HD1 . . . . . 8 . HD2 . . c30643_6pv2 1 46 1 . . 1 1 2 2 PRO HD2 H . . . 1 1 2 2 PRO HD3 H . . . . . 1.855 1.425 2.285 . . . . . A . 2 PRO HD2 . . A . 2 PRO HD3 . . . 2 . HD1 . . . . . 2 . HD2 . . c30643_6pv2 1 47 1 . . 1 1 13 13 PHE HB2 H . . . 1 1 13 13 PHE HB3 H . . . . . 1.865 1.430 2.300 . . . . . A . 13 PHE HB2 . . A . 13 PHE HB3 . . . 13 . HB1 . . . . . 13 . HB2 . . c30643_6pv2 1 48 1 OR . 1 1 13 13 PHE HE2 H . . . 1 1 13 13 PHE HD1 H . . . . . 1.930 1.464 2.396 . . . . . A . 13 PHE HE2 . . A . 13 PHE HD1 . . . 13 . HE2 . . . . . 13 . HD1 . . c30643_6pv2 1 48 2 OR . 1 1 13 13 PHE HE2 H . . . 1 1 13 13 PHE HD2 H . . . . . 1.930 1.464 2.396 . . . . . A . 13 PHE HE2 . . A . 13 PHE HD2 . . . 13 . HE2 . . . . . 13 . HD2 . . c30643_6pv2 1 48 3 OR . 1 1 13 13 PHE HE1 H . . . 1 1 13 13 PHE HD2 H . . . . . 1.930 1.464 2.396 . . . . . A . 13 PHE HE1 . . A . 13 PHE HD2 . . . 13 . HE1 . . . . . 13 . HD2 . . c30643_6pv2 1 48 4 OR . 1 1 13 13 PHE HE1 H . . . 1 1 13 13 PHE HD1 H . . . . . 1.930 1.464 2.396 . . . . . A . 13 PHE HE1 . . A . 13 PHE HD1 . . . 13 . HE1 . . . . . 13 . HD1 . . c30643_6pv2 1 49 1 . . 1 1 26 26 HIS HB2 H . . . 1 1 26 26 HIS HB3 H . . . . . 1.946 1.472 2.420 . . . . . A . 26 HIS HB2 . . A . 26 HIS HB3 . . . 26 . HB1 . . . . . 26 . HB2 . . c30643_6pv2 1 50 1 . . 1 1 19 19 LEU HB2 H . . . 1 1 19 19 LEU HB3 H . . . . . 1.962 1.481 2.443 . . . . . A . 19 LEU HB2 . . A . 19 LEU HB3 . . . 19 . HB1 . . . . . 19 . HB2 . . c30643_6pv2 1 51 1 OR . 1 1 13 13 PHE HE2 H . . . 1 1 13 13 PHE HZ H . . . . . 2.013 1.506 2.520 . . . . . A . 13 PHE HE2 . . A . 13 PHE HZ . . . 13 . HE2 . . . . . 13 . HZ . . c30643_6pv2 1 51 2 OR . 1 1 13 13 PHE HE1 H . . . 1 1 13 13 PHE HZ H . . . . . 2.013 1.506 2.520 . . . . . A . 13 PHE HE1 . . A . 13 PHE HZ . . . 13 . HE1 . . . . . 13 . HZ . . c30643_6pv2 1 52 1 . . 1 1 11 11 LYS HA H . . . 1 1 12 12 ARG H H . . . . . 2.044 1.522 2.566 . . . . . A . 11 LYS HA . . A . 12 ARG H . . . 11 . HA . . . . . 12 . HN . . c30643_6pv2 1 53 1 OR . 1 1 20 20 GLN HA H . . . 1 1 20 20 GLN HB2 H . . . . . 2.048 1.524 2.572 . . . . . A . 20 GLN HA . . A . 20 GLN HB2 . . . 20 . HA . . . . . 20 . HB1 . . c30643_6pv2 1 53 2 OR . 1 1 20 20 GLN HA H . . . 1 1 20 20 GLN HB3 H . . . . . 2.048 1.524 2.572 . . . . . A . 20 GLN HA . . A . 20 GLN HB3 . . . 20 . HA . . . . . 20 . HB2 . . c30643_6pv2 1 54 1 . . 1 1 6 6 THR HB H . . . 1 1 6 6 THR MG H . . . . . 2.088 1.543 2.633 . . . . . A . 6 THR HB . . A . 6 THR MG . . . 6 . HB . . . . . 6 . HG21 . . c30643_6pv2 1 55 1 . . 1 1 2 2 PRO HB2 H . . . 1 1 2 2 PRO HB3 H . . . . . 2.091 1.545 2.637 . . . . . A . 2 PRO HB2 . . A . 2 PRO HB3 . . . 2 . HB1 . . . . . 2 . HB2 . . c30643_6pv2 1 56 1 OR . 1 1 29 29 GLU HB3 H . . . 1 1 29 29 GLU HG2 H . . . . . 2.104 1.551 2.657 . . . . . A . 29 GLU HB3 . . A . 29 GLU HG2 . . . 29 . HB2 . . . . . 29 . HG1 . . c30643_6pv2 1 56 2 OR . 1 1 29 29 GLU HB3 H . . . 1 1 29 29 GLU HG3 H . . . . . 2.104 1.551 2.657 . . . . . A . 29 GLU HB3 . . A . 29 GLU HG3 . . . 29 . HB2 . . . . . 29 . HG2 . . c30643_6pv2 1 57 1 . . 1 1 19 19 LEU MD1 H . . . 1 1 19 19 LEU HG H . . . . . 2.116 1.557 2.675 . . . . . A . 19 LEU MD1 . . A . 19 LEU HG . . . 19 . HD11 . . . . . 19 . HG . . c30643_6pv2 1 58 1 . . 1 1 13 13 PHE H H . . . 1 1 12 12 ARG HA H . . . . . 2.137 1.566 2.708 . . . . . A . 13 PHE H . . A . 12 ARG HA . . . 13 . HN . . . . . 12 . HA . . c30643_6pv2 1 59 1 . . 1 1 4 4 NLE H H . . . 1 1 3 3 PHE HA H . . . . . 2.146 1.570 2.722 . . . . . A . 4 NLE H . . A . 3 PHE HA . . . 4 . HN . . . . . 3 . HA . . c30643_6pv2 1 60 1 . . 1 1 19 19 LEU MD2 H . . . 1 1 19 19 LEU HG H . . . . . 2.151 1.573 2.729 . . . . . A . 19 LEU MD2 . . A . 19 LEU HG . . . 19 . HD21 . . . . . 19 . HG . . c30643_6pv2 1 61 1 . . 1 1 4 4 NLE HA H . . . 1 1 5 5 CYS H H . . . . . 2.153 1.573 2.733 . . . . . A . 4 NLE HA . . A . 5 CYS H . . . 4 . HA . . . . . 5 . HN . . c30643_6pv2 1 62 1 OR . 1 1 13 13 PHE HD2 H . . . 1 1 13 13 PHE HB2 H . . . . . 2.169 1.581 2.757 . . . . . A . 13 PHE HD2 . . A . 13 PHE HB2 . . . 13 . HD2 . . . . . 13 . HB1 . . c30643_6pv2 1 62 2 OR . 1 1 13 13 PHE HD1 H . . . 1 1 13 13 PHE HB2 H . . . . . 2.169 1.581 2.757 . . . . . A . 13 PHE HD1 . . A . 13 PHE HB2 . . . 13 . HD1 . . . . . 13 . HB1 . . c30643_6pv2 1 63 1 . . 1 1 25 25 THR MG H . . . 1 1 25 25 THR HB H . . . . . 2.178 1.585 2.771 . . . . . A . 25 THR MG . . A . 25 THR HB . . . 25 . HG21 . . . . . 25 . HB . . c30643_6pv2 1 64 1 OR . 1 1 3 3 PHE HD2 H . . . 1 1 3 3 PHE HB2 H . . . . . 2.221 1.604 2.838 . . . . . A . 3 PHE HD2 . . A . 3 PHE HB2 . . . 3 . HD2 . . . . . 3 . HB1 . . c30643_6pv2 1 64 2 OR . 1 1 3 3 PHE HD1 H . . . 1 1 3 3 PHE HB2 H . . . . . 2.221 1.604 2.838 . . . . . A . 3 PHE HD1 . . A . 3 PHE HB2 . . . 3 . HD1 . . . . . 3 . HB1 . . c30643_6pv2 1 65 1 . . 1 1 26 26 HIS HD2 H . . . 1 1 23 23 LYS HA H . . . . . 2.223 1.605 2.841 . . . . . A . 26 HIS HD2 . . A . 23 LYS HA . . . 26 . HD2 . . . . . 23 . HA . . c30643_6pv2 1 66 1 . . 1 1 5 5 CYS HB2 H . . . 1 1 22 22 HIS HD2 H . . . . . 2.226 1.606 2.846 . . . . . A . 5 CYS HB2 . . A . 22 HIS HD2 . . . 5 . HB1 . . . . . 22 . HD2 . . c30643_6pv2 1 67 1 . . 1 1 22 22 HIS HB3 H . . . 1 1 22 22 HIS H H . . . . . 2.235 1.610 2.860 . . . . . A . 22 HIS HB3 . . A . 22 HIS H . . . 22 . HB2 . . . . . 22 . HN . . c30643_6pv2 1 68 1 OR . 1 1 11 11 LYS HA H . . . 1 1 11 11 LYS HG2 H . . . . . 2.241 1.613 2.869 . . . . . A . 11 LYS HA . . A . 11 LYS HG2 . . . 11 . HA . . . . . 11 . HG1 . . c30643_6pv2 1 68 2 OR . 1 1 11 11 LYS HA H . . . 1 1 11 11 LYS HG3 H . . . . . 2.241 1.613 2.869 . . . . . A . 11 LYS HA . . A . 11 LYS HG3 . . . 11 . HA . . . . . 11 . HG2 . . c30643_6pv2 1 69 1 . . 1 1 21 21 ARG HB2 H . . . 1 1 21 21 ARG HA H . . . . . 2.250 1.617 2.883 . . . . . A . 21 ARG HB2 . . A . 21 ARG HA . . . 21 . HB1 . . . . . 21 . HA . . c30643_6pv2 1 70 1 . . 1 1 24 24 ARG HB2 H . . . 1 1 24 24 ARG H H . . . . . 2.254 1.619 2.889 . . . . . A . 24 ARG HB2 . . A . 24 ARG H . . . 24 . HB1 . . . . . 24 . HN . . c30643_6pv2 1 71 1 OR . 1 1 24 24 ARG HB2 H . . . 1 1 24 24 ARG HD2 H . . . . . 2.263 1.623 2.903 . . . . . A . 24 ARG HB2 . . A . 24 ARG HD2 . . . 24 . HB1 . . . . . 24 . HD1 . . c30643_6pv2 1 71 2 OR . 1 1 24 24 ARG HB2 H . . . 1 1 24 24 ARG HD3 H . . . . . 2.263 1.623 2.903 . . . . . A . 24 ARG HB2 . . A . 24 ARG HD3 . . . 24 . HB1 . . . . . 24 . HD2 . . c30643_6pv2 1 72 1 . . 1 1 18 18 GLU HG2 H . . . 1 1 18 18 GLU HG3 H . . . . . 2.263 1.623 2.903 . . . . . A . 18 GLU HG2 . . A . 18 GLU HG3 . . . 18 . HG1 . . . . . 18 . HG2 . . c30643_6pv2 1 73 1 OR . 1 1 13 13 PHE HD2 H . . . 1 1 13 13 PHE HB3 H . . . . . 2.265 1.623 2.907 . . . . . A . 13 PHE HD2 . . A . 13 PHE HB3 . . . 13 . HD2 . . . . . 13 . HB2 . . c30643_6pv2 1 73 2 OR . 1 1 13 13 PHE HD1 H . . . 1 1 13 13 PHE HB3 H . . . . . 2.265 1.623 2.907 . . . . . A . 13 PHE HD1 . . A . 13 PHE HB3 . . . 13 . HD1 . . . . . 13 . HB2 . . c30643_6pv2 1 74 1 OR . 1 1 3 3 PHE HD2 H . . . 1 1 3 3 PHE HB3 H . . . . . 2.280 1.630 2.930 . . . . . A . 3 PHE HD2 . . A . 3 PHE HB3 . . . 3 . HD2 . . . . . 3 . HB2 . . c30643_6pv2 1 74 2 OR . 1 1 3 3 PHE HD1 H . . . 1 1 3 3 PHE HB3 H . . . . . 2.280 1.630 2.930 . . . . . A . 3 PHE HD1 . . A . 3 PHE HB3 . . . 3 . HD1 . . . . . 3 . HB2 . . c30643_6pv2 1 75 1 OR . 1 1 23 23 LYS HB2 H . . . 1 1 23 23 LYS HA H . . . . . 2.282 1.631 2.933 . . . . . A . 23 LYS HB2 . . A . 23 LYS HA . . . 23 . HB1 . . . . . 23 . HA . . c30643_6pv2 1 75 2 OR . 1 1 23 23 LYS HB3 H . . . 1 1 23 23 LYS HA H . . . . . 2.282 1.631 2.933 . . . . . A . 23 LYS HB3 . . A . 23 LYS HA . . . 23 . HB2 . . . . . 23 . HA . . c30643_6pv2 1 76 1 OR . 1 1 8 8 ORN HA H . . . 1 1 8 8 ORN HB2 H . . . . . 2.282 1.631 2.933 . . . . . A . 8 ORN HA . . A . 8 ORN HB2 . . . 8 . HA . . . . . 8 . HB1 . . c30643_6pv2 1 76 2 OR . 1 1 8 8 ORN HB3 H . . . 1 1 8 8 ORN HA H . . . . . 2.282 1.631 2.933 . . . . . A . 8 ORN HB3 . . A . 8 ORN HA . . . 8 . HB2 . . . . . 8 . HA . . c30643_6pv2 1 77 1 . . 1 1 2 2 PRO HA H . . . 1 1 3 3 PHE H H . . . . . 2.282 1.631 2.933 . . . . . A . 2 PRO HA . . A . 3 PHE H . . . 2 . HA . . . . . 3 . HN . . c30643_6pv2 1 78 1 . . 1 1 8 8 ORN HD3 H . . . 1 1 8 8 ORN HA H . . . . . 2.292 1.635 2.949 . . . . . A . 8 ORN HD3 . . A . 8 ORN HA . . . 8 . HD2 . . . . . 8 . HA . . c30643_6pv2 1 79 1 . . 1 1 6 6 THR MG H . . . 1 1 6 6 THR HA H . . . . . 2.294 1.636 2.952 . . . . . A . 6 THR MG . . A . 6 THR HA . . . 6 . HG21 . . . . . 6 . HA . . c30643_6pv2 1 80 1 . . 1 1 7 7 TRP HD1 H . . . 1 1 7 7 TRP HE1 H . . . . . 2.297 1.638 2.956 . . . . . A . 7 TRP HD1 . . A . 7 TRP HE1 . . . 7 . HD1 . . . . . 7 . HE1 . . c30643_6pv2 1 81 1 . . 1 1 19 19 LEU HB3 H . . . 1 1 19 19 LEU H H . . . . . 2.303 1.640 2.966 . . . . . A . 19 LEU HB3 . . A . 19 LEU H . . . 19 . HB2 . . . . . 19 . HN . . c30643_6pv2 1 82 1 OR . 1 1 8 8 ORN HD2 H . . . 1 1 8 8 ORN HB2 H . . . . . 2.305 1.641 2.969 . . . . . A . 8 ORN HD2 . . A . 8 ORN HB2 . . . 8 . HD1 . . . . . 8 . HB1 . . c30643_6pv2 1 82 2 OR . 1 1 8 8 ORN HD2 H . . . 1 1 8 8 ORN HB3 H . . . . . 2.305 1.641 2.969 . . . . . A . 8 ORN HD2 . . A . 8 ORN HB3 . . . 8 . HD1 . . . . . 8 . HB2 . . c30643_6pv2 1 83 1 OR . 1 1 18 18 GLU HB2 H . . . 1 1 18 18 GLU H H . . . . . 2.308 1.642 2.974 . . . . . A . 18 GLU HB2 . . A . 18 GLU H . . . 18 . HB1 . . . . . 18 . HN . . c30643_6pv2 1 83 2 OR . 1 1 18 18 GLU HB3 H . . . 1 1 18 18 GLU H H . . . . . 2.308 1.642 2.974 . . . . . A . 18 GLU HB3 . . A . 18 GLU H . . . 18 . HB2 . . . . . 18 . HN . . c30643_6pv2 1 84 1 . . 1 1 19 19 LEU HA H . . . 1 1 19 19 LEU MD1 H . . . . . 2.310 1.643 2.977 . . . . . A . 19 LEU HA . . A . 19 LEU MD1 . . . 19 . HA . . . . . 19 . HD11 . . c30643_6pv2 1 85 1 . . 1 1 25 25 THR MG H . . . 1 1 25 25 THR HA H . . . . . 2.310 1.643 2.977 . . . . . A . 25 THR MG . . A . 25 THR HA . . . 25 . HG21 . . . . . 25 . HA . . c30643_6pv2 1 86 1 . . 1 1 19 19 LEU HB2 H . . . 1 1 19 19 LEU HA H . . . . . 2.312 1.644 2.980 . . . . . A . 19 LEU HB2 . . A . 19 LEU HA . . . 19 . HB1 . . . . . 19 . HA . . c30643_6pv2 1 87 1 . . 1 1 22 22 HIS HB3 H . . . 1 1 19 19 LEU HA H . . . . . 2.314 1.644 2.984 . . . . . A . 22 HIS HB3 . . A . 19 LEU HA . . . 22 . HB2 . . . . . 19 . HA . . c30643_6pv2 1 88 1 . . 1 1 21 21 ARG HB3 H . . . 1 1 21 21 ARG HA H . . . . . 2.319 1.647 2.991 . . . . . A . 21 ARG HB3 . . A . 21 ARG HA . . . 21 . HB2 . . . . . 21 . HA . . c30643_6pv2 1 89 1 . . 1 1 10 10 GLY HA3 H . . . 1 1 10 10 GLY H H . . . . . 2.324 1.649 2.999 . . . . . A . 10 GLY HA3 . . A . 10 GLY H . . . 10 . HA2 . . . . . 10 . HN . . c30643_6pv2 1 90 1 OR . 1 1 20 20 GLN HG2 H . . . 1 1 20 20 GLN HB2 H . . . . . 2.326 1.650 3.002 . . . . . A . 20 GLN HG2 . . A . 20 GLN HB2 . . . 20 . HG1 . . . . . 20 . HB1 . . c30643_6pv2 1 90 2 OR . 1 1 20 20 GLN HG2 H . . . 1 1 20 20 GLN HB3 H . . . . . 2.326 1.650 3.002 . . . . . A . 20 GLN HG2 . . A . 20 GLN HB3 . . . 20 . HG1 . . . . . 20 . HB2 . . c30643_6pv2 1 91 1 OR . 1 1 12 12 ARG HG3 H . . . 1 1 12 12 ARG HD2 H . . . . . 2.331 1.652 3.010 . . . . . A . 12 ARG HG3 . . A . 12 ARG HD2 . . . 12 . HG2 . . . . . 12 . HD1 . . c30643_6pv2 1 91 2 OR . 1 1 12 12 ARG HG3 H . . . 1 1 12 12 ARG HD3 H . . . . . 2.331 1.652 3.010 . . . . . A . 12 ARG HG3 . . A . 12 ARG HD3 . . . 12 . HG2 . . . . . 12 . HD2 . . c30643_6pv2 1 92 1 . . 1 1 3 3 PHE HB2 H . . . 1 1 13 13 PHE HB2 H . . . . . 2.333 1.652 3.014 . . . . . A . 3 PHE HB2 . . A . 13 PHE HB2 . . . 3 . HB1 . . . . . 13 . HB1 . . c30643_6pv2 1 93 1 . . 1 1 7 7 TRP H H . . . 1 1 7 7 TRP HB2 H . . . . . 2.338 1.655 3.021 . . . . . A . 7 TRP H . . A . 7 TRP HB2 . . . 7 . HN . . . . . 7 . HB1 . . c30643_6pv2 1 94 1 OR . 1 1 20 20 GLN H H . . . 1 1 20 20 GLN HB2 H . . . . . 2.341 1.656 3.026 . . . . . A . 20 GLN H . . A . 20 GLN HB2 . . . 20 . HN . . . . . 20 . HB1 . . c30643_6pv2 1 94 2 OR . 1 1 20 20 GLN H H . . . 1 1 20 20 GLN HB3 H . . . . . 2.341 1.656 3.026 . . . . . A . 20 GLN H . . A . 20 GLN HB3 . . . 20 . HN . . . . . 20 . HB2 . . c30643_6pv2 1 95 1 OR . 1 1 23 23 LYS H H . . . 1 1 23 23 LYS HB2 H . . . . . 2.343 1.657 3.029 . . . . . A . 23 LYS H . . A . 23 LYS HB2 . . . 23 . HN . . . . . 23 . HB1 . . c30643_6pv2 1 95 2 OR . 1 1 23 23 LYS H H . . . 1 1 23 23 LYS HB3 H . . . . . 2.343 1.657 3.029 . . . . . A . 23 LYS H . . A . 23 LYS HB3 . . . 23 . HN . . . . . 23 . HB2 . . c30643_6pv2 1 96 1 . . 1 1 19 19 LEU H H . . . 1 1 18 18 GLU H H . . . . . 2.359 1.664 3.054 . . . . . A . 19 LEU H . . A . 18 GLU H . . . 19 . HN . . . . . 18 . HN . . c30643_6pv2 1 97 1 . . 1 1 17 17 ASP HA H . . . 1 1 17 17 ASP HB3 H . . . . . 2.369 1.667 3.071 . . . . . A . 17 ASP HA . . A . 17 ASP HB3 . . . 17 . HA . . . . . 17 . HB2 . . c30643_6pv2 1 98 1 OR . 1 1 13 13 PHE HD2 H . . . 1 1 13 13 PHE HA H . . . . . 2.369 1.667 3.071 . . . . . A . 13 PHE HD2 . . A . 13 PHE HA . . . 13 . HD2 . . . . . 13 . HA . . c30643_6pv2 1 98 2 OR . 1 1 13 13 PHE HD1 H . . . 1 1 13 13 PHE HA H . . . . . 2.369 1.667 3.071 . . . . . A . 13 PHE HD1 . . A . 13 PHE HA . . . 13 . HD1 . . . . . 13 . HA . . c30643_6pv2 1 99 1 . . 1 1 21 21 ARG HB2 H . . . 1 1 21 21 ARG HD2 H . . . . . 2.369 1.667 3.071 . . . . . A . 21 ARG HB2 . . A . 21 ARG HD2 . . . 21 . HB1 . . . . . 21 . HD1 . . c30643_6pv2 1 100 1 . . 1 1 7 7 TRP H H . . . 1 1 7 7 TRP HB3 H . . . . . 2.375 1.670 3.080 . . . . . A . 7 TRP H . . A . 7 TRP HB3 . . . 7 . HN . . . . . 7 . HB2 . . c30643_6pv2 1 101 1 . . 1 1 17 17 ASP HA H . . . 1 1 17 17 ASP HB2 H . . . . . 2.377 1.670 3.084 . . . . . A . 17 ASP HA . . A . 17 ASP HB2 . . . 17 . HA . . . . . 17 . HB1 . . c30643_6pv2 1 102 1 OR . 1 1 18 18 GLU HA H . . . 1 1 18 18 GLU HB2 H . . . . . 2.380 1.672 3.088 . . . . . A . 18 GLU HA . . A . 18 GLU HB2 . . . 18 . HA . . . . . 18 . HB1 . . c30643_6pv2 1 102 2 OR . 1 1 18 18 GLU HA H . . . 1 1 18 18 GLU HB3 H . . . . . 2.380 1.672 3.088 . . . . . A . 18 GLU HA . . A . 18 GLU HB3 . . . 18 . HA . . . . . 18 . HB2 . . c30643_6pv2 1 103 1 . . 1 1 14 14 THR HB H . . . 1 1 14 14 THR MG H . . . . . 2.380 1.672 3.088 . . . . . A . 14 THR HB . . A . 14 THR MG . . . 14 . HB . . . . . 14 . HG21 . . c30643_6pv2 1 104 1 OR . 1 1 21 21 ARG HG2 H . . . 1 1 21 21 ARG HD3 H . . . . . 2.389 1.676 3.102 . . . . . A . 21 ARG HG2 . . A . 21 ARG HD3 . . . 21 . HG1 . . . . . 21 . HD2 . . c30643_6pv2 1 104 2 OR . 1 1 21 21 ARG HG3 H . . . 1 1 21 21 ARG HD3 H . . . . . 2.389 1.676 3.102 . . . . . A . 21 ARG HG3 . . A . 21 ARG HD3 . . . 21 . HG2 . . . . . 21 . HD2 . . c30643_6pv2 1 105 1 OR . 1 1 13 13 PHE HD1 H . . . 1 1 19 19 LEU MD1 H . . . . . 2.403 1.681 3.125 . . . . . A . 13 PHE HD1 . . A . 19 LEU MD1 . . . 13 . HD1 . . . . . 19 . HD11 . . c30643_6pv2 1 105 2 OR . 1 1 13 13 PHE HD2 H . . . 1 1 19 19 LEU MD1 H . . . . . 2.403 1.681 3.125 . . . . . A . 13 PHE HD2 . . A . 19 LEU MD1 . . . 13 . HD2 . . . . . 19 . HD11 . . c30643_6pv2 1 106 1 . . 1 1 13 13 PHE HB3 H . . . 1 1 13 13 PHE HA H . . . . . 2.409 1.683 3.135 . . . . . A . 13 PHE HB3 . . A . 13 PHE HA . . . 13 . HB2 . . . . . 13 . HA . . c30643_6pv2 1 107 1 . . 1 1 24 24 ARG HA H . . . 1 1 24 24 ARG HG3 H . . . . . 2.415 1.686 3.144 . . . . . A . 24 ARG HA . . A . 24 ARG HG3 . . . 24 . HA . . . . . 24 . HG2 . . c30643_6pv2 1 108 1 . . 1 1 22 22 HIS HB2 H . . . 1 1 22 22 HIS H H . . . . . 2.419 1.688 3.150 . . . . . A . 22 HIS HB2 . . A . 22 HIS H . . . 22 . HB1 . . . . . 22 . HN . . c30643_6pv2 1 109 1 . . 1 1 26 26 HIS H H . . . 1 1 26 26 HIS HB3 H . . . . . 2.419 1.688 3.150 . . . . . A . 26 HIS H . . A . 26 HIS HB3 . . . 26 . HN . . . . . 26 . HB2 . . c30643_6pv2 1 110 1 . . 1 1 25 25 THR H H . . . 1 1 25 25 THR MG H . . . . . 2.425 1.690 3.160 . . . . . A . 25 THR H . . A . 25 THR MG . . . 25 . HN . . . . . 25 . HG21 . . c30643_6pv2 1 111 1 . . 1 1 2 2 PRO HB3 H . . . 1 1 2 2 PRO HA H . . . . . 2.428 1.691 3.165 . . . . . A . 2 PRO HB3 . . A . 2 PRO HA . . . 2 . HB2 . . . . . 2 . HA . . c30643_6pv2 1 112 1 . . 1 1 5 5 CYS HB2 H . . . 1 1 5 5 CYS HA H . . . . . 2.441 1.696 3.186 . . . . . A . 5 CYS HB2 . . A . 5 CYS HA . . . 5 . HB1 . . . . . 5 . HA . . c30643_6pv2 1 113 1 OR . 1 1 8 8 ORN HD3 H . . . 1 1 8 8 ORN HB2 H . . . . . 2.445 1.698 3.192 . . . . . A . 8 ORN HD3 . . A . 8 ORN HB2 . . . 8 . HD2 . . . . . 8 . HB1 . . c30643_6pv2 1 113 2 OR . 1 1 8 8 ORN HD3 H . . . 1 1 8 8 ORN HB3 H . . . . . 2.445 1.698 3.192 . . . . . A . 8 ORN HD3 . . A . 8 ORN HB3 . . . 8 . HD2 . . . . . 8 . HB2 . . c30643_6pv2 1 114 1 OR . 1 1 11 11 LYS H H . . . 1 1 11 11 LYS HB2 H . . . . . 2.445 1.698 3.192 . . . . . A . 11 LYS H . . A . 11 LYS HB2 . . . 11 . HN . . . . . 11 . HB1 . . c30643_6pv2 1 114 2 OR . 1 1 11 11 LYS H H . . . 1 1 11 11 LYS HB3 H . . . . . 2.445 1.698 3.192 . . . . . A . 11 LYS H . . A . 11 LYS HB3 . . . 11 . HN . . . . . 11 . HB2 . . c30643_6pv2 1 115 1 . . 1 1 19 19 LEU HB3 H . . . 1 1 19 19 LEU MD2 H . . . . . 2.451 1.700 3.202 . . . . . A . 19 LEU HB3 . . A . 19 LEU MD2 . . . 19 . HB2 . . . . . 19 . HD21 . . c30643_6pv2 1 116 1 . . 1 1 5 5 CYS HB2 H . . . 1 1 19 19 LEU MD1 H . . . . . 2.451 1.700 3.202 . . . . . A . 5 CYS HB2 . . A . 19 LEU MD1 . . . 5 . HB1 . . . . . 19 . HD11 . . c30643_6pv2 1 117 1 OR . 1 1 23 23 LYS HB2 H . . . 1 1 24 24 ARG H H . . . . . 2.455 1.702 3.208 . . . . . A . 23 LYS HB2 . . A . 24 ARG H . . . 23 . HB1 . . . . . 24 . HN . . c30643_6pv2 1 117 2 OR . 1 1 23 23 LYS HB3 H . . . 1 1 24 24 ARG H H . . . . . 2.455 1.702 3.208 . . . . . A . 23 LYS HB3 . . A . 24 ARG H . . . 23 . HB2 . . . . . 24 . HN . . c30643_6pv2 1 118 1 OR . 1 1 17 17 ASP HA H . . . 1 1 20 20 GLN HB2 H . . . . . 2.455 1.702 3.208 . . . . . A . 17 ASP HA . . A . 20 GLN HB2 . . . 