data_c30446_6cxn ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID c30446_6cxn _Entry.Title ; HRFLRH peptide NMR structure ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2018-04-03 _Entry.Accession_date 2018-04-03 _Entry.Last_release_date 2018-05-21 _Entry.Original_release_date 2018-05-21 _Entry.Origination author _Entry.Format_name . _Entry.NMR_STAR_version 3.2.0.16 _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype SOLUTION _Entry.Source_data_format . _Entry.Source_data_format_version . _Entry.Generated_software_name . _Entry.Generated_software_version . _Entry.Generated_software_ID 1 _Entry.Generated_software_label $software_1 _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' c30446_6cxn 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 D. Pires D. A.T. . . c30446_6cxn 2 L. Arake L. M.R. . . c30446_6cxn 3 L. Silva L. P. . . c30446_6cxn 4 A. Lopez-Castillo A. . . . c30446_6cxn 5 M. Prates M. V. . . c30446_6cxn 6 C. Nascimento C. J. . . c30446_6cxn 7 C. 'Bloch Jr' C. . . . c30446_6cxn stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID 'Amphibian Skin Secretion' . c30446_6cxn 'METAL BINDING PROTEIN' . c30446_6cxn 'metal affinity and CO2 affinity' . c30446_6cxn stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 c30446_6cxn stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 28 c30446_6cxn '1H chemical shifts' 49 c30446_6cxn stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 1 . . 2018-06-26 . original BMRB . c30446_6cxn stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 6CXN . c30446_6cxn stop_ save_ ############### # Citations # ############### save_citation_1 _Citation.Sf_category citations _Citation.Sf_framecode citation_1 _Citation.Entry_ID c30446_6cxn _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 29933027 _Citation.Full_citation . _Citation.Title ; A Previously Undescribed Hexapeptide His-Arg-Phe-Leu-Arg-His-NH2 From Amphibian Skin Secretion shows CO2 and Metal Biding Affinities ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev Peptides _Citation.Journal_name_full . _Citation.Journal_volume . _Citation.Journal_issue . _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD 0353 _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first . _Citation.Page_last . _Citation.Year 2018 _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.ORCID _Citation_author.Entry_ID _Citation_author.Citation_ID 1 D. Pires D. A.T. . . c30446_6cxn 1 2 L. Arake L. M.R. . . c30446_6cxn 1 3 L. Silva L. P. . . c30446_6cxn 1 4 A. Lopez-Castillo A. . . . c30446_6cxn 1 5 M. Prates M. V. . . c30446_6cxn 1 6 C. Nascimento C. J. . . c30446_6cxn 1 7 C. 'Bloch Jr' C. . . . c30446_6cxn 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID c30446_6cxn _Assembly.ID 1 _Assembly.Name 'Hexapeptide HRFLRH' _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 . . . . . . c30446_6cxn 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID c30446_6cxn _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 ; HRFLRHX ; _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 7 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method syn _Entity.Parent_entity_ID 1 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 867.036 _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 . HIS . c30446_6cxn 1 2 . ARG . c30446_6cxn 1 3 . PHE . c30446_6cxn 1 4 . LEU . c30446_6cxn 1 5 . ARG . c30446_6cxn 1 6 . HIS . c30446_6cxn 1 7 . NH2 . c30446_6cxn 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 . HIS 1 1 c30446_6cxn 1 . ARG 2 2 c30446_6cxn 1 . PHE 3 3 c30446_6cxn 1 . LEU 4 4 c30446_6cxn 1 . ARG 5 5 c30446_6cxn 1 . HIS 6 6 c30446_6cxn 1 . NH2 7 7 c30446_6cxn 1 stop_ save_ #################### # Natural source # #################### save_natural_source _Entity_natural_src_list.Sf_category natural_source _Entity_natural_src_list.Sf_framecode natural_source _Entity_natural_src_list.Entry_ID c30446_6cxn _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 . 536631 organism . 'Phyllomedusa centralis' 'Mato Grosso leaf frog' . . Eukaryota Metazoa Phyllomedusa centralis . . . . . . . . . . . . . c30446_6cxn 1 stop_ save_ ######################### # Experimental source # ######################### save_experimental_source _Entity_experimental_src_list.Sf_category experimental_source _Entity_experimental_src_list.Sf_framecode experimental_source _Entity_experimental_src_list.Entry_ID c30446_6cxn _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' . . . . . . . . . . . . . . . . c30446_6cxn 1 stop_ save_ ################################# # Polymer residues and ligands # ################################# save_chem_comp_NH2 _Chem_comp.Sf_category chem_comp _Chem_comp.Sf_framecode chem_comp_NH2 _Chem_comp.Entry_ID c30446_6cxn _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 c30446_6cxn NH2 N SMILES ACDLabs 10.04 c30446_6cxn NH2 QGZKDVFQNNGYKY-UHFFFAOYAF InChIKey InChI 1.02b c30446_6cxn NH2 [NH2] SMILES CACTVS 3.341 c30446_6cxn NH2 [NH2] SMILES 'OpenEye OEToolkits' 1.5.0 c30446_6cxn NH2 [NH2] SMILES_CANONICAL CACTVS 3.341 c30446_6cxn NH2 [NH2] SMILES_CANONICAL 'OpenEye OEToolkits' 1.5.0 c30446_6cxn 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 c30446_6cxn NH2 l^{2}-azane 'SYSTEMATIC NAME' 'OpenEye OEToolkits' 1.5.0 c30446_6cxn 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 . c30446_6cxn NH2 HN1 HN1 HN1 1HN . H . . N 0 . . . 1 no no . . . . 9.517 . 8.769 . -7.044 . -0.385 -0.545 -0.771 2 . c30446_6cxn NH2 HN2 HN2 HN2 2HN . H . . N 0 . . . 1 no no . . . . 10.323 . 9.890 . -8.082 . 1.020 0.000 0.000 3 . c30446_6cxn 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 . c30446_6cxn NH2 2 . SING N HN2 no N 2 . c30446_6cxn NH2 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID c30446_6cxn _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details '2 mM [U-13C] Hexapeptide, 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 Hexapeptide [U-13C] . . 1 $entity_1 . . 2 . . mM . . . . c30446_6cxn 1 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_1 _Sample_condition_list.Entry_ID c30446_6cxn _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 2 . mM c30446_6cxn 1 pH 4.1 . pH c30446_6cxn 1 pressure 1 . atm c30446_6cxn 1 temperature 298 . K c30446_6cxn 1 stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Software.Sf_category software _Software.Sf_framecode software_1 _Software.Entry_ID c30446_6cxn _Software.ID 1 _Software.Type . _Software.Name CNS _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Brunger, Adams, Clore, Gros, Nilges and Read' . . c30446_6cxn 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID refinement c30446_6cxn 1 'structure calculation' c30446_6cxn 1 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_NMR_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_1 _NMR_spectrometer.Entry_ID c30446_6cxn _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model AvanceIII _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID c30446_6cxn _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 NMR_spectrometer_1 Bruker AvanceIII . 800 . . . c30446_6cxn 1 stop_ save_ ############################# # NMR applied experiments # ############################# save_experiment_list _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode experiment_list _Experiment_list.Entry_ID c30446_6cxn _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 . . . . . . . . . . . . . . . . c30446_6cxn 1 2 '2D 1H-13C HSQC aliphatic' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . c30446_6cxn 1 3 '2D 1H-13C HSQC aromatic' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . c30446_6cxn 1 4 '2D 1H-1H NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . c30446_6cxn 1 5 '2D 1H-1H TOCSY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . c30446_6cxn 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chem_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chem_shift_reference_1 _Chem_shift_reference.Entry_ID c30446_6cxn _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.000 internal indirect 0.25144953 . . . . . c30446_6cxn 1 H 1 DSS 'methyl protons' . . . . ppm 0.000 internal direct 1.0 . . . . . c30446_6cxn 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chemical_shifts_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_1 _Assigned_chem_shift_list.Entry_ID c30446_6cxn _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chem_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-1H TOCSY' . . . c30446_6cxn 1 2 '2D 1H-13C HSQC aliphatic' . . . c30446_6cxn 1 3 '2D 1H-13C HSQC aromatic' . . . c30446_6cxn 1 4 '2D 1H-1H NOESY' . . . c30446_6cxn 1 5 '2D 1H-1H TOCSY' . . . c30446_6cxn 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Ambiguity_set_ID _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 1 1 HIS HA H 1 4.213 . . . . . . . A 1 HIS HA . c30446_6cxn 1 2 . 1 1 1 1 HIS HB2 H 1 3.224 . . . . . . . A 1 HIS HB2 . c30446_6cxn 1 3 . 1 1 1 1 HIS HB3 H 1 3.224 . . . . . . . A 1 HIS HB3 . c30446_6cxn 1 4 . 1 1 1 1 HIS HD2 H 1 7.085 . . . . . . . A 1 HIS HD2 . c30446_6cxn 1 5 . 