17 . HA . . . . . 20 . HB1 . . c30643_6pv2 1 118 2 OR . 1 1 17 17 ASP HA H . . . 1 1 20 20 GLN HB3 H . . . . . 2.455 1.702 3.208 . . . . . A . 17 ASP HA . . A . 20 GLN HB3 . . . 17 . HA . . . . . 20 . HB2 . . c30643_6pv2 1 119 1 . . 1 1 27 27 THR MG H . . . 1 1 27 27 THR HB H . . . . . 2.455 1.702 3.208 . . . . . A . 27 THR MG . . A . 27 THR HB . . . 27 . HG21 . . . . . 27 . HB . . c30643_6pv2 1 120 1 . . 1 1 19 19 LEU HB2 H . . . 1 1 19 19 LEU H H . . . . . 2.458 1.703 3.213 . . . . . A . 19 LEU HB2 . . A . 19 LEU H . . . 19 . HB1 . . . . . 19 . HN . . c30643_6pv2 1 121 1 . . 1 1 19 19 LEU MD1 H . . . 1 1 22 22 HIS HD2 H . . . . . 2.462 1.704 3.220 . . . . . A . 19 LEU MD1 . . A . 22 HIS HD2 . . . 19 . HD11 . . . . . 22 . HD2 . . c30643_6pv2 1 122 1 . . 1 1 12 12 ARG HA H . . . 1 1 12 12 ARG HG3 H . . . . . 2.465 1.705 3.225 . . . . . A . 12 ARG HA . . A . 12 ARG HG3 . . . 12 . HA . . . . . 12 . HG2 . . c30643_6pv2 1 123 1 OR . 1 1 3 3 PHE HD2 H . . . 1 1 3 3 PHE HA H . . . . . 2.473 1.709 3.237 . . . . . A . 3 PHE HD2 . . A . 3 PHE HA . . . 3 . HD2 . . . . . 3 . HA . . c30643_6pv2 1 123 2 OR . 1 1 3 3 PHE HD1 H . . . 1 1 3 3 PHE HA H . . . . . 2.473 1.709 3.237 . . . . . A . 3 PHE HD1 . . A . 3 PHE HA . . . 3 . HD1 . . . . . 3 . HA . . c30643_6pv2 1 124 1 . . 1 1 1 1 ARG HA H . . . 1 1 2 2 PRO HD3 H . . . . . 2.473 1.709 3.237 . . . . . A . 1 ARG HA . . A . 2 PRO HD3 . . . 1 . HA . . . . . 2 . HD2 . . c30643_6pv2 1 125 1 . . 1 1 5 5 CYS HB3 H . . . 1 1 5 5 CYS H H . . . . . 2.476 1.710 3.242 . . . . . A . 5 CYS HB3 . . A . 5 CYS H . . . 5 . HB2 . . . . . 5 . HN . . c30643_6pv2 1 126 1 . . 1 1 15 15 ARG HA H . . . 1 1 16 16 SER H H . . . . . 2.480 1.711 3.249 . . . . . A . 15 ARG HA . . A . 16 SER H . . . 15 . HA . . . . . 16 . HN . . c30643_6pv2 1 127 1 . . 1 1 9 9 CYS HB2 H . . . 1 1 9 9 CYS HA H . . . . . 2.487 1.714 3.260 . . . . . A . 9 CYS HB2 . . A . 9 CYS HA . . . 9 . HB1 . . . . . 9 . HA . . c30643_6pv2 1 128 1 . . 1 1 19 19 LEU MD1 H . . . 1 1 5 5 CYS HA H . . . . . 2.487 1.714 3.260 . . . . . A . 19 LEU MD1 . . A . 5 CYS HA . . . 19 . HD11 . . . . . 5 . HA . . c30643_6pv2 1 129 1 . . 1 1 25 25 THR H H . . . 1 1 26 26 HIS H H . . . . . 2.495 1.717 3.273 . . . . . A . 25 THR H . . A . 26 HIS H . . . 25 . HN . . . . . 26 . HN . . c30643_6pv2 1 130 1 . . 1 1 9 9 CYS HB2 H . . . 1 1 26 26 HIS HE1 H . . . . . 2.495 1.717 3.273 . . . . . A . 9 CYS HB2 . . A . 26 HIS HE1 . . . 9 . HB1 . . . . . 26 . HE1 . . c30643_6pv2 1 131 1 OR . 1 1 12 12 ARG HB2 H . . . 1 1 12 12 ARG HD2 H . . . . . 2.499 1.718 3.280 . . . . . A . 12 ARG HB2 . . A . 12 ARG HD2 . . . 12 . HB1 . . . . . 12 . HD1 . . c30643_6pv2 1 131 2 OR . 1 1 12 12 ARG HB2 H . . . 1 1 12 12 ARG HD3 H . . . . . 2.499 1.718 3.280 . . . . . A . 12 ARG HB2 . . A . 12 ARG HD3 . . . 12 . HB1 . . . . . 12 . HD2 . . c30643_6pv2 1 131 3 OR . 1 1 12 12 ARG HB3 H . . . 1 1 12 12 ARG HD2 H . . . . . 2.499 1.718 3.280 . . . . . A . 12 ARG HB3 . . A . 12 ARG HD2 . . . 12 . HB2 . . . . . 12 . HD1 . . c30643_6pv2 1 131 4 OR . 1 1 12 12 ARG HB3 H . . . 1 1 12 12 ARG HD3 H . . . . . 2.499 1.718 3.280 . . . . . A . 12 ARG HB3 . . A . 12 ARG HD3 . . . 12 . HB2 . . . . . 12 . HD2 . . c30643_6pv2 1 132 1 . . 1 1 22 22 HIS HB3 H . . . 1 1 22 22 HIS HD2 H . . . . . 2.503 1.720 3.286 . . . . . A . 22 HIS HB3 . . A . 22 HIS HD2 . . . 22 . HB2 . . . . . 22 . HD2 . . c30643_6pv2 1 133 1 . . 1 1 15 15 ARG HG3 H . . . 1 1 15 15 ARG HD3 H . . . . . 2.507 1.721 3.293 . . . . . A . 15 ARG HG3 . . A . 15 ARG HD3 . . . 15 . HG2 . . . . . 15 . HD2 . . c30643_6pv2 1 134 1 . . 1 1 10 10 GLY HA2 H . . . 1 1 10 10 GLY H H . . . . . 2.507 1.721 3.293 . . . . . A . 10 GLY HA2 . . A . 10 GLY H . . . 10 . HA1 . . . . . 10 . HN . . c30643_6pv2 1 135 1 OR . 1 1 13 13 PHE H H . . . 1 1 13 13 PHE HD2 H . . . . . 2.511 1.723 3.299 . . . . . A . 13 PHE H . . A . 13 PHE HD2 . . . 13 . HN . . . . . 13 . HD2 . . c30643_6pv2 1 135 2 OR . 1 1 13 13 PHE H H . . . 1 1 13 13 PHE HD1 H . . . . . 2.511 1.723 3.299 . . . . . A . 13 PHE H . . A . 13 PHE HD1 . . . 13 . HN . . . . . 13 . HD1 . . c30643_6pv2 1 136 1 . . 1 1 13 13 PHE HA H . . . 1 1 14 14 THR H H . . . . . 2.511 1.723 3.299 . . . . . A . 13 PHE HA . . A . 14 THR H . . . 13 . HA . . . . . 14 . HN . . c30643_6pv2 1 137 1 . . 1 1 22 22 HIS H H . . . 1 1 22 22 HIS HA H . . . . . 2.519 1.726 3.312 . . . . . A . 22 HIS H . . A . 22 HIS HA . . . 22 . HN . . . . . 22 . HA . . c30643_6pv2 1 138 1 . . 1 1 21 21 ARG HB2 H . . . 1 1 21 21 ARG HD3 H . . . . . 2.519 1.726 3.312 . . . . . A . 21 ARG HB2 . . A . 21 ARG HD3 . . . 21 . HB1 . . . . . 21 . HD2 . . c30643_6pv2 1 139 1 . . 1 1 26 26 HIS HD2 H . . . 1 1 26 26 HIS HB3 H . . . . . 2.519 1.726 3.312 . . . . . A . 26 HIS HD2 . . A . 26 HIS HB3 . . . 26 . HD2 . . . . . 26 . HB2 . . c30643_6pv2 1 140 1 OR . 1 1 12 12 ARG HG2 H . . . 1 1 12 12 ARG HD2 H . . . . . 2.525 1.728 3.322 . . . . . A . 12 ARG HG2 . . A . 12 ARG HD2 . . . 12 . HG1 . . . . . 12 . HD1 . . c30643_6pv2 1 140 2 OR . 1 1 12 12 ARG HG2 H . . . 1 1 12 12 ARG HD3 H . . . . . 2.525 1.728 3.322 . . . . . A . 12 ARG HG2 . . A . 12 ARG HD3 . . . 12 . HG1 . . . . . 12 . HD2 . . c30643_6pv2 1 141 1 . . 1 1 19 19 LEU MD2 H . . . 1 1 3 3 PHE HB3 H . . . . . 2.527 1.729 3.325 . . . . . A . 19 LEU MD2 . . A . 3 PHE HB3 . . . 19 . HD21 . . . . . 3 . HB2 . . c30643_6pv2 1 142 1 OR . 1 1 12 12 ARG HB2 H . . . 1 1 12 12 ARG H H . . . . . 2.532 1.731 3.333 . . . . . A . 12 ARG HB2 . . A . 12 ARG H . . . 12 . HB1 . . . . . 12 . HN . . c30643_6pv2 1 142 2 OR . 1 1 12 12 ARG HB3 H . . . 1 1 12 12 ARG H H . . . . . 2.532 1.731 3.333 . . . . . A . 12 ARG HB3 . . A . 12 ARG H . . . 12 . HB2 . . . . . 12 . HN . . c30643_6pv2 1 143 1 . . 1 1 2 2 PRO HB3 H . . . 1 1 2 2 PRO HG3 H . . . . . 2.534 1.731 3.337 . . . . . A . 2 PRO HB3 . . A . 2 PRO HG3 . . . 2 . HB2 . . . . . 2 . HG2 . . c30643_6pv2 1 144 1 . . 1 1 3 3 PHE HA H . . . 1 1 3 3 PHE HB3 H . . . . . 2.541 1.734 3.348 . . . . . A . 3 PHE HA . . A . 3 PHE HB3 . . . 3 . HA . . . . . 3 . HB2 . . c30643_6pv2 1 145 1 . . 1 1 22 22 HIS HB2 H . . . 1 1 22 22 HIS HA H . . . . . 2.545 1.736 3.354 . . . . . A . 22 HIS HB2 . . A . 22 HIS HA . . . 22 . HB1 . . . . . 22 . HA . . c30643_6pv2 1 146 1 OR . 1 1 24 24 ARG HD2 H . . . 1 1 24 24 ARG HG2 H . . . . . 2.545 1.736 3.354 . . . . . A . 24 ARG HD2 . . A . 24 ARG HG2 . . . 24 . HD1 . . . . . 24 . HG1 . . c30643_6pv2 1 146 2 OR . 1 1 24 24 ARG HD3 H . . . 1 1 24 24 ARG HG2 H . . . . . 2.545 1.736 3.354 . . . . . A . 24 ARG HD3 . . A . 24 ARG HG2 . . . 24 . HD2 . . . . . 24 . HG1 . . c30643_6pv2 1 147 1 . . 1 1 15 15 ARG HG3 H . . . 1 1 15 15 ARG HA H . . . . . 2.547 1.736 3.358 . . . . . A . 15 ARG HG3 . . A . 15 ARG HA . . . 15 . HG2 . . . . . 15 . HA . . c30643_6pv2 1 148 1 OR . 1 1 13 13 PHE HE2 H . . . 1 1 19 19 LEU MD1 H . . . . . 2.547 1.736 3.358 . . . . . A . 13 PHE HE2 . . A . 19 LEU MD1 . . . 13 . HE2 . . . . . 19 . HD11 . . c30643_6pv2 1 148 2 OR . 1 1 13 13 PHE HE1 H . . . 1 1 19 19 LEU MD1 H . . . . . 2.547 1.736 3.358 . . . . . A . 13 PHE HE1 . . A . 19 LEU MD1 . . . 13 . HE1 . . . . . 19 . HD11 . . c30643_6pv2 1 149 1 . . 1 1 4 4 NLE HA H . . . 1 1 4 4 NLE HB2 H . . . . . 2.547 1.736 3.358 . . . . . A . 4 NLE HA . . A . 4 NLE HB2 . . . 4 . HA . . . . . 4 . HB1 . . c30643_6pv2 1 150 1 . . 1 1 16 16 SER HB3 H . . . 1 1 16 16 SER HA H . . . . . 2.550 1.737 3.363 . . . . . A . 16 SER HB3 . . A . 16 SER HA . . . 16 . HB2 . . . . . 16 . HA . . c30643_6pv2 1 151 1 . . 1 1 28 28 GLY HA2 H . . . 1 1 28 28 GLY H H . . . . . 2.553 1.738 3.368 . . . . . A . 28 GLY HA2 . . A . 28 GLY H . . . 28 . HA1 . . . . . 28 . HN . . c30643_6pv2 1 152 1 . . 1 1 24 24 ARG HA H . . . 1 1 24 24 ARG H H . . . . . 2.556 1.740 3.372 . . . . . A . 24 ARG HA . . A . 24 ARG H . . . 24 . HA . . . . . 24 . HN . . c30643_6pv2 1 153 1 OR . 1 1 3 3 PHE HD1 H . . . 1 1 19 19 LEU MD2 H . . . . . 2.556 1.739 3.373 . . . . . A . 3 PHE HD1 . . A . 19 LEU MD2 . . . 3 . HD1 . . . . . 19 . HD21 . . c30643_6pv2 1 153 2 OR . 1 1 3 3 PHE HD2 H . . . 1 1 19 19 LEU MD2 H . . . . . 2.556 1.739 3.373 . . . . . A . 3 PHE HD2 . . A . 19 LEU MD2 . . . 3 . HD2 . . . . . 19 . HD21 . . c30643_6pv2 1 154 1 . . 1 1 9 9 CYS HA H . . . 1 1 9 9 CYS HB3 H . . . . . 2.558 1.740 3.376 . . . . . A . 9 CYS HA . . A . 9 CYS HB3 . . . 9 . HA . . . . . 9 . HB2 . . c30643_6pv2 1 155 1 OR . 1 1 11 11 LYS HA H . . . 1 1 11 11 LYS HB2 H . . . . . 2.560 1.741 3.379 . . . . . A . 11 LYS HA . . A . 11 LYS HB2 . . . 11 . HA . . . . . 11 . HB1 . . c30643_6pv2 1 155 2 OR . 1 1 11 11 LYS HA H . . . 1 1 11 11 LYS HB3 H . . . . . 2.560 1.741 3.379 . . . . . A . 11 LYS HA . . A . 11 LYS HB3 . . . 11 . HA . . . . . 11 . HB2 . . c30643_6pv2 1 156 1 . . 1 1 5 5 CYS HB2 H . . . 1 1 5 5 CYS H H . . . . . 2.562 1.742 3.382 . . . . . A . 5 CYS HB2 . . A . 5 CYS H . . . 5 . HB1 . . . . . 5 . HN . . c30643_6pv2 1 157 1 . . 1 1 14 14 THR MG H . . . 1 1 14 14 THR HA H . . . . . 2.562 1.741 3.383 . . . . . A . 14 THR MG . . A . 14 THR HA . . . 14 . HG21 . . . . . 14 . HA . . c30643_6pv2 1 158 1 OR . 1 1 13 13 PHE HD2 H . . . 1 1 18 18 GLU HB2 H . . . . . 2.564 1.742 3.386 . . . . . A . 13 PHE HD2 . . A . 18 GLU HB2 . . . 13 . HD2 . . . . . 18 . HB1 . . c30643_6pv2 1 158 2 OR . 1 1 13 13 PHE HD1 H . . . 1 1 18 18 GLU HB2 H . . . . . 2.564 1.742 3.386 . . . . . A . 13 PHE HD1 . . A . 18 GLU HB2 . . . 13 . HD1 . . . . . 18 . HB1 . . c30643_6pv2 1 158 3 OR . 1 1 13 13 PHE HD2 H . . . 1 1 18 18 GLU HB3 H . . . . . 2.564 1.742 3.386 . . . . . A . 13 PHE HD2 . . A . 18 GLU HB3 . . . 13 . HD2 . . . . . 18 . HB2 . . c30643_6pv2 1 158 4 OR . 1 1 13 13 PHE HD1 H . . . 1 1 18 18 GLU HB3 H . . . . . 2.564 1.742 3.386 . . . . . A . 13 PHE HD1 . . A . 18 GLU HB3 . . . 13 . HD1 . . . . . 18 . HB2 . . c30643_6pv2 1 159 1 OR . 1 1 21 21 ARG H H . . . 1 1 20 20 GLN HB2 H . . . . . 2.566 1.743 3.389 . . . . . A . 21 ARG H . . A . 20 GLN HB2 . . . 21 . HN . . . . . 20 . HB1 . . c30643_6pv2 1 159 2 OR . 1 1 21 21 ARG H H . . . 1 1 20 20 GLN HB3 H . . . . . 2.566 1.743 3.389 . . . . . A . 21 ARG H . . A . 20 GLN HB3 . . . 21 . HN . . . . . 20 . HB2 . . c30643_6pv2 1 160 1 OR . 1 1 13 13 PHE HE2 H . . . 1 1 22 22 HIS HD2 H . . . . . 2.568 1.744 3.392 . . . . . A . 13 PHE HE2 . . A . 22 HIS HD2 . . . 13 . HE2 . . . . . 22 . HD2 . . c30643_6pv2 1 160 2 OR . 1 1 13 13 PHE HE1 H . . . 1 1 22 22 HIS HD2 H . . . . . 2.568 1.744 3.392 . . . . . A . 13 PHE HE1 . . A . 22 HIS HD2 . . . 13 . HE1 . . . . . 22 . HD2 . . c30643_6pv2 1 161 1 OR . 1 1 8 8 ORN HD2 H . . . 1 1 8 8 ORN HG2 H . . . . . 2.569 1.744 3.394 . . . . . A . 8 ORN HD2 . . A . 8 ORN HG2 . . . 8 . HD1 . . . . . 8 . HG1 . . c30643_6pv2 1 161 2 OR . 1 1 8 8 ORN HD2 H . . . 1 1 8 8 ORN HG3 H . . . . . 2.569 1.744 3.394 . . . . . A . 8 ORN HD2 . . A . 8 ORN HG3 . . . 8 . HD1 . . . . . 8 . HG2 . . c30643_6pv2 1 162 1 . . 1 1 27 27 THR MG H . . . 1 1 27 27 THR HA H . . . . . 2.574 1.746 3.402 . . . . . A . 27 THR MG . . A . 27 THR HA . . . 27 . HG21 . . . . . 27 . HA . . c30643_6pv2 1 163 1 . . 1 1 13 13 PHE H H . . . 1 1 3 3 PHE H H . . . . . 2.576 1.747 3.405 . . . . . A . 13 PHE H . . A . 3 PHE H . . . 13 . HN . . . . . 3 . HN . . c30643_6pv2 1 164 1 . . 1 1 13 13 PHE HB3 H . . . 1 1 15 15 ARG H H . . . . . 2.577 1.747 3.407 . . . . . A . 13 PHE HB3 . . A . 15 ARG H . . . 13 . HB2 . . . . . 15 . HN . . c30643_6pv2 1 165 1 OR . 1 1 21 21 ARG HG2 H . . . 1 1 21 21 ARG HA H . . . . . 2.579 1.748 3.410 . . . . . A . 21 ARG HG2 . . A . 21 ARG HA . . . 21 . HG1 . . . . . 21 . HA . . c30643_6pv2 1 165 2 OR . 1 1 21 21 ARG HG3 H . . . 1 1 21 21 ARG HA H . . . . . 2.579 1.748 3.410 . . . . . A . 21 ARG HG3 . . A . 21 ARG HA . . . 21 . HG2 . . . . . 21 . HA . . c30643_6pv2 1 166 1 OR . 1 1 20 20 GLN HA H . . . 1 1 23 23 LYS HB2 H . . . . . 2.579 1.747 3.411 . . . . . A . 20 GLN HA . . A . 23 LYS HB2 . . . 20 . HA . . . . . 23 . HB1 . . c30643_6pv2 1 166 2 OR . 1 1 20 20 GLN HA H . . . 1 1 23 23 LYS HB3 H . . . . . 2.579 1.747 3.411 . . . . . A . 20 GLN HA . . A . 23 LYS HB3 . . . 20 . HA . . . . . 23 . HB2 . . c30643_6pv2 1 167 1 . . 1 1 20 20 GLN HA H . . . 1 1 20 20 GLN H H . . . . . 2.582 1.749 3.415 . . . . . A . 20 GLN HA . . A . 20 GLN H . . . 20 . HA . . . . . 20 . HN . . c30643_6pv2 1 168 1 . . 1 1 5 5 CYS HA H . . . 1 1 6 6 THR H H . . . . . 2.586 1.750 3.422 . . . . . A . 5 CYS HA . . A . 6 THR H . . . 5 . HA . . . . . 6 . HN . . c30643_6pv2 1 169 1 . . 1 1 22 22 HIS H H . . . 1 1 23 23 LYS H H . . . . . 2.591 1.752 3.430 . . . . . A . 22 HIS H . . A . 23 LYS H . . . 22 . HN . . . . . 23 . HN . . c30643_6pv2 1 170 1 . . 1 1 20 20 GLN H H . . . 1 1 19 19 LEU H H . . . . . 2.591 1.752 3.430 . . . . . A . 20 GLN H . . A . 19 LEU H . . . 20 . HN . . . . . 19 . HN . . c30643_6pv2 1 171 1 OR . 1 1 18 18 GLU HB2 H . . . 1 1 13 13 PHE HB3 H . . . . . 2.592 1.752 3.432 . . . . . A . 18 GLU HB2 . . A . 13 PHE HB3 . . . 18 . HB1 . . . . . 13 . HB2 . . c30643_6pv2 1 171 2 OR . 1 1 18 18 GLU HB3 H . . . 1 1 13 13 PHE HB3 H . . . . . 2.592 1.752 3.432 . . . . . A . 18 GLU HB3 . . A . 13 PHE HB3 . . . 18 . HB2 . . . . . 13 . HB2 . . c30643_6pv2 1 172 1 . . 1 1 7 7 TRP HA H . . . 1 1 7 7 TRP HB2 H . . . . . 2.594 1.753 3.435 . . . . . A . 7 TRP HA . . A . 7 TRP HB2 . . . 7 . HA . . . . . 7 . HB1 . . c30643_6pv2 1 173 1 . . 1 1 7 7 TRP HA H . . . 1 1 7 7 TRP HB3 H . . . . . 2.594 1.753 3.435 . . . . . A . 7 TRP HA . . A . 7 TRP HB3 . . . 7 . HA . . . . . 7 . HB2 . . c30643_6pv2 1 174 1 . . 1 1 25 25 THR H H . . . 1 1 25 25 THR HA H . . . . . 2.595 1.753 3.437 . . . . . A . 25 THR H . . A . 25 THR HA . . . 25 . HN . . . . . 25 . HA . . c30643_6pv2 1 175 1 . . 1 1 7 7 TRP HE3 H . . . 1 1 7 7 TRP HB3 H . . . . . 2.598 1.754 3.442 . . . . . A . 7 TRP HE3 . . A . 7 TRP HB3 . . . 7 . HE3 . . . . . 7 . HB2 . . c30643_6pv2 1 176 1 . . 1 1 9 9 CYS HA H . . . 1 1 10 10 GLY H H . . . . . 2.602 1.756 3.448 . . . . . A . 9 CYS HA . . A . 10 GLY H . . . 9 . HA . . . . . 10 . HN . . c30643_6pv2 1 177 1 . . 1 1 19 19 LEU HB3 H . . . 1 1 20 20 GLN H H . . . . . 2.610 1.758 3.462 . . . . . A . 19 LEU HB3 . . A . 20 GLN H . . . 19 . HB2 . . . . . 20 . HN . . c30643_6pv2 1 178 1 . . 1 1 22 22 HIS HB3 H . . . 1 1 23 23 LYS H H . . . . . 2.611 1.759 3.463 . . . . . A . 22 HIS HB3 . . A . 23 LYS H . . . 22 . HB2 . . . . . 23 . HN . . c30643_6pv2 1 179 1 . . 1 1 19 19 LEU HB3 H . . . 1 1 19 19 LEU HA H . . . . . 2.617 1.761 3.473 . . . . . A . 19 LEU HB3 . . A . 19 LEU HA . . . 19 . HB2 . . . . . 19 . HA . . c30643_6pv2 1 180 1 . . 1 1 19 19 LEU HA H . . . 1 1 19 19 LEU H H . . . . . 2.621 1.762 3.480 . . . . . A . 19 LEU HA . . A . 19 LEU H . . . 19 . HA . . . . . 19 . HN . . c30643_6pv2 1 181 1 . . 1 1 18 18 GLU HA H . . . 1 1 18 18 GLU H H . . . . . 2.621 1.762 3.480 . . . . . A . 18 GLU HA . . A . 18 GLU H . . . 18 . HA . . . . . 18 . HN . . c30643_6pv2 1 182 1 . . 1 1 23 23 LYS H H . . . 1 1 23 23 LYS HA H . . . . . 2.622 1.762 3.482 . . . . . A . 23 LYS H . . A . 23 LYS HA . . . 23 . HN . . . . . 23 . HA . . c30643_6pv2 1 183 1 . . 1 1 19 19 LEU HB3 H . . . 1 1 19 19 LEU MD1 H . . . . . 2.625 1.764 3.486 . . . . . A . 19 LEU HB3 . . A . 19 LEU MD1 . . . 19 . HB2 . . . . . 19 . HD11 . . c30643_6pv2 1 184 1 . . 1 1 19 19 LEU HB2 H . . . 1 1 3 3 PHE HB3 H . . . . . 2.629 1.765 3.493 . . . . . A . 19 LEU HB2 . . A . 3 PHE HB3 . . . 19 . HB1 . . . . . 3 . HB2 . . c30643_6pv2 1 185 1 OR . 1 1 11 11 LYS H H . . . 1 1 11 11 LYS HG2 H . . . . . 2.630 1.766 3.494 . . . . . A . 11 LYS H . . A . 11 LYS HG2 . . . 11 . HN . . . . . 11 . HG1 . . c30643_6pv2 1 185 2 OR . 1 1 11 11 LYS H H . . . 1 1 11 11 LYS HG3 H . . . . . 2.630 1.766 3.494 . . . . . A . 11 LYS H . . A . 11 LYS HG3 . . . 11 . HN . . . . . 11 . HG2 . . c30643_6pv2 1 186 1 . . 1 1 13 13 PHE H H . . . 1 1 13 13 PHE HB2 H . . . . . 2.631 1.766 3.496 . . . . . A . 13 PHE H . . A . 13 PHE HB2 . . . 13 . HN . . . . . 13 . HB1 . . c30643_6pv2 1 187 1 . . 1 1 13 13 PHE HB2 H . . . 1 1 13 13 PHE HA H . . . . . 2.636 1.767 3.505 . . . . . A . 13 PHE HB2 . . A . 13 PHE HA . . . 13 . HB1 . . . . . 13 . HA . . c30643_6pv2 1 188 1 . . 1 1 5 5 CYS HB3 H . . . 1 1 5 5 CYS HA H . . . . . 2.638 1.768 3.508 . . . . . A . 5 CYS HB3 . . A . 5 CYS HA . . . 5 . HB2 . . . . . 5 . HA . . c30643_6pv2 1 189 1 OR . 1 1 8 8 ORN HD3 H . . . 1 1 8 8 ORN HG2 H . . . . . 2.639 1.768 3.510 . . . . . A . 8 ORN HD3 . . A . 8 ORN HG2 . . . 8 . HD2 . . . . . 8 . HG1 . . c30643_6pv2 1 189 2 OR . 1 1 8 8 ORN HD3 H . . . 1 1 8 8 ORN HG3 H . . . . . 2.639 1.768 3.510 . . . . . A . 8 ORN HD3 . . A . 8 ORN HG3 . . . 8 . HD2 . . . . . 8 . HG2 . . c30643_6pv2 1 190 1 OR . 1 1 19 19 LEU HB2 H . . . 1 1 13 13 PHE HD2 H . . . . . 2.642 1.770 3.514 . . . . . A . 19 LEU HB2 . . A . 13 PHE HD2 . . . 19 . HB1 . . . . . 13 . HD2 . . c30643_6pv2 1 190 2 OR . 1 1 19 19 LEU HB2 H . . . 1 1 13 13 PHE HD1 H . . . . . 2.642 1.770 3.514 . . . . . A . 19 LEU HB2 . . A . 13 PHE HD1 . . . 19 . HB1 . . . . . 13 . HD1 . . c30643_6pv2 1 191 1 . . 1 1 26 26 HIS HB2 H . . . 1 1 26 26 HIS HA H . . . . . 2.643 1.770 3.516 . . . . . A . 26 HIS HB2 . . A . 26 HIS HA . . . 26 . HB1 . . . . . 26 . HA . . c30643_6pv2 1 192 1 . . 1 1 3 3 PHE HB2 H . . . 1 1 3 3 PHE H H . . . . . 2.644 1.770 3.518 . . . . . A . 3 PHE HB2 . . A . 3 PHE H . . . 3 . HB1 . . . . . 3 . HN . . c30643_6pv2 1 193 1 OR . 1 1 12 12 ARG HB2 H . . . 1 1 12 12 ARG HA H . . . . . 2.647 1.771 3.523 . . . . . A . 12 ARG HB2 . . A . 12 ARG HA . . . 12 . HB1 . . . . . 12 . HA . . c30643_6pv2 1 193 2 OR . 1 1 12 12 ARG HB3 H . . . 1 1 12 12 ARG HA H . . . . . 2.647 1.771 3.523 . . . . . A . 12 ARG HB3 . . A . 12 ARG HA . . . 12 . HB2 . . . . . 12 . HA . . c30643_6pv2 1 194 1 . . 1 1 22 22 HIS HB3 H . . . 1 1 19 19 LEU MD1 H . . . . . 2.651 1.773 3.529 . . . . . A . 22 HIS HB3 . . A . 19 LEU MD1 . . . 22 . HB2 . . . . . 19 . HD11 . . c30643_6pv2 1 195 1 . . 1 1 22 22 HIS HB2 H . . . 1 1 13 13 PHE HZ H . . . . . 2.652 1.773 3.531 . . . . . A . 22 HIS HB2 . . A . 13 PHE HZ . . . 22 . HB1 . . . . . 13 . HZ . . c30643_6pv2 1 196 1 OR . 1 1 19 19 LEU H H . . . 1 1 18 18 GLU HB2 H . . . . . 2.652 1.773 3.531 . . . . . A . 19 LEU H . . A . 18 GLU HB2 . . . 19 . HN . . . . . 18 . HB1 . . c30643_6pv2 1 196 2 OR . 1 1 19 19 LEU H H . . . 1 1 18 18 GLU HB3 H . . . . . 2.652 1.773 3.531 . . . . . A . 19 LEU H . . A . 18 GLU HB3 . . . 19 . HN . . . . . 18 . HB2 . . c30643_6pv2 1 197 1 . . 1 1 25 25 THR H H . . . 1 1 24 24 ARG H H . . . . . 2.653 1.773 3.533 . . . . . A . 25 THR H . . A . 24 ARG H . . . 25 . HN . . . . . 24 . HN . . c30643_6pv2 1 198 1 OR . 1 1 3 3 PHE HE2 H . . . 1 1 15 15 ARG HA H . . . . . 2.653 1.773 3.533 . . . . . A . 3 PHE HE2 . . A . 15 ARG HA . . . 3 . HE2 . . . . . 15 . HA . . c30643_6pv2 1 198 2 OR . 1 1 3 3 PHE HE1 H . . . 1 1 15 15 ARG HA H . . . . . 2.653 1.773 3.533 . . . . . A . 3 PHE HE1 . . A . 15 ARG HA . . . 3 . HE1 . . . . . 15 . HA . . c30643_6pv2 1 199 1 . . 1 1 21 21 ARG H H . . . 1 1 21 21 ARG HA H . . . . . 2.653 1.773 3.533 . . . . . A . 21 ARG H . . A . 21 ARG HA . . . 21 . HN . . . . . 21 . HA . . c30643_6pv2 1 200 1 OR . 1 1 15 15 ARG HB2 H . . . 1 1 15 15 ARG HA H . . . . . 2.654 1.774 3.534 . . . . . A . 15 ARG HB2 . . A . 15 ARG HA . . . 15 . HB1 . . . . . 15 . HA . . c30643_6pv2 1 200 2 OR . 1 1 15 15 ARG HB3 H . . . 1 1 15 15 ARG HA H . . . . . 2.654 1.774 3.534 . . . . . A . 15 ARG HB3 . . A . 15 ARG HA . . . 15 . HB2 . . . . . 15 . HA . . c30643_6pv2 1 201 1 . . 1 1 2 2 PRO HD2 H . . . 1 1 2 2 PRO HG2 H . . . . . 2.658 1.775 3.541 . . . . . A . 2 PRO HD2 . . A . 2 PRO HG2 . . . 2 . HD1 . . . . . 2 . HG1 . . c30643_6pv2 1 202 1 . . 1 1 21 21 ARG H H . . . 1 1 20 20 GLN H H . . . . . 2.659 1.775 3.543 . . . . . A . 21 ARG H . . A . 20 GLN H . . . 21 . HN . . . . . 20 . HN . . c30643_6pv2 1 203 1 . . 1 1 2 2 PRO HB2 H . . . 1 1 3 3 PHE H H . . . . . 2.663 1.777 3.549 . . . . . A . 2 PRO HB2 . . A . 3 PHE H . . . 2 . HB1 . . . . . 3 . HN . . c30643_6pv2 1 204 1 . . 1 1 7 7 TRP H H . . . 1 1 6 6 THR HA H . . . . . 2.664 1.777 3.551 . . . . . A . 7 TRP H . . A . 6 THR HA . . . 7 . HN . . . . . 6 . HA . . c30643_6pv2 1 205 1 OR . 1 1 24 24 ARG HD2 H . . . 1 1 24 24 ARG HG3 H . . . . . 2.672 1.780 3.564 . . . . . A . 24 ARG HD2 . . A . 24 ARG HG3 . . . 24 . HD1 . . . . . 24 . HG2 . . c30643_6pv2 1 205 2 OR . 1 1 24 24 ARG HD3 H . . . 1 1 24 24 ARG HG3 H . . . . . 2.672 1.780 3.564 . . . . . A . 24 ARG HD3 . . A . 24 ARG HG3 . . . 24 . HD2 . . . . . 24 . HG2 . . c30643_6pv2 1 206 1 . . 1 1 23 23 LYS H H . . . 1 1 24 24 ARG H H . . . . . 2.672 1.779 3.565 . . . . . A . 23 LYS H . . A . 24 ARG H . . . 23 . HN . . . . . 24 . HN . . c30643_6pv2 1 207 1 . . 1 1 18 18 GLU HG3 H . . . 1 1 18 18 GLU H H . . . . . 2.674 1.781 3.567 . . . . . A . 18 GLU HG3 . . A . 18 GLU H . . . 18 . HG2 . . . . . 18 . HN . . c30643_6pv2 1 208 1 . . 1 1 28 28 GLY H H . . . 1 1 27 27 THR HA H . . . . . 2.674 1.780 3.568 . . . . . A . 28 GLY H . . A . 27 THR HA . . . 28 . HN . . . . . 27 . HA . . c30643_6pv2 1 209 1 . . 1 1 12 12 ARG HG3 H . . . 1 1 12 12 ARG H H . . . . . 2.677 1.781 3.573 . . . . . A . 12 ARG HG3 . . A . 12 ARG H . . . 12 . HG2 . . . . . 12 . HN . . c30643_6pv2 1 210 1 OR . 1 1 8 8 ORN HA H . . . 1 1 8 8 ORN HG2 H . . . . . 2.677 1.781 3.573 . . . . . A . 8 ORN HA . . A . 8 ORN HG2 . . . 8 . HA . . . . . 8 . HG1 . . c30643_6pv2 1 210 2 OR . 1 1 8 8 ORN HA H . . . 1 1 8 8 ORN HG3 H . . . . . 2.677 1.781 3.573 . . . . . A . 8 ORN HA . . A . 8 ORN HG3 . . . 8 . HA . . . . . 8 . HG2 . . c30643_6pv2 1 211 1 . . 1 1 26 26 HIS H H . . . 1 1 27 27 THR H H . . . . . 2.682 1.783 3.581 . . . . . A . 26 HIS H . . A . 27 THR H . . . 26 . HN . . . . . 27 . HN . . c30643_6pv2 1 212 1 . . 1 1 28 28 GLY H H . . . 1 1 28 28 GLY HA3 H . . . . . 2.683 1.783 3.583 . . . . . A . 28 GLY H . . A . 28 GLY HA3 . . . 28 . HN . . . . . 28 . HA2 . . c30643_6pv2 1 213 1 . . 1 1 15 15 ARG HG3 H . . . 1 1 15 15 ARG HD2 H . . . . . 2.684 1.783 3.585 . . . . . A . 15 ARG HG3 . . A . 15 ARG HD2 . . . 15 . HG2 . . . . . 15 . HD1 . . c30643_6pv2 1 214 1 OR . 1 1 13 13 PHE HD2 H . . . 1 1 19 19 LEU HA H . . . . . 2.690 1.786 3.594 . . . . . A . 13 PHE HD2 . . A . 19 LEU HA . . . 13 . HD2 . . . . . 19 . HA . . c30643_6pv2 1 214 2 OR . 1 1 13 13 PHE HD1 H . . . 1 1 19 19 LEU HA H . . . . . 2.690 1.786 3.594 . . . . . A . 13 PHE HD1 . . A . 19 LEU HA . . . 13 . HD1 . . . . . 19 . HA . . c30643_6pv2 1 215 1 OR . 1 1 23 23 LYS H H . . . 1 1 23 23 LYS HG2 H . . . . . 2.696 1.787 3.605 . . . . . A . 23 LYS H . . A . 23 LYS HG2 . . . 23 . HN . . . . . 23 . HG1 . . c30643_6pv2 1 215 2 OR . 1 1 23 23 LYS H H . . . 1 1 23 23 LYS HG3 H . . . . . 2.696 1.787 3.605 . . . . . A . 23 LYS H . . A . 23 LYS HG3 . . . 23 . HN . . . . . 23 . HG2 . . c30643_6pv2 1 216 1 . . 1 1 2 2 PRO HD2 H . . . 1 1 2 2 PRO HG3 H . . . . . 2.702 1.789 3.615 . . . . . A . 2 PRO HD2 . . A . 2 PRO HG3 . . . 2 . HD1 . . . . . 2 . HG2 . . c30643_6pv2 1 217 1 . . 1 1 18 18 GLU HA H . . . 1 1 18 18 GLU HG3 H . . . . . 2.703 1.790 3.616 . . . . . A . 18 GLU HA . . A . 18 GLU HG3 . . . 18 . HA . . . . . 18 . HG2 . . c30643_6pv2 1 218 1 . . 1 1 11 11 LYS H H . . . 1 1 5 5 CYS HB3 H . . . . . 2.706 1.790 3.622 . . . . . A . 11 LYS H . . A . 5 CYS HB3 . . . 11 . HN . . . . . 5 . HB2 . . c30643_6pv2 1 219 1 . . 1 1 29 29 GLU HA H . . . 1 1 29 29 GLU H H . . . . . 2.709 1.792 3.626 . . . . . A . 29 GLU HA . . A . 29 GLU H . . . 29 . HA . . . . . 29 . HN . . c30643_6pv2 1 220 1 OR . 1 1 20 20 GLN HG2 H . . . 1 1 23 23 LYS HB2 H . . . . . 2.713 1.793 3.633 . . . . . A . 20 GLN HG2 . . A . 23 LYS HB2 . . . 20 . HG1 . . . . . 23 . HB1 . . c30643_6pv2 1 220 2 OR . 1 1 20 20 GLN HG2 H . . . 1 1 23 23 LYS HB3 H . . . . . 2.713 1.793 3.633 . . . . . A . 20 GLN HG2 . . A . 23 LYS HB3 . . . 20 . HG1 . . . . . 23 . HB2 . . c30643_6pv2 1 221 1 . . 1 1 17 17 ASP H H . . . 1 1 17 17 ASP HB3 H . . . . . 2.715 1.794 3.636 . . . . . A . 17 ASP H . . A . 17 ASP HB3 . . . 17 . HN . . . . . 17 . HB2 . . c30643_6pv2 1 222 1 . . 1 1 7 7 TRP HE1 H . . . 1 1 7 7 TRP HZ2 H . . . . . 2.715 1.794 3.636 . . . . . A . 7 TRP HE1 . . A . 7 TRP HZ2 . . . 7 . HE1 . . . . . 7 . HZ2 . . c30643_6pv2 1 223 1 OR . 1 1 13 13 PHE HE2 H . . . 1 1 11 11 LYS HB2 H . . . . . 2.721 1.795 3.647 . . . . . A . 13 PHE HE2 . . A . 11 LYS HB2 . . . 13 . HE2 . . . . . 11 . HB1 . . c30643_6pv2 1 223 2 OR . 1 1 13 13 PHE HE1 H . . . 1 1 11 11 LYS HB2 H . . . . . 2.721 1.795 3.647 . . . . . A . 13 PHE HE1 . . A . 11 LYS HB2 . . . 13 . HE1 . . . . . 11 . HB1 . . c30643_6pv2 1 223 3 OR . 1 1 13 13 PHE HE2 H . . . 1 1 11 11 LYS HB3 H . . . . . 2.721 1.795 3.647 . . . . . A . 13 PHE HE2 . . A . 11 LYS HB3 . . . 13 . HE2 . . . . . 11 . HB2 . . c30643_6pv2 1 223 4 OR . 1 1 13 13 PHE HE1 H . . . 1 1 11 11 LYS HB3 H . . . . . 2.721 1.795 3.647 . . . . . A . 13 PHE HE1 . . A . 11 LYS HB3 . . . 13 . HE1 . . . . . 11 . HB2 . . c30643_6pv2 1 224 1 OR . 1 1 13 13 PHE HD2 H . . . 1 1 12 12 ARG HA H . . . . . 2.722 1.796 3.648 . . . . . A . 13 PHE HD2 . . A . 12 ARG HA . . . 13 . HD2 . . . . . 12 . HA . . c30643_6pv2 1 224 2 OR . 1 1 13 13 PHE HD1 H . . . 1 1 12 12 ARG HA H . . . . . 2.722 1.796 3.648 . . . . . A . 13 PHE HD1 . . A . 12 ARG HA . . . 13 . HD1 . . . . . 12 . HA . . c30643_6pv2 1 225 1 OR . 1 1 11 11 LYS HG2 H . . . 1 1 12 12 ARG H H . . . . . 2.722 1.796 3.648 . . . . . A . 11 LYS HG2 . . A . 12 ARG H . . . 11 . HG1 . . . . . 12 . HN . . c30643_6pv2 1 225 2 OR . 1 1 11 11 LYS HG3 H . . . 1 1 12 12 ARG H H . . . . . 2.722 1.796 3.648 . . . . . A . 11 LYS HG3 . . A . 12 ARG H . . . 11 . HG2 . . . . . 12 . HN . . c30643_6pv2 1 226 1 . . 1 1 4 4 NLE H H . . . 1 1 4 4 NLE HB3 H . . . . . 2.724 1.796 3.652 . . . . . A . 4 NLE H . . A . 4 NLE HB3 . . . 4 . HN . . . . . 4 . HB2 . . c30643_6pv2 1 227 1 . . 1 1 1 1 ARG HA H . . . 1 1 2 2 PRO HD2 H . . . . . 2.725 1.797 3.653 . . . . . A . 1 ARG HA . . A . 2 PRO HD2 . . . 1 . HA . . . . . 2 . HD1 . . c30643_6pv2 1 228 1 . . 1 1 26 26 HIS H H . . . 1 1 26 26 HIS HA H . . . . . 2.731 1.799 3.663 . . . . . A . 26 HIS H . . A . 26 HIS HA . . . 26 . HN . . . . . 26 . HA . . c30643_6pv2 1 229 1 . . 1 1 11 11 LYS H H . . . 1 1 10 10 GLY H H . . . . . 2.732 1.799 3.665 . . . . . A . 11 LYS H . . A . 10 GLY H . . . 11 . HN . . . . . 10 . HN . . c30643_6pv2 1 230 1 OR . 1 1 29 29 GLU HG2 H . . . 1 1 29 29 GLU HB2 H . . . . . 2.733 1.800 3.666 . . . . . A . 29 GLU HG2 . . A . 29 GLU HB2 . . . 29 . HG1 . . . . . 29 . HB1 . . c30643_6pv2 1 230 2 OR . 1 1 29 29 GLU HG3 H . . . 1 1 29 29 GLU HB2 H . . . . . 2.733 1.800 3.666 . . . . . A . 29 GLU HG3 . . A . 29 GLU HB2 . . . 29 . HG2 . . . . . 29 . HB1 . . c30643_6pv2 1 231 1 . . 1 1 9 9 CYS HB2 H . . . 1 1 10 10 GLY H H . . . . . 2.733 1.800 3.666 . . . . . A . 9 CYS HB2 . . A . 10 GLY H . . . 9 . HB1 . . . . . 10 . HN . . c30643_6pv2 1 232 1 OR . 1 1 3 3 PHE HD2 H . . . 1 1 3 3 PHE H H . . . . . 2.733 1.799 3.667 . . . . . A . 3 PHE HD2 . . A . 3 PHE H . . . 3 . HD2 . . . . . 3 . HN . . c30643_6pv2 1 232 2 OR . 1 1 3 3 PHE HD1 H . . . 1 1 3 3 PHE H H . . . . . 2.733 1.799 3.667 . . . . . A . 3 PHE HD1 . . A . 3 PHE H . . . 3 . HD1 . . . . . 3 . HN . . c30643_6pv2 1 233 1 OR . 1 1 11 11 LYS HB2 H . . . 1 1 22 22 HIS HE1 H . . . . . 2.735 1.800 3.670 . . . . . A . 11 LYS HB2 . . A . 22 HIS HE1 . . . 11 . HB1 . . . . . 22 . HE1 . . c30643_6pv2 1 233 2 OR . 1 1 11 11 LYS HB3 H . . . 1 1 22 22 HIS HE1 H . . . . . 2.735 1.800 3.670 . . . . . A . 11 LYS HB3 . . A . 22 HIS HE1 . . . 11 . HB2 . . . . . 22 . HE1 . . c30643_6pv2 1 234 1 . . 1 1 29 29 GLU H H . . . 1 1 29 29 GLU HB2 H . . . . . 2.737 1.801 3.673 . . . . . A . 29 GLU H . . A . 29 GLU HB2 . . . 29 . HN . . . . . 29 . HB1 . . c30643_6pv2 1 235 1 . . 1 1 4 4 NLE H H . . . 1 1 4 4 NLE HB2 H . . . . . 2.737 1.801 3.673 . . . . . A . 4 NLE H . . A . 4 NLE HB2 . . . 4 . HN . . . . . 4 . HB1 . . c30643_6pv2 1 236 1 . . 1 1 7 7 TRP HD1 H . . . 1 1 7 7 TRP HB2 H . . . . . 2.745 1.803 3.687 . . . . . A . 7 TRP HD1 . . A . 7 TRP HB2 . . . 7 . HD1 . . . . . 7 . HB1 . . c30643_6pv2 1 237 1 . . 1 1 26 26 HIS HA H . . . 1 1 27 27 THR H H . . . . . 2.748 1.804 3.692 . . . . . A . 26 HIS HA . . A . 27 THR H . . . 26 . HA . . . . . 27 . HN . . c30643_6pv2 1 238 1 . . 1 1 2 2 PRO HD3 H . . . 1 1 2 2 PRO HG3 H . . . . . 2.751 1.805 3.697 . . . . . A . 2 PRO HD3 . . A . 2 PRO HG3 . . . 2 . HD2 . . . . . 2 . HG2 . . c30643_6pv2 1 239 1 OR . 1 1 11 11 LYS HD2 H . . . 1 1 22 22 HIS HE1 H . . . . . 2.753 1.806 3.700 . . . . . A . 11 LYS HD2 . . A . 22 HIS HE1 . . . 11 . HD1 . . . . . 22 . HE1 . . c30643_6pv2 1 239 2 OR . 1 1 11 11 LYS HD3 H . . . 1 1 22 22 HIS HE1 H . . . . . 2.753 1.806 3.700 . . . . . A . 11 LYS HD3 . . A . 22 HIS HE1 . . . 11 . HD2 . . . . . 22 . HE1 . . c30643_6pv2 1 240 1 . . 1 1 22 22 HIS HD2 H . . . 1 1 5 5 CYS HB3 H . . . . . 2.761 1.808 3.714 . . . . . A . 22 HIS HD2 . . A . 5 CYS HB3 . . . 22 . HD2 . . . . . 5 . HB2 . . c30643_6pv2 1 241 1 OR . 1 1 1 1 ARG HB2 H . . . 1 1 1 1 ARG HD2 H . . . . . 2.764 1.809 3.719 . . . . . A . 1 ARG HB2 . . A . 1 ARG HD2 . . . 1 . HB1 . . . . . 1 . HD1 . . c30643_6pv2 1 241 2 OR . 1 1 1 1 ARG HB2 H . . . 1 1 1 1 ARG HD3 H . . . . . 2.764 1.809 3.719 . . . . . A . 1 ARG HB2 . . A . 1 ARG HD3 . . . 1 . HB1 . . . . . 1 . HD2 . . c30643_6pv2 1 241 3 OR . 1 1 1 1 ARG HB3 H . . . 1 1 1 1 ARG HD2 H . . . . . 2.764 1.809 3.719 . . . . . A . 1 ARG HB3 . . A . 1 ARG HD2 . . . 1 . HB2 . . . . . 1 . HD1 . . c30643_6pv2 1 241 4 OR . 1 1 1 1 ARG HB3 H . . . 1 1 1 1 ARG HD3 H . . . . . 2.764 1.809 3.719 . . . . . A . 1 ARG HB3 . . A . 1 ARG HD3 . . . 1 . HB2 . . . . . 1 . HD2 . . c30643_6pv2 1 242 1 . . 1 1 19 19 LEU MD2 H . . . 1 1 3 3 PHE HB2 H . . . . . 2.764 1.809 3.719 . . . . . A . 19 LEU MD2 . . A . 3 PHE HB2 . . . 19 . HD21 . . . . . 3 . HB1 . . c30643_6pv2 1 243 1 . . 1 1 17 17 ASP HA H . . . 1 1 17 17 ASP H H . . . . . 2.769 1.811 3.727 . . . . . A . 17 ASP HA . . A . 17 ASP H . . . 17 . HA . . . . . 17 . HN . . c30643_6pv2 1 244 1 . . 1 1 22 22 HIS HD2 H . . . 1 1 23 23 LYS HA H . . . . . 2.769 1.811 3.727 . . . . . A . 22 HIS HD2 . . A . 23 LYS HA . . . 22 . HD2 . . . . . 23 . HA . . c30643_6pv2 1 245 1 . . 1 1 24 24 ARG HA H . . . 1 1 24 24 ARG HG2 H . . . . . 2.770 1.811 3.729 . . . . . A . 24 ARG HA . . A . 24 ARG HG2 . . . 24 . HA . . . . . 24 . HG1 . . c30643_6pv2 1 246 1 . . 1 1 13 13 PHE H H . . . 1 1 13 13 PHE HA H . . . . . 2.771 1.811 3.731 . . . . . A . 13 PHE H . . A . 13 PHE HA . . . 13 . HN . . . . . 13 . HA . . c30643_6pv2 1 247 1 OR . 1 1 23 23 LYS HA H . . . 1 1 23 23 LYS HG2 H . . . . . 2.778 1.813 3.743 . . . . . A . 23 LYS HA . . A . 23 LYS HG2 . . . 23 . HA . . . . . 23 . HG1 . . c30643_6pv2 1 247 2 OR . 1 1 23 23 LYS HA H . . . 1 1 23 23 LYS HG3 H . . . . . 2.778 1.813 3.743 . . . . . A . 23 LYS HA . . A . 23 LYS HG3 . . . 23 . HA . . . . . 23 . HG2 . . c30643_6pv2 1 248 1 . . 1 1 13 13 PHE HB2 H . . . 1 1 3 3 PHE HB3 H . . . . . 2.781 1.814 3.748 . . . . . A . 13 PHE HB2 . . A . 3 PHE HB3 . . . 13 . HB1 . . . . . 3 . HB2 . . c30643_6pv2 1 249 1 OR . 1 1 3 3 PHE HE2 H . . . 1 1 16 16 SER HB3 H . . . . . 2.783 1.815 3.751 . . . . . A . 3 PHE HE2 . . A . 16 SER HB3 . . . 3 . HE2 . . . . . 16 . HB2 . . c30643_6pv2 1 249 2 OR . 1 1 3 3 PHE HE1 H . . . 1 1 16 16 SER HB3 H . . . . . 2.783 1.815 3.751 . . . . . A . 3 PHE HE1 . . A . 16 SER HB3 . . . 3 . HE1 . . . . . 16 . HB2 . . c30643_6pv2 1 250 1 . . 1 1 26 26 HIS HE1 H . . . 1 1 9 9 CYS HB3 H . . . . . 2.784 1.815 3.753 . . . . . A . 26 HIS HE1 . . A . 9 CYS HB3 . . . 26 . HE1 . . . . . 9 . HB2 . . c30643_6pv2 1 251 1 . . 1 1 8 8 ORN HD2 H . . . 1 1 8 8 ORN HA H . . . . . 2.786 1.816 3.756 . . . . . A . 8 ORN HD2 . . A . 8 ORN HA . . . 8 . HD1 . . . . . 8 . HA . . c30643_6pv2 1 252 1 . . 1 1 14 14 THR H H . . . 1 1 15 15 ARG H H . . . . . 2.786 1.816 3.756 . . . . . A . 14 THR H . . A . 15 ARG H . . . 14 . HN . . . . . 15 . HN . . c30643_6pv2 1 253 1 OR . 1 1 21 21 ARG HG2 H . . . 1 1 21 21 ARG HD2 H . . . . . 2.789 1.817 3.761 . . . . . A . 21 ARG HG2 . . A . 21 ARG HD2 . . . 21 . HG1 . . . . . 21 . HD1 . . c30643_6pv2 1 253 2 OR . 1 1 21 21 ARG HG3 H . . . 1 1 21 21 ARG HD2 H . . . . . 2.789 1.817 3.761 . . . . . A . 21 ARG HG3 . . A . 21 ARG HD2 . . . 21 . HG2 . . . . . 21 . HD1 . . c30643_6pv2 1 254 1 OR . 1 1 4 4 NLE HG2 H . . . 1 1 4 4 NLE HA H . . . . . 2.790 1.817 3.763 . . . . . A . 4 NLE HG2 . . A . 4 NLE HA . . . 4 . HG1 . . . . . 4 . HA . . c30643_6pv2 1 254 2 OR . 1 1 4 4 NLE HG3 H . . . 1 1 4 4 NLE HA H . . . . . 2.790 1.817 3.763 . . . . . A . 4 NLE HG3 . . A . 4 NLE HA . . . 4 . HG2 . . . . . 4 . HA . . c30643_6pv2 1 255 1 OR . 1 1 12 12 ARG HD2 H . . . 1 1 2 2 PRO HG3 H . . . . . 2.793 1.818 3.768 . . . . . A . 12 ARG HD2 . . A . 2 PRO HG3 . . . 12 . HD1 . . . . . 2 . HG2 . . c30643_6pv2 1 255 2 OR . 1 1 12 12 ARG HD3 H . . . 1 1 2 2 PRO HG3 H . . . . . 2.793 1.818 3.768 . . . . . A . 12 ARG HD3 . . A . 2 PRO HG3 . . . 12 . HD2 . . . . . 2 . HG2 . . c30643_6pv2 1 256 1 OR . 1 1 11 11 LYS H H . . . 1 1 11 11 LYS HD2 H . . . . . 2.796 1.819 3.773 . . . . . A . 11 LYS H . . A . 11 LYS HD2 . . . 11 . HN . . . . . 11 . HD1 . . c30643_6pv2 1 256 2 OR . 1 1 11 11 LYS H H . . . 1 1 11 11 LYS HD3 H . . . . . 2.796 1.819 3.773 . . . . . A . 11 LYS H . . A . 11 LYS HD3 . . . 11 . HN . . . . . 11 . HD2 . . c30643_6pv2 1 257 1 OR . 1 1 18 18 GLU HB2 H . . . 1 1 15 15 ARG H H . . . . . 2.802 1.821 3.783 . . . . . A . 18 GLU HB2 . . A . 15 ARG H . . . 18 . HB1 . . . . . 15 . HN . . c30643_6pv2 1 257 2 OR . 1 1 18 18 GLU HB3 H . . . 1 1 15 15 ARG H H . . . . . 2.802 1.821 3.783 . . . . . A . 18 GLU HB3 . . A . 15 ARG H . . . 18 . HB2 . . . . . 15 . HN . . c30643_6pv2 1 258 1 . . 1 1 3 3 PHE HB2 H . . . 1 1 3 3 PHE HA H . . . . . 2.805 1.821 3.789 . . . . . A . 3 PHE HB2 . . A . 3 PHE HA . . . 3 . HB1 . . . . . 3 . HA . . c30643_6pv2 1 259 1 . . 1 1 19 19 LEU HB3 H . . . 1 1 3 3 PHE HB2 H . . . . . 2.805 1.821 3.789 . . . . . A . 19 LEU HB3 . . A . 3 PHE HB2 . . . 19 . HB2 . . . . . 3 . HB1 . . c30643_6pv2 1 260 1 . . 1 1 12 12 ARG HG2 H . . . 1 1 12 12 ARG HA H . . . . . 2.806 1.822 3.790 . . . . . A . 12 ARG HG2 . . A . 12 ARG HA . . . 12 . HG1 . . . . . 12 . HA . . c30643_6pv2 1 261 1 OR . 1 1 3 3 PHE HD2 H . . . 1 1 14 14 THR HA H . . . . . 2.816 1.825 3.807 . . . . . A . 3 PHE HD2 . . A . 14 THR HA . . . 3 . HD2 . . . . . 14 . HA . . c30643_6pv2 1 261 2 OR . 1 1 3 3 PHE HD1 H . . . 1 1 14 14 THR HA H . . . . . 2.816 1.825 3.807 . . . . . A . 3 PHE HD1 . . A . 14 THR HA . . . 3 . HD1 . . . . . 14 . HA . . c30643_6pv2 1 262 1 . . 1 1 24 24 ARG H H . . . 1 1 24 24 ARG HG2 H . . . . . 2.825 1.827 3.823 . . . . . A . 24 ARG H . . A . 24 ARG HG2 . . . 24 . HN . . . . . 24 . HG1 . . c30643_6pv2 1 263 1 . . 1 1 17 17 ASP H H . . . 1 1 18 18 GLU H H . . . . . 2.829 1.829 3.829 . . . . . A . 17 ASP H . . A . 18 GLU H . . . 17 . HN . . . . . 18 . HN . . c30643_6pv2 1 264 1 . . 1 1 22 22 HIS HB3 H . . . 1 1 22 22 HIS HA H . . . . . 2.830 1.829 3.831 . . . . . A . 22 HIS HB3 . . A . 22 HIS HA . . . 22 . HB2 . . . . . 22 . HA . . c30643_6pv2 1 265 1 . . 1 1 2 2 PRO HB2 H . . . 1 1 2 2 PRO HA H . . . . . 2.832 1.829 3.835 . . . . . A . 2 PRO HB2 . . A . 2 PRO HA . . . 2 . HB1 . . . . . 