1 1 1 1 HIS HE1 H 1 8.417 . . . . . . . A 1 HIS HE1 . c30446_6cxn 1 6 . 1 1 1 1 HIS CA C 13 48.922 . . . . . . . A 1 HIS CA . c30446_6cxn 1 7 . 1 1 1 1 HIS CB C 13 34.957 . . . . . . . A 1 HIS CB . c30446_6cxn 1 8 . 1 1 1 1 HIS CD2 C 13 115.636 . . . . . . . A 1 HIS CD2 . c30446_6cxn 1 9 . 1 1 1 1 HIS CE1 C 13 139.555 . . . . . . . A 1 HIS CE1 . c30446_6cxn 1 10 . 1 1 2 2 ARG H H 1 8.674 . . . . . . . A 2 ARG H . c30446_6cxn 1 11 . 1 1 2 2 ARG HA H 1 4.335 . . . . . . . A 2 ARG HA . c30446_6cxn 1 12 . 1 1 2 2 ARG HB2 H 1 1.681 . . . . . . . A 2 ARG HB2 . c30446_6cxn 1 13 . 1 1 2 2 ARG HB3 H 1 1.681 . . . . . . . A 2 ARG HB3 . c30446_6cxn 1 14 . 1 1 2 2 ARG HG2 H 1 1.550 . . . . . . . A 2 ARG HG2 . c30446_6cxn 1 15 . 1 1 2 2 ARG HG3 H 1 1.550 . . . . . . . A 2 ARG HG3 . c30446_6cxn 1 16 . 1 1 2 2 ARG HD2 H 1 3.116 . . . . . . . A 2 ARG HD2 . c30446_6cxn 1 17 . 1 1 2 2 ARG HD3 H 1 3.116 . . . . . . . A 2 ARG HD3 . c30446_6cxn 1 18 . 1 1 2 2 ARG HE H 1 7.116 . . . . . . . A 2 ARG HE . c30446_6cxn 1 19 . 1 1 2 2 ARG CA C 13 49.593 . . . . . . . A 2 ARG CA . c30446_6cxn 1 20 . 1 1 2 2 ARG CB C 13 35.927 . . . . . . . A 2 ARG CB . c30446_6cxn 1 21 . 1 1 2 2 ARG CG C 13 42.388 . . . . . . . A 2 ARG CG . c30446_6cxn 1 22 . 1 1 2 2 ARG CD C 13 42.577 . . . . . . . A 2 ARG CD . c30446_6cxn 1 23 . 1 1 3 3 PHE H H 1 8.620 . . . . . . . A 3 PHE H . c30446_6cxn 1 24 . 1 1 3 3 PHE HA H 1 4.603 . . . . . . . A 3 PHE HA . c30446_6cxn 1 25 . 1 1 3 3 PHE HB2 H 1 3.048 . . . . . . . A 3 PHE HB2 . c30446_6cxn 1 26 . 1 1 3 3 PHE HB3 H 1 2.991 . . . . . . . A 3 PHE HB3 . c30446_6cxn 1 27 . 1 1 3 3 PHE HD1 H 1 7.229 . . . . . . . A 3 PHE HD1 . c30446_6cxn 1 28 . 1 1 3 3 PHE HD2 H 1 7.229 . . . . . . . A 3 PHE HD2 . c30446_6cxn 1 29 . 1 1 3 3 PHE HE1 H 1 7.229 . . . . . . . A 3 PHE HE1 . c30446_6cxn 1 30 . 1 1 3 3 PHE HE2 H 1 7.229 . . . . . . . A 3 PHE HE2 . c30446_6cxn 1 31 . 1 1 3 3 PHE HZ H 1 7.298 . . . . . . . A 3 PHE HZ . c30446_6cxn 1 32 . 1 1 3 3 PHE CA C 13 50.341 . . . . . . . A 3 PHE CA . c30446_6cxn 1 33 . 1 1 3 3 PHE CB C 13 40.705 . . . . . . . A 3 PHE CB . c30446_6cxn 1 34 . 1 1 3 3 PHE CD1 C 13 131.360 . . . . . . . A 3 PHE CD1 . c30446_6cxn 1 35 . 1 1 3 3 PHE CD2 C 13 131.360 . . . . . . . A 3 PHE CD2 . c30446_6cxn 1 36 . 1 1 3 3 PHE CE1 C 13 128.625 . . . . . . . A 3 PHE CE1 . c30446_6cxn 1 37 . 1 1 3 3 PHE CE2 C 13 128.625 . . . . . . . A 3 PHE CE2 . c30446_6cxn 1 38 . 1 1 3 3 PHE CZ C 13 130.706 . . . . . . . A 3 PHE CZ . c30446_6cxn 1 39 . 1 1 4 4 LEU H H 1 8.262 . . . . . . . A 4 LEU H . c30446_6cxn 1 40 . 1 1 4 4 LEU HA H 1 4.315 . . . . . . . A 4 LEU HA . c30446_6cxn 1 41 . 1 1 4 4 LEU HB2 H 1 1.446 . . . . . . . A 4 LEU HB2 . c30446_6cxn 1 42 . 1 1 4 4 LEU HB3 H 1 1.446 . . . . . . . A 4 LEU HB3 . c30446_6cxn 1 43 . 1 1 4 4 LEU HG H 1 1.489 . . . . . . . A 4 LEU HG . c30446_6cxn 1 44 . 1 1 4 4 LEU HD11 H 1 0.778 . . . . . . . A 4 LEU HD11 . c30446_6cxn 1 45 . 1 1 4 4 LEU HD12 H 1 0.778 . . . . . . . A 4 LEU HD11 . c30446_6cxn 1 46 . 1 1 4 4 LEU HD13 H 1 0.778 . . . . . . . A 4 LEU HD11 . c30446_6cxn 1 47 . 1 1 4 4 LEU HD21 H 1 0.841 . . . . . . . A 4 LEU HD21 . c30446_6cxn 1 48 . 1 1 4 4 LEU HD22 H 1 0.841 . . . . . . . A 4 LEU HD21 . c30446_6cxn 1 49 . 1 1 4 4 LEU HD23 H 1 0.841 . . . . . . . A 4 LEU HD21 . c30446_6cxn 1 50 . 1 1 4 4 LEU CA C 13 48.744 . . . . . . . A 4 LEU CA . c30446_6cxn 1 51 . 1 1 4 4 LEU CB C 13 42.405 . . . . . . . A 4 LEU CB . c30446_6cxn 1 52 . 1 1 4 4 LEU CG C 13 33.567 . . . . . . . A 4 LEU CG . c30446_6cxn 1 53 . 1 1 4 4 LEU CD1 C 13 31.832 . . . . . . . A 4 LEU CD1 . c30446_6cxn 1 54 . 1 1 4 4 LEU CD2 C 13 32.515 . . . . . . . A 4 LEU CD2 . c30446_6cxn 1 55 . 1 1 5 5 ARG H H 1 8.294 . . . . . . . A 5 ARG H . c30446_6cxn 1 56 . 1 1 5 5 ARG HA H 1 4.190 . . . . . . . A 5 ARG HA . c30446_6cxn 1 57 . 1 1 5 5 ARG HB2 H 1 1.757 . . . . . . . A 5 ARG HB2 . c30446_6cxn 1 58 . 1 1 5 5 ARG HB3 H 1 1.702 . . . . . . . A 5 ARG HB3 . c30446_6cxn 1 59 . 1 1 5 5 ARG HG2 H 1 1.591 . . . . . . . A 5 ARG HG2 . c30446_6cxn 1 60 . 1 1 5 5 ARG HG3 H 1 1.531 . . . . . . . A 5 ARG HG3 . c30446_6cxn 1 61 . 1 1 5 5 ARG HD2 H 1 3.162 . . . . . . . A 5 ARG HD2 . c30446_6cxn 1 62 . 1 1 5 5 ARG HD3 H 1 3.162 . . . . . . . A 5 ARG HD3 . c30446_6cxn 1 63 . 1 1 5 5 ARG HE H 1 7.179 . . . . . . . A 5 ARG HE . c30446_6cxn 1 64 . 1 1 5 5 ARG CA C 13 49.592 . . . . . . . A 5 ARG CA . c30446_6cxn 1 65 . 1 1 5 5 ARG CB C 13 35.878 . . . . . . . A 5 ARG CB . c30446_6cxn 1 66 . 1 1 5 5 ARG CG C 13 33.720 . . . . . . . A 5 ARG CG . c30446_6cxn 1 67 . 1 1 5 5 ARG CD C 13 42.585 . . . . . . . A 5 ARG CD . c30446_6cxn 1 68 . 1 1 6 6 HIS H H 1 8.567 . . . . . . . A 6 HIS H . c30446_6cxn 1 69 . 1 1 6 6 HIS HA H 1 4.623 . . . . . . . A 6 HIS HA . c30446_6cxn 1 70 . 1 1 6 6 HIS HB2 H 1 3.225 . . . . . . . A 6 HIS HB2 . c30446_6cxn 1 71 . 1 1 6 6 HIS HB3 H 1 3.134 . . . . . . . A 6 HIS HB3 . c30446_6cxn 1 72 . 1 1 6 6 HIS HD2 H 1 7.286 . . . . . . . A 6 HIS HD2 . c30446_6cxn 1 73 . 1 1 6 6 HIS HE1 H 1 8.562 . . . . . . . A 6 HIS HE1 . c30446_6cxn 1 74 . 1 1 6 6 HIS CA C 13 48.955 . . . . . . . A 6 HIS CA . c30446_6cxn 1 75 . 1 1 6 6 HIS CB C 13 34.908 . . . . . . . A 6 HIS CB . c30446_6cxn 1 76 . 1 1 6 6 HIS CD2 C 13 114.267 . . . . . . . A 6 HIS CD2 . c30446_6cxn 1 77 . 1 1 6 6 HIS CE1 C 13 138.183 . . . . . . . A 6 HIS CE1 . c30446_6cxn 1 stop_ save_ ############################## # Structure determinations # ############################## ########################## # Conformer statistics # ########################## save_conformer_statistics _Conformer_stat_list.Sf_category conformer_statistics _Conformer_stat_list.Sf_framecode conformer_statistics _Conformer_stat_list.Entry_ID c30446_6cxn _Conformer_stat_list.ID 1 _Conformer_stat_list.Conf_family_coord_set_ID 1 _Conformer_stat_list.Conf_family_coord_set_label $Original_constraints_and_structures _Conformer_stat_list.Conformer_submitted_total_num 20 save_ ##################################### # Conformer family coordinate set # ##################################### save_ensemble_of_conformers _Conformer_family_coord_set.Sf_category conformer_family_coord_set _Conformer_family_coord_set.Sf_framecode ensemble_of_conformers _Conformer_family_coord_set.Entry_ID c30446_6cxn _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 . . . c30446_6cxn 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 . . . . c30446_6cxn 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 HIS C C 0.199 -6.621 2.984 . . . 1.0 . . . . . . . . . . . . A . 1 HIS C . . . . . . . . . c30446_6cxn 1 . 1 . 2 . 1 1 1 HIS CA C 0.450 -7.978 2.335 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CA . . . . . . . . . c30446_6cxn 1 . 1 . 3 . 1 1 1 HIS CB C 1.808 -7.984 1.631 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CB . . . . . . . . . c30446_6cxn 1 . 1 . 4 . 1 1 1 HIS CD2 C 1.996 -9.551 -0.428 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CD2 . . . . . . . . . c30446_6cxn 1 . 1 . 5 . 1 1 1 HIS CE1 C 2.695 -11.354 0.606 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CE1 . . . . . . . . . c30446_6cxn 1 . 1 . 6 . 1 1 1 HIS CG C 2.092 -9.253 0.890 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CG . . . . . . . . . c30446_6cxn 1 . 1 . 7 . 1 1 1 HIS H1 H -0.536 -9.314 1.119 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H1 . . . . . . . . . c30446_6cxn 1 . 1 . 8 . 1 1 1 HIS H2 H -0.422 -7.721 0.490 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H2 . . . . . . . . . c30446_6cxn 1 . 1 . 9 . 1 1 1 HIS H3 H -1.523 -8.068 1.760 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H3 . . . . . . . . . c30446_6cxn 1 . 1 . 10 . 1 1 1 HIS HA H 0.442 -8.741 3.099 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HA . . . . . . . . . c30446_6cxn 1 . 1 . 11 . 1 1 1 HIS HB2 H 1.840 -7.171 0.921 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HB2 . . . . . . . . . c30446_6cxn 1 . 1 . 12 . 1 1 1 HIS HB3 H 2.587 -7.845 2.366 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HB3 . . . . . . . . . c30446_6cxn 1 . 1 . 13 . 1 1 1 HIS HD1 H 2.700 -10.509 2.470 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HD1 . . . . . . . . . c30446_6cxn 1 . 1 . 14 . 1 1 1 HIS HD2 H 1.680 -8.881 -1.215 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HD2 . . . . . . . . . c30446_6cxn 1 . 1 . 15 . 1 1 1 HIS HE1 H 3.030 -12.362 0.802 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HE1 . . . . . . . . . c30446_6cxn 1 . 1 . 16 . 1 1 1 HIS HE2 H 2.320 -11.379 -1.407 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HE2 . . . . . . . . . c30446_6cxn 1 . 1 . 17 . 1 1 1 HIS N N -0.603 -8.299 1.336 . . . 1.0 . . . . . . . . . . . . A . 1 HIS N . . . . . . . . . c30446_6cxn 1 . 1 . 18 . 1 1 1 HIS ND1 N 2.531 -10.404 1.510 . . . 1.0 . . . . . . . . . . . . A . 1 HIS ND1 . . . . . . . . . c30446_6cxn 1 . 1 . 19 . 1 1 1 HIS NE2 N 2.376 -10.862 -0.577 . . . 1.0 . . . . . . . . . . . . A . 1 HIS NE2 . . . . . . . . . c30446_6cxn 1 . 1 . 20 . 1 1 1 HIS O O -0.060 -6.534 4.184 . . . 