2 . HA . . c30643_6pv2 1 266 1 OR . 1 1 3 3 PHE HE2 H . . . 1 1 16 16 SER HB2 H . . . . . 2.834 1.830 3.838 . . . . . A . 3 PHE HE2 . . A . 16 SER HB2 . . . 3 . HE2 . . . . . 16 . HB1 . . c30643_6pv2 1 266 2 OR . 1 1 3 3 PHE HE1 H . . . 1 1 16 16 SER HB2 H . . . . . 2.834 1.830 3.838 . . . . . A . 3 PHE HE1 . . A . 16 SER HB2 . . . 3 . HE1 . . . . . 16 . HB1 . . c30643_6pv2 1 267 1 . . 1 1 12 12 ARG HA H . . . 1 1 12 12 ARG H H . . . . . 2.836 1.830 3.842 . . . . . A . 12 ARG HA . . A . 12 ARG H . . . 12 . HA . . . . . 12 . HN . . c30643_6pv2 1 268 1 OR . 1 1 13 13 PHE HE2 H . . . 1 1 5 5 CYS HB3 H . . . . . 2.837 1.831 3.843 . . . . . A . 13 PHE HE2 . . A . 5 CYS HB3 . . . 13 . HE2 . . . . . 5 . HB2 . . c30643_6pv2 1 268 2 OR . 1 1 13 13 PHE HE1 H . . . 1 1 5 5 CYS HB3 H . . . . . 2.837 1.831 3.843 . . . . . A . 13 PHE HE1 . . A . 5 CYS HB3 . . . 13 . HE1 . . . . . 5 . HB2 . . c30643_6pv2 1 269 1 . . 1 1 26 26 HIS HB2 H . . . 1 1 26 26 HIS H H . . . . . 2.838 1.831 3.845 . . . . . A . 26 HIS HB2 . . A . 26 HIS H . . . 26 . HB1 . . . . . 26 . HN . . c30643_6pv2 1 270 1 . . 1 1 18 18 GLU HG2 H . . . 1 1 18 18 GLU H H . . . . . 2.839 1.831 3.847 . . . . . A . 18 GLU HG2 . . A . 18 GLU H . . . 18 . HG1 . . . . . 18 . HN . . c30643_6pv2 1 271 1 . . 1 1 7 7 TRP HA H . . . 1 1 7 7 TRP HE3 H . . . . . 2.849 1.835 3.863 . . . . . A . 7 TRP HA . . A . 7 TRP HE3 . . . 7 . HA . . . . . 7 . HE3 . . c30643_6pv2 1 272 1 . . 1 1 4 4 NLE HB3 H . . . 1 1 4 4 NLE HA H . . . . . 2.852 1.835 3.869 . . . . . A . 4 NLE HB3 . . A . 4 NLE HA . . . 4 . HB2 . . . . . 4 . HA . . c30643_6pv2 1 273 1 . . 1 1 7 7 TRP HE3 H . . . 1 1 7 7 TRP HB2 H . . . . . 2.855 1.836 3.874 . . . . . A . 7 TRP HE3 . . A . 7 TRP HB2 . . . 7 . HE3 . . . . . 7 . HB1 . . c30643_6pv2 1 274 1 OR . 1 1 13 13 PHE HD2 H . . . 1 1 13 13 PHE HZ H . . . . . 2.856 1.837 3.875 . . . . . A . 13 PHE HD2 . . A . 13 PHE HZ . . . 13 . HD2 . . . . . 13 . HZ . . c30643_6pv2 1 274 2 OR . 1 1 13 13 PHE HD1 H . . . 1 1 13 13 PHE HZ H . . . . . 2.856 1.837 3.875 . . . . . A . 13 PHE HD1 . . A . 13 PHE HZ . . . 13 . HD1 . . . . . 13 . HZ . . c30643_6pv2 1 275 1 . . 1 1 15 15 ARG HA H . . . 1 1 15 15 ARG H H . . . . . 2.858 1.837 3.879 . . . . . A . 15 ARG HA . . A . 15 ARG H . . . 15 . HA . . . . . 15 . HN . . c30643_6pv2 1 276 1 OR . 1 1 13 13 PHE HZ H . . . 1 1 11 11 LYS HB2 H . . . . . 2.861 1.838 3.884 . . . . . A . 13 PHE HZ . . A . 11 LYS HB2 . . . 13 . HZ . . . . . 11 . HB1 . . c30643_6pv2 1 276 2 OR . 1 1 13 13 PHE HZ H . . . 1 1 11 11 LYS HB3 H . . . . . 2.861 1.838 3.884 . . . . . A . 13 PHE HZ . . A . 11 LYS HB3 . . . 13 . HZ . . . . . 11 . HB2 . . c30643_6pv2 1 277 1 . . 1 1 27 27 THR MG H . . . 1 1 27 27 THR H H . . . . . 2.863 1.839 3.887 . . . . . A . 27 THR MG . . A . 27 THR H . . . 27 . HG21 . . . . . 27 . HN . . c30643_6pv2 1 278 1 . . 1 1 13 13 PHE HB3 H . . . 1 1 14 14 THR H H . . . . . 2.865 1.839 3.891 . . . . . A . 13 PHE HB3 . . A . 14 THR H . . . 13 . HB2 . . . . . 14 . HN . . c30643_6pv2 1 279 1 OR . 1 1 15 15 ARG HB2 H . . . 1 1 15 15 ARG HD2 H . . . . . 2.869 1.840 3.898 . . . . . A . 15 ARG HB2 . . A . 15 ARG HD2 . . . 15 . HB1 . . . . . 15 . HD1 . . c30643_6pv2 1 279 2 OR . 1 1 15 15 ARG HB3 H . . . 1 1 15 15 ARG HD2 H . . . . . 2.869 1.840 3.898 . . . . . A . 15 ARG HB3 . . A . 15 ARG HD2 . . . 15 . HB2 . . . . . 15 . HD1 . . c30643_6pv2 1 280 1 . . 1 1 18 18 GLU HG2 H . . . 1 1 13 13 PHE HB3 H . . . . . 2.873 1.841 3.905 . . . . . A . 18 GLU HG2 . . A . 13 PHE HB3 . . . 18 . HG1 . . . . . 13 . HB2 . . c30643_6pv2 1 281 1 OR . 1 1 1 1 ARG HB2 H . . . 1 1 2 2 PRO HD2 H . . . . . 2.873 1.841 3.905 . . . . . A . 1 ARG HB2 . . A . 2 PRO HD2 . . . 1 . HB1 . . . . . 2 . HD1 . . c30643_6pv2 1 281 2 OR . 1 1 1 1 ARG HB3 H . . . 1 1 2 2 PRO HD2 H . . . . . 2.873 1.841 3.905 . . . . . A . 1 ARG HB3 . . A . 2 PRO HD2 . . . 1 . HB2 . . . . . 2 . HD1 . . c30643_6pv2 1 282 1 . . 1 1 26 26 HIS HB3 H . . . 1 1 26 26 HIS HA H . . . . . 2.873 1.841 3.905 . . . . . A . 26 HIS HB3 . . A . 26 HIS HA . . . 26 . HB2 . . . . . 26 . HA . . c30643_6pv2 1 283 1 OR . 1 1 3 3 PHE HD2 H . . . 1 1 16 16 SER HA H . . . . . 2.876 1.842 3.910 . . . . . A . 3 PHE HD2 . . A . 16 SER HA . . . 3 . HD2 . . . . . 16 . HA . . c30643_6pv2 1 283 2 OR . 1 1 3 3 PHE HD1 H . . . 1 1 16 16 SER HA H . . . . . 2.876 1.842 3.910 . . . . . A . 3 PHE HD1 . . A . 16 SER HA . . . 3 . HD1 . . . . . 16 . HA . . c30643_6pv2 1 284 1 . . 1 1 30 30 LYS HA H . . . 1 1 30 30 LYS HB2 H . . . . . 2.884 1.845 3.923 . . . . . A . 30 LYS HA . . A . 30 LYS HB2 . . . 30 . HA . . . . . 30 . HB1 . . c30643_6pv2 1 285 1 . . 1 1 4 4 NLE H H . . . 1 1 4 4 NLE HA H . . . . . 2.890 1.846 3.934 . . . . . A . 4 NLE H . . A . 4 NLE HA . . . 4 . HN . . . . . 4 . HA . . c30643_6pv2 1 286 1 . . 1 1 17 17 ASP H H . . . 1 1 17 17 ASP HB2 H . . . . . 2.891 1.846 3.936 . . . . . A . 17 ASP H . . A . 17 ASP HB2 . . . 17 . HN . . . . . 17 . HB1 . . c30643_6pv2 1 287 1 . . 1 1 21 21 ARG HB2 H . . . 1 1 18 18 GLU HA H . . . . . 2.895 1.848 3.942 . . . . . A . 21 ARG HB2 . . A . 18 GLU HA . . . 21 . HB1 . . . . . 18 . HA . . c30643_6pv2 1 288 1 OR . 1 1 22 22 HIS HB3 H . . . 1 1 13 13 PHE HE2 H . . . . . 2.899 1.848 3.950 . . . . . A . 22 HIS HB3 . . A . 13 PHE HE2 . . . 22 . HB2 . . . . . 13 . HE2 . . c30643_6pv2 1 288 2 OR . 1 1 22 22 HIS HB3 H . . . 1 1 13 13 PHE HE1 H . . . . . 2.899 1.848 3.950 . . . . . A . 22 HIS HB3 . . A . 13 PHE HE1 . . . 22 . HB2 . . . . . 13 . HE1 . . c30643_6pv2 1 289 1 . . 1 1 26 26 HIS HD2 H . . . 1 1 7 7 TRP HB3 H . . . . . 2.908 1.851 3.965 . . . . . A . 26 HIS HD2 . . A . 7 TRP HB3 . . . 26 . HD2 . . . . . 7 . HB2 . . c30643_6pv2 1 290 1 . . 1 1 26 26 HIS HB2 H . . . 1 1 26 26 HIS HD2 H . . . . . 2.915 1.853 3.977 . . . . . A . 26 HIS HB2 . . A . 26 HIS HD2 . . . 26 . HB1 . . . . . 26 . HD2 . . c30643_6pv2 1 291 1 OR . 1 1 3 3 PHE HD2 H . . . 1 1 15 15 ARG HA H . . . . . 2.917 1.853 3.981 . . . . . A . 3 PHE HD2 . . A . 15 ARG HA . . . 3 . HD2 . . . . . 15 . HA . . c30643_6pv2 1 291 2 OR . 1 1 3 3 PHE HD1 H . . . 1 1 15 15 ARG HA H . . . . . 2.917 1.853 3.981 . . . . . A . 3 PHE HD1 . . A . 15 ARG HA . . . 3 . HD1 . . . . . 15 . HA . . c30643_6pv2 1 292 1 . . 1 1 5 5 CYS H H . . . 1 1 5 5 CYS HA H . . . . . 2.917 1.853 3.981 . . . . . A . 5 CYS H . . A . 5 CYS HA . . . 5 . HN . . . . . 5 . HA . . c30643_6pv2 1 293 1 OR . 1 1 3 3 PHE HD2 H . . . 1 1 2 2 PRO HA H . . . . . 2.918 1.853 3.983 . . . . . A . 3 PHE HD2 . . A . 2 PRO HA . . . 3 . HD2 . . . . . 2 . HA . . c30643_6pv2 1 293 2 OR . 1 1 3 3 PHE HD1 H . . . 1 1 2 2 PRO HA H . . . . . 2.918 1.853 3.983 . . . . . A . 3 PHE HD1 . . A . 2 PRO HA . . . 3 . HD1 . . . . . 2 . HA . . c30643_6pv2 1 294 1 . . 1 1 3 3 PHE HA H . . . 1 1 3 3 PHE H H . . . . . 2.919 1.854 3.984 . . . . . A . 3 PHE HA . . A . 3 PHE H . . . 3 . HA . . . . . 3 . HN . . c30643_6pv2 1 295 1 . . 1 1 13 13 PHE HB2 H . . . 1 1 15 15 ARG H H . . . . . 2.921 1.855 3.987 . . . . . A . 13 PHE HB2 . . A . 15 ARG H . . . 13 . HB1 . . . . . 15 . HN . . c30643_6pv2 1 296 1 . . 1 1 7 7 TRP HA H . . . 1 1 7 7 TRP HD1 H . . . . . 2.922 1.855 3.989 . . . . . A . 7 TRP HA . . A . 7 TRP HD1 . . . 7 . HA . . . . . 7 . HD1 . . c30643_6pv2 1 297 1 . . 1 1 28 28 GLY HA3 H . . . 1 1 29 29 GLU H H . . . . . 2.922 1.855 3.989 . . . . . A . 28 GLY HA3 . . A . 29 GLU H . . . 28 . HA2 . . . . . 29 . HN . . c30643_6pv2 1 298 1 OR . 1 1 23 23 LYS HD2 H . . . 1 1 23 23 LYS HA H . . . . . 2.923 1.855 3.991 . . . . . A . 23 LYS HD2 . . A . 23 LYS HA . . . 23 . HD1 . . . . . 23 . HA . . c30643_6pv2 1 298 2 OR . 1 1 23 23 LYS HD3 H . . . 1 1 23 23 LYS HA H . . . . . 2.923 1.855 3.991 . . . . . A . 23 LYS HD3 . . A . 23 LYS HA . . . 23 . HD2 . . . . . 23 . HA . . c30643_6pv2 1 299 1 . . 1 1 14 14 THR HB H . . . 1 1 15 15 ARG H H . . . . . 2.929 1.857 4.001 . . . . . A . 14 THR HB . . A . 15 ARG H . . . 14 . HB . . . . . 15 . HN . . c30643_6pv2 1 300 1 OR . 1 1 4 4 NLE HG2 H . . . 1 1 5 5 CYS H H . . . . . 2.931 1.857 4.005 . . . . . A . 4 NLE HG2 . . A . 5 CYS H . . . 4 . HG1 . . . . . 5 . HN . . c30643_6pv2 1 300 2 OR . 1 1 4 4 NLE HG3 H . . . 1 1 5 5 CYS H H . . . . . 2.931 1.857 4.005 . . . . . A . 4 NLE HG3 . . A . 5 CYS H . . . 4 . HG2 . . . . . 5 . HN . . c30643_6pv2 1 301 1 OR . 1 1 13 13 PHE HD2 H . . . 1 1 4 4 NLE HA H . . . . . 2.937 1.859 4.015 . . . . . A . 13 PHE HD2 . . A . 4 NLE HA . . . 13 . HD2 . . . . . 4 . HA . . c30643_6pv2 1 301 2 OR . 1 1 13 13 PHE HD1 H . . . 1 1 4 4 NLE HA H . . . . . 2.937 1.859 4.015 . . . . . A . 13 PHE HD1 . . A . 4 NLE HA . . . 13 . HD1 . . . . . 4 . HA . . c30643_6pv2 1 302 1 OR . 1 1 13 13 PHE HE2 H . . . 1 1 11 11 LYS HD2 H . . . . . 2.939 1.860 4.018 . . . . . A . 13 PHE HE2 . . A . 11 LYS HD2 . . . 13 . HE2 . . . . . 11 . HD1 . . c30643_6pv2 1 302 2 OR . 1 1 13 13 PHE HE1 H . . . 1 1 11 11 LYS HD2 H . . . . . 2.939 1.860 4.018 . . . . . A . 13 PHE HE1 . . A . 11 LYS HD2 . . . 13 . HE1 . . . . . 11 . HD1 . . c30643_6pv2 1 302 3 OR . 1 1 13 13 PHE HE2 H . . . 1 1 11 11 LYS HD3 H . . . . . 2.939 1.860 4.018 . . . . . A . 13 PHE HE2 . . A . 11 LYS HD3 . . . 13 . HE2 . . . . . 11 . HD2 . . c30643_6pv2 1 302 4 OR . 1 1 13 13 PHE HE1 H . . . 1 1 11 11 LYS HD3 H . . . . . 2.939 1.860 4.018 . . . . . A . 13 PHE HE1 . . A . 11 LYS HD3 . . . 13 . HE1 . . . . . 11 . HD2 . . c30643_6pv2 1 303 1 . . 1 1 25 25 THR H H . . . 1 1 25 25 THR HB H . . . . . 2.939 1.860 4.018 . . . . . A . 25 THR H . . A . 25 THR HB . . . 25 . HN . . . . . 25 . HB . . c30643_6pv2 1 304 1 . . 1 1 2 2 PRO HD3 H . . . 1 1 2 2 PRO HG2 H . . . . . 2.940 1.860 4.020 . . . . . A . 2 PRO HD3 . . A . 2 PRO HG2 . . . 2 . HD2 . . . . . 2 . HG1 . . c30643_6pv2 1 305 1 . . 1 1 7 7 TRP HD1 H . . . 1 1 7 7 TRP HB3 H . . . . . 2.941 1.860 4.022 . . . . . A . 7 TRP HD1 . . A . 7 TRP HB3 . . . 7 . HD1 . . . . . 7 . HB2 . . c30643_6pv2 1 306 1 OR . 1 1 13 13 PHE H H . . . 1 1 12 12 ARG HB2 H . . . . . 2.946 1.861 4.031 . . . . . A . 13 PHE H . . A . 12 ARG HB2 . . . 13 . HN . . . . . 12 . HB1 . . c30643_6pv2 1 306 2 OR . 1 1 13 13 PHE H H . . . 1 1 12 12 ARG HB3 H . . . . . 2.946 1.861 4.031 . . . . . A . 13 PHE H . . A . 12 ARG HB3 . . . 13 . HN . . . . . 12 . HB2 . . c30643_6pv2 1 307 1 . . 1 1 20 20 GLN H H . . . 1 1 17 17 ASP HA H . . . . . 2.950 1.862 4.038 . . . . . A . 20 GLN H . . A . 17 ASP HA . . . 20 . HN . . . . . 17 . HA . . c30643_6pv2 1 308 1 . . 1 1 28 28 GLY HA2 H . . . 1 1 29 29 GLU H H . . . . . 2.956 1.864 4.048 . . . . . A . 28 GLY HA2 . . A . 29 GLU H . . . 28 . HA1 . . . . . 29 . HN . . c30643_6pv2 1 309 1 . . 1 1 16 16 SER H H . . . 1 1 16 16 SER HA H . . . . . 2.961 1.865 4.057 . . . . . A . 16 SER H . . A . 16 SER HA . . . 16 . HN . . . . . 16 . HA . . c30643_6pv2 1 310 1 OR . 1 1 15 15 ARG HB2 H . . . 1 1 15 15 ARG HD3 H . . . . . 2.962 1.865 4.059 . . . . . A . 15 ARG HB2 . . A . 15 ARG HD3 . . . 15 . HB1 . . . . . 15 . HD2 . . c30643_6pv2 1 310 2 OR . 1 1 15 15 ARG HB3 H . . . 1 1 15 15 ARG HD3 H . . . . . 2.962 1.865 4.059 . . . . . A . 15 ARG HB3 . . A . 15 ARG HD3 . . . 15 . HB2 . . . . . 15 . HD2 . . c30643_6pv2 1 311 1 OR . 1 1 13 13 PHE HE2 H . . . 1 1 19 19 LEU HA H . . . . . 2.966 1.866 4.066 . . . . . A . 13 PHE HE2 . . A . 19 LEU HA . . . 13 . HE2 . . . . . 19 . HA . . c30643_6pv2 1 311 2 OR . 1 1 13 13 PHE HE1 H . . . 1 1 19 19 LEU HA H . . . . . 2.966 1.866 4.066 . . . . . A . 13 PHE HE1 . . A . 19 LEU HA . . . 13 . HE1 . . . . . 19 . HA . . c30643_6pv2 1 312 1 . . 1 1 29 29 GLU HA H . . . 1 1 29 29 GLU HB2 H . . . . . 2.969 1.867 4.071 . . . . . A . 29 GLU HA . . A . 29 GLU HB2 . . . 29 . HA . . . . . 29 . HB1 . . c30643_6pv2 1 313 1 . . 1 1 4 4 NLE H H . . . 1 1 3 3 PHE HB3 H . . . . . 2.974 1.868 4.080 . . . . . A . 4 NLE H . . A . 3 PHE HB3 . . . 4 . HN . . . . . 3 . HB2 . . c30643_6pv2 1 314 1 . . 1 1 26 26 HIS HD2 H . . . 1 1 7 7 TRP HB2 H . . . . . 2.977 1.869 4.085 . . . . . A . 26 HIS HD2 . . A . 7 TRP HB2 . . . 26 . HD2 . . . . . 7 . HB1 . . c30643_6pv2 1 315 1 . . 1 1 14 14 THR HB H . . . 1 1 14 14 THR H H . . . . . 2.980 1.870 4.090 . . . . . A . 14 THR HB . . A . 14 THR H . . . 14 . HB . . . . . 14 . HN . . c30643_6pv2 1 316 1 . . 1 1 19 19 LEU HB2 H . . . 1 1 13 13 PHE HB2 H . . . . . 2.981 1.870 4.092 . . . . . A . 19 LEU HB2 . . A . 13 PHE HB2 . . . 19 . HB1 . . . . . 13 . HB1 . . c30643_6pv2 1 317 1 . . 1 1 26 26 HIS HB3 H . . . 1 1 27 27 THR H H . . . . . 2.982 1.870 4.094 . . . . . A . 26 HIS HB3 . . A . 27 THR H . . . 26 . HB2 . . . . . 27 . HN . . c30643_6pv2 1 318 1 . . 1 1 16 16 SER HB2 H . . . 1 1 16 16 SER H H . . . . . 2.984 1.871 4.097 . . . . . A . 16 SER HB2 . . A . 16 SER H . . . 16 . HB1 . . . . . 16 . HN . . c30643_6pv2 1 319 1 . . 1 1 11 11 LYS H H . . . 1 1 10 10 GLY HA3 H . . . . . 2.985 1.871 4.099 . . . . . A . 11 LYS H . . A . 10 GLY HA3 . . . 11 . HN . . . . . 10 . HA2 . . c30643_6pv2 1 320 1 . . 1 1 20 20 GLN HA H . . . 1 1 23 23 LYS H H . . . . . 2.986 1.871 4.101 . . . . . A . 20 GLN HA . . A . 23 LYS H . . . 20 . HA . . . . . 23 . HN . . c30643_6pv2 1 321 1 . . 1 1 20 20 GLN HA H . . . 1 1 19 19 LEU HG H . . . . . 2.989 1.872 4.106 . . . . . A . 20 GLN HA . . A . 19 LEU HG . . . 20 . HA . . . . . 19 . HG . . c30643_6pv2 1 322 1 OR . 1 1 15 15 ARG HB2 H . . . 1 1 18 18 GLU H H . . . . . 3.000 1.875 4.125 . . . . . A . 15 ARG HB2 . . A . 18 GLU H . . . 15 . HB1 . . . . . 18 . HN . . c30643_6pv2 1 322 2 OR . 1 1 15 15 ARG HB3 H . . . 1 1 18 18 GLU H H . . . . . 3.000 1.875 4.125 . . . . . A . 15 ARG HB3 . . A . 18 GLU H . . . 15 . HB2 . . . . . 18 . HN . . c30643_6pv2 1 323 1 . . 1 1 16 16 SER HB2 H . . . 1 1 16 16 SER HA H . . . . . 3.002 1.876 4.128 . . . . . A . 16 SER HB2 . . A . 16 SER HA . . . 16 . HB1 . . . . . 16 . HA . . c30643_6pv2 1 324 1 OR . 1 1 5 5 CYS HB3 H . . . 1 1 11 11 LYS HB2 H . . . . . 3.003 1.876 4.130 . . . . . A . 5 CYS HB3 . . A . 11 LYS HB2 . . . 5 . HB2 . . . . . 11 . HB1 . . c30643_6pv2 1 324 2 OR . 1 1 5 5 CYS HB3 H . . . 1 1 11 11 LYS HB3 H . . . . . 3.003 1.876 4.130 . . . . . A . 5 CYS HB3 . . A . 11 LYS HB3 . . . 5 . HB2 . . . . . 11 . HB2 . . c30643_6pv2 1 325 1 . . 1 1 12 12 ARG HG2 H . . . 1 1 12 12 ARG H H . . . . . 3.007 1.876 4.138 . . . . . A . 12 ARG HG2 . . A . 12 ARG H . . . 12 . HG1 . . . . . 12 . HN . . c30643_6pv2 1 326 1 . . 1 1 26 26 HIS HD2 H . . . 1 1 22 22 HIS HD2 H . . . . . 3.007 1.876 4.138 . . . . . A . 26 HIS HD2 . . A . 22 HIS HD2 . . . 26 . HD2 . . . . . 22 . HD2 . . c30643_6pv2 1 327 1 . . 1 1 15 15 ARG HG2 H . . . 1 1 15 15 ARG H H . . . . . 3.009 1.877 4.141 . . . . . A . 15 ARG HG2 . . A . 15 ARG H . . . 15 . HG1 . . . . . 15 . HN . . c30643_6pv2 1 328 1 . . 1 1 28 28 GLY H H . . . 1 1 27 27 THR H H . . . . . 3.009 1.877 4.141 . . . . . A . 28 GLY H . . A . 27 THR H . . . 28 . HN . . . . . 27 . HN . . c30643_6pv2 1 329 1 . . 1 1 19 19 LEU MD2 H . . . 1 1 3 3 PHE HA H . . . . . 3.012 1.878 4.146 . . . . . A . 19 LEU MD2 . . A . 3 PHE HA . . . 19 . HD21 . . . . . 3 . HA . . c30643_6pv2 1 330 1 . . 1 1 19 19 LEU MD1 H . . . 1 1 5 5 CYS HB3 H . . . . . 3.019 1.880 4.158 . . . . . A . 19 LEU MD1 . . A . 5 CYS HB3 . . . 19 . HD11 . . . . . 5 . HB2 . . c30643_6pv2 1 331 1 . . 1 1 12 12 ARG HE H . . . 1 1 12 12 ARG HG3 H . . . . . 3.033 1.883 4.183 . . . . . A . 12 ARG HE . . A . 12 ARG HG3 . . . 12 . HE . . . . . 12 . HG2 . . c30643_6pv2 1 332 1 . . 1 1 16 16 SER HB3 H . . . 1 1 16 16 SER H H . . . . . 3.034 1.883 4.185 . . . . . A . 16 SER HB3 . . A . 16 SER H . . . 16 . HB2 . . . . . 16 . HN . . c30643_6pv2 1 333 1 . . 1 1 14 14 THR H H . . . 1 1 14 14 THR HA H . . . . . 3.048 1.887 4.209 . . . . . A . 14 THR H . . A . 14 THR HA . . . 14 . HN . . . . . 14 . HA . . c30643_6pv2 1 334 1 . . 1 1 7 7 TRP HE3 H . . . 1 1 26 26 HIS HD2 H . . . . . 3.050 1.888 4.212 . . . . . A . 7 TRP HE3 . . A . 26 HIS HD2 . . . 7 . HE3 . . . . . 26 . HD2 . . c30643_6pv2 1 335 1 . . 1 1 7 7 TRP H H . . . 1 1 9 9 CYS HB3 H . . . . . 3.050 1.888 4.212 . . . . . A . 7 TRP H . . A . 9 CYS HB3 . . . 7 . HN . . . . . 9 . HB2 . . c30643_6pv2 1 336 1 OR . 1 1 11 11 LYS HD2 H . . . 1 1 13 13 PHE HZ H . . . . . 3.054 1.888 4.220 . . . . . A . 11 LYS HD2 . . A . 13 PHE HZ . . . 11 . HD1 . . . . . 13 . HZ . . c30643_6pv2 1 336 2 OR . 1 1 11 11 LYS HD3 H . . . 1 1 13 13 PHE HZ H . . . . . 3.054 1.888 4.220 . . . . . A . 11 LYS HD3 . . A . 13 PHE HZ . . . 11 . HD2 . . . . . 13 . HZ . . c30643_6pv2 1 337 1 . . 1 1 29 29 GLU HB3 H . . . 1 1 29 29 GLU H H . . . . . 3.056 1.889 4.223 . . . . . A . 29 GLU HB3 . . A . 29 GLU H . . . 29 . HB2 . . . . . 29 . HN . . c30643_6pv2 1 338 1 . . 1 1 13 13 PHE H H . . . 1 1 13 13 PHE HB3 H . . . . . 3.058 1.889 4.227 . . . . . A . 13 PHE H . . A . 13 PHE HB3 . . . 13 . HN . . . . . 13 . HB2 . . c30643_6pv2 1 339 1 OR . 1 1 15 15 ARG HB2 H . . . 1 1 17 17 ASP H H . . . . . 3.058 1.889 4.227 . . . . . A . 15 ARG HB2 . . A . 17 ASP H . . . 15 . HB1 . . . . . 17 . HN . . c30643_6pv2 1 339 2 OR . 1 1 15 15 ARG HB3 H . . . 1 1 17 17 ASP H H . . . . . 3.058 1.889 4.227 . . . . . A . 15 ARG HB3 . . A . 17 ASP H . . . 15 . HB2 . . . . . 17 . HN . . c30643_6pv2 1 340 1 . . 1 1 7 7 TRP H H . . . 1 1 6 6 THR H H . . . . . 3.059 1.889 4.229 . . . . . A . 7 TRP H . . A . 6 THR H . . . 7 . HN . . . . . 6 . HN . . c30643_6pv2 1 341 1 . . 1 1 26 26 HIS H H . . . 1 1 26 26 HIS HD2 H . . . . . 3.067 1.891 4.243 . . . . . A . 26 HIS H . . A . 26 HIS HD2 . . . 26 . HN . . . . . 26 . HD2 . . c30643_6pv2 1 342 1 . . 1 1 14 14 THR MG H . . . 1 1 14 14 THR H H . . . . . 3.071 1.892 4.250 . . . . . A . 14 THR MG . . A . 14 THR H . . . 14 . HG21 . . . . . 14 . HN . . c30643_6pv2 1 343 1 . . 1 1 17 17 ASP HB2 H . . . 1 1 18 18 GLU H H . . . . . 3.071 1.892 4.250 . . . . . A . 17 ASP HB2 . . A . 18 GLU H . . . 17 . HB1 . . . . . 18 . HN . . c30643_6pv2 1 344 1 . . 1 1 21 21 ARG HA H . . . 1 1 24 24 ARG H H . . . . . 3.071 1.892 4.250 . . . . . A . 21 ARG HA . . A . 24 ARG H . . . 21 . HA . . . . . 24 . HN . . c30643_6pv2 1 345 1 . . 1 1 3 3 PHE HB3 H . . . 1 1 3 3 PHE H H . . . . . 3.071 1.892 4.250 . . . . . A . 3 PHE HB3 . . A . 3 PHE H . . . 3 . HB2 . . . . . 3 . HN . . c30643_6pv2 1 346 1 . . 1 1 12 12 ARG HA H . . . 1 1 5 5 CYS H H . . . . . 3.072 1.892 4.252 . . . . . A . 12 ARG HA . . A . 5 CYS H . . . 12 . HA . . . . . 5 . HN . . c30643_6pv2 1 347 1 . . 1 1 19 19 LEU H H . . . 1 1 16 16 SER HA H . . . . . 3.074 1.893 4.255 . . . . . A . 19 LEU H . . A . 16 SER HA . . . 19 . HN . . . . . 16 . HA . . c30643_6pv2 1 348 1 OR . 1 1 22 22 HIS HD2 H . . . 1 1 23 23 LYS HG2 H . . . . . 3.081 1.895 4.267 . . . . . A . 22 HIS HD2 . . A . 23 LYS HG2 . . . 22 . HD2 . . . . . 23 . HG1 . . c30643_6pv2 1 348 2 OR . 1 1 22 22 HIS HD2 H . . . 1 1 23 23 LYS HG3 H . . . . . 3.081 1.895 4.267 . . . . . A . 22 HIS HD2 . . A . 23 LYS HG3 . . . 22 . HD2 . . . . . 23 . HG2 . . c30643_6pv2 1 349 1 . . 1 1 19 19 LEU HB2 H . . . 1 1 20 20 GLN H H . . . . . 3.082 1.894 4.270 . . . . . A . 19 LEU HB2 . . A . 20 GLN H . . . 19 . HB1 . . . . . 20 . HN . . c30643_6pv2 1 350 1 . . 1 1 22 22 HIS HD2 H . . . 1 1 13 13 PHE HZ H . . . . . 3.096 1.898 4.294 . . . . . A . 22 HIS HD2 . . A . 13 PHE HZ . . . 22 . HD2 . . . . . 13 . HZ . . c30643_6pv2 1 351 1 . . 1 1 24 24 ARG H H . . . 1 1 23 23 LYS HA H . . . . . 3.102 1.899 4.305 . . . . . A . 24 ARG H . . A . 23 LYS HA . . . 24 . HN . . . . . 23 . HA . . c30643_6pv2 1 352 1 OR . 1 1 1 1 ARG HD2 H . . . 1 1 1 1 ARG HG2 H . . . . . 3.103 1.899 4.307 . . . . . A . 1 ARG HD2 . . A . 1 ARG HG2 . . . 1 . HD1 . . . . . 1 . HG1 . . c30643_6pv2 1 352 2 OR . 1 1 1 1 ARG HD3 H . . . 1 1 1 1 ARG HG2 H . . . . . 3.103 1.899 4.307 . . . . . A . 1 ARG HD3 . . A . 1 ARG HG2 . . . 1 . HD2 . . . . . 1 . HG1 . . c30643_6pv2 1 353 1 . . 1 1 5 5 CYS HB2 H . . . 1 1 11 11 LYS H H . . . . . 3.103 1.899 4.307 . . . . . A . 5 CYS HB2 . . A . 11 LYS H . . . 5 . HB1 . . . . . 11 . HN . . c30643_6pv2 1 354 1 . . 1 1 27 27 THR HB H . . . 1 1 27 27 THR H H . . . . . 3.105 1.900 4.310 . . . . . A . 27 THR HB . . A . 27 THR H . . . 27 . HB . . . . . 27 . HN . . c30643_6pv2 1 355 1 . . 1 1 18 18 GLU HA H . . . 1 1 19 19 LEU H H . . . . . 3.107 1.900 4.314 . . . . . A . 18 GLU HA . . A . 19 LEU H . . . 18 . HA . . . . . 19 . HN . . c30643_6pv2 1 356 1 OR . 1 1 15 15 ARG HB2 H . . . 1 1 15 15 ARG H H . . . . . 3.111 1.901 4.321 . . . . . A . 15 ARG HB2 . . A . 15 ARG H . . . 15 . HB1 . . . . . 15 . HN . . c30643_6pv2 1 356 2 OR . 1 1 15 15 ARG HB3 H . . . 1 1 15 15 ARG H H . . . . . 3.111 1.901 4.321 . . . . . A . 15 ARG HB3 . . A . 15 ARG H . . . 15 . HB2 . . . . . 15 . HN . . c30643_6pv2 1 357 1 . . 1 1 27 27 THR HA H . . . 1 1 27 27 THR H H . . . . . 3.111 1.901 4.321 . . . . . A . 27 THR HA . . A . 27 THR H . . . 27 . HA . . . . . 27 . HN . . c30643_6pv2 1 358 1 OR . 1 1 21 21 ARG HA H . . . 1 1 24 24 ARG HD2 H . . . . . 3.112 1.901 4.323 . . . . . A . 21 ARG HA . . A . 24 ARG HD2 . . . 21 . HA . . . . . 24 . HD1 . . c30643_6pv2 1 358 2 OR . 1 1 21 21 ARG HA H . . . 1 1 24 24 ARG HD3 H . . . . . 3.112 1.901 4.323 . . . . . A . 21 ARG HA . . A . 24 ARG HD3 . . . 21 . HA . . . . . 24 . HD2 . . c30643_6pv2 1 359 1 . . 1 1 22 22 HIS HB3 H . . . 1 1 13 13 PHE HZ H . . . . . 3.118 1.903 4.333 . . . . . A . 22 HIS HB3 . . A . 13 PHE HZ . . . 22 . HB2 . . . . . 13 . HZ . . c30643_6pv2 1 360 1 . . 1 1 17 17 ASP H H . . . 1 1 16 16 SER H H . . . . . 3.120 1.903 4.337 . . . . . A . 17 ASP H . . A . 16 SER H . . . 17 . HN . . . . . 16 . HN . . c30643_6pv2 1 361 1 . . 1 1 14 14 THR HA H . . . 1 1 15 15 ARG H H . . . . . 3.122 1.904 4.340 . . . . . A . 14 THR HA . . A . 15 ARG H . . . 14 . HA . . . . . 15 . HN . . c30643_6pv2 1 362 1 OR . 1 1 12 12 ARG H H . . . 1 1 11 11 LYS HB2 H . . . . . 3.129 1.905 4.353 . . . . . A . 12 ARG H . . A . 11 LYS HB2 . . . 12 . HN . . . . . 11 . HB1 . . c30643_6pv2 1 362 2 OR . 1 1 12 12 ARG H H . . . 1 1 11 11 LYS HB3 H . . . . . 3.129 1.905 4.353 . . . . . A . 12 ARG H . . A . 11 LYS HB3 . . . 12 . HN . . . . . 11 . HB2 . . c30643_6pv2 1 363 1 . . 1 1 19 19 LEU HB3 H . . . 1 1 19 19 LEU HG H . . . . . 3.139 1.907 4.371 . . . . . A . 19 LEU HB3 . . A . 19 LEU HG . . . 19 . HB2 . . . . . 19 . HG . . c30643_6pv2 1 364 1 . . 1 1 19 19 LEU HB3 H . . . 1 1 16 16 SER HA H . . . . . 3.145 1.909 4.381 . . . . . A . 19 LEU HB3 . . A . 16 SER HA . . . 19 . HB2 . . . . . 16 . HA . . c30643_6pv2 1 365 1 . . 1 1 6 6 THR MG H . . . 1 1 6 6 THR H H . . . . . 3.147 1.909 4.385 . . . . . A . 6 THR MG . . A . 6 THR H . . . 6 . HG21 . . . . . 6 . HN . . c30643_6pv2 1 366 1 OR . 1 1 29 29 GLU HG2 H . . . 1 1 29 29 GLU H H . . . . . 3.159 1.912 4.406 . . . . . A . 29 GLU HG2 . . A . 29 GLU H . . . 29 . HG1 . . . . . 29 . HN . . c30643_6pv2 1 366 2 OR . 1 1 29 29 GLU HG3 H . . . 1 1 29 29 GLU H H . . . . . 3.159 1.912 4.406 . . . . . A . 29 GLU HG3 . . A . 29 GLU H . . . 29 . HG2 . . . . . 29 . HN . . c30643_6pv2 1 367 1 . . 1 1 17 17 ASP HA H . . . 1 1 18 18 GLU H H . . . . . 3.165 1.913 4.417 . . . . . A . 17 ASP HA . . A . 18 GLU H . . . 17 . HA . . . . . 18 . HN . . c30643_6pv2 1 368 1 . . 1 1 17 17 ASP H H . . . 1 1 16 16 SER HB2 H . . . . . 3.165 1.913 4.417 . . . . . A . 17 ASP H . . A . 16 SER HB2 . . . 17 . HN . . . . . 16 . HB1 . . c30643_6pv2 1 369 1 . . 1 1 26 26 HIS H H . . . 1 1 25 25 THR HA H . . . . . 3.171 1.914 4.428 . . . . . A . 26 HIS H . . A . 25 THR HA . . . 26 . HN . . . . . 25 . HA . . c30643_6pv2 1 370 1 . . 1 1 10 10 GLY HA3 H . . . 1 1 4 4 NLE HE1 H . . . . . 3.175 1.915 4.435 . . . . . A . 10 GLY HA3 . . A . 4 NLE HE1 . . . 10 . HA2 . . . . . 4 . HE1 . . c30643_6pv2 1 371 1 . . 1 1 10 10 GLY HA2 H . . . 1 1 6 6 THR H H . . . . . 3.177 1.915 4.439 . . . . . A . 10 GLY HA2 . . A . 6 THR H . . . 10 . HA1 . . . . . 6 . HN . . c30643_6pv2 1 372 1 . . 1 1 10 10 GLY HA2 H . . . 1 1 4 4 NLE HE1 H . . . . . 3.179 1.915 4.443 . . . . . A . 10 GLY HA2 . . A . 4 NLE HE1 . . . 10 . HA1 . . . . . 4 . HE1 . . c30643_6pv2 1 373 1 . . 1 1 30 30 LYS H H . . . 1 1 30 30 LYS HB2 H . . . . . 3.184 1.917 4.451 . . . . . A . 30 LYS H . . A . 30 LYS HB2 . . . 30 . HN . . . . . 30 . HB1 . . c30643_6pv2 1 374 1 . . 1 1 19 19 LEU MD1 H . . . 1 1 4 4 NLE HA H . . . . . 3.186 1.917 4.455 . . . . . A . 19 LEU MD1 . . A . 4 NLE HA . . . 19 . HD11 . . . . . 4 . HA . . c30643_6pv2 1 375 1 . . 1 1 26 26 HIS H H . . . 1 1 23 23 LYS HA H . . . . . 3.188 1.918 4.458 . . . . . A . 26 HIS H . . A . 23 LYS HA . . . 26 . HN . . . . . 23 . HA . . c30643_6pv2 1 376 1 OR . 1 1 3 3 PHE HE2 H . . . 1 1 16 16 SER HA H . . . . . 3.188 1.918 4.458 . . . . . A . 3 PHE HE2 . . A . 16 SER HA . . . 3 . HE2 . . . . . 16 . HA . . c30643_6pv2 1 376 2 OR . 1 1 3 3 PHE HE1 H . . . 1 1 16 16 SER HA H . . . . . 3.188 1.918 4.458 . . . . . A . 3 PHE HE1 . . A . 16 SER HA . . . 3 . HE1 . . . . . 16 . HA . . c30643_6pv2 1 377 1 OR . 1 1 15 15 ARG HB2 H . . . 1 1 16 16 SER H H . . . . . 3.190 1.918 4.462 . . . . . A . 15 ARG HB2 . . A . 16 SER H . . . 15 . HB1 . . . . . 16 . HN . . c30643_6pv2 1 377 2 OR . 1 1 15 15 ARG HB3 H . . . 1 1 16 16 SER H H . . . . . 3.190 1.918 4.462 . . . . . A . 15 ARG HB3 . . A . 16 SER H . . . 15 . HB2 . . . . . 16 . HN . . c30643_6pv2 1 378 1 OR . 1 1 3 3 PHE HD2 H . . . 1 1 16 16 SER HB3 H . . . . . 3.201 1.920 4.482 . . . . . A . 3 PHE HD2 . . A . 16 SER HB3 . . . 3 . HD2 . . . . . 16 . HB2 . . c30643_6pv2 1 378 2 OR . 1 1 3 3 PHE HD1 H . . . 1 1 16 16 SER HB3 H . . . . . 3.201 1.920 4.482 . . . . . A . 3 PHE HD1 . . A . 16 SER HB3 . . . 3 . HD1 . . . . . 16 . HB2 . . c30643_6pv2 1 379 1 OR . 1 1 13 13 PHE HE2 H . . . 1 1 13 13 PHE HB2 H . . . . . 3.201 1.920 4.482 . . . . . A . 13 PHE HE2 . . A . 13 PHE HB2 . . . 13 . HE2 . . . . . 13 . HB1 . . c30643_6pv2 1 379 2 OR . 1 1 13 13 PHE HE1 H . . . 1 1 13 13 PHE HB2 H . . . . . 3.201 1.920 4.482 . . . . . A . 13 PHE HE1 . . A . 13 PHE HB2 . . . 13 . HE1 . . . . . 13 . HB1 . . c30643_6pv2 1 380 1 . . 1 1 25 25 THR H H . . . 1 1 23 23 LYS HA H . . . . . 3.215 1.923 4.507 . . . . . A . 25 THR H . . A . 23 LYS HA . . . 25 . HN . . . . . 23 . HA . . c30643_6pv2 1 381 1 . . 1 1 20 20 GLN H H . . . 1 1 19 19 LEU HG H . . . . . 3.229 1.926 4.532 . . . . . A . 20 GLN H . . A . 19 LEU HG . . . 20 . HN . . . . . 19 . HG . . c30643_6pv2 1 382 1 . . 1 1 27 27 THR HB H . . . 1 1 28 28 GLY H H . . . . . 3.231 1.926 4.536 . . . . . A . 27 THR HB . . A . 28 GLY H . . . 27 . HB . . . . . 28 . HN . . c30643_6pv2 1 383 1 . . 1 1 24 24 ARG HA H . . . 1 1 27 27 THR H H . . . . . 3.233 1.926 4.540 . . . . . A . 24 ARG HA . . A . 27 THR H . . . 24 . HA . . . . . 27 . HN . . c30643_6pv2 1 384 1 . . 1 1 19 19 LEU HA H . . . 1 1 22 22 HIS HD2 H . . . . . 3.236 1.927 4.545 . . . . . A . 19 LEU HA . . A . 22 HIS HD2 . . . 19 . HA . . . . . 22 . HD2 . . c30643_6pv2 1 385 1 . . 1 1 19 19 LEU HB2 H . . . 1 1 16 16 SER HA H . . . . . 3.240 1.927 4.553 . . . . . A . 19 LEU HB2 . . A . 16 SER HA . . . 19 . HB1 . . . . . 16 . HA . . c30643_6pv2 1 386 1 . . 1 1 19 19 LEU H H . . . 1 1 13 13 PHE HB3 H . . . . . 3.240 1.927 4.553 . . . . . A . 19 LEU H . . A . 13 PHE HB3 . . . 19 . HN . . . . . 13 . HB2 . . c30643_6pv2 1 387 1 . . 1 1 29 29 GLU HA H . . . 1 1 29 29 GLU HB3 H . . . . . 3.245 1.928 4.562 . . . . . A . 29 GLU HA . . A . 29 GLU HB3 . . . 29 . HA . . . . . 29 . HB2 . . c30643_6pv2 1 388 1 . . 1 1 23 23 LYS H H . . . 1 1 22 22 HIS HA H . . . . . 3.250 1.929 4.571 . . . . . A . 23 LYS H . . A . 22 HIS HA . . . 23 . HN . . . . . 22 . HA . . c30643_6pv2 1 389 1 . . 1 1 13 13 PHE HA H . . . 1 1 15 15 ARG H H . . . . . 3.263 1.932 4.594 . . . . . A . 13 PHE HA . . A . 15 ARG H . . . 13 . HA . . . . . 15 . HN . . c30643_6pv2 1 390 1 . . 1 1 6 6 THR MG H . . . 1 1 5 5 CYS HA H . . . . . 3.278 1.935 4.621 . . . . . A . 6 THR MG . . A . 5 CYS HA . . . 6 . HG21 . . . . . 5 . HA . . c30643_6pv2 1 391 1 . . 1 1 5 5 CYS HB3 H . . . 1 1 6 6 THR H H . . . . . 3.281 1.935 4.627 . . . . . A . 5 CYS HB3 . . A . 6 THR H . . . 5 . HB2 . . . . . 6 . HN . . c30643_6pv2 1 392 1 . . 1 1 22 22 HIS HD2 H . . . 1 1 5 5 CYS HA H . . . . . 3.281 1.935 4.627 . . . . . A . 22 HIS HD2 . . A . 5 CYS HA . . . 22 . HD2 . . . . . 5 . HA . . c30643_6pv2 1 393 1 . . 1 1 15 15 ARG HG2 H . . . 1 1 18 18 GLU H H . . . . . 3.289 1.937 4.641 . . . . . A . 15 ARG HG2 . . A . 18 GLU H . . . 15 . HG1 . . . . . 18 . HN . . c30643_6pv2 1 394 1 . . 1 1 13 13 PHE H H . . . 1 1 4 4 NLE HA H . . . . . 3.289 1.937 4.641 . . . . . A . 13 PHE H . . A . 4 NLE HA . . . 13 . HN . . . . . 4 . HA . . c30643_6pv2 1 395 1 OR . 1 1 11 11 LYS HG2 H . . . 1 1 22 22 HIS HE1 H . . . . . 3.294 1.937 4.651 . . . . . A . 11 LYS HG2 . . A . 22 HIS HE1 . . . 11 . HG1 . . . . . 22 . HE1 . . c30643_6pv2 1 395 2 OR . 1 1 11 11 LYS HG3 H . . . 1 1 22 22 HIS HE1 H . . . . . 3.294 1.937 4.651 . . . . . A . 11 LYS HG3 . . A . 22 HIS HE1 . . . 11 . HG2 . . . . . 22 . HE1 . . c30643_6pv2 1 396 1 . . 1 1 26 26 HIS HB2 H . . . 1 1 7 7 TRP HD1 H . . . . . 3.300 1.939 4.661 . . . . . A . 26 HIS HB2 . . A . 7 TRP HD1 . . . 26 . HB1 . . . . . 7 . HD1 . . c30643_6pv2 1 397 1 OR . 1 1 23 23 LYS HB2 H . . . 1 1 26 26 HIS HD2 H . . . . . 3.308 1.940 4.676 . . . . . A . 23 LYS HB2 . . A . 26 HIS HD2 . . . 23 . HB1 . . . . . 26 . HD2 . . c30643_6pv2 1 397 2 OR . 1 1 23 23 LYS HB3 H . . . 1 1 26 26 HIS HD2 H . . . . . 3.308 1.940 4.676 . . . . . A . 23 LYS HB3 . . A . 26 HIS HD2 . . . 23 . HB2 . . . . . 26 . HD2 . . c30643_6pv2 1 398 1 . . 1 1 23 23 LYS H H . . . 1 1 22 22 HIS HD2 H . . . . . 3.317 1.942 4.692 . . . . . A . 23 LYS H . . A . 22 HIS HD2 . . . 23 . HN . . . . . 22 . HD2 . . c30643_6pv2 1 399 1 . . 1 1 20 20 GLN H H . . . 1 1 19 19 LEU HA H . . . . . 3.317 1.942 4.692 . . . . . A . 20 GLN H . . A . 19 LEU HA . . . 20 . HN . . . . . 19 . HA . . c30643_6pv2 1 400 1 OR . 1 1 23 23 LYS HB2 H . . . 1 1 22 22 HIS HD2 H . . . . . 3.319 1.942 4.696 . . . . . A . 23 LYS HB2 . . A . 22 HIS HD2 . . . 23 . HB1 . . . . . 22 . HD2 . . c30643_6pv2 1 400 2 OR . 1 1 23 23 LYS HB3 H . . . 1 1 22 22 HIS HD2 H . . . . . 3.319 1.942 4.696 . . . . . A . 23 LYS HB3 . . A . 22 HIS HD2 . . . 23 . HB2 . . . . . 22 . HD2 . . c30643_6pv2 1 401 1 OR . 1 1 23 23 LYS HD2 H . . . 1 1 22 22 HIS HD2 H . . . . . 3.331 1.944 4.718 . . . . . A . 23 LYS HD2 . . A . 22 HIS HD2 . . . 23 . HD1 . . . . . 22 . HD2 . . c30643_6pv2 1 401 2 OR . 1 1 23 23 LYS HD3 H . . . 1 1 22 22 HIS HD2 H . . . . . 3.331 1.944 4.718 . . . . . A . 23 LYS HD3 . . A . 22 HIS HD2 . . . 23 . HD2 . . . . . 22 . HD2 . . c30643_6pv2 1 402 1 OR . 1 1 13 13 PHE HE2 H . . . 1 1 5 5 CYS H H . . . . . 3.337 1.945 4.729 . . . . . A . 13 PHE HE2 . . A . 5 CYS H . . . 13 . HE2 . . . . . 5 . HN . . c30643_6pv2 1 402 2 OR . 1 1 13 13 PHE HE1 H . . . 1 1 5 5 CYS H H . . . . . 3.337 1.945 4.729 . . . . . A . 13 PHE HE1 . . A . 5 CYS H . . . 13 . HE1 . . . . . 5 . HN . . c30643_6pv2 1 403 1 OR . 1 1 3 3 PHE HE2 H . . . 1 1 3 3 PHE HB3 H . . . . . 3.343 1.946 4.740 . . . . . A . 3 PHE HE2 . . A . 3 PHE HB3 . . . 3 . HE2 . . . . . 3 . HB2 . . c30643_6pv2 1 403 2 OR . 1 1 3 3 PHE HE1 H . . . 1 1 3 3 PHE HB3 H . . . . . 3.343 1.946 4.740 . . . . . A . 3 PHE HE1 . . A . 3 PHE HB3 . . . 3 . HE1 . . . . . 3 . HB2 . . c30643_6pv2 1 404 1 . . 1 1 26 26 HIS HE1 H . . . 1 1 7 7 TRP HD1 H . . . . . 3.343 1.946 4.740 . . . . . A . 26 HIS HE1 . . A . 7 TRP HD1 . . . 26 . HE1 . . . . . 7 . HD1 . . c30643_6pv2 1 405 1 OR . 1 1 26 26 HIS HD2 H . . . 1 1 23 23 LYS HG2 H . . . . . 3.346 1.947 4.745 . . . . . A . 26 HIS HD2 . . A . 23 LYS HG2 . . . 26 . HD2 . . . . . 23 . HG1 . . c30643_6pv2 1 405 2 OR . 1 1 26 26 HIS HD2 H . . . 1 1 23 23 LYS HG3 H . . . . . 3.346 1.947 4.745 . . . . . A . 26 HIS HD2 . . A . 23 LYS HG3 . . . 26 . HD2 . . . . . 23 . HG2 . . c30643_6pv2 1 406 1 . . 1 1 19 19 LEU MD1 H . . . 1 1 5 5 CYS H H . . . . . 3.358 1.948 4.768 . . . . . A . 19 LEU MD1 . . A . 5 CYS H . . . 19 . HD11 . . . . . 5 . HN . . c30643_6pv2 1 407 1 . . 1 1 20 20 GLN H H . . . 1 1 19 19 LEU MD2 H . . . . . 3.358 1.948 4.768 . . . . . A . 20 GLN H . . A . 19 LEU MD2 . . . 20 . HN . . . . . 19 . HD21 . . c30643_6pv2 1 408 1 . . 1 1 7 7 TRP H H . . . 1 1 7 7 TRP HD1 H . . . . . 3.361 1.949 4.773 . . . . . A . 7 TRP H . . A . 7 TRP HD1 . . . 7 . HN . . . . . 7 . HD1 . . c30643_6pv2 1 409 1 . . 1 1 17 17 ASP HB3 H . . . 1 1 18 18 GLU H H . . . . . 3.361 1.949 4.773 . . . . . A . 17 ASP HB3 . . A . 18 GLU H . . . 17 . HB2 . . . . . 18 . HN . . c30643_6pv2 1 410 1 . . 1 1 24 24 ARG HA H . . . 1 1 25 25 THR H H . . . . . 3.368 1.950 4.786 . . . . . A . 24 ARG HA . . A . 25 THR H . . . 24 . HA . . . . . 25 . HN . . c30643_6pv2 1 411 1 OR . 1 1 13 13 PHE HE2 H . . . 1 1 12 12 ARG HA H . . . . . 3.371 1.951 4.791 . . . . . A . 13 PHE HE2 . . A . 12 ARG HA . . . 13 . HE2 . . . . . 12 . HA . . c30643_6pv2 1 411 2 OR . 1 1 13 13 PHE HE1 H . . . 1 1 12 12 ARG HA H . . . . . 3.371 1.951 4.791 . . . . . A . 13 PHE HE1 . . A . 12 ARG HA . . . 13 . HE1 . . . . . 12 . HA . . c30643_6pv2 1 412 1 OR . 1 1 13 13 PHE HE2 H . . . 1 1 13 13 PHE HA H . . . . . 3.371 1.951 4.791 . . . . . A . 13 PHE HE2 . . A . 13 PHE HA . . . 13 . HE2 . . . . . 13 . HA . . c30643_6pv2 1 412 2 OR . 1 1 13 13 PHE HE1 H . . . 1 1 13 13 PHE HA H . . . . . 3.371 1.951 4.791 . . . . . A . 13 PHE HE1 . . A . 13 PHE HA . . . 13 . HE1 . . . . . 13 . HA . . c30643_6pv2 1 413 1 . . 1 1 25 25 THR MG H . . . 1 1 22 22 HIS HE1 H . . . . . 3.381 1.953 4.809 . . . . . A . 25 THR MG . . A . 22 HIS HE1 . . . 25 . HG21 . . . . . 22 . HE1 . . c30643_6pv2 1 414 1 . . 1 1 24 24 ARG HA H . . . 1 1 26 26 HIS H H . . . . . 3.394 1.954 4.834 . . . . . A . 24 ARG HA . . A . 26 HIS H . . . 24 . HA . . . . . 26 . HN . . c30643_6pv2 1 415 1 . . 1 1 13 13 PHE HZ H . . . 1 1 22 22 HIS HE1 H . . . . . 3.411 1.957 4.865 . . . . . A . 13 PHE HZ . . A . 22 HIS HE1 . . . 13 . HZ . . . . . 22 . HE1 . . c30643_6pv2 1 416 1 OR . 1 1 23 23 LYS HD2 H . . . 1 1 26 26 HIS HD2 H . . . . . 3.411 1.957 4.865 . . . . . A . 23 LYS HD2 . . A . 26 HIS HD2 . . . 23 . HD1 . . . . . 26 . HD2 . . c30643_6pv2 1 416 2 OR . 1 1 23 23 LYS HD3 H . . . 1 1 26 26 HIS HD2 H . . . . . 3.411 1.957 4.865 . . . . . A . 23 LYS HD3 . . A . 26 HIS HD2 . . . 23 . HD2 . . . . . 26 . HD2 . . c30643_6pv2 1 417 1 . . 1 1 19 19 LEU MD1 H . . . 1 1 19 19 LEU H H . . . . . 3.414 1.957 4.871 . . . . . A . 19 LEU MD1 . . A . 19 LEU H . . . 19 . HD11 . . . . . 19 . HN . . c30643_6pv2 1 418 1 . . 1 1 19 19 LEU H H . . . 1 1 13 13 PHE HB2 H . . . . . 3.418 1.958 4.878 . . . . . A . 19 LEU H . . A . 13 PHE HB2 . . . 19 . HN . . . . . 13 . HB1 . . c30643_6pv2 1 419 1 . . 1 1 15 15 ARG HG2 H . . . 1 1 15 15 ARG HA H . . . . . 3.421 1.958 4.884 . . . . . A . 15 ARG HG2 . . A . 15 ARG HA . . . 15 . HG1 . . . . . 15 . HA . . c30643_6pv2 1 420 1 OR . 1 1 3 3 PHE HE2 H . . . 1 1 16 16 SER H H . . . . . 3.432 1.960 4.904 . . . . . A . 3 PHE HE2 . . A . 16 SER H . . . 3 . HE2 . . . . . 16 . HN . . c30643_6pv2 1 420 2 OR . 1 1 3 3 PHE HE1 H . . . 1 1 16 16 SER H H . . . . . 3.432 1.960 4.904 . . . . . A . 3 PHE HE1 . . A . 16 SER H . . . 3 . HE1 . . . . . 16 . HN . . c30643_6pv2 1 421 1 . . 1 1 2 2 PRO HA H . . . 1 1 2 2 PRO HG3 H . . . . . 3.443 1.961 4.925 . . . . . A . 2 PRO HA . . A . 2 PRO HG3 . . . 2 . HA . . . . . 2 . HG2 . . c30643_6pv2 1 422 1 . . 1 1 2 2 PRO HB3 H . . . 