1.0 . . . . . . . . . . . . A . 1 HIS O . . . . . . . . . c30446_6cxn 1 . 1 . 21 . 1 1 2 ARG C C -0.805 -3.407 1.714 . . . 1.0 . . . . . . . . . . . . A . 2 ARG C . . . . . . . . . c30446_6cxn 1 . 1 . 22 . 1 1 2 ARG CA C 0.061 -4.210 2.679 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CA . . . . . . . . . c30446_6cxn 1 . 1 . 23 . 1 1 2 ARG CB C 1.400 -3.501 2.891 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CB . . . . . . . . . c30446_6cxn 1 . 1 . 24 . 1 1 2 ARG CD C 2.388 -2.848 5.111 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CD . . . . . . . . . c30446_6cxn 1 . 1 . 25 . 1 1 2 ARG CG C 1.379 -2.493 4.030 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CG . . . . . . . . . c30446_6cxn 1 . 1 . 26 . 1 1 2 ARG CZ C 3.035 -1.969 7.320 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CZ . . . . . . . . . c30446_6cxn 1 . 1 . 27 . 1 1 2 ARG H H 0.489 -5.697 1.234 . . . 1.0 . . . . . . . . . . . . A . 2 ARG H . . . . . . . . . c30446_6cxn 1 . 1 . 28 . 1 1 2 ARG HA H -0.451 -4.283 3.626 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HA . . . . . . . . . c30446_6cxn 1 . 1 . 29 . 1 1 2 ARG HB2 H 2.156 -4.242 3.106 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB2 . . . . . . . . . c30446_6cxn 1 . 1 . 30 . 1 1 2 ARG HB3 H 1.666 -2.981 1.983 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB3 . . . . . . . . . c30446_6cxn 1 . 1 . 31 . 1 1 2 ARG HD2 H 2.064 -3.753 5.604 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD2 . . . . . . . . . c30446_6cxn 1 . 1 . 32 . 1 1 2 ARG HD3 H 3.349 -3.016 4.648 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD3 . . . . . . . . . c30446_6cxn 1 . 1 . 33 . 1 1 2 ARG HE H 2.206 -0.892 5.859 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HE . . . . . . . . . c30446_6cxn 1 . 1 . 34 . 1 1 2 ARG HG2 H 1.618 -1.516 3.636 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG2 . . . . . . . . . c30446_6cxn 1 . 1 . 35 . 1 1 2 ARG HG3 H 0.390 -2.476 4.464 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG3 . . . . . . . . . c30446_6cxn 1 . 1 . 36 . 1 1 2 ARG HH11 H 3.413 -3.939 7.060 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH11 . . . . . . . . . c30446_6cxn 1 . 1 . 37 . 1 1 2 ARG HH12 H 3.858 -3.295 8.605 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH12 . . . . . . . . . c30446_6cxn 1 . 1 . 38 . 1 1 2 ARG HH21 H 2.790 -0.045 7.890 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH21 . . . . . . . . . c30446_6cxn 1 . 1 . 39 . 1 1 2 ARG HH22 H 3.504 -1.086 9.077 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH22 . . . . . . . . . c30446_6cxn 1 . 1 . 40 . 1 1 2 ARG N N 0.279 -5.564 2.182 . . . 1.0 . . . . . . . . . . . . A . 2 ARG N . . . . . . . . . c30446_6cxn 1 . 1 . 41 . 1 1 2 ARG NE N 2.519 -1.787 6.107 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NE . . . . . . . . . c30446_6cxn 1 . 1 . 42 . 1 1 2 ARG NH1 N 3.471 -3.166 7.692 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH1 . . . . . . . . . c30446_6cxn 1 . 1 . 43 . 1 1 2 ARG NH2 N 3.117 -0.949 8.165 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH2 . . . . . . . . . c30446_6cxn 1 . 1 . 44 . 1 1 2 ARG O O -1.181 -3.895 0.648 . . . 1.0 . . . . . . . . . . . . A . 2 ARG O . . . . . . . . . c30446_6cxn 1 . 1 . 45 . 1 1 3 PHE C C -1.109 -0.620 0.192 . . . 1.0 . . . . . . . . . . . . A . 3 PHE C . . . . . . . . . c30446_6cxn 1 . 1 . 46 . 1 1 3 PHE CA C -1.944 -1.304 1.267 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CA . . . . . . . . . c30446_6cxn 1 . 1 . 47 . 1 1 3 PHE CB C -2.653 -0.260 2.127 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CB . . . . . . . . . c30446_6cxn 1 . 1 . 48 . 1 1 3 PHE CD1 C -4.890 -1.222 1.479 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CD1 . . . . . . . . . c30446_6cxn 1 . 1 . 49 . 1 1 3 PHE CD2 C -4.740 1.118 1.917 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CD2 . . . . . . . . . c30446_6cxn 1 . 1 . 50 . 1 1 3 PHE CE1 C -6.239 -1.089 1.213 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CE1 . . . . . . . . . c30446_6cxn 1 . 1 . 51 . 1 1 3 PHE CE2 C -6.090 1.256 1.652 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CE2 . . . . . . . . . c30446_6cxn 1 . 1 . 52 . 1 1 3 PHE CG C -4.124 -0.121 1.834 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CG . . . . . . . . . c30446_6cxn 1 . 1 . 53 . 1 1 3 PHE CZ C -6.840 0.152 1.299 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CZ . . . . . . . . . c30446_6cxn 1 . 1 . 54 . 1 1 3 PHE H H -0.793 -1.843 2.959 . . . 1.0 . . . . . . . . . . . . A . 3 PHE H . . . . . . . . . c30446_6cxn 1 . 1 . 55 . 1 1 3 PHE HA H -2.683 -1.913 0.785 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HA . . . . . . . . . c30446_6cxn 1 . 1 . 56 . 1 1 3 PHE HB2 H -2.547 -0.530 3.171 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HB2 . . . . . . . . . c30446_6cxn 1 . 1 . 57 . 1 1 3 PHE HB3 H -2.189 0.698 1.954 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HB3 . . . . . . . . . c30446_6cxn 1 . 1 . 58 . 1 1 3 PHE HD1 H -4.422 -2.193 1.409 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HD1 . . . . . . . . . c30446_6cxn 1 . 1 . 59 . 1 1 3 PHE HD2 H -4.155 1.983 2.193 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HD2 . . . . . . . . . c30446_6cxn 1 . 1 . 60 . 1 1 3 PHE HE1 H -6.824 -1.954 0.937 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HE1 . . . . . . . . . c30446_6cxn 1 . 1 . 61 . 1 1 3 PHE HE2 H -6.557 2.228 1.720 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HE2 . . . . . . . . . c30446_6cxn 1 . 1 . 62 . 1 1 3 PHE HZ H -7.894 0.258 1.092 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HZ . . . . . . . . . c30446_6cxn 1 . 1 . 63 . 1 1 3 PHE N N -1.121 -2.175 2.097 . . . 1.0 . . . . . . . . . . . . A . 3 PHE N . . . . . . . . . c30446_6cxn 1 . 1 . 64 . 1 1 3 PHE O O 0.120 -0.688 0.206 . . . 1.0 . . . . . . . . . . . . A . 3 PHE O . . . . . . . . . c30446_6cxn 1 . 1 . 65 . 1 1 4 LEU C C -0.839 2.183 -1.472 . . . 1.0 . . . . . . . . . . . . A . 4 LEU C . . . . . . . . . c30446_6cxn 1 . 1 . 66 . 1 1 4 LEU CA C -1.116 0.727 -1.833 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CA . . . . . . . . . c30446_6cxn 1 . 1 . 67 . 1 1 4 LEU CB C -1.956 0.652 -3.107 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CB . . . . . . . . . c30446_6cxn 1 . 1 . 68 . 1 1 4 LEU CD1 C -3.966 -0.744 -2.609 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CD1 . . . . . . . . . c30446_6cxn 1 . 1 . 69 . 1 1 4 LEU CD2 C -2.831 -0.945 -4.830 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CD2 . . . . . . . . . c30446_6cxn 1 . 1 . 70 . 1 1 4 LEU CG C -2.639 -0.694 -3.342 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CG . . . . . . . . . c30446_6cxn 1 . 1 . 71 . 1 1 4 LEU H H -2.766 0.048 -0.699 . . . 1.0 . . . . . . . . . . . . A . 4 LEU H . . . . . . . . . c30446_6cxn 1 . 1 . 72 . 1 1 4 LEU HA H -0.182 0.226 -2.006 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HA . . . . . . . . . c30446_6cxn 1 . 1 . 73 . 1 1 4 LEU HB2 H -2.716 1.418 -3.059 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HB2 . . . . . . . . . c30446_6cxn 1 . 1 . 74 . 1 1 4 LEU HB3 H -1.314 0.857 -3.951 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HB3 . . . . . . . . . c30446_6cxn 1 . 1 . 75 . 1 1 4 LEU HD11 H -4.137 0.200 -2.114 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD11 . . . . . . . . . c30446_6cxn 1 . 1 . 76 . 1 1 4 LEU HD12 H -3.936 -1.533 -1.873 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD12 . . . . . . . . . c30446_6cxn 1 . 1 . 77 . 1 1 4 LEU HD13 H -4.763 -0.935 -3.311 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD13 . . . . . . . . . c30446_6cxn 1 . 1 . 78 . 1 1 4 LEU HD21 H -2.671 -1.992 -5.042 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD21 . . . . . . . . . c30446_6cxn 1 . 1 . 79 . 1 1 4 LEU HD22 H -2.123 -0.352 -5.390 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD22 . . . . . . . . . c30446_6cxn 1 . 1 . 80 . 1 1 4 LEU HD23 H -3.836 -0.670 -5.115 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD23 . . . . . . . . . c30446_6cxn 1 . 1 . 81 . 1 1 4 LEU HG H -2.014 -1.480 -2.944 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HG . . . . . . . . . c30446_6cxn 1 . 1 . 82 . 1 1 4 LEU N N -1.789 0.035 -0.743 . . . 1.0 . . . . . . . . . . . . A . 4 LEU N . . . . . . . . . c30446_6cxn 1 . 1 . 83 . 1 1 4 LEU O O -1.566 2.787 -0.684 . . . 1.0 . . . . . . . . . . . . A . 4 LEU O . . . . . . . . . c30446_6cxn 1 . 1 . 84 . 1 1 5 ARG C C 1.185 4.773 -3.042 . . . 1.0 . . . . . . . . . . . . A . 5 ARG C . . . . . . . . . c30446_6cxn 1 . 1 . 85 . 1 1 5 ARG CA C 0.592 4.126 -1.795 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CA . . . . . . . . . c30446_6cxn 1 . 1 . 86 . 1 1 5 ARG CB C 1.594 4.199 -0.644 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CB . . . . . . . . . c30446_6cxn 1 . 1 . 87 . 1 1 5 ARG CD C 2.623 6.477 -0.411 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CD . . . . . . . . . c30446_6cxn 1 . 1 . 88 . 