1 1 3 3 PHE H H . . . . . 3.447 1.962 4.932 . . . . . A . 2 PRO HB3 . . A . 3 PHE H . . . 2 . HB2 . . . . . 3 . HN . . c30643_6pv2 1 423 1 OR . 1 1 1 1 ARG HB2 H . . . 1 1 2 2 PRO HD3 H . . . . . 3.454 1.963 4.945 . . . . . A . 1 ARG HB2 . . A . 2 PRO HD3 . . . 1 . HB1 . . . . . 2 . HD2 . . c30643_6pv2 1 423 2 OR . 1 1 1 1 ARG HB3 H . . . 1 1 2 2 PRO HD3 H . . . . . 3.454 1.963 4.945 . . . . . A . 1 ARG HB3 . . A . 2 PRO HD3 . . . 1 . HB2 . . . . . 2 . HD2 . . c30643_6pv2 1 424 1 . . 1 1 21 21 ARG H H . . . 1 1 17 17 ASP HA H . . . . . 3.466 1.965 4.967 . . . . . A . 21 ARG H . . A . 17 ASP HA . . . 21 . HN . . . . . 17 . HA . . c30643_6pv2 1 425 1 . . 1 1 26 26 HIS HE1 H . . . 1 1 7 7 TRP HB3 H . . . . . 3.477 1.965 4.989 . . . . . A . 26 HIS HE1 . . A . 7 TRP HB3 . . . 26 . HE1 . . . . . 7 . HB2 . . c30643_6pv2 1 426 1 . . 1 1 15 15 ARG HG3 H . . . 1 1 14 14 THR HB H . . . . . 3.485 1.966 5.004 . . . . . A . 15 ARG HG3 . . A . 14 THR HB . . . 15 . HG2 . . . . . 14 . HB . . c30643_6pv2 1 427 1 . . 1 1 19 19 LEU MD1 H . . . 1 1 13 13 PHE HB2 H . . . . . 3.485 1.966 5.004 . . . . . A . 19 LEU MD1 . . A . 13 PHE HB2 . . . 19 . HD11 . . . . . 13 . HB1 . . c30643_6pv2 1 428 1 . . 1 1 5 5 CYS HB3 H . . . 1 1 10 10 GLY H H . . . . . 3.494 1.968 5.020 . . . . . A . 5 CYS HB3 . . A . 10 GLY H . . . 5 . HB2 . . . . . 10 . HN . . c30643_6pv2 1 429 1 . . 1 1 17 17 ASP H H . . . 1 1 16 16 SER HB3 H . . . . . 3.506 1.969 5.043 . . . . . A . 17 ASP H . . A . 16 SER HB3 . . . 17 . HN . . . . . 16 . HB2 . . c30643_6pv2 1 430 1 . . 1 1 27 27 THR MG H . . . 1 1 28 28 GLY H H . . . . . 3.515 1.971 5.059 . . . . . A . 27 THR MG . . A . 28 GLY H . . . 27 . HG21 . . . . . 28 . HN . . c30643_6pv2 1 431 1 OR . 1 1 18 18 GLU HA H . . . 1 1 13 13 PHE HD2 H . . . . . 3.528 1.973 5.083 . . . . . A . 18 GLU HA . . A . 13 PHE HD2 . . . 18 . HA . . . . . 13 . HD2 . . c30643_6pv2 1 431 2 OR . 1 1 18 18 GLU HA H . . . 1 1 13 13 PHE HD1 H . . . . . 3.528 1.973 5.083 . . . . . A . 18 GLU HA . . A . 13 PHE HD1 . . . 18 . HA . . . . . 13 . HD1 . . c30643_6pv2 1 432 1 . . 1 1 22 22 HIS HD2 H . . . 1 1 22 22 HIS HE1 H . . . . . 3.532 1.973 5.091 . . . . . A . 22 HIS HD2 . . A . 22 HIS HE1 . . . 22 . HD2 . . . . . 22 . HE1 . . c30643_6pv2 1 433 1 . . 1 1 8 8 ORN HD3 H . . . 1 1 7 7 TRP HD1 H . . . . . 3.536 1.973 5.099 . . . . . A . 8 ORN HD3 . . A . 7 TRP HD1 . . . 8 . HD2 . . . . . 7 . HD1 . . c30643_6pv2 1 434 1 . . 1 1 9 9 CYS HB2 H . . . 1 1 7 7 TRP HD1 H . . . . . 3.536 1.973 5.099 . . . . . A . 9 CYS HB2 . . A . 7 TRP HD1 . . . 9 . HB1 . . . . . 7 . HD1 . . c30643_6pv2 1 435 1 . . 1 1 6 6 THR HA H . . . 1 1 9 9 CYS HB3 H . . . . . 3.569 1.977 5.161 . . . . . A . 6 THR HA . . A . 9 CYS HB3 . . . 6 . HA . . . . . 9 . HB2 . . c30643_6pv2 1 436 1 . . 1 1 19 19 LEU MD2 H . . . 1 1 19 19 LEU H H . . . . . 3.569 1.977 5.161 . . . . . A . 19 LEU MD2 . . A . 19 LEU H . . . 19 . HD21 . . . . . 19 . HN . . c30643_6pv2 1 437 1 . . 1 1 26 26 HIS H H . . . 1 1 25 25 THR HB H . . . . . 3.598 1.980 5.216 . . . . . A . 26 HIS H . . A . 25 THR HB . . . 26 . HN . . . . . 25 . HB . . c30643_6pv2 1 438 1 . . 1 1 26 26 HIS HE1 H . . . 1 1 26 26 HIS HD2 H . . . . . 3.635 1.984 5.286 . . . . . A . 26 HIS HE1 . . A . 26 HIS HD2 . . . 26 . HE1 . . . . . 26 . HD2 . . c30643_6pv2 1 439 1 . . 1 1 20 20 GLN H H . . . 1 1 16 16 SER HA H . . . . . 3.662 1.985 5.339 . . . . . A . 20 GLN H . . A . 16 SER HA . . . 20 . HN . . . . . 16 . HA . . c30643_6pv2 1 440 1 . . 1 1 17 17 ASP H H . . . 1 1 16 16 SER HA H . . . . . 3.713 1.989 5.437 . . . . . A . 17 ASP H . . A . 16 SER HA . . . 17 . HN . . . . . 16 . HA . . c30643_6pv2 1 441 1 . . 1 1 20 20 GLN H H . . . 1 1 18 18 GLU H H . . . . . 3.764 1.993 5.535 . . . . . A . 20 GLN H . . A . 18 GLU H . . . 20 . HN . . . . . 18 . HN . . c30643_6pv2 1 442 1 . . 1 1 2 2 PRO HA H . . . 1 1 2 2 PRO HG2 H . . . . . 3.810 1.995 5.625 . . . . . A . 2 PRO HA . . A . 2 PRO HG2 . . . 2 . HA . . . . . 2 . HG1 . . c30643_6pv2 1 443 1 . . 1 1 17 17 ASP HA H . . . 1 1 19 19 LEU H H . . . . . 3.833 1.996 5.670 . . . . . A . 17 ASP HA . . A . 19 LEU H . . . 17 . HA . . . . . 19 . HN . . c30643_6pv2 1 444 1 . . 1 1 26 26 HIS HD2 H . . . 1 1 22 22 HIS HE1 H . . . . . 3.888 1.998 5.778 . . . . . A . 26 HIS HD2 . . A . 22 HIS HE1 . . . 26 . HD2 . . . . . 22 . HE1 . . c30643_6pv2 1 445 1 OR . 1 1 12 12 ARG HB2 H . . . 1 1 2 2 PRO HG3 H . . . . . 4.023 2.000 6.046 . . . . . A . 12 ARG HB2 . . A . 2 PRO HG3 . . . 12 . HB1 . . . . . 2 . HG2 . . c30643_6pv2 1 445 2 OR . 1 1 12 12 ARG HB3 H . . . 1 1 2 2 PRO HG3 H . . . . . 4.023 2.000 6.046 . . . . . A . 12 ARG HB3 . . A . 2 PRO HG3 . . . 12 . HB2 . . . . . 2 . HG2 . . c30643_6pv2 1 stop_ loop_ _Gen_dist_constraint_parse_err.ID _Gen_dist_constraint_parse_err.Content _Gen_dist_constraint_parse_err.Begin_line _Gen_dist_constraint_parse_err.Begin_column _Gen_dist_constraint_parse_err.End_line _Gen_dist_constraint_parse_err.End_column _Gen_dist_constraint_parse_err.Entry_ID _Gen_dist_constraint_parse_err.Gen_dist_constraint_list_ID 1 '# Restraints file 1: wsh2032_ambig.tbl' 1 1 1 38 c30643_6pv2 1 2 '# Restraints file 2: wsh2032_unambig.tbl' 131 1 131 40 c30643_6pv2 1 stop_ loop_ _Gen_dist_constraint_comment_org.ID _Gen_dist_constraint_comment_org.Comment_text _Gen_dist_constraint_comment_org.Comment_begin_line _Gen_dist_constraint_comment_org.Comment_begin_column _Gen_dist_constraint_comment_org.Comment_end_line _Gen_dist_constraint_comment_org.Comment_end_column _Gen_dist_constraint_comment_org.Entry_ID _Gen_dist_constraint_comment_org.Gen_dist_constraint_list_ID 1 'spec=NOESY, no=5, id=2, vol=1.060000e+09' 2 127 2 169 c30643_6pv2 1 2 'spec=NOESY, no=14, id=11, vol=4.640000e+08' 4 127 4 171 c30643_6pv2 1 3 'spec=NOESY, no=52, id=49, vol=1.700000e+08' 8 127 8 171 c30643_6pv2 1 4 'spec=NOESY, no=75, id=72, vol=1.360000e+08' 10 127 10 171 c30643_6pv2 1 5 'spec=NOESY, no=97, id=94, vol=1.120000e+08' 14 127 14 171 c30643_6pv2 1 6 'spec=NOESY, no=103, id=100, vol=1.080000e+08' 16 127 16 173 c30643_6pv2 1 7 'spec=NOESY, no=115, id=112, vol=1.000000e+08' 18 127 18 173 c30643_6pv2 1 8 'spec=NOESY, no=127, id=124, vol=9.360000e+07' 21 127 21 173 c30643_6pv2 1 9 'spec=NOESY, no=129, id=126, vol=9.300000e+07' 23 127 23 173 c30643_6pv2 1 10 'spec=NOESY, no=137, id=134, vol=9.080000e+07' 29 127 29 173 c30643_6pv2 1 11 'spec=NOESY, no=149, id=146, vol=8.600000e+07' 32 127 32 173 c30643_6pv2 1 12 'spec=NOESY, no=165, id=162, vol=7.840000e+07' 35 127 35 173 c30643_6pv2 1 13 'spec=NOESY, no=199, id=196, vol=6.740000e+07' 38 127 38 173 c30643_6pv2 1 14 'spec=NOESY, no=212, id=209, vol=6.330000e+07' 42 127 42 173 c30643_6pv2 1 15 'spec=NOESY, no=221, id=218, vol=6.140000e+07' 44 127 44 173 c30643_6pv2 1 16 'spec=NOESY, no=254, id=250, vol=5.140000e+07' 46 127 46 173 c30643_6pv2 1 17 'spec=NOESY, no=269, id=265, vol=4.740000e+07' 48 127 48 173 c30643_6pv2 1 18 'spec=NOESY, no=273, id=269, vol=4.660000e+07' 50 127 50 173 c30643_6pv2 1 19 'spec=NOESY, no=285, id=281, vol=4.350000e+07' 52 127 52 173 c30643_6pv2 1 20 'spec=NOESY, no=306, id=302, vol=3.950000e+07' 57 127 57 173 c30643_6pv2 1 21 'spec=NOESY, no=315, id=311, vol=3.700000e+07' 60 127 60 173 c30643_6pv2 1 22 'spec=NOESY, no=335, id=331, vol=3.380000e+07' 64 127 64 173 c30643_6pv2 1 23 'spec=NOESY, no=336, id=332, vol=3.330000e+07' 67 127 67 173 c30643_6pv2 1 24 'spec=NOESY, no=356, id=351, vol=3.070000e+07' 70 127 70 173 c30643_6pv2 1 25 'spec=NOESY, no=376, id=371, vol=2.780000e+07' 76 127 76 173 c30643_6pv2 1 26 'spec=NOESY, no=379, id=374, vol=2.710000e+07' 82 127 82 173 c30643_6pv2 1 27 'spec=NOESY, no=380, id=375, vol=2.700000e+07' 85 127 85 173 c30643_6pv2 1 28 'spec=NOESY, no=413, id=408, vol=2.070000e+07' 88 127 88 173 c30643_6pv2 1 29 'spec=NOESY, no=426, id=421, vol=1.880000e+07' 96 127 96 173 c30643_6pv2 1 30 'spec=NOESY, no=433, id=427, vol=1.800000e+07' 102 127 102 173 c30643_6pv2 1 31 'spec=NOESY, no=440, id=434, vol=1.740000e+07' 105 127 105 173 c30643_6pv2 1 32 'spec=NOESY, no=443, id=437, vol=1.680000e+07' 111 127 111 173 c30643_6pv2 1 33 'spec=NOESY, no=447, id=441, vol=1.620000e+07' 117 127 117 173 c30643_6pv2 1 34 'spec=NOESY, no=455, id=449, vol=1.500000e+07' 119 127 119 173 c30643_6pv2 1 35 'spec=NOESY, no=461, id=455, vol=1.440000e+07' 121 127 121 173 c30643_6pv2 1 36 'spec=NOESY, no=476, id=470, vol=1.110000e+07' 123 127 123 173 c30643_6pv2 1 37 'spec=NOESY, no=478, id=472, vol=1.010000e+07' 125 127 125 173 c30643_6pv2 1 38 'spec=NOESY, no=479, id=473, vol=9.940000e+06' 127 127 127 173 c30643_6pv2 1 39 'spec=NOESY, no=480, id=474, vol=9.920000e+06' 129 127 129 173 c30643_6pv2 1 40 'spec=NOESY, no=3, id=0, vol=1.730000e+09' 132 127 132 169 c30643_6pv2 1 41 'spec=NOESY, no=6, id=3, vol=9.580000e+08' 134 127 134 169 c30643_6pv2 1 42 'spec=NOESY, no=4, id=1, vol=1.150000e+09' 133 127 133 169 c30643_6pv2 1 43 'spec=NOESY, no=7, id=4, vol=8.590000e+08' 136 127 136 169 c30643_6pv2 1 44 'spec=NOESY, no=8, id=5, vol=7.090000e+08' 137 127 137 169 c30643_6pv2 1 45 'spec=NOESY, no=9, id=6, vol=6.680000e+08' 138 127 138 169 c30643_6pv2 1 46 'spec=NOESY, no=10, id=7, vol=6.330000e+08' 139 127 139 170 c30643_6pv2 1 47 'spec=NOESY, no=12, id=9, vol=4.990000e+08' 141 127 141 170 c30643_6pv2 1 48 'spec=NOESY, no=11, id=8, vol=6.130000e+08' 140 127 140 170 c30643_6pv2 1 49 'spec=NOESY, no=13, id=10, vol=4.750000e+08' 145 127 145 171 c30643_6pv2 1 50 'spec=NOESY, no=16, id=13, vol=3.880000e+08' 147 127 147 171 c30643_6pv2 1 51 'spec=NOESY, no=15, id=12, vol=4.530000e+08' 146 127 146 171 c30643_6pv2 1 52 'spec=NOESY, no=18, id=15, vol=3.500000e+08' 150 127 150 171 c30643_6pv2 1 53 'spec=NOESY, no=17, id=14, vol=3.540000e+08' 149 127 149 171 c30643_6pv2 1 54 'spec=NOESY, no=19, id=16, vol=3.120000e+08' 152 127 152 171 c30643_6pv2 1 55 'spec=NOESY, no=21, id=18, vol=2.980000e+08' 156 127 156 171 c30643_6pv2 1 56 'spec=NOESY, no=20, id=17, vol=3.090000e+08' 155 127 155 171 c30643_6pv2 1 57 'spec=NOESY, no=22, id=19, vol=2.880000e+08' 158 127 158 171 c30643_6pv2 1 58 'spec=NOESY, no=23, id=20, vol=2.710000e+08' 161 127 161 171 c30643_6pv2 1 59 'spec=NOESY, no=25, id=22, vol=2.610000e+08' 163 127 163 171 c30643_6pv2 1 60 'spec=NOESY, no=24, id=21, vol=2.640000e+08' 162 127 162 171 c30643_6pv2 1 61 'spec=NOESY, no=27, id=24, vol=2.480000e+08' 167 127 167 171 c30643_6pv2 1 62 'spec=NOESY, no=26, id=23, vol=2.590000e+08' 166 127 166 171 c30643_6pv2 1 63 'spec=NOESY, no=28, id=25, vol=2.420000e+08' 169 127 169 171 c30643_6pv2 1 64 'spec=NOESY, no=30, id=27, vol=2.150000e+08' 173 127 173 171 c30643_6pv2 1 65 'spec=NOESY, no=29, id=26, vol=2.310000e+08' 172 127 172 171 c30643_6pv2 1 66 'spec=NOESY, no=31, id=28, vol=2.140000e+08' 175 127 175 171 c30643_6pv2 1 67 'spec=NOESY, no=32, id=29, vol=2.120000e+08' 176 127 176 171 c30643_6pv2 1 68 'spec=NOESY, no=34, id=31, vol=2.040000e+08' 178 127 178 171 c30643_6pv2 1 69 'spec=NOESY, no=33, id=30, vol=2.070000e+08' 177 127 177 171 c30643_6pv2 1 70 'spec=NOESY, no=35, id=32, vol=1.990000e+08' 180 127 180 171 c30643_6pv2 1 71 'spec=NOESY, no=37, id=34, vol=1.920000e+08' 182 127 182 171 c30643_6pv2 1 72 'spec=NOESY, no=36, id=33, vol=1.970000e+08' 181 127 181 171 c30643_6pv2 1 73 'spec=NOESY, no=39, id=36, vol=1.910000e+08' 185 127 185 171 c30643_6pv2 1 74 'spec=NOESY, no=38, id=35, vol=1.920000e+08' 184 127 184 171 c30643_6pv2 1 75 'spec=NOESY, no=40, id=37, vol=1.840000e+08' 187 127 187 171 c30643_6pv2 1 76 'spec=NOESY, no=41, id=38, vol=1.830000e+08' 189 127 189 171 c30643_6pv2 1 77 'spec=NOESY, no=42, id=39, vol=1.830000e+08' 191 127 191 171 c30643_6pv2 1 78 'spec=NOESY, no=43, id=40, vol=1.830000e+08' 193 127 193 171 c30643_6pv2 1 79 'spec=NOESY, no=45, id=42, vol=1.770000e+08' 195 127 195 171 c30643_6pv2 1 80 'spec=NOESY, no=44, id=41, vol=1.780000e+08' 194 127 194 171 c30643_6pv2 1 81 'spec=NOESY, no=46, id=43, vol=1.760000e+08' 198 127 198 171 c30643_6pv2 1 82 'spec=NOESY, no=49, id=46, vol=1.720000e+08' 200 127 200 171 c30643_6pv2 1 83 'spec=NOESY, no=48, id=45, vol=1.730000e+08' 199 127 199 171 c30643_6pv2 1 84 'spec=NOESY, no=50, id=47, vol=1.710000e+08' 202 127 202 171 c30643_6pv2 1 85 'spec=NOESY, no=51, id=48, vol=1.700000e+08' 204 127 204 171 c30643_6pv2 1 86 'spec=NOESY, no=53, id=50, vol=1.700000e+08' 207 127 207 171 c30643_6pv2 1 87 'spec=NOESY, no=54, id=51, vol=1.690000e+08' 210 127 210 171 c30643_6pv2 1 88 'spec=NOESY, no=55, id=52, vol=1.680000e+08' 211 127 211 171 c30643_6pv2 1 89 'spec=NOESY, no=56, id=53, vol=1.660000e+08' 212 127 212 171 c30643_6pv2 1 90 'spec=NOESY, no=58, id=55, vol=1.630000e+08' 214 127 214 171 c30643_6pv2 1 91 'spec=NOESY, no=57, id=54, vol=1.640000e+08' 213 127 213 171 c30643_6pv2 1 92 'spec=NOESY, no=59, id=56, vol=1.610000e+08' 216 127 216 171 c30643_6pv2 1 93 'spec=NOESY, no=60, id=57, vol=1.600000e+08' 218 127 218 171 c30643_6pv2 1 94 'spec=NOESY, no=62, id=59, vol=1.570000e+08' 220 127 220 171 c30643_6pv2 1 95 'spec=NOESY, no=61, id=58, vol=1.580000e+08' 219 127 219 171 c30643_6pv2 1 96 'spec=NOESY, no=63, id=60, vol=1.560000e+08' 222 127 222 171 c30643_6pv2 1 97 'spec=NOESY, no=65, id=62, vol=1.500000e+08' 224 127 224 171 c30643_6pv2 1 98 'spec=NOESY, no=66, id=63, vol=1.470000e+08' 225 127 225 171 c30643_6pv2 1 99 'spec=NOESY, no=68, id=65, vol=1.460000e+08' 227 127 227 171 c30643_6pv2 1 100 'spec=NOESY, no=67, id=64, vol=1.460000e+08' 226 127 226 171 c30643_6pv2 1 101 'spec=NOESY, no=69, id=66, vol=1.460000e+08' 229 127 229 171 c30643_6pv2 1 102 'spec=NOESY, no=70, id=67, vol=1.440000e+08' 230 127 230 171 c30643_6pv2 1 103 'spec=NOESY, no=72, id=69, vol=1.420000e+08' 232 127 232 171 c30643_6pv2 1 104 'spec=NOESY, no=71, id=68, vol=1.430000e+08' 231 127 231 171 c30643_6pv2 1 105 'spec=NOESY, no=73, id=70, vol=1.420000e+08' 234 127 234 171 c30643_6pv2 1 106 'spec=NOESY, no=74, id=71, vol=1.390000e+08' 237 127 237 171 c30643_6pv2 1 107 'spec=NOESY, no=76, id=73, vol=1.340000e+08' 239 127 239 171 c30643_6pv2 1 108 'spec=NOESY, no=77, id=74, vol=1.320000e+08' 245 127 245 171 c30643_6pv2 1 109 'spec=NOESY, no=79, id=76, vol=1.300000e+08' 246 127 246 171 c30643_6pv2 1 110 'spec=NOESY, no=80, id=77, vol=1.290000e+08' 247 127 247 171 c30643_6pv2 1 111 'spec=NOESY, no=82, id=79, vol=1.270000e+08' 249 127 249 171 c30643_6pv2 1 112 'spec=NOESY, no=81, id=78, vol=1.290000e+08' 248 127 248 171 c30643_6pv2 1 113 'spec=NOESY, no=83, id=80, vol=1.260000e+08' 252 127 252 171 c30643_6pv2 1 114 'spec=NOESY, no=85, id=82, vol=1.210000e+08' 254 127 254 171 c30643_6pv2 1 115 'spec=NOESY, no=84, id=81, vol=1.220000e+08' 253 127 253 171 c30643_6pv2 1 116 'spec=NOESY, no=86, id=83, vol=1.210000e+08' 256 127 256 171 c30643_6pv2 1 117 'spec=NOESY, no=87, id=84, vol=1.190000e+08' 258 127 258 171 c30643_6pv2 1 118 'spec=NOESY, no=88, id=85, vol=1.190000e+08' 261 127 261 171 c30643_6pv2 1 119 'spec=NOESY, no=89, id=86, vol=1.180000e+08' 264 127 264 171 c30643_6pv2 1 120 'spec=NOESY, no=90, id=87, vol=1.180000e+08' 266 127 266 171 c30643_6pv2 1 121 'spec=NOESY, no=91, id=88, vol=1.180000e+08' 268 127 268 171 c30643_6pv2 1 122 'spec=NOESY, no=93, id=90, vol=1.160000e+08' 272 127 272 171 c30643_6pv2 1 123 'spec=NOESY, no=92, id=89, vol=1.170000e+08' 271 127 271 171 c30643_6pv2 1 124 'spec=NOESY, no=95, id=92, vol=1.130000e+08' 276 127 276 171 c30643_6pv2 1 125 'spec=NOESY, no=94, id=91, vol=1.150000e+08' 275 127 275 171 c30643_6pv2 1 126 'spec=NOESY, no=96, id=93, vol=1.130000e+08' 278 127 278 171 c30643_6pv2 1 127 'spec=NOESY, no=98, id=95, vol=1.120000e+08' 279 127 279 171 c30643_6pv2 1 128 'spec=NOESY, no=99, id=96, vol=1.110000e+08' 280 127 280 171 c30643_6pv2 1 129 'spec=NOESY, no=102, id=99, vol=1.090000e+08' 282 127 282 172 c30643_6pv2 1 130 'spec=NOESY, no=101, id=98, vol=1.090000e+08' 281 127 281 172 c30643_6pv2 1 131 'spec=NOESY, no=104, id=101, vol=1.070000e+08' 285 127 285 173 c30643_6pv2 1 132 'spec=NOESY, no=106, id=103, vol=1.060000e+08' 287 127 287 173 c30643_6pv2 1 133 'spec=NOESY, no=105, id=102, vol=1.070000e+08' 286 127 286 173 c30643_6pv2 1 134 'spec=NOESY, no=107, id=104, vol=1.050000e+08' 291 127 291 173 c30643_6pv2 1 135 'spec=NOESY, no=108, id=105, vol=1.040000e+08' 292 127 292 173 c30643_6pv2 1 136 'spec=NOESY, no=110, id=107, vol=1.030000e+08' 294 127 294 173 c30643_6pv2 1 137 'spec=NOESY, no=109, id=106, vol=1.040000e+08' 293 127 293 173 c30643_6pv2 1 138 'spec=NOESY, no=111, id=108, vol=1.030000e+08' 296 127 296 173 c30643_6pv2 1 139 'spec=NOESY, no=112, id=109, vol=1.010000e+08' 297 127 297 173 c30643_6pv2 1 140 'spec=NOESY, no=113, id=110, vol=1.010000e+08' 298 127 298 173 c30643_6pv2 1 141 'spec=NOESY, no=116, id=113, vol=9.960000e+07' 300 127 300 173 c30643_6pv2 1 142 'spec=NOESY, no=114, id=111, vol=1.010000e+08' 299 127 299 173 c30643_6pv2 1 143 'spec=NOESY, no=117, id=114, vol=9.920000e+07' 302 127 302 173 c30643_6pv2 1 144 'spec=NOESY, no=118, id=115, vol=9.800000e+07' 305 127 305 173 c30643_6pv2 1 145 'spec=NOESY, no=119, id=116, vol=9.750000e+07' 307 127 307 173 c30643_6pv2 1 146 'spec=NOESY, no=120, id=117, vol=9.600000e+07' 308 127 308 173 c30643_6pv2 1 147 'spec=NOESY, no=122, id=119, vol=9.510000e+07' 310 127 310 173 c30643_6pv2 1 148 'spec=NOESY, no=121, id=118, vol=9.510000e+07' 309 127 309 173 c30643_6pv2 1 149 'spec=NOESY, no=124, id=121, vol=9.450000e+07' 313 127 313 173 c30643_6pv2 1 150 'spec=NOESY, no=123, id=120, vol=9.460000e+07' 312 127 312 173 c30643_6pv2 1 151 'spec=NOESY, no=125, id=122, vol=9.450000e+07' 319 127 319 173 c30643_6pv2 1 152 'spec=NOESY, no=126, id=123, vol=9.390000e+07' 320 127 320 173 c30643_6pv2 1 153 'spec=NOESY, no=128, id=125, vol=9.320000e+07' 321 127 321 173 c30643_6pv2 1 154 'spec=NOESY, no=131, id=128, vol=9.260000e+07' 323 127 323 173 c30643_6pv2 1 155 'spec=NOESY, no=130, id=127, vol=9.270000e+07' 322 127 322 173 c30643_6pv2 1 156 'spec=NOESY, no=133, id=130, vol=9.180000e+07' 330 127 330 173 c30643_6pv2 1 157 'spec=NOESY, no=132, id=129, vol=9.220000e+07' 329 127 329 173 c30643_6pv2 1 158 'spec=NOESY, no=135, id=132, vol=9.120000e+07' 333 127 333 173 c30643_6pv2 1 159 'spec=NOESY, no=134, id=131, vol=9.140000e+07' 332 127 332 173 c30643_6pv2 1 160 'spec=NOESY, no=136, id=133, vol=9.090000e+07' 336 127 336 173 c30643_6pv2 1 161 'spec=NOESY, no=138, id=135, vol=9.050000e+07' 340 127 340 173 c30643_6pv2 1 162 'spec=NOESY, no=139, id=136, vol=9.010000e+07' 342 127 342 173 c30643_6pv2 1 163 'spec=NOESY, no=140, id=137, vol=8.980000e+07' 344 127 344 173 c30643_6pv2 1 164 'spec=NOESY, no=142, id=139, vol=8.880000e+07' 347 127 347 173 c30643_6pv2 1 165 'spec=NOESY, no=141, id=138, vol=8.970000e+07' 346 127 346 173 c30643_6pv2 1 166 'spec=NOESY, no=143, id=140, vol=8.840000e+07' 350 127 350 173 c30643_6pv2 1 167 'spec=NOESY, no=145, id=142, vol=8.780000e+07' 352 127 352 173 c30643_6pv2 1 168 'spec=NOESY, no=144, id=141, vol=8.810000e+07' 351 127 351 173 c30643_6pv2 1 169 'spec=NOESY, no=146, id=143, vol=8.770000e+07' 354 127 354 173 c30643_6pv2 1 170 'spec=NOESY, no=147, id=144, vol=8.710000e+07' 356 127 356 173 c30643_6pv2 1 171 'spec=NOESY, no=148, id=145, vol=8.640000e+07' 357 127 357 173 c30643_6pv2 1 172 'spec=NOESY, no=150, id=147, vol=8.530000e+07' 358 127 358 173 c30643_6pv2 1 173 'spec=NOESY, no=152, id=149, vol=8.510000e+07' 360 127 360 173 c30643_6pv2 1 174 'spec=NOESY, no=151, id=148, vol=8.530000e+07' 359 127 359 173 c30643_6pv2 1 175 'spec=NOESY, no=153, id=150, vol=8.480000e+07' 362 127 362 173 c30643_6pv2 1 176 'spec=NOESY, no=154, id=151, vol=8.480000e+07' 363 127 363 173 c30643_6pv2 1 177 'spec=NOESY, no=155, id=152, vol=8.460000e+07' 364 127 364 173 c30643_6pv2 1 178 'spec=NOESY, no=156, id=153, vol=8.390000e+07' 365 127 365 173 c30643_6pv2 1 179 'spec=NOESY, no=157, id=154, vol=8.320000e+07' 366 127 366 173 c30643_6pv2 1 180 'spec=NOESY, no=158, id=155, vol=8.160000e+07' 367 127 367 173 c30643_6pv2 1 181 'spec=NOESY, no=159, id=156, vol=8.150000e+07' 368 127 368 173 c30643_6pv2 1 182 'spec=NOESY, no=160, id=157, vol=8.030000e+07' 369 127 369 173 c30643_6pv2 1 183 'spec=NOESY, no=161, id=158, vol=7.970000e+07' 370 127 370 173 c30643_6pv2 1 184 'spec=NOESY, no=162, id=159, vol=7.960000e+07' 371 127 371 173 c30643_6pv2 1 185 'spec=NOESY, no=164, id=161, vol=7.890000e+07' 373 127 373 173 c30643_6pv2 1 186 'spec=NOESY, no=163, id=160, vol=7.940000e+07' 372 127 372 173 c30643_6pv2 1 187 'spec=NOESY, no=167, id=164, vol=7.810000e+07' 377 127 377 173 c30643_6pv2 1 188 'spec=NOESY, no=166, id=163, vol=7.820000e+07' 376 127 376 173 c30643_6pv2 1 189 'spec=NOESY, no=168, id=165, vol=7.780000e+07' 379 127 379 173 c30643_6pv2 1 190 'spec=NOESY, no=169, id=166, vol=7.690000e+07' 380 127 380 173 c30643_6pv2 1 191 'spec=NOESY, no=171, id=168, vol=7.640000e+07' 382 127 382 173 c30643_6pv2 1 192 'spec=NOESY, no=170, id=167, vol=7.660000e+07' 381 127 381 173 c30643_6pv2 1 193 'spec=NOESY, no=172, id=169, vol=7.600000e+07' 384 127 384 173 c30643_6pv2 1 194 'spec=NOESY, no=173, id=170, vol=7.570000e+07' 386 127 386 173 c30643_6pv2 1 195 'spec=NOESY, no=175, id=172, vol=7.510000e+07' 388 127 388 173 c30643_6pv2 1 196 'spec=NOESY, no=174, id=171, vol=7.560000e+07' 387 127 387 173 c30643_6pv2 1 197 'spec=NOESY, no=176, id=173, vol=7.440000e+07' 390 127 390 173 c30643_6pv2 1 198 'spec=NOESY, no=178, id=175, vol=7.420000e+07' 394 127 394 173 c30643_6pv2 1 199 'spec=NOESY, no=177, id=174, vol=7.420000e+07' 393 127 393 173 c30643_6pv2 1 200 'spec=NOESY, no=180, id=177, vol=7.400000e+07' 397 127 397 173 c30643_6pv2 1 201 'spec=NOESY, no=179, id=176, vol=7.400000e+07' 396 127 396 173 c30643_6pv2 1 202 'spec=NOESY, no=182, id=179, vol=7.390000e+07' 400 127 400 173 c30643_6pv2 1 203 'spec=NOESY, no=181, id=178, vol=7.400000e+07' 399 127 399 173 c30643_6pv2 1 204 'spec=NOESY, no=183, id=180, vol=7.320000e+07' 402 127 402 173 c30643_6pv2 1 205 'spec=NOESY, no=184, id=181, vol=7.310000e+07' 403 127 403 173 c30643_6pv2 1 206 'spec=NOESY, no=185, id=182, vol=7.240000e+07' 404 127 404 173 c30643_6pv2 1 207 'spec=NOESY, no=187, id=184, vol=7.180000e+07' 406 127 406 173 c30643_6pv2 1 208 'spec=NOESY, no=186, id=183, vol=7.220000e+07' 405 127 405 173 c30643_6pv2 1 209 'spec=NOESY, no=189, id=186, vol=7.100000e+07' 408 127 408 173 c30643_6pv2 1 210 'spec=NOESY, no=190, id=187, vol=7.090000e+07' 410 127 410 173 c30643_6pv2 1 211 'spec=NOESY, no=191, id=188, vol=7.070000e+07' 411 127 411 173 c30643_6pv2 1 212 'spec=NOESY, no=192, id=189, vol=7.060000e+07' 412 127 412 173 c30643_6pv2 1 213 'spec=NOESY, no=194, id=191, vol=7.010000e+07' 414 127 414 173 c30643_6pv2 1 214 'spec=NOESY, no=193, id=190, vol=7.020000e+07' 413 127 413 173 c30643_6pv2 1 215 'spec=NOESY, no=195, id=192, vol=6.940000e+07' 416 127 416 173 c30643_6pv2 1 216 'spec=NOESY, no=196, id=193, vol=6.920000e+07' 417 127 417 173 c30643_6pv2 1 217 'spec=NOESY, no=198, id=195, vol=6.820000e+07' 419 127 419 173 c30643_6pv2 1 218 'spec=NOESY, no=197, id=194, vol=6.900000e+07' 418 127 418 173 c30643_6pv2 1 219 'spec=NOESY, no=200, id=197, vol=6.720000e+07' 421 127 421 173 c30643_6pv2 1 220 'spec=NOESY, no=201, id=198, vol=6.630000e+07' 423 127 423 173 c30643_6pv2 1 221 'spec=NOESY, no=202, id=199, vol=6.620000e+07' 424 127 424 173 c30643_6pv2 1 222 'spec=NOESY, no=203, id=200, vol=6.570000e+07' 425 127 425 173 c30643_6pv2 1 223 'spec=NOESY, no=205, id=202, vol=6.480000e+07' 427 127 427 173 c30643_6pv2 1 224 'spec=NOESY, no=204, id=201, vol=6.540000e+07' 426 127 426 173 c30643_6pv2 1 225 'spec=NOESY, no=206, id=203, vol=6.450000e+07' 429 127 429 173 c30643_6pv2 1 226 'spec=NOESY, no=209, id=206, vol=6.360000e+07' 431 127 431 173 c30643_6pv2 1 227 'spec=NOESY, no=207, id=204, vol=6.450000e+07' 430 127 430 173 c30643_6pv2 1 228 'spec=NOESY, no=210, id=207, vol=6.350000e+07' 435 127 435 173 c30643_6pv2 1 229 'spec=NOESY, no=211, id=208, vol=6.350000e+07' 437 127 437 173 c30643_6pv2 1 230 'spec=NOESY, no=213, id=210, vol=6.320000e+07' 439 127 439 173 c30643_6pv2 1 231 'spec=NOESY, no=214, id=211, vol=6.310000e+07' 440 127 440 173 c30643_6pv2 1 232 'spec=NOESY, no=215, id=212, vol=6.230000e+07' 441 127 441 173 c30643_6pv2 1 233 'spec=NOESY, no=217, id=214, vol=6.200000e+07' 443 127 443 173 c30643_6pv2 1 234 'spec=NOESY, no=216, id=213, vol=6.210000e+07' 442 127 442 173 c30643_6pv2 1 235 'spec=NOESY, no=219, id=216, vol=6.190000e+07' 446 127 446 173 c30643_6pv2 1 236 'spec=NOESY, no=218, id=215, vol=6.200000e+07' 445 127 445 173 c30643_6pv2 1 237 'spec=NOESY, no=220, id=217, vol=6.170000e+07' 448 127 448 173 c30643_6pv2 1 238 'spec=NOESY, no=222, id=219, vol=6.140000e+07' 450 127 450 173 c30643_6pv2 1 239 'spec=NOESY, no=223, id=220, vol=6.140000e+07' 451 127 451 173 c30643_6pv2 1 240 'spec=NOESY, no=224, id=221, vol=6.030000e+07' 452 127 452 173 c30643_6pv2 1 241 'spec=NOESY, no=225, id=222, vol=5.990000e+07' 453 127 453 173 c30643_6pv2 1 242 'spec=NOESY, no=227, id=224, vol=5.930000e+07' 455 127 455 173 c30643_6pv2 1 243 'spec=NOESY, no=226, id=223, vol=5.960000e+07' 454 127 454 173 c30643_6pv2 1 244 'spec=NOESY, no=230, id=227, vol=5.790000e+07' 458 127 458 173 c30643_6pv2 1 245 'spec=NOESY, no=228, id=225, vol=5.830000e+07' 457 127 457 173 c30643_6pv2 1 246 'spec=NOESY, no=231, id=228, vol=5.790000e+07' 462 127 462 173 c30643_6pv2 1 247 'spec=NOESY, no=232, id=229, vol=5.730000e+07' 465 127 465 173 c30643_6pv2 1 248 'spec=NOESY, no=233, id=230, vol=5.730000e+07' 466 127 466 173 c30643_6pv2 1 249 'spec=NOESY, no=234, id=231, vol=5.710000e+07' 467 127 467 173 c30643_6pv2 1 250 'spec=NOESY, no=236, id=233, vol=5.620000e+07' 469 127 469 173 c30643_6pv2 1 251 'spec=NOESY, no=235, id=232, vol=5.700000e+07' 468 127 468 173 c30643_6pv2 1 252 'spec=NOESY, no=237, id=234, vol=5.580000e+07' 471 127 471 173 c30643_6pv2 1 253 'spec=NOESY, no=240, id=237, vol=5.560000e+07' 473 127 473 173 c30643_6pv2 1 254 'spec=NOESY, no=238, id=235, vol=5.580000e+07' 472 127 472 173 c30643_6pv2 1 255 'spec=NOESY, no=241, id=238, vol=5.540000e+07' 475 127 475 173 c30643_6pv2 1 256 'spec=NOESY, no=242, id=239, vol=5.520000e+07' 476 127 476 173 c30643_6pv2 1 257 'spec=NOESY, no=244, id=241, vol=5.490000e+07' 478 127 478 173 c30643_6pv2 1 258 'spec=NOESY, no=243, id=240, vol=5.520000e+07' 477 127 477 173 c30643_6pv2 1 259 'spec=NOESY, no=245, id=242, vol=5.470000e+07' 480 127 480 173 c30643_6pv2 1 260 'spec=NOESY, no=246, id=243, vol=5.440000e+07' 482 127 482 173 c30643_6pv2 1 261 'spec=NOESY, no=247, id=244, vol=5.400000e+07' 484 127 484 173 c30643_6pv2 1 262 'spec=NOESY, no=248, id=245, vol=5.340000e+07' 486 127 486 173 c30643_6pv2 1 263 'spec=NOESY, no=249, id=246, vol=5.300000e+07' 488 127 488 173 c30643_6pv2 1 264 'spec=NOESY, no=250, id=247, vol=5.300000e+07' 489 127 489 173 c30643_6pv2 1 265 'spec=NOESY, no=253, id=249, vol=5.180000e+07' 491 127 491 173 c30643_6pv2 1 266 'spec=NOESY, no=251, id=248, vol=5.290000e+07' 490 127 490 173 c30643_6pv2 1 267 'spec=NOESY, no=255, id=251, vol=5.080000e+07' 493 127 493 173 c30643_6pv2 1 268 'spec=NOESY, no=256, id=252, vol=5.040000e+07' 494 127 494 173 c30643_6pv2 1 269 'spec=NOESY, no=257, id=253, vol=5.030000e+07' 495 127 495 173 c30643_6pv2 1 270 'spec=NOESY, no=259, id=255, vol=4.980000e+07' 497 127 497 173 c30643_6pv2 1 271 'spec=NOESY, no=258, id=254, vol=5.000000e+07' 496 127 496 173 c30643_6pv2 1 272 'spec=NOESY, no=261, id=257, vol=4.950000e+07' 500 127 500 173 c30643_6pv2 1 273 'spec=NOESY, no=260, id=256, vol=4.960000e+07' 499 127 499 173 c30643_6pv2 1 274 'spec=NOESY, no=262, id=258, vol=4.940000e+07' 502 127 502 173 c30643_6pv2 1 275 'spec=NOESY, no=263, id=259, vol=4.930000e+07' 503 127 503 173 c30643_6pv2 1 276 'spec=NOESY, no=264, id=260, vol=4.830000e+07' 504 127 504 173 c30643_6pv2 1 277 'spec=NOESY, no=265, id=261, vol=4.800000e+07' 505 127 505 173 c30643_6pv2 1 278 'spec=NOESY, no=267, id=263, vol=4.760000e+07' 507 127 507 173 c30643_6pv2 1 279 'spec=NOESY, no=266, id=262, vol=4.770000e+07' 506 127 506 173 c30643_6pv2 1 280 'spec=NOESY, no=270, id=266, vol=4.710000e+07' 510 127 510 173 c30643_6pv2 1 281 'spec=NOESY, no=268, id=264, vol=4.740000e+07' 509 127 509 173 c30643_6pv2 1 282 'spec=NOESY, no=271, id=267, vol=4.690000e+07' 512 127 512 173 c30643_6pv2 1 283 'spec=NOESY, no=274, id=270, vol=4.630000e+07' 516 127 516 173 c30643_6pv2 1 284 'spec=NOESY, no=272, id=268, vol=4.670000e+07' 515 127 515 173 c30643_6pv2 1 285 'spec=NOESY, no=276, id=272, vol=4.590000e+07' 519 127 519 173 c30643_6pv2 1 286 'spec=NOESY, no=275, id=271, vol=4.590000e+07' 518 127 518 173 c30643_6pv2 1 287 'spec=NOESY, no=279, id=275, vol=4.560000e+07' 522 127 522 173 c30643_6pv2 1 288 'spec=NOESY, no=278, id=274, vol=4.590000e+07' 521 127 521 173 c30643_6pv2 1 289 'spec=NOESY, no=280, id=276, vol=4.490000e+07' 524 127 524 173 c30643_6pv2 1 290 'spec=NOESY, no=282, id=278, vol=4.430000e+07' 525 127 525 173 c30643_6pv2 1 291 'spec=NOESY, no=283, id=279, vol=4.420000e+07' 526 127 526 173 c30643_6pv2 1 292 'spec=NOESY, no=286, id=282, vol=4.350000e+07' 528 127 528 173 c30643_6pv2 1 293 'spec=NOESY, no=284, id=280, vol=4.390000e+07' 527 127 527 173 c30643_6pv2 1 294 'spec=NOESY, no=288, id=284, vol=4.220000e+07' 531 127 531 173 c30643_6pv2 1 295 'spec=NOESY, no=287, id=283, vol=4.270000e+07' 530 127 530 173 c30643_6pv2 1 296 'spec=NOESY, no=290, id=286, vol=4.190000e+07' 534 127 534 173 c30643_6pv2 1 297 'spec=NOESY, no=289, id=285, vol=4.210000e+07' 533 127 533 173 c30643_6pv2 1 298 'spec=NOESY, no=292, id=288, vol=4.180000e+07' 537 127 537 173 c30643_6pv2 1 299 'spec=NOESY, no=291, id=287, vol=4.190000e+07' 536 127 536 173 c30643_6pv2 1 300 'spec=NOESY, no=293, id=289, vol=4.170000e+07' 539 127 539 173 c30643_6pv2 1 301 'spec=NOESY, no=294, id=290, vol=4.160000e+07' 540 127 540 173 c30643_6pv2 1 302 'spec=NOESY, no=295, id=291, vol=4.150000e+07' 541 127 541 173 c30643_6pv2 1 303 'spec=NOESY, no=297, id=293, vol=4.140000e+07' 543 127 543 173 c30643_6pv2 1 304 'spec=NOESY, no=296, id=292, vol=4.150000e+07' 542 127 542 173 c30643_6pv2 1 305 'spec=NOESY, no=299, id=295, vol=4.070000e+07' 546 127 546 173 c30643_6pv2 1 306 'spec=NOESY, no=298, id=294, vol=4.090000e+07' 545 127 545 173 c30643_6pv2 1 307 'spec=NOESY, no=300, id=296, vol=4.020000e+07' 548 127 548 173 c30643_6pv2 1 308 'spec=NOESY, no=301, id=297, vol=4.010000e+07' 550 127 550 173 c30643_6pv2 1 309 'spec=NOESY, no=302, id=298, vol=4.010000e+07' 554 127 554 173 c30643_6pv2 1 310 'spec=NOESY, no=303, id=299, vol=4.000000e+07' 555 127 555 173 c30643_6pv2 1 311 'spec=NOESY, no=305, id=301, vol=3.950000e+07' 557 127 557 173 c30643_6pv2 1 312 'spec=NOESY, no=304, id=300, vol=3.990000e+07' 556 127 556 173 c30643_6pv2 1 313 'spec=NOESY, no=307, id=303, vol=3.920000e+07' 559 127 559 173 c30643_6pv2 1 314 'spec=NOESY, no=308, id=304, vol=3.870000e+07' 560 127 560 173 c30643_6pv2 1 315 'spec=NOESY, no=310, id=306, vol=3.820000e+07' 562 127 562 173 c30643_6pv2 1 316 'spec=NOESY, no=309, id=305, vol=3.830000e+07' 561 127 561 173 c30643_6pv2 1 317 'spec=NOESY, no=311, id=307, vol=3.790000e+07' 564 127 564 173 c30643_6pv2 1 318 'spec=NOESY, no=312, id=308, vol=3.770000e+07' 566 127 566 173 c30643_6pv2 1 319 'spec=NOESY, no=313, id=309, vol=3.730000e+07' 567 127 567 173 c30643_6pv2 1 320 'spec=NOESY, no=314, id=310, vol=3.710000e+07' 568 127 568 173 c30643_6pv2 1 321 'spec=NOESY, no=316, id=312, vol=3.690000e+07' 569 127 569 173 c30643_6pv2 1 322 'spec=NOESY, no=317, id=313, vol=3.680000e+07' 570 127 570 173 c30643_6pv2 1 323 'spec=NOESY, no=318, id=314, vol=3.670000e+07' 571 127 571 173 c30643_6pv2 1 324 'spec=NOESY, no=320, id=316, vol=3.660000e+07' 572 127 572 173 c30643_6pv2 1 325 'spec=NOESY, no=321, id=317, vol=3.650000e+07' 573 127 573 173 c30643_6pv2 1 326 'spec=NOESY, no=322, id=318, vol=3.640000e+07' 574 127 574 173 c30643_6pv2 1 327 'spec=NOESY, no=324, id=320, vol=3.540000e+07' 576 127 576 173 c30643_6pv2 1 328 'spec=NOESY, no=323, id=319, vol=3.620000e+07' 575 127 575 173 c30643_6pv2 1 329 'spec=NOESY, no=326, id=322, vol=3.520000e+07' 579 127 579 173 c30643_6pv2 1 330 'spec=NOESY, no=325, id=321, vol=3.530000e+07' 578 127 578 173 c30643_6pv2 1 331 'spec=NOESY, no=327, id=323, vol=3.490000e+07' 581 127 581 173 c30643_6pv2 1 332 'spec=NOESY, no=328, id=324, vol=3.490000e+07' 582 127 582 173 c30643_6pv2 1 333 'spec=NOESY, no=329, id=325, vol=3.480000e+07' 583 127 583 173 c30643_6pv2 1 334 'spec=NOESY, no=332, id=328, vol=3.460000e+07' 585 127 585 173 c30643_6pv2 1 335 'spec=NOESY, no=331, id=327, vol=3.480000e+07' 584 127 584 173 c30643_6pv2 1 336 'spec=NOESY, no=334, id=330, vol=3.410000e+07' 588 127 588 173 c30643_6pv2 1 337 'spec=NOESY, no=337, id=333, vol=3.320000e+07' 591 127 591 173 c30643_6pv2 1 338 'spec=NOESY, no=338, id=334, vol=3.310000e+07' 592 127 592 173 c30643_6pv2 1 339 'spec=NOESY, no=340, id=336, vol=3.220000e+07' 593 127 593 173 c30643_6pv2 1 340 'spec=NOESY, no=341, id=337, vol=3.210000e+07' 594 127 594 173 c30643_6pv2 1 341 'spec=NOESY, no=343, id=339, vol=3.180000e+07' 596 127 596 173 c30643_6pv2 1 342 'spec=NOESY, no=342, id=338, vol=3.210000e+07' 595 127 595 173 c30643_6pv2 1 343 'spec=NOESY, no=344, id=340, vol=3.170000e+07' 598 127 598 173 c30643_6pv2 1 344 'spec=NOESY, no=346, id=342, vol=3.160000e+07' 600 127 600 173 c30643_6pv2 1 345 'spec=NOESY, no=345, id=341, vol=3.160000e+07' 599 127 599 173 c30643_6pv2 1 346 'spec=NOESY, no=347, id=343, vol=3.150000e+07' 602 127 602 173 c30643_6pv2 1 347 'spec=NOESY, no=350, id=346, vol=3.080000e+07' 604 127 604 173 c30643_6pv2 1 348 'spec=NOESY, no=349, id=345, vol=3.100000e+07' 603 127 603 173 c30643_6pv2 1 349 'spec=NOESY, no=351, id=347, vol=3.080000e+07' 607 127 607 173 c30643_6pv2 1 350 'spec=NOESY, no=353, id=348, vol=3.080000e+07' 608 127 608 173 c30643_6pv2 1 351 'spec=NOESY, no=354, id=349, vol=3.080000e+07' 609 127 609 173 c30643_6pv2 1 352 'spec=NOESY, no=357, id=352, vol=3.070000e+07' 610 127 610 173 c30643_6pv2 1 353 'spec=NOESY, no=359, id=354, vol=3.020000e+07' 612 127 612 173 c30643_6pv2 1 354 'spec=NOESY, no=358, id=353, vol=3.060000e+07' 611 127 611 173 c30643_6pv2 1 355 'spec=NOESY, no=360, id=355, vol=3.010000e+07' 614 127 614 173 c30643_6pv2 1 356 'spec=NOESY, no=361, id=356, vol=2.930000e+07' 615 127 615 173 c30643_6pv2 1 357 'spec=NOESY, no=365, id=360, vol=2.890000e+07' 617 127 617 173 c30643_6pv2 1 358 'spec=NOESY, no=364, id=359, vol=2.900000e+07' 616 127 616 173 c30643_6pv2 1 359 'spec=NOESY, no=366, id=361, vol=2.890000e+07' 619 127 619 173 c30643_6pv2 1 360 'spec=NOESY, no=367, id=362, vol=2.880000e+07' 620 127 620 173 c30643_6pv2 1 361 'spec=NOESY, no=369, id=364, vol=2.850000e+07' 622 127 622 173 c30643_6pv2 1 362 'spec=NOESY, no=368, id=363, vol=2.870000e+07' 621 127 621 173 c30643_6pv2 1 363 'spec=NOESY, no=371, id=366, vol=2.840000e+07' 625 127 625 173 c30643_6pv2 1 364 'spec=NOESY, no=370, id=365, vol=2.850000e+07' 624 127 624 173 c30643_6pv2 1 365 'spec=NOESY, no=372, id=367, vol=2.810000e+07' 627 127 627 173 c30643_6pv2 1 366 'spec=NOESY, no=373, id=368, vol=2.800000e+07' 628 127 628 173 c30643_6pv2 1 367 'spec=NOESY, no=378, id=373, vol=2.750000e+07' 630 127 630 173 c30643_6pv2 1 368 'spec=NOESY, no=375, id=370, vol=2.790000e+07' 629 127 629 173 c30643_6pv2 1 369 'spec=NOESY, no=381, id=376, vol=2.700000e+07' 632 127 