1 1 5 ARG CG C 1.556 5.523 0.099 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CG . . . . . . . . . c30446_6cxn 1 . 1 . 89 . 1 1 5 ARG CZ C 2.833 8.869 -0.966 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CZ . . . . . . . . . c30446_6cxn 1 . 1 . 90 . 1 1 5 ARG H H 0.759 2.207 -2.674 . . . 1.0 . . . . . . . . . . . . A . 5 ARG H . . . . . . . . . c30446_6cxn 1 . 1 . 91 . 1 1 5 ARG HA H -0.300 4.664 -1.515 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HA . . . . . . . . . c30446_6cxn 1 . 1 . 92 . 1 1 5 ARG HB2 H 1.374 3.407 0.062 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HB2 . . . . . . . . . c30446_6cxn 1 . 1 . 93 . 1 1 5 ARG HB3 H 2.593 4.060 -1.040 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HB3 . . . . . . . . . c30446_6cxn 1 . 1 . 94 . 1 1 5 ARG HD2 H 3.497 6.389 0.216 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HD2 . . . . . . . . . c30446_6cxn 1 . 1 . 95 . 1 1 5 ARG HD3 H 2.878 6.201 -1.424 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HD3 . . . . . . . . . c30446_6cxn 1 . 1 . 96 . 1 1 5 ARG HE H 1.323 8.060 0.057 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HE . . . . . . . . . c30446_6cxn 1 . 1 . 97 . 1 1 5 ARG HG2 H 0.586 5.976 -0.041 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HG2 . . . . . . . . . c30446_6cxn 1 . 1 . 98 . 1 1 5 ARG HG3 H 1.721 5.340 1.149 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HG3 . . . . . . . . . c30446_6cxn 1 . 1 . 99 . 1 1 5 ARG HH11 H 4.353 7.716 -1.639 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH11 . . . . . . . . . c30446_6cxn 1 . 1 . 100 . 1 1 5 ARG HH12 H 4.476 9.401 -2.017 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH12 . . . . . . . . . c30446_6cxn 1 . 1 . 101 . 1 1 5 ARG HH21 H 1.483 10.277 -0.439 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH21 . . . . . . . . . c30446_6cxn 1 . 1 . 102 . 1 1 5 ARG HH22 H 2.848 10.856 -1.336 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH22 . . . . . . . . . c30446_6cxn 1 . 1 . 103 . 1 1 5 ARG N N 0.218 2.740 -2.054 . . . 1.0 . . . . . . . . . . . . A . 5 ARG N . . . . . . . . . c30446_6cxn 1 . 1 . 104 . 1 1 5 ARG NE N 2.168 7.865 -0.398 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NE . . . . . . . . . c30446_6cxn 1 . 1 . 105 . 1 1 5 ARG NH1 N 3.982 8.643 -1.592 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NH1 . . . . . . . . . c30446_6cxn 1 . 1 . 106 . 1 1 5 ARG NH2 N 2.348 10.101 -0.909 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NH2 . . . . . . . . . c30446_6cxn 1 . 1 . 107 . 1 1 5 ARG O O 2.011 4.174 -3.732 . . . 1.0 . . . . . . . . . . . . A . 5 ARG O . . . . . . . . . c30446_6cxn 1 . 1 . 108 . 1 1 6 HIS C C 1.068 8.231 -4.308 . . . 1.0 . . . . . . . . . . . . A . 6 HIS C . . . . . . . . . c30446_6cxn 1 . 1 . 109 . 1 1 6 HIS CA C 1.247 6.727 -4.491 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CA . . . . . . . . . c30446_6cxn 1 . 1 . 110 . 1 1 6 HIS CB C 0.514 6.264 -5.751 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CB . . . . . . . . . c30446_6cxn 1 . 1 . 111 . 1 1 6 HIS CD2 C -1.716 7.214 -4.825 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CD2 . . . . . . . . . c30446_6cxn 1 . 1 . 112 . 1 1 6 HIS CE1 C -3.050 6.506 -6.415 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CE1 . . . . . . . . . c30446_6cxn 1 . 1 . 113 . 1 1 6 HIS CG C -0.957 6.543 -5.724 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CG . . . . . . . . . c30446_6cxn 1 . 1 . 114 . 1 1 6 HIS H H 0.099 6.424 -2.739 . . . 1.0 . . . . . . . . . . . . A . 6 HIS H . . . . . . . . . c30446_6cxn 1 . 1 . 115 . 1 1 6 HIS HA H 2.299 6.512 -4.598 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HA . . . . . . . . . c30446_6cxn 1 . 1 . 116 . 1 1 6 HIS HB2 H 0.933 6.773 -6.611 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HB2 . . . . . . . . . c30446_6cxn 1 . 1 . 117 . 1 1 6 HIS HB3 H 0.649 5.194 -5.864 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HB3 . . . . . . . . . c30446_6cxn 1 . 1 . 118 . 1 1 6 HIS HD1 H -1.575 5.595 -7.502 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HD1 . . . . . . . . . c30446_6cxn 1 . 1 . 119 . 1 1 6 HIS HD2 H -1.366 7.690 -3.920 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HD2 . . . . . . . . . c30446_6cxn 1 . 1 . 120 . 1 1 6 HIS HE1 H -3.933 6.312 -7.004 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HE1 . . . . . . . . . c30446_6cxn 1 . 1 . 121 . 1 1 6 HIS HE2 H -3.795 7.505 -4.789 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HE2 . . . . . . . . . c30446_6cxn 1 . 1 . 122 . 1 1 6 HIS N N 0.758 5.999 -3.326 . . . 1.0 . . . . . . . . . . . . A . 6 HIS N . . . . . . . . . c30446_6cxn 1 . 1 . 123 . 1 1 6 HIS ND1 N -1.823 6.112 -6.707 . . . 1.0 . . . . . . . . . . . . A . 6 HIS ND1 . . . . . . . . . c30446_6cxn 1 . 1 . 124 . 1 1 6 HIS NE2 N -3.011 7.176 -5.278 . . . 1.0 . . . . . . . . . . . . A . 6 HIS NE2 . . . . . . . . . c30446_6cxn 1 . 1 . 125 . 1 1 6 HIS O O 0.555 8.641 -3.246 . . . 1.0 . . . . . . . . . . . . A . 6 HIS O . . . . . . . . . c30446_6cxn 1 . 2 . 126 . 1 1 1 HIS C C -0.310 -6.590 3.044 . . . 1.0 . . . . . . . . . . . . A . 1 HIS C . . . . . . . . . c30446_6cxn 1 . 2 . 127 . 1 1 1 HIS CA C -0.594 -8.010 2.565 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CA . . . . . . . . . c30446_6cxn 1 . 2 . 128 . 1 1 1 HIS CB C -1.380 -8.778 3.629 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CB . . . . . . . . . c30446_6cxn 1 . 2 . 129 . 1 1 1 HIS CD2 C -0.672 -8.631 6.120 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CD2 . . . . . . . . . c30446_6cxn 1 . 2 . 130 . 1 1 1 HIS CE1 C 0.982 -10.068 6.069 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CE1 . . . . . . . . . c30446_6cxn 1 . 2 . 131 . 1 1 1 HIS CG C -0.578 -9.097 4.852 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CG . . . . . . . . . c30446_6cxn 1 . 2 . 132 . 1 1 1 HIS H1 H 1.066 -8.367 1.403 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H1 . . . . . . . . . c30446_6cxn 1 . 2 . 133 . 1 1 1 HIS H2 H 0.431 -9.754 2.190 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H2 . . . . . . . . . c30446_6cxn 1 . 2 . 134 . 1 1 1 HIS H3 H 1.312 -8.584 3.086 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H3 . . . . . . . . . c30446_6cxn 1 . 2 . 135 . 1 1 1 HIS HA H -1.174 -7.965 1.656 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HA . . . . . . . . . c30446_6cxn 1 . 2 . 136 . 1 1 1 HIS HB2 H -2.231 -8.187 3.935 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HB2 . . . . . . . . . c30446_6cxn 1 . 2 . 137 . 1 1 1 HIS HB3 H -1.728 -9.709 3.206 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HB3 . . . . . . . . . c30446_6cxn 1 . 2 . 138 . 1 1 1 HIS HD1 H 0.788 -10.504 4.079 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HD1 . . . . . . . . . c30446_6cxn 1 . 2 . 139 . 1 1 1 HIS HD2 H -1.387 -7.906 6.486 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HD2 . . . . . . . . . c30446_6cxn 1 . 2 . 140 . 1 1 1 HIS HE1 H 1.813 -10.690 6.367 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HE1 . . . . . . . . . c30446_6cxn 1 . 2 . 141 . 1 1 1 HIS HE2 H 0.425 -9.175 7.826 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HE2 . . . . . . . . . c30446_6cxn 1 . 2 . 142 . 1 1 1 HIS N N 0.668 -8.745 2.286 . . . 1.0 . . . . . . . . . . . . A . 1 HIS N . . . . . . . . . c30446_6cxn 1 . 2 . 143 . 1 1 1 HIS ND1 N 0.469 -9.995 4.854 . . . 1.0 . . . . . . . . . . . . A . 1 HIS ND1 . . . . . . . . . c30446_6cxn 1 . 2 . 144 . 1 1 1 HIS NE2 N 0.308 -9.250 6.855 . . . 1.0 . . . . . . . . . . . . A . 1 HIS NE2 . . . . . . . . . c30446_6cxn 1 . 2 . 145 . 1 1 1 HIS O O -0.158 -6.347 4.242 . . . 1.0 . . . . . . . . . . . . A . 1 HIS O . . . . . . . . . c30446_6cxn 1 . 2 . 146 . 1 1 2 ARG C C -0.903 -3.333 1.652 . . . 1.0 . . . . . . . . . . . . A . 2 ARG C . . . . . . . . . c30446_6cxn 1 . 2 . 147 . 1 1 2 ARG CA C 0.025 -4.259 2.428 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CA . . . . . . . . . c30446_6cxn 1 . 2 . 148 . 1 1 2 ARG CB C 1.485 -3.911 2.127 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CB . . . . . . . . . c30446_6cxn 1 . 2 . 149 . 1 1 2 ARG CD C 2.306 -2.756 4.204 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CD . . . . . . . . . c30446_6cxn 1 . 2 . 150 . 1 1 2 ARG CG C 2.395 -4.005 3.341 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CG . . . . . . . . . c30446_6cxn 1 . 2 . 151 . 1 1 2 ARG CZ C 2.142 -2.167 6.591 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CZ . . . . . . . . . c30446_6cxn 1 . 2 . 152 . 1 1 2 ARG H H -0.370 -5.911 1.165 . . . 1.0 . . . . . . . . . . . . A . 2 ARG H . . . . . . . . . c30446_6cxn 1 . 2 . 153 . 1 1 2 ARG HA H -0.157 -4.126 3.484 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HA . . . . . . . . . c30446_6cxn 1 . 2 . 154 . 1 1 2 ARG HB2 H 1.856 -4.589 1.373 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB2 . . . . . . . . . c30446_6cxn 1 . 2 . 155 . 1 1 2 ARG HB3 H 1.532 -2.902 1.746 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB3 . . . . . . . . . c30446_6cxn 1 . 2 . 156 . 1 1 2 ARG HD2 H 3.201 -2.170 4.060 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD2 . . . . . . . . . c30446_6cxn 1 . 2 . 157 . 1 1 2 ARG HD3 H 1.446 -2.180 3.895 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD3 . . . . . . . . . c30446_6cxn 1 . 2 . 158 . 1 1 2 ARG HE H 2.107 -4.026 5.867 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HE . . . . . . . . . c30446_6cxn 1 . 2 . 159 . 1 1 2 ARG HG2 H 2.103 -4.860 3.932 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG2 . . . . . . . . . c30446_6cxn 1 . 2 . 160 . 1 1 2 ARG HG3 H 3.415 -4.128 3.006 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG3 . . . . . . . . . c30446_6cxn 1 . 2 . 161 . 1 1 2 ARG HH11 H 2.324 -0.582 5.347 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH11 . . . . . . . . . c30446_6cxn 1 . 2 . 162 . 1 1 2 ARG HH12 H 2.206 -0.194 7.031 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH12 . . . . . . . . . c30446_6cxn 1 . 2 . 163 . 1 1 2 ARG HH21 H 1.952 -3.518 8.082 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH21 . . . . . . . . . c30446_6cxn 1 . 2 . 164 . 1 1 2 ARG HH22 H 1.996 -1.861 8.584 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH22 . . . . . . . . . c30446_6cxn 1 . 2 . 165 . 1 1 2 ARG N N -0.240 -5.655 2.102 . . . 1.0 . . . . . . . . . . . . A . 2 ARG N . . . . . . . . . c30446_6cxn 1 . 2 . 166 . 1 1 2 ARG NE N 2.175 -3.079 5.623 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NE . . . . . . . . . c30446_6cxn 1 . 2 . 167 . 1 1 2 ARG NH1 N 2.231 -0.875 6.299 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH1 . . . . . . . . . c30446_6cxn 1 . 2 . 168 . 1 1 2 ARG NH2 N 2.020 -2.547 7.856 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH2 . . . . . . . . . c30446_6cxn 1 . 2 . 169 . 1 1 2 ARG O O -1.705 -3.784 0.833 . . . 1.0 . . . . . . . . . . . . A . 2 ARG O . . . . . . . . . c30446_6cxn 1 . 2 . 170 . 1 1 3 PHE C C -0.945 -0.516 -0.012 . . . 1.0 . . . . . . . . . . . . A . 3 PHE C . . . . . . . . . c30446_6cxn 1 . 2 . 171 . 1 1 3 PHE CA C -1.624 -1.046 1.245 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CA . . . . . . . . . c30446_6cxn 1 . 2 . 172 . 1 1 3 PHE CB C -1.953 0.106 2.192 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CB . . . . . . . . . c30446_6cxn 1 . 2 . 173 . 1 1 3 PHE CD1 C -4.401 -0.477 2.045 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CD1 . . . . . . . . . c30446_6cxn 1 . 2 . 174 . 1 1 3 PHE CD2 C -3.792 1.798 2.427 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CD2 . . . . . . . . . c30446_6cxn 1 . 2 . 175 . 1 1 3 PHE CE1 C -5.738 -0.127 2.074 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CE1 . . . . . . . . . c30446_6cxn 1 . 2 . 176 . 1 1 3 PHE CE2 C -5.128 2.153 2.457 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CE2 . . . . . . . . . c30446_6cxn 1 . 2 . 177 . 1 1 3 PHE CG C -3.412 0.481 2.221 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CG . . . . . . . . . c30446_6cxn 1 . 2 . 178 . 1 1 3 PHE CZ C -6.101 1.189 2.280 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CZ . . . . . . . . . c30446_6cxn 1 . 2 . 179 . 1 1 3 PHE H H -0.136 -1.738 2.581 . . . 1.0 . . . . . . . . . . . . A . 3 PHE H . . . . . . . . . c30446_6cxn 1 . 2 . 180 . 1 1 3 PHE HA H -2.537 -1.527 0.957 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HA . . . . . . . . . c30446_6cxn 1 . 2 . 181 . 1 1 3 PHE HB2 H -1.662 -0.169 3.199 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HB2 . . . . . . . . . c30446_6cxn 1 . 2 . 182 . 1 1 3 PHE HB3 H -1.395 0.975 1.881 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HB3 . . . . . . . . . c30446_6cxn 1 . 2 . 183 . 1 1 3 PHE HD1 H -4.119 -1.507 1.882 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HD1 . . . . . . . . . c30446_6cxn 1 . 2 . 184 . 1 1 3 PHE HD2 H -3.033 2.553 2.565 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HD2 . . . . . . . . . c30446_6cxn 1 . 2 . 185 . 1 1 3 PHE HE1 H -6.497 -0.882 1.936 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HE1 . . . . . . . . . c30446_6cxn 1 . 2 . 186 . 1 1 3 PHE HE2 H -5.410 3.183 2.618 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HE2 . . . . . . . . . c30446_6cxn 1 . 2 . 187 . 1 1 3 PHE HZ H -7.145 1.465 2.304 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HZ . . . . . . . . . c30446_6cxn 1 . 2 . 188 . 1 1 3 PHE N N -0.792 -2.036 1.917 . . . 1.0 . . . . . . . . . . . . A . 3 PHE N . . . . . . . . . c30446_6cxn 1 . 2 . 189 . 1 1 3 PHE O O 0.229 -0.789 -0.261 . . . 1.0 . . . . . . . . . . . . A . 3 PHE O . . . . . . . . . c30446_6cxn 1 . 2 . 190 . 1 1 4 LEU C C -0.432 2.103 -1.782 . . . 1.0 . . . . . . . . . . . . A . 4 LEU C . . . . . . . . . c30446_6cxn 1 . 2 . 191 . 1 1 4 LEU CA C -1.184 0.802 -2.042 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CA . . . . . . . . . c30446_6cxn 1 . 2 . 192 . 1 1 4 LEU CB C -2.325 1.042 -3.028 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CB . . . . . . . . . c30446_6cxn 1 . 2 . 193 . 1 1 4 LEU CD1 C -4.418 0.028 -2.117 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CD1 . . . . . . . . . c30446_6cxn 1 . 2 . 194 . 1 1 4 LEU CD2 C -3.895 -0.181 -4.554 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CD2 . . . . . . . . . c30446_6cxn 1 . 2 . 195 . 1 1 4 LEU CG C -3.315 -0.115 -3.149 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CG . . . . . . . . . c30446_6cxn 1 . 2 . 196 . 1 1 4 LEU H H -2.628 0.412 -0.550 . . . 1.0 . . . . . . . . . . . . A . 4 LEU H . . . . . . . . . c30446_6cxn 1 . 2 . 197 . 1 1 4 LEU HA H -0.506 0.084 -2.467 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HA . . . . . . . . . c30446_6cxn 1 . 2 . 198 . 1 1 4 LEU HB2 H -2.865 1.924 -2.716 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HB2 . . . . . . . . . c30446_6cxn 1 . 2 . 199 . 1 1 4 LEU HB3 H -1.900 1.226 -4.003 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HB3 . . . . . . . . . c30446_6cxn 1 . 2 . 200 . 1 1 4 LEU HD11 H -4.175 -0.573 -1.254 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD11 . . . . . . . . . c30446_6cxn 1 . 2 . 201 . 1 1 4 LEU HD12 H -5.353 -0.307 -2.539 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD12 . . . . . . . . . c30446_6cxn 1 . 2 . 202 . 1 1 4 LEU HD13 H -4.502 1.063 -1.823 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD13 . . . . . . . . . c30446_6cxn 1 . 2 . 203 . 1 1 4 LEU HD21 H -4.852 0.319 -4.572 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD21 . . . . . . . . . c30446_6cxn 1 . 2 . 204 . 1 1 4 LEU HD22 H -4.022 -1.213 -4.842 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD22 . . . . . . . . . c30446_6cxn 1 . 2 . 205 . 1 1 4 LEU HD23 H -3.221 0.306 -5.244 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD23 . . . . . . . . . c30446_6cxn 1 . 2 . 206 . 1 1 4 LEU HG H -2.799 -1.043 -2.951 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HG . . . . . . . . . c30446_6cxn 1 . 2 . 207 . 1 1 4 LEU N N -1.700 0.237 -0.803 . . . 1.0 . . . . . . . . . . . . A . 4 LEU N . . . . . . . . . c30446_6cxn 1 . 2 . 208 . 1 1 4 LEU O O -0.669 2.779 -0.781 . . . 1.0 . . . . . . . . . . . . A . 4 LEU O . . . . . . . . . c30446_6cxn 1 . 2 . 209 . 1 1 5 ARG C C 0.677 4.787 -3.414 . . . 1.0 . . . . . . . . . . . . A . 5 ARG C . . . . . . . . . c30446_6cxn 1 . 2 . 210 . 1 1 5 ARG CA C 1.262 3.668 -2.559 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CA . . . . . . . . . c30446_6cxn 1 . 2 . 211 . 1 1 5 ARG CB C 2.715 3.409 -2.962 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CB . . . . . . . . . c30446_6cxn 1 . 2 . 212 . 1 1 5 ARG CD C 4.083 5.489 -3.305 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CD . . . . . . . . . c30446_6cxn 1 . 2 . 213 . 1 1 5 ARG CG C 3.701 4.381 -2.336 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CG . . . . . . . . . c30446_6cxn 1 . 2 . 214 . 1 1 5 ARG CZ C 6.049 6.503 -2.219 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CZ . . . . . . . . . c30446_6cxn 1 . 2 . 215 . 1 1 5 ARG H H 0.619 1.867 -3.466 . . . 1.0 . . . . . . . . . . . . A . 5 ARG H . . . . . . . . . c30446_6cxn 1 . 2 . 216 . 1 1 5 ARG HA H 1.235 3.971 -1.523 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HA . . . . . . . . . c30446_6cxn 1 . 2 . 217 . 1 1 5 ARG HB2 H 2.988 2.405 -2.656 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HB2 . . . . . . . . . c30446_6cxn 1 . 2 . 218 . 1 1 5 ARG HB3 H 2.797 3.488 -4.040 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HB3 . . . . . . . . . c30446_6cxn 1 . 2 . 219 . 1 1 5 ARG HD2 H 4.723 5.076 -4.070 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HD2 . . . . . . . . . c30446_6cxn 1 . 2 . 220 . 1 1 5 ARG HD3 H 3.184 5.878 -3.760 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HD3 . . . . . . . . . c30446_6cxn 1 . 2 . 221 . 1 1 5 ARG HE H 4.295 7.416 -2.494 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HE . . . . . . . . . c30446_6cxn 1 . 2 . 222 . 1 1 5 ARG HG2 H 3.250 4.823 -1.460 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HG2 . . . . . . . . . c30446_6cxn 1 . 2 . 223 . 