632 173 c30643_6pv2 1 370 'spec=NOESY, no=384, id=379, vol=2.660000e+07' 634 127 634 173 c30643_6pv2 1 371 'spec=NOESY, no=382, id=377, vol=2.670000e+07' 633 127 633 173 c30643_6pv2 1 372 'spec=NOESY, no=385, id=380, vol=2.600000e+07' 637 127 637 173 c30643_6pv2 1 373 'spec=NOESY, no=387, id=382, vol=2.570000e+07' 639 127 639 173 c30643_6pv2 1 374 'spec=NOESY, no=388, id=383, vol=2.570000e+07' 640 127 640 173 c30643_6pv2 1 375 'spec=NOESY, no=390, id=385, vol=2.520000e+07' 642 127 642 173 c30643_6pv2 1 376 'spec=NOESY, no=389, id=384, vol=2.540000e+07' 641 127 641 173 c30643_6pv2 1 377 'spec=NOESY, no=393, id=388, vol=2.500000e+07' 646 127 646 173 c30643_6pv2 1 378 'spec=NOESY, no=392, id=387, vol=2.510000e+07' 645 127 645 173 c30643_6pv2 1 379 'spec=NOESY, no=396, id=391, vol=2.470000e+07' 650 127 650 173 c30643_6pv2 1 380 'spec=NOESY, no=395, id=390, vol=2.480000e+07' 649 127 649 173 c30643_6pv2 1 381 'spec=NOESY, no=398, id=393, vol=2.460000e+07' 654 127 654 173 c30643_6pv2 1 382 'spec=NOESY, no=397, id=392, vol=2.460000e+07' 653 127 653 173 c30643_6pv2 1 383 'spec=NOESY, no=399, id=394, vol=2.450000e+07' 656 127 656 173 c30643_6pv2 1 384 'spec=NOESY, no=400, id=395, vol=2.400000e+07' 658 127 658 173 c30643_6pv2 1 385 'spec=NOESY, no=401, id=396, vol=2.400000e+07' 660 127 660 173 c30643_6pv2 1 386 'spec=NOESY, no=402, id=397, vol=2.340000e+07' 662 127 662 173 c30643_6pv2 1 387 'spec=NOESY, no=403, id=398, vol=2.280000e+07' 663 127 663 173 c30643_6pv2 1 388 'spec=NOESY, no=404, id=399, vol=2.270000e+07' 664 127 664 173 c30643_6pv2 1 389 'spec=NOESY, no=405, id=400, vol=2.260000e+07' 665 127 665 173 c30643_6pv2 1 390 'spec=NOESY, no=406, id=401, vol=2.250000e+07' 666 127 666 173 c30643_6pv2 1 391 'spec=NOESY, no=407, id=402, vol=2.230000e+07' 667 127 667 173 c30643_6pv2 1 392 'spec=NOESY, no=408, id=403, vol=2.230000e+07' 668 127 668 173 c30643_6pv2 1 393 'spec=NOESY, no=409, id=404, vol=2.210000e+07' 669 127 669 173 c30643_6pv2 1 394 'spec=NOESY, no=410, id=405, vol=2.190000e+07' 670 127 670 173 c30643_6pv2 1 395 'spec=NOESY, no=412, id=407, vol=2.080000e+07' 672 127 672 173 c30643_6pv2 1 396 'spec=NOESY, no=411, id=406, vol=2.140000e+07' 671 127 671 173 c30643_6pv2 1 397 'spec=NOESY, no=414, id=409, vol=2.070000e+07' 675 127 675 173 c30643_6pv2 1 398 'spec=NOESY, no=415, id=410, vol=2.070000e+07' 676 127 676 173 c30643_6pv2 1 399 'spec=NOESY, no=416, id=411, vol=2.040000e+07' 677 127 677 173 c30643_6pv2 1 400 'spec=NOESY, no=418, id=413, vol=2.020000e+07' 679 127 679 173 c30643_6pv2 1 401 'spec=NOESY, no=417, id=412, vol=2.040000e+07' 678 127 678 173 c30643_6pv2 1 402 'spec=NOESY, no=421, id=416, vol=1.970000e+07' 682 127 682 173 c30643_6pv2 1 403 'spec=NOESY, no=420, id=415, vol=2.000000e+07' 681 127 681 173 c30643_6pv2 1 404 'spec=NOESY, no=422, id=417, vol=1.940000e+07' 684 127 684 173 c30643_6pv2 1 405 'spec=NOESY, no=424, id=419, vol=1.930000e+07' 686 127 686 173 c30643_6pv2 1 406 'spec=NOESY, no=423, id=418, vol=1.940000e+07' 685 127 685 173 c30643_6pv2 1 407 'spec=NOESY, no=425, id=420, vol=1.890000e+07' 688 127 688 173 c30643_6pv2 1 408 'spec=NOESY, no=427, id=422, vol=1.870000e+07' 690 127 690 173 c30643_6pv2 1 409 'spec=NOESY, no=428, id=423, vol=1.850000e+07' 692 127 692 173 c30643_6pv2 1 410 'spec=NOESY, no=430, id=425, vol=1.840000e+07' 695 127 695 173 c30643_6pv2 1 411 'spec=NOESY, no=429, id=424, vol=1.850000e+07' 694 127 694 173 c30643_6pv2 1 412 'spec=NOESY, no=432, id=426, vol=1.800000e+07' 697 127 697 173 c30643_6pv2 1 413 'spec=NOESY, no=434, id=428, vol=1.800000e+07' 700 127 700 173 c30643_6pv2 1 414 'spec=NOESY, no=435, id=429, vol=1.790000e+07' 703 127 703 173 c30643_6pv2 1 415 'spec=NOESY, no=436, id=430, vol=1.790000e+07' 704 127 704 173 c30643_6pv2 1 416 'spec=NOESY, no=438, id=432, vol=1.760000e+07' 706 127 706 173 c30643_6pv2 1 417 'spec=NOESY, no=437, id=431, vol=1.770000e+07' 705 127 705 173 c30643_6pv2 1 418 'spec=NOESY, no=439, id=433, vol=1.760000e+07' 708 127 708 173 c30643_6pv2 1 419 'spec=NOESY, no=441, id=435, vol=1.730000e+07' 710 127 710 173 c30643_6pv2 1 420 'spec=NOESY, no=442, id=436, vol=1.690000e+07' 713 127 713 173 c30643_6pv2 1 421 'spec=NOESY, no=445, id=439, vol=1.640000e+07' 715 127 715 173 c30643_6pv2 1 422 'spec=NOESY, no=444, id=438, vol=1.640000e+07' 714 127 714 173 c30643_6pv2 1 423 'spec=NOESY, no=446, id=440, vol=1.630000e+07' 717 127 717 173 c30643_6pv2 1 424 'spec=NOESY, no=448, id=442, vol=1.620000e+07' 720 127 720 173 c30643_6pv2 1 425 'spec=NOESY, no=450, id=444, vol=1.580000e+07' 722 127 722 173 c30643_6pv2 1 426 'spec=NOESY, no=449, id=443, vol=1.610000e+07' 721 127 721 173 c30643_6pv2 1 427 'spec=NOESY, no=452, id=446, vol=1.550000e+07' 724 127 724 173 c30643_6pv2 1 428 'spec=NOESY, no=454, id=448, vol=1.520000e+07' 726 127 726 173 c30643_6pv2 1 429 'spec=NOESY, no=453, id=447, vol=1.540000e+07' 725 127 725 173 c30643_6pv2 1 430 'spec=NOESY, no=456, id=450, vol=1.490000e+07' 728 127 728 173 c30643_6pv2 1 431 'spec=NOESY, no=458, id=452, vol=1.460000e+07' 729 127 729 173 c30643_6pv2 1 432 'spec=NOESY, no=460, id=454, vol=1.440000e+07' 731 127 731 173 c30643_6pv2 1 433 'spec=NOESY, no=459, id=453, vol=1.440000e+07' 730 127 730 173 c30643_6pv2 1 434 'spec=NOESY, no=462, id=456, vol=1.420000e+07' 734 127 734 173 c30643_6pv2 1 435 'spec=NOESY, no=464, id=458, vol=1.370000e+07' 736 127 736 173 c30643_6pv2 1 436 'spec=NOESY, no=463, id=457, vol=1.390000e+07' 735 127 735 173 c30643_6pv2 1 437 'spec=NOESY, no=465, id=459, vol=1.340000e+07' 739 127 739 173 c30643_6pv2 1 438 'spec=NOESY, no=466, id=460, vol=1.330000e+07' 741 127 741 173 c30643_6pv2 1 439 'spec=NOESY, no=467, id=461, vol=1.320000e+07' 742 127 742 173 c30643_6pv2 1 440 'spec=NOESY, no=468, id=462, vol=1.320000e+07' 743 127 743 173 c30643_6pv2 1 441 'spec=NOESY, no=471, id=465, vol=1.250000e+07' 745 127 745 173 c30643_6pv2 1 442 'spec=NOESY, no=470, id=464, vol=1.250000e+07' 744 127 744 173 c30643_6pv2 1 443 'spec=NOESY, no=473, id=467, vol=1.190000e+07' 748 127 748 173 c30643_6pv2 1 444 'spec=NOESY, no=474, id=468, vol=1.170000e+07' 749 127 749 173 c30643_6pv2 1 445 'spec=NOESY, no=475, id=469, vol=1.120000e+07' 750 127 750 173 c30643_6pv2 1 446 'spec=NOESY, no=477, id=471, vol=1.070000e+07' 751 127 751 173 c30643_6pv2 1 447 'spec=NOESY, no=481, id=475, vol=9.850000e+06' 752 127 752 173 c30643_6pv2 1 448 'spec=NOESY, no=483, id=477, vol=9.080000e+06' 753 127 753 173 c30643_6pv2 1 449 'spec=NOESY, no=484, id=478, vol=8.440000e+06' 754 127 754 173 c30643_6pv2 1 450 'spec=NOESY, no=485, id=479, vol=8.140000e+06' 755 127 755 173 c30643_6pv2 1 451 'spec=NOESY, no=487, id=481, vol=6.090000e+06' 757 127 757 173 c30643_6pv2 1 452 'spec=NOESY, no=486, id=480, vol=7.470000e+06' 756 127 756 173 c30643_6pv2 1 stop_ loop_ _Gen_dist_constraint_conv_err.ID _Gen_dist_constraint_conv_err.Gen_dist_constraint_parse_file_ID _Gen_dist_constraint_conv_err.Parse_file_constraint_ID _Gen_dist_constraint_conv_err.Conv_error_type _Gen_dist_constraint_conv_err.Conv_error_note _Gen_dist_constraint_conv_err.Entry_ID _Gen_dist_constraint_conv_err.Gen_dist_constraint_list_ID 1 2 64 1 "Not handling restraint 64, item 1, resonance(s) ' .8.HE' (nmrStar names) not linked" c30643_6pv2 1 2 2 98 1 "Not handling restraint 98, item 1, resonance(s) ' .8.HE' (nmrStar names) not linked" c30643_6pv2 1 3 2 164 1 "Not handling restraint 164, item 1, resonance(s) ' .8.HE' (nmrStar names) not linked" c30643_6pv2 1 4 2 208 1 "Not handling restraint 208, item 2, resonance(s) ' .8.HE' (nmrStar names) not linked" c30643_6pv2 1 5 2 208 1 "Not handling restraint 208, item 3, resonance(s) ' .8.HE' (nmrStar names) not linked" c30643_6pv2 1 6 2 252 1 "Not handling restraint 252, item 1, resonance(s) ' .8.HE' (nmrStar names) not linked" c30643_6pv2 1 7 2 295 1 "Not handling restraint 295, item 2, resonance(s) ' .8.HE' (nmrStar names) not linked" c30643_6pv2 1 8 2 295 1 "Not handling restraint 295, item 3, resonance(s) ' .8.HE' (nmrStar names) not linked" c30643_6pv2 1 9 2 444 1 "Not handling restraint 444, item 1, resonance(s) ' .8.HE' (nmrStar names) not linked" c30643_6pv2 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 c30643_6pv2 _Gen_dist_constraint_list.ID 2 _Gen_dist_constraint_list.Constraint_type 'hydrogen bond' _Gen_dist_constraint_list.Details 'Generated by Wattos' _Gen_dist_constraint_list.Constraint_file_ID 1 _Gen_dist_constraint_list.Block_ID 3 loop_ _Gen_dist_constraint_software.Software_ID _Gen_dist_constraint_software.Software_label _Gen_dist_constraint_software.Method_ID _Gen_dist_constraint_software.Method_label _Gen_dist_constraint_software.Entry_ID _Gen_dist_constraint_software.Gen_dist_constraint_list_ID . . . . c30643_6pv2 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 3 3 PHE H H . . . 1 1 13 13 PHE O O . . . . . 1.9 1.8 2.0 . . . . . A . 3 PHE H . . A . 13 PHE O . . . 3 . HN . . . . . 13 . O . . c30643_6pv2 2 2 1 . . 1 1 13 13 PHE O O . . . 1 1 3 3 PHE N N . . . . . 2.9 2.7 3.1 . . . . . A . 13 PHE O . . A . 3 PHE N . . . 13 . O . . . . . 3 . N . . c30643_6pv2 2 3 1 . . 1 1 13 13 PHE H H . . . 1 1 3 3 PHE O O . . . . . 1.9 1.8 2.0 . . . . . A . 13 PHE H . . A . 3 PHE O . . . 13 . HN . . . . . 3 . O . . c30643_6pv2 2 4 1 . . 1 1 3 3 PHE O O . . . 1 1 13 13 PHE N N . . . . . 2.9 2.7 3.1 . . . . . A . 3 PHE O . . A . 13 PHE N . . . 3 . O . . . . . 13 . N . . c30643_6pv2 2 5 1 . . 1 1 5 5 CYS H H . . . 1 1 11 11 LYS O O . . . . . 1.9 1.8 2.0 . . . . . A . 5 CYS H . . A . 11 LYS O . . . 5 . HN . . . . . 11 . O . . c30643_6pv2 2 6 1 . . 1 1 11 11 LYS O O . . . 1 1 5 5 CYS N N . . . . . 2.9 2.7 3.1 . . . . . A . 11 LYS O . . A . 5 CYS N . . . 11 . O . . . . . 5 . N . . c30643_6pv2 2 7 1 . . 1 1 9 9 CYS H H . . . 1 1 7 7 TRP O O . . . . . 1.9 1.8 2.0 . . . . . A . 9 CYS H . . A . 7 TRP O . . . 9 . HN . . . . . 7 . O . . c30643_6pv2 2 8 1 . . 1 1 7 7 TRP O O . . . 1 1 9 9 CYS N N . . . . . 2.9 2.7 3.1 . . . . . A . 7 TRP O . . A . 9 CYS N . . . 7 . O . . . . . 9 . N . . c30643_6pv2 2 9 1 . . 1 1 19 19 LEU H H . . . 1 1 15 15 ARG O O . . . . . 1.9 1.8 2.0 . . . . . A . 19 LEU H . . A . 15 ARG O . . . 19 . HN . . . . . 15 . O . . c30643_6pv2 2 10 1 . . 1 1 15 15 ARG O O . . . 1 1 19 19 LEU N N . . . . . 2.9 2.7 3.1 . . . . . A . 15 ARG O . . A . 19 LEU N . . . 15 . O . . . . . 19 . N . . c30643_6pv2 2 11 1 . . 1 1 20 20 GLN H H . . . 1 1 16 16 SER O O . . . . . 1.9 1.8 2.0 . . . . . A . 20 GLN H . . A . 16 SER O . . . 20 . HN . . . . . 16 . O . . c30643_6pv2 2 12 1 . . 1 1 16 16 SER O O . . . 1 1 20 20 GLN N N . . . . . 2.9 2.7 3.1 . . . . . A . 16 SER O . . A . 20 GLN N . . . 16 . O . . . . . 20 . N . . c30643_6pv2 2 13 1 . . 1 1 21 21 ARG H H . . . 1 1 17 17 ASP O O . . . . . 1.9 1.8 2.0 . . . . . A . 21 ARG H . . A . 17 ASP O . . . 21 . HN . . . . . 17 . O . . c30643_6pv2 2 14 1 . . 1 1 17 17 ASP O O . . . 1 1 21 21 ARG N N . . . . . 2.9 2.7 3.1 . . . . . A . 17 ASP O . . A . 21 ARG N . . . 17 . O . . . . . 21 . N . . c30643_6pv2 2 15 1 . . 1 1 22 22 HIS H H . . . 1 1 18 18 GLU O O . . . . . 1.9 1.8 2.0 . . . . . A . 22 HIS H . . A . 18 GLU O . . . 22 . HN . . . . . 18 . O . . c30643_6pv2 2 16 1 . . 1 1 18 18 GLU O O . . . 1 1 22 22 HIS N N . . . . . 2.9 2.7 3.1 . . . . . A . 18 GLU O . . A . 22 HIS N . . . 18 . O . . . . . 22 . N . . c30643_6pv2 2 17 1 . . 1 1 23 23 LYS H H . . . 1 1 19 19 LEU O O . . . . . 1.9 1.8 2.0 . . . . . A . 23 LYS H . . A . 19 LEU O . . . 23 . HN . . . . . 19 . O . . c30643_6pv2 2 18 1 . . 1 1 19 19 LEU O O . . . 1 1 23 23 LYS N N . . . . . 2.9 2.7 3.1 . . . . . A . 19 LEU O . . A . 23 LYS N . . . 19 . O . . . . . 23 . N . . c30643_6pv2 2 19 1 . . 1 1 24 24 ARG H H . . . 1 1 20 20 GLN O O . . . . . 1.9 1.8 2.0 . . . . . A . 24 ARG H . . A . 20 GLN O . . . 24 . HN . . . . . 20 . O . . c30643_6pv2 2 20 1 . . 1 1 20 20 GLN O O . . . 1 1 24 24 ARG N N . . . . . 2.9 2.7 3.1 . . . . . A . 20 GLN O . . A . 24 ARG N . . . 20 . O . . . . . 24 . N . . c30643_6pv2 2 21 1 . . 1 1 24 24 ARG H H . . . 1 1 21 21 ARG O O . . . . . 1.9 1.8 2.0 . . . . . A . 24 ARG H . . A . 21 ARG O . . . 24 . HN . . . . . 21 . O . . c30643_6pv2 2 22 1 . . 1 1 24 24 ARG N N . . . 1 1 21 21 ARG O O . . . . . 2.9 2.7 3.1 . . . . . A . 24 ARG N . . A . 21 ARG O . . . 24 . N . . . . . 21 . O . . c30643_6pv2 2 23 1 . . 1 1 25 25 THR H H . . . 1 1 22 22 HIS O O . . . . . 1.9 1.8 2.0 . . . . . A . 25 THR H . . A . 22 HIS O . . . 25 . HN . . . . . 22 . O . . c30643_6pv2 2 24 1 . . 1 1 22 22 HIS O O . . . 1 1 25 25 THR N N . . . . . 2.9 2.7 3.1 . . . . . A . 22 HIS O . . A . 25 THR N . . . 22 . O . . . . . 25 . N . . c30643_6pv2 2 25 1 . . 1 1 26 26 HIS H H . . . 1 1 23 23 LYS O O . . . . . 1.9 1.8 2.0 . . . . . A . 26 HIS H . . A . 23 LYS O . . . 26 . HN . . . . . 23 . O . . c30643_6pv2 2 26 1 . . 1 1 23 23 LYS O O . . . 1 1 26 26 HIS N N . . . . . 2.9 2.7 3.1 . . . . . A . 23 LYS O . . A . 26 HIS N . . . 23 . O . . . . . 26 . N . . c30643_6pv2 2 27 1 . . 1 1 27 27 THR H H . . . 1 1 23 23 LYS O O . . . . . 1.9 1.8 2.0 . . . . . A . 27 THR H . . A . 23 LYS O . . . 27 . HN . . . . . 23 . O . . c30643_6pv2 2 28 1 . . 1 1 23 23 LYS O O . . . 1 1 27 27 THR N N . . . . . 2.9 2.7 3.1 . . . . . A . 23 LYS O . . A . 27 THR N . . . 23 . O . . . . . 27 . N . . c30643_6pv2 2 stop_ loop_ _Gen_dist_constraint_comment_org.ID _Gen_dist_constraint_comment_org.Comment_text _Gen_dist_constraint_comment_org.Comment_begin_line _Gen_dist_constraint_comment_org.Comment_begin_column _Gen_dist_constraint_comment_org.Comment_end_line _Gen_dist_constraint_comment_org.Comment_end_column _Gen_dist_constraint_comment_org.Entry_ID _Gen_dist_constraint_comment_org.Gen_dist_constraint_list_ID 1 hairpin 2 1 2 9 c30643_6pv2 2 2 helix 12 1 12 7 c30643_6pv2 2 stop_ loop_ _Gen_dist_constraint_parse_err.ID _Gen_dist_constraint_parse_err.Content _Gen_dist_constraint_parse_err.Begin_line _Gen_dist_constraint_parse_err.Begin_column _Gen_dist_constraint_parse_err.End_line _Gen_dist_constraint_parse_err.End_column _Gen_dist_constraint_parse_err.Entry_ID _Gen_dist_constraint_parse_err.Gen_dist_constraint_list_ID 1 '# Restraints file 3: wsh2032_hbonds_v2.tbl' 1 1 1 42 c30643_6pv2 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 c30643_6pv2 _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 . . . . c30643_6pv2 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 2 2 PRO C C . . 1 1 3 3 PHE N N . . 1 1 3 3 PHE CA C . . 1 1 3 3 PHE C C . -160.0 -80.0 . . . A . 2 PRO C . . A . 3 PHE N . . A . 3 PHE CA . . A . 3 PHE C . . . 2 . C . . . . . 3 . N . . . . . 3 . CA . . . . . 3 . C . . c30643_6pv2 1 2 . . 1 1 3 3 PHE C C . . 1 1 4 4 NLE N N . . 1 1 4 4 NLE CA C . . 1 1 4 4 NLE C C . -160.0 -80.0 . . . A . 3 PHE C . . A . 4 NLE N . . A . 4 NLE CA . . A . 4 NLE C . . . 3 . C . . . . . 4 . N . . . . . 4 . CA . . . . . 4 . C . . c30643_6pv2 1 3 . . 1 1 11 11 LYS C C . . 1 1 12 12 ARG N N . . 1 1 12 12 ARG CA C . . 1 1 12 12 ARG C C . -160.0 -80.0 . . . A . 11 LYS C . . A . 12 ARG N . . A . 12 ARG CA . . A . 12 ARG C . . . 11 . C . . . . . 12 . N . . . . . 12 . CA . . . . . 12 . C . . c30643_6pv2 1 4 . . 1 1 14 14 THR C C . . 1 1 15 15 ARG N N . . 1 1 15 15 ARG CA C . . 1 1 15 15 ARG C C . -160.0 -80.0 . . . A . 14 THR C . . A . 15 ARG N . . A . 15 ARG CA . . A . 15 ARG C . . . 14 . C . . . . . 15 . N . . . . . 15 . CA . . . . . 15 . C . . c30643_6pv2 1 5 . . 1 1 17 17 ASP C C . . 1 1 18 18 GLU N N . . 1 1 18 18 GLU CA C . . 1 1 18 18 GLU C C . -90.0 -40.0 . . . A . 17 ASP C . . A . 18 GLU N . . A . 18 GLU CA . . A . 18 GLU C . . . 17 . C . . . . . 18 . N . . . . . 18 . CA . . . . . 18 . C . . c30643_6pv2 1 6 . . 1 1 18 18 GLU C C . . 1 1 19 19 LEU N N . . 1 1 19 19 LEU CA C . . 1 1 19 19 LEU C C . -90.0 -40.0 . . . A . 18 GLU C . . A . 19 LEU N . . A . 19 LEU CA . . A . 19 LEU C . . . 18 . C . . . . . 19 . N . . . . . 19 . CA . . . . . 19 . C . . c30643_6pv2 1 stop_ loop_ _TA_constraint_comment_org.ID _TA_constraint_comment_org.Comment_text _TA_constraint_comment_org.Comment_begin_line _TA_constraint_comment_org.Comment_begin_column _TA_constraint_comment_org.Comment_end_line _TA_constraint_comment_org.Comment_end_column _TA_constraint_comment_org.Entry_ID _TA_constraint_comment_org.Torsion_angle_constraint_list_ID 1 ; Phi angle constraints F3 ; 2 1 4 4 c30643_6pv2 1 2 X4 7 1 7 4 c30643_6pv2 1 3 R12 10 1 10 5 c30643_6pv2 1 4 R15 13 1 13 5 c30643_6pv2 1 5 E18 16 1 16 5 c30643_6pv2 1 6 L19 19 1 19 5 c30643_6pv2 1 stop_ loop_ _TA_constraint_parse_err.ID _TA_constraint_parse_err.Content _TA_constraint_parse_err.Begin_line _TA_constraint_parse_err.Begin_column _TA_constraint_parse_err.End_line _TA_constraint_parse_err.End_column _TA_constraint_parse_err.Entry_ID _TA_constraint_parse_err.Torsion_angle_constraint_list_ID 1 '# Restraints file 4: wsh2032_dihedrals.tbl' 1 1 1 42 c30643_6pv2 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 c30643_6pv2 _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 DNA BINDING PROTEIN 19-JUL-19 6PV2 *TITLE BACKBONE-MODIFIED VARIANT OF ZINC FINGER 2 FROM THE TRANSCRIPTION *TITLE 2 FACTOR SP1 DNA BINDING DOMAIN: ORN IN THE METAL-BINDING TURN *COMPND MOL_ID: 1; *COMPND 2 MOLECULE: TRANSCRIPTION FACTOR SP1; *COMPND 3 CHAIN: A; *COMPND 4 FRAGMENT: DNA-BINDING DOMAIN, ZINC FINGER 2 RESIDUES 654-684; *COMPND 5 ENGINEERED: YES *SOURCE MOL_ID: 1; *SOURCE 2 SYNTHETIC: YES; *SOURCE 3 ORGANISM_SCIENTIFIC: HOMO SAPIENS; *SOURCE 4 ORGANISM_COMMON: HUMAN; *SOURCE 5 ORGANISM_TAXID: 9606 *KEYWDS ZINC FINGER, PROTEOMIMETIC, FOLDAMER, DNA BINDING PROTEIN *EXPDTA SOLUTION NMR *NUMMDL 10 *AUTHOR S.R.RAO,W.S.HORNE *REVDAT 1 24-JUN-20 6PV2 0' save_