1 1 5 ARG HG3 H 4.592 3.841 -2.051 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HG3 . . . . . . . . . c30446_6cxn 1 . 2 . 224 . 1 1 5 ARG HH11 H 6.327 4.600 -2.846 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH11 . . . . . . . . . c30446_6cxn 1 . 2 . 225 . 1 1 5 ARG HH12 H 7.694 5.336 -2.080 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH12 . . . . . . . . . c30446_6cxn 1 . 2 . 226 . 1 1 5 ARG HH21 H 6.093 8.386 -1.486 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH21 . . . . . . . . . c30446_6cxn 1 . 2 . 227 . 1 1 5 ARG HH22 H 7.561 7.486 -1.307 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH22 . . . . . . . . . c30446_6cxn 1 . 2 . 228 . 1 1 5 ARG N N 0.475 2.448 -2.690 . . . 1.0 . . . . . . . . . . . . A . 5 ARG N . . . . . . . . . c30446_6cxn 1 . 2 . 229 . 1 1 5 ARG NE N 4.788 6.581 -2.638 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NE . . . . . . . . . c30446_6cxn 1 . 2 . 230 . 1 1 5 ARG NH1 N 6.747 5.388 -2.396 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NH1 . . . . . . . . . c30446_6cxn 1 . 2 . 231 . 1 1 5 ARG NH2 N 6.614 7.544 -1.622 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NH2 . . . . . . . . . c30446_6cxn 1 . 2 . 232 . 1 1 5 ARG O O 0.137 4.541 -4.492 . . . 1.0 . . . . . . . . . . . . A . 5 ARG O . . . . . . . . . c30446_6cxn 1 . 2 . 233 . 1 1 6 HIS C C 1.288 8.313 -3.649 . . . 1.0 . . . . . . . . . . . . A . 6 HIS C . . . . . . . . . c30446_6cxn 1 . 2 . 234 . 1 1 6 HIS CA C 0.271 7.176 -3.644 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CA . . . . . . . . . c30446_6cxn 1 . 2 . 235 . 1 1 6 HIS CB C -1.039 7.651 -3.013 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CB . . . . . . . . . c30446_6cxn 1 . 2 . 236 . 1 1 6 HIS CD2 C -0.500 7.145 -0.527 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CD2 . . . . . . . . . c30446_6cxn 1 . 2 . 237 . 1 1 6 HIS CE1 C -1.080 9.079 0.327 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CE1 . . . . . . . . . c30446_6cxn 1 . 2 . 238 . 1 1 6 HIS CG C -0.929 7.927 -1.546 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CG . . . . . . . . . c30446_6cxn 1 . 2 . 239 . 1 1 6 HIS H H 1.230 6.151 -2.060 . . . 1.0 . . . . . . . . . . . . A . 6 HIS H . . . . . . . . . c30446_6cxn 1 . 2 . 240 . 1 1 6 HIS HA H 0.081 6.875 -4.663 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HA . . . . . . . . . c30446_6cxn 1 . 2 . 241 . 1 1 6 HIS HB2 H -1.355 8.566 -3.500 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HB2 . . . . . . . . . c30446_6cxn 1 . 2 . 242 . 1 1 6 HIS HB3 H -1.796 6.887 -3.154 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HB3 . . . . . . . . . c30446_6cxn 1 . 2 . 243 . 1 1 6 HIS HD1 H -1.637 9.910 -1.458 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HD1 . . . . . . . . . c30446_6cxn 1 . 2 . 244 . 1 1 6 HIS HD2 H -0.143 6.128 -0.606 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HD2 . . . . . . . . . c30446_6cxn 1 . 2 . 245 . 1 1 6 HIS HE1 H -1.269 9.877 1.029 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HE1 . . . . . . . . . c30446_6cxn 1 . 2 . 246 . 1 1 6 HIS HE2 H -0.284 7.609 1.510 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HE2 . . . . . . . . . c30446_6cxn 1 . 2 . 247 . 1 1 6 HIS N N 0.789 6.018 -2.925 . . . 1.0 . . . . . . . . . . . . A . 6 HIS N . . . . . . . . . c30446_6cxn 1 . 2 . 248 . 1 1 6 HIS ND1 N -1.286 9.132 -0.977 . . . 1.0 . . . . . . . . . . . . A . 6 HIS ND1 . . . . . . . . . c30446_6cxn 1 . 2 . 249 . 1 1 6 HIS NE2 N -0.604 7.884 0.625 . . . 1.0 . . . . . . . . . . . . A . 6 HIS NE2 . . . . . . . . . c30446_6cxn 1 . 2 . 250 . 1 1 6 HIS O O 2.117 8.361 -4.582 . . . 1.0 . . . . . . . . . . . . A . 6 HIS O . . . . . . . . . c30446_6cxn 1 . 3 . 251 . 1 1 1 HIS C C -0.486 -6.604 2.647 . . . 1.0 . . . . . . . . . . . . A . 1 HIS C . . . . . . . . . c30446_6cxn 1 . 3 . 252 . 1 1 1 HIS CA C -0.464 -7.983 1.995 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CA . . . . . . . . . c30446_6cxn 1 . 3 . 253 . 1 1 1 HIS CB C -1.892 -8.492 1.785 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CB . . . . . . . . . c30446_6cxn 1 . 3 . 254 . 1 1 1 HIS CD2 C -2.864 -9.013 -0.562 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CD2 . . . . . . . . . c30446_6cxn 1 . 3 . 255 . 1 1 1 HIS CE1 C -1.760 -10.864 -0.963 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CE1 . . . . . . . . . c30446_6cxn 1 . 3 . 256 . 1 1 1 HIS CG C -2.074 -9.255 0.510 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CG . . . . . . . . . c30446_6cxn 1 . 3 . 257 . 1 1 1 HIS H1 H 1.281 -8.733 2.785 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H1 . . . . . . . . . c30446_6cxn 1 . 3 . 258 . 1 1 1 HIS H2 H 0.079 -9.913 2.455 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H2 . . . . . . . . . c30446_6cxn 1 . 3 . 259 . 1 1 1 HIS H3 H -0.085 -8.873 3.811 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H3 . . . . . . . . . c30446_6cxn 1 . 3 . 260 . 1 1 1 HIS HA H 0.032 -7.912 1.039 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HA . . . . . . . . . c30446_6cxn 1 . 3 . 261 . 1 1 1 HIS HB2 H -2.158 -9.144 2.603 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HB2 . . . . . . . . . c30446_6cxn 1 . 3 . 262 . 1 1 1 HIS HB3 H -2.568 -7.649 1.769 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HB3 . . . . . . . . . c30446_6cxn 1 . 3 . 263 . 1 1 1 HIS HD1 H -0.744 -10.861 0.813 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HD1 . . . . . . . . . c30446_6cxn 1 . 3 . 264 . 1 1 1 HIS HD2 H -3.538 -8.177 -0.687 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HD2 . . . . . . . . . c30446_6cxn 1 . 3 . 265 . 1 1 1 HIS HE1 H -1.393 -11.758 -1.444 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HE1 . . . . . . . . . c30446_6cxn 1 . 3 . 266 . 1 1 1 HIS HE2 H -3.018 -10.070 -2.370 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HE2 . . . . . . . . . c30446_6cxn 1 . 3 . 267 . 1 1 1 HIS N N 0.269 -8.964 2.837 . . . 1.0 . . . . . . . . . . . . A . 1 HIS N . . . . . . . . . c30446_6cxn 1 . 3 . 268 . 1 1 1 HIS ND1 N -1.396 -10.422 0.228 . . . 1.0 . . . . . . . . . . . . A . 1 HIS ND1 . . . . . . . . . c30446_6cxn 1 . 3 . 269 . 1 1 1 HIS NE2 N -2.650 -10.027 -1.462 . . . 1.0 . . . . . . . . . . . . A . 1 HIS NE2 . . . . . . . . . c30446_6cxn 1 . 3 . 270 . 1 1 1 HIS O O -0.991 -6.440 3.758 . . . 1.0 . . . . . . . . . . . . A . 1 HIS O . . . . . . . . . c30446_6cxn 1 . 3 . 271 . 1 1 2 ARG C C -0.775 -3.329 1.624 . . . 1.0 . . . . . . . . . . . . A . 2 ARG C . . . . . . . . . c30446_6cxn 1 . 3 . 272 . 1 1 2 ARG CA C 0.107 -4.251 2.459 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CA . . . . . . . . . c30446_6cxn 1 . 3 . 273 . 1 1 2 ARG CB C 1.547 -3.732 2.466 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CB . . . . . . . . . c30446_6cxn 1 . 3 . 274 . 1 1 2 ARG CD C 3.612 -3.230 3.807 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CD . . . . . . . . . c30446_6cxn 1 . 3 . 275 . 1 1 2 ARG CG C 2.246 -3.898 3.805 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CG . . . . . . . . . c30446_6cxn 1 . 3 . 276 . 1 1 2 ARG CZ C 3.830 -2.357 6.100 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CZ . . . . . . . . . c30446_6cxn 1 . 3 . 277 . 1 1 2 ARG H H 0.449 -5.810 1.069 . . . 1.0 . . . . . . . . . . . . A . 2 ARG H . . . . . . . . . c30446_6cxn 1 . 3 . 278 . 1 1 2 ARG HA H -0.266 -4.263 3.472 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HA . . . . . . . . . c30446_6cxn 1 . 3 . 279 . 1 1 2 ARG HB2 H 2.114 -4.268 1.720 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB2 . . . . . . . . . c30446_6cxn 1 . 3 . 280 . 1 1 2 ARG HB3 H 1.541 -2.681 2.215 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB3 . . . . . . . . . c30446_6cxn 1 . 3 . 281 . 1 1 2 ARG HD2 H 4.267 -3.778 3.145 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD2 . . . . . . . . . c30446_6cxn 1 . 3 . 282 . 1 1 2 ARG HD3 H 3.504 -2.217 3.447 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD3 . . . . . . . . . c30446_6cxn 1 . 3 . 283 . 1 1 2 ARG HE H 4.922 -3.840 5.333 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HE . . . . . . . . . c30446_6cxn 1 . 3 . 284 . 1 1 2 ARG HG2 H 1.638 -3.450 4.577 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG2 . . . . . . . . . c30446_6cxn 1 . 3 . 285 . 1 1 2 ARG HG3 H 2.370 -4.951 4.008 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG3 . . . . . . . . . c30446_6cxn 1 . 3 . 286 . 1 1 2 ARG HH11 H 2.413 -1.440 4.986 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH11 . . . . . . . . . c30446_6cxn 1 . 3 . 287 . 1 1 2 ARG HH12 H 2.586 -0.844 6.602 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH12 . . . . . . . . . c30446_6cxn 1 . 3 . 288 . 1 1 2 ARG HH21 H 5.151 -3.058 7.459 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH21 . . . . . . . . . c30446_6cxn 1 . 3 . 289 . 1 1 2 ARG HH22 H 4.141 -1.762 8.007 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH22 . . . . . . . . . c30446_6cxn 1 . 3 . 290 . 1 1 2 ARG N N 0.064 -5.616 1.949 . . . 1.0 . . . . . . . . . . . . A . 2 ARG N . . . . . . . . . c30446_6cxn 1 . 3 . 291 . 1 1 2 ARG NE N 4.206 -3.199 5.141 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NE . . . . . . . . . c30446_6cxn 1 . 3 . 292 . 1 1 2 ARG NH1 N 2.863 -1.475 5.877 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH1 . . . . . . . . . c30446_6cxn 1 . 3 . 293 . 1 1 2 ARG NH2 N 4.422 -2.396 7.286 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH2 . . . . . . . . . c30446_6cxn 1 . 3 . 294 . 1 1 2 ARG O O -1.366 -3.751 0.630 . . . 1.0 . . . . . . . . . . . . A . 2 ARG O . . . . . . . . . c30446_6cxn 1 . 3 . 295 . 1 1 3 PHE C C -0.929 -0.530 0.119 . . . 1.0 . . . . . . . . . . . . A . 3 PHE C . . . . . . . . . c30446_6cxn 1 . 3 . 296 . 1 1 3 PHE CA C -1.672 -1.087 1.327 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CA . . . . . . . . . c30446_6cxn 1 . 3 . 297 . 1 1 3 PHE CB C -2.078 0.047 2.264 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CB . . . . . . . . . c30446_6cxn 1 . 3 . 298 . 1 1 3 PHE CD1 C -4.503 -0.580 1.990 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CD1 . . . . . . . . . c30446_6cxn 1 . 3 . 299 . 1 1 3 PHE CD2 C -3.955 1.710 2.367 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CD2 . . . . . . . . . c30446_6cxn 1 . 3 . 300 . 1 1 3 PHE CE1 C -5.845 -0.254 1.939 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CE1 . . . . . . . . . c30446_6cxn 1 . 3 . 301 . 1 1 3 PHE CE2 C -5.296 2.042 2.316 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CE2 . . . . . . . . . c30446_6cxn 1 . 3 . 302 . 1 1 3 PHE CG C -3.542 0.397 2.205 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CG . . . . . . . . . c30446_6cxn 1 . 3 . 303 . 1 1 3 PHE CZ C -6.242 1.059 2.102 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CZ . . . . . . . . . c30446_6cxn 1 . 3 . 304 . 1 1 3 PHE H H -0.367 -1.792 2.836 . . . 1.0 . . . . . . . . . . . . A . 3 PHE H . . . . . . . . . c30446_6cxn 1 . 3 . 305 . 1 1 3 PHE HA H -2.557 -1.582 0.980 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HA . . . . . . . . . c30446_6cxn 1 . 3 . 306 . 1 1 3 PHE HB2 H -1.846 -0.236 3.284 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HB2 . . . . . . . . . c30446_6cxn 1 . 3 . 307 . 1 1 3 PHE HB3 H -1.517 0.929 1.998 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HB3 . . . . . . . . . c30446_6cxn 1 . 3 . 308 . 1 1 3 PHE HD1 H -4.195 -1.608 1.862 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HD1 . . . . . . . . . c30446_6cxn 1 . 3 . 309 . 1 1 3 PHE HD2 H -3.217 2.481 2.535 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HD2 . . . . . . . . . c30446_6cxn 1 . 3 . 310 . 1 1 3 PHE HE1 H -6.583 -1.025 1.771 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HE1 . . . . . . . . . c30446_6cxn 1 . 3 . 311 . 1 1 3 PHE HE2 H -5.604 3.069 2.444 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HE2 . . . . . . . . . c30446_6cxn 1 . 3 . 312 . 1 1 3 PHE HZ H -7.290 1.316 2.062 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HZ . . . . . . . . . c30446_6cxn 1 . 3 . 313 . 1 1 3 PHE N N -0.860 -2.069 2.036 . . . 1.0 . . . . . . . . . . . . A . 3 PHE N . . . . . . . . . c30446_6cxn 1 . 3 . 314 . 1 1 3 PHE O O 0.264 -0.776 -0.060 . . . 1.0 . . . . . . . . . . . . A . 3 PHE O . . . . . . . . . c30446_6cxn 1 . 3 . 315 . 1 1 4 LEU C C -0.513 2.198 -1.625 . . . 1.0 . . . . . . . . . . . . A . 4 LEU C . . . . . . . . . c30446_6cxn 1 . 3 . 316 . 1 1 4 LEU CA C -1.067 0.805 -1.909 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CA . . . . . . . . . c30446_6cxn 1 . 3 . 317 . 1 1 4 LEU CB C -2.108 0.871 -3.025 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CB . . . . . . . . . c30446_6cxn 1 . 3 . 318 . 1 1 4 LEU CD1 C -4.188 -0.241 -2.207 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CD1 . . . . . . . . . c30446_6cxn 1 . 3 . 319 . 1 1 4 LEU CD2 C -3.452 -0.572 -4.574 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CD2 . . . . . . . . . c30446_6cxn 1 . 3 . 320 . 1 1 4 LEU CG C -2.997 -0.365 -3.136 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CG . . . . . . . . . c30446_6cxn 1 . 3 . 321 . 1 1 4 LEU H H -2.594 0.371 -0.515 . . . 1.0 . . . . . . . . . . . . A . 4 LEU H . . . . . . . . . c30446_6cxn 1 . 3 . 322 . 1 1 4 LEU HA H -0.262 0.166 -2.226 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HA . . . . . . . . . c30446_6cxn 1 . 3 . 323 . 1 1 4 LEU HB2 H -2.738 1.732 -2.852 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HB2 . . . . . . . . . c30446_6cxn 1 . 3 . 324 . 1 1 4 LEU HB3 H -1.593 1.003 -3.964 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HB3 . . . . . . . . . c30446_6cxn 1 . 3 . 325 . 1 1 4 LEU HD11 H -3.981 -0.777 -1.293 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD11 . . . . . . . . . c30446_6cxn 1 . 3 . 326 . 1 1 4 LEU HD12 H -5.064 -0.657 -2.681 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD12 . . . . . . . . . c30446_6cxn 1 . 3 . 327 . 1 1 4 LEU HD13 H -4.358 0.801 -1.981 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD13 . . . . . . . . . c30446_6cxn 1 . 3 . 328 . 1 1 4 LEU HD21 H -4.041 0.276 -4.890 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD21 . . . . . . . . . c30446_6cxn 1 . 3 . 329 . 1 1 4 LEU HD22 H -4.049 -1.469 -4.637 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD22 . . . . . . . . . c30446_6cxn 1 . 3 . 330 . 1 1 4 LEU HD23 H -2.588 -0.669 -5.214 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD23 . . . . . . . . . c30446_6cxn 1 . 3 . 331 . 1 1 4 LEU HG H -2.432 -1.234 -2.832 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HG . . . . . . . . . c30446_6cxn 1 . 3 . 332 . 1 1 4 LEU N N -1.648 0.217 -0.711 . . . 1.0 . . . . . . . . . . . . A . 4 LEU N . . . . . . . . . c30446_6cxn 1 . 3 . 333 . 1 1 4 LEU O O -1.038 2.925 -0.783 . . . 1.0 . . . . . . . . . . . . A . 4 LEU O . . . . . . . . . c30446_6cxn 1 . 3 . 334 . 1 1 5 ARG C C 0.920 4.759 -3.372 . . . 1.0 . . . . . . . . . . . . A . 5 ARG C . . . . . . . . . c30446_6cxn 1 . 3 . 335 . 1 1 5 ARG CA C 1.174 3.868 -2.161 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CA . . . . . . . . . c30446_6cxn 1 . 3 . 336 . 1 1 5 ARG CB C 2.679 3.712 -1.935 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CB . . . . . . . . . c30446_6cxn 1 . 3 . 337 . 1 1 5 ARG CD C 3.963 5.868 -2.067 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CD . . . . . . . . . c30446_6cxn 1 . 3 . 338 . 1 1 5 ARG CG C 3.296 4.856 -1.149 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CG . . . . . . . . . c30446_6cxn 1 . 3 . 339 . 1 1 5 ARG CZ C 5.098 7.440 -0.546 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CZ . . . . . . . . . c30446_6cxn 1 . 3 . 340 . 1 1 5 ARG H H 0.922 1.938 -2.993 . . . 1.0 . . . . . . . . . . . . A . 5 ARG H . . . . . . . . . c30446_6cxn 1 . 3 . 341 . 1 1 5 ARG HA H 0.736 4.332 -1.289 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HA . . . . . . . . . c30446_6cxn 1 . 3 . 342 . 1 1 5 ARG HB2 H 2.856 2.792 -1.390 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HB2 . . . . . . . . . c30446_6cxn 1 . 3 . 343 . 1 1 5 ARG HB3 H 3.172 3.657 -2.899 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HB3 . . . . . . . . . c30446_6cxn 1 . 3 . 344 . 1 1 5 ARG HD2 H 4.934 5.491 -2.353 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HD2 . . . . . . . . . c30446_6cxn 1 . 3 . 345 . 1 1 5 ARG HD3 H 3.352 5.992 -2.949 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HD3 . . . . . . . . . c30446_6cxn 1 . 3 . 346 . 1 1 5 ARG HE H 3.490 7.873 -1.647 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HE . . . . . . . . . c30446_6cxn 1 . 3 . 347 . 1 1 5 ARG HG2 H 2.520 5.353 -0.586 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HG2 . . . . . . . . . c30446_6cxn 1 . 3 . 348 . 1 1 5 ARG HG3 H 4.036 4.456 -0.471 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HG3 . . . . . . . . . c30446_6cxn 1 . 3 . 349 . 1 1 5 ARG HH11 H 5.930 5.598 -0.621 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH11 . . . . . . . . . c30446_6cxn 1 . 3 . 350 . 1 1 5 ARG HH12 H 6.709 6.722 0.442 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH12 . . . . . . . . . c30446_6cxn 1 . 3 . 351 . 1 1 5 ARG HH21 H 4.513 9.352 -0.249 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH21 . . . . . . . . . c30446_6cxn 1 . 3 . 352 . 1 1 5 ARG HH22 H 5.904 8.853 0.654 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH22 . . . . . . . . . c30446_6cxn 1 . 3 . 353 . 1 1 5 ARG N N 0.550 2.562 -2.335 . . . 1.0 . . . . . . . . . . . . A . 5 ARG N . . . . . . . . . c30446_6cxn 1 . 3 . 354 . 1 1 5 ARG NE N 4.131 7.167 -1.419 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NE . . . . . . . . . c30446_6cxn 1 . 3 . 355 . 1 1 5 ARG NH1 N 5.985 6.510 -0.215 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NH1 . . . . . . . . . c30446_6cxn 1 . 3 . 356 . 1 1 5 ARG NH2 N 5.178 8.647 -0.003 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NH2 . . . . . . . . . c30446_6cxn 1 . 3 . 357 . 1 1 5 ARG O O 0.957 4.299 -4.513 . . . 1.0 . . . . . . . . . . . . A . 5 ARG O . . . . . . . . . c30446_6cxn 1 . 3 . 358 . 1 1 6 HIS C C 1.002 8.355 -3.858 . . . 1.0 . . . . . . . . . . . . A . 6 HIS C . . . . . . . . . c30446_6cxn 1 . 3 . 359 . 1 1 6 HIS CA C 0.399 6.993 -4.186 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CA . . . . . . . . . c30446_6cxn 1 . 3 . 360 . 1 1 6 HIS CB C -1.106 7.131 -4.418 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CB . . . . . . . . . c30446_6cxn 1 . 3 . 361 . 1 1 6 HIS CD2 C -2.395 6.793 -2.192 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CD2 . . . . . . . . . c30446_6cxn 1 . 3 . 362 . 1 1 6 HIS CE1 C -2.828 8.897 -1.750 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CE1 . . . . . . . . . c30446_6cxn 1 . 3 . 363 . 1 1 6 HIS CG C -1.864 7.536 -3.192 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CG . . . . . . . . . c30446_6cxn 1 . 3 . 364 . 1 1 6 HIS H H 0.644 6.345 -2.186 . . . 1.0 . . . . . . . . . . . . A . 6 HIS H . . . . . . . . . c30446_6cxn 1 . 3 . 365 . 1 1 6 HIS HA H 0.860 6.616 -5.086 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HA . . . . . . . . . c30446_6cxn 1 . 3 . 366 . 1 1 6 HIS HB2 H -1.279 7.883 -5.179 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HB2 . . . . . . . . . c30446_6cxn 1 . 3 . 367 . 1 1 6 HIS HB3 H -1.500 6.179 -4.755 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HB3 . . . . . . . . . c30446_6cxn 1 . 3 . 368 . 1 1 6 HIS HD1 H -1.900 9.631 -3.420 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HD1 . . . . . . . . . c30446_6cxn 1 . 3 . 369 . 1 1 6 HIS HD2 H -2.359 5.716 -2.105 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HD2 . . . . . . . . . c30446_6cxn 1 . 3 . 370 . 1 1 6 HIS HE1 H -3.188 9.792 -1.266 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HE1 . . . . . . . . . c30446_6cxn 1 . 3 . 371 . 1 1 6 HIS HE2 H -3.530 7.405 -0.535 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HE2 . . . . . . . . . c30446_6cxn 1 . 3 . 372 . 1 1 6 HIS N N 0.661 6.037 -3.116 . . . 1.0 . . . . . . . . . . . . A . 6 HIS N . . . . . . . . . c30446_6cxn 1 . 3 . 373 . 1 1 6 HIS ND1 N -2.153 8.850 -2.885 . . . 1.0 . . . . . . . . . . . . A . 6 HIS ND1 . . . . . . . . . c30446_6cxn 1 . 3 . 374 . 1 1 6 HIS NE2 N -2.988 7.662 -1.310 . . . 1.0 . . . . . . . . . . . . A . 6 HIS NE2 . . . . . . . . . c30446_6cxn 1 . 3 . 375 . 1 1 6 HIS O O 0.527 8.995 -2.896 . . . 1.0 . . . . . . . . . . . . A . 6 HIS O . . . . . . . . . c30446_6cxn 1 . 4 . 376 . 1 1 1 HIS C C 0.090 -6.515 3.256 . . . 1.0 . . . . . . . . . . . . A . 1 HIS C . . . . . . . . . c30446_6cxn 1 . 4 . 377 . 1 1 1 HIS CA C 0.043 -7.979 2.833 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CA . . . . . . . . . c30446_6cxn 1 . 4 . 378 . 1 1 1 HIS CB C 1.459 -8.557 2.773 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CB . . . . . . . . . c30446_6cxn 1 . 4 . 379 . 1 1 1 HIS CD2 C 0.890 -11.083 2.931 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CD2 . . . . . . . . . c30446_6cxn 1 . 4 . 380 . 1 1 1 HIS CE1 C 2.281 -11.624 4.537 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CE1 . . . . . . . . . c30446_6cxn 1 . 4 . 381 . 1 1 1 HIS CG C 1.556 -9.959 3.289 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CG . . . . . . . . . c30446_6cxn 1 . 4 . 382 . 1 1 1 HIS H1 H 0.118 -7.864 0.780 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H1 . . . . . . . . . c30446_6cxn 1 . 4 . 383 . 1 1 1 HIS H2 H -1.415 -7.502 1.462 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H2 . . . . . . . . . c30446_6cxn 1 . 4 . 384 . 1 1 1 HIS H3 H -0.868 -9.127 1.389 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H3 . . . . . . . . . c30446_6cxn 1 . 4 . 385 . 1 1 1 HIS HA H -0.538 -8.536 3.552 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HA . . . . . . . . . c30446_6cxn 1 . 4 . 386 . 1 1 1 HIS HB2 H 1.797 -8.558 1.747 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HB2 . . . . . . . . . c30446_6cxn 1 . 4 . 387 . 1 1 1 HIS HB3 H 2.119 -7.938 3.364 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HB3 . . . . . . . . . c30446_6cxn 1 . 4 . 388 . 1 1 1 HIS HD1 H 3.040 -9.738 4.768 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HD1 . . . . . . . . . c30446_6cxn 1 . 4 . 389 . 1 1 1 HIS HD2 H 0.131 -11.162 2.166 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HD2 . . . . . . . . . c30446_6cxn 1 . 4 . 390 . 1 1 1 HIS HE1 H 2.828 -12.192 5.275 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HE1 . . . . . . . . . c30446_6cxn 1 . 4 . 391 . 1 1 1 HIS HE2 H 1.122 -13.049 3.632 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HE2 . . . . . . . . . c30446_6cxn 1 . 4 . 392 . 1 1 1 HIS N N -0.587 -8.132 1.495 . . . 1.0 . . . . . . . . . . . . A . 1 HIS N . . . . . . . . . c30446_6cxn 1 . 4 . 393 . 1 1 1 HIS ND1 N 2.419 -10.332 4.298 . . . 1.0 . . . . . . . . . . . . A . 1 HIS ND1 . . . . . . . . . c30446_6cxn 1 . 4 . 394 . 1 1 1 HIS NE2 N 1.360 -12.103 3.722 . . . 1.0 . . . . . . . . . . . . A . 1 HIS NE2 . . . . . . . . . c30446_6cxn 1 . 4 . 395 . 1 1 1 HIS O O 0.041 -6.200 4.446 . . . 1.0 . . . . . . . . . . . . A . 1 HIS O . . . . . . . . . c30446_6cxn 1 . 4 . 396 . 1 1 2 ARG C C -0.748 -3.433 1.665 . . . 1.0 . . . . . . . . . . . . A . 2 ARG C . . . . . . . . . c30446_6cxn 1 . 4 . 397 . 1 1 2 ARG CA C 0.237 -4.191 2.547 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CA . . . . . . . . . c30446_6cxn 1 . 4 . 398 . 1 1 2 ARG CB C 1.654 -3.660 2.323 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CB . . . . . . . . . c30446_6cxn 1 . 4 . 399 . 1 1 2 ARG CD C 3.322 -2.873 0.617 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CD . . . . . . . . . c30446_6cxn 1 . 4 . 400 . 1 1 2 ARG CG C 2.125 -3.772 0.883 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CG . . . . . . . . . c30446_6cxn 1 . 4 . 401 . 1 1 2 ARG CZ C 3.742 -0.527 -0.006 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CZ . . . . . . . . . c30446_6cxn 1 . 4 . 402 . 1 1 2 ARG H H 0.219 -5.935 1.347 . . . 1.0 . . . . . . . . . . . . A . 2 ARG H . . . . . . . . . c30446_6cxn 1 . 4 . 403 . 1 1 2 ARG HA H -0.036 -4.040 3.580 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HA . . . . . . . . . c30446_6cxn 1 . 4 . 404 . 1 1 2 ARG HB2 H 1.686 -2.620 2.610 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB2 . . . . . . . . . c30446_6cxn 1 . 4 . 405 . 1 1 2 ARG HB3 H 2.337 -4.218 2.947 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB3 . . . . . . . . . c30446_6cxn 1 . 4 . 406 . 1 1 2 ARG HD2 H 3.859 -2.728 1.542 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD2 . . . . . . . . . c30446_6cxn 1 . 4 . 407 . 1 1 2 ARG HD3 H 3.967 -3.358 -0.101 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD3 . . . . . . . . . c30446_6cxn 1 . 4 . 408 . 1 1 2 ARG HE H 1.993 -1.467 -0.205 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HE . . . . . . . . . c30446_6cxn 1 . 4 . 409 . 1 1 2 ARG HG2 H 2.405 -4.796 0.684 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG2 . . . . . . . . . c30446_6cxn 1 . 4 . 410 . 1 1 2 ARG HG3 H 1.316 -3.484 0.227 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG3 . . . . . . . . . c30446_6cxn 1 . 4 . 411 . 1 1 2 ARG HH11 H 5.348 -1.492 0.756 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH11 . . . . . . . . . c30446_6cxn 1 . 4 . 412 . 1 1 2 ARG HH12 H 5.617 0.159 0.309 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH12 . . . . . . . . . c30446_6cxn 1 . 4 . 413 . 1 1 2 ARG HH21 H 2.346 0.704 -0.794 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH21 . . . . . . . . . c30446_6cxn 1 . 4 . 414 . 1 1 2 ARG HH22 H 3.914 1.407 -0.570 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH22 . . . . . . . . . c30446_6cxn 1 . 4 . 415 . 1 1 2 ARG N N 0.184 -5.623 2.276 . . . 1.0 . . . . . . . . . . . . A . 2 ARG N . . . . . . . . . c30446_6cxn 1 . 4 . 416 . 1 1 2 ARG NE N 2.922 -1.570 0.091 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NE . . . . . . . . . c30446_6cxn 1 . 4 . 417 . 1 1 2 ARG NH1 N 5.006 -0.628 0.385 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH1 . . . . . . . . . c30446_6cxn 1 . 4 . 418 . 1 1 2 ARG NH2 N 3.297 0.622 -0.497 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH2 . . . . . . . . . c30446_6cxn 1 . 4 . 419 . 1 1 2 ARG O O -1.421 -4.023 0.819 . . . 1.0 . . . . . . . . . . . . A . 2 ARG O . . . . . . . . . c30446_6cxn 1 . 4 . 420 . 1 1 3 PHE C C -1.009 -0.611 -0.061 . . . 1.0 . . . . . . . . . . . . A . 3 PHE C . . . . . . . . . c30446_6cxn 1 . 4 . 421 . 1 1 3 PHE CA C -1.735 -1.285 1.095 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CA . . . . . . . . . c30446_6cxn 1 . 4 . 422 . 1 1 3 PHE CB C -2.390 -0.235 1.991 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CB . . . . . . . . . c30446_6cxn 1 . 4 . 423 . 1 1 3 PHE CD1 C -4.646 -1.259 1.521 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CD1 . . . . . . . . . c30446_6cxn 1 . 4 . 424 . 1 1 3 PHE CD2 C -4.533 1.073 2.008 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CD2 . . . . . . . . . c30446_6cxn 1 . 4 . 425 . 1 1 3 PHE CE1 C -6.018 -1.166 1.382 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CE1 . . . . . . . . . c30446_6cxn 1 . 4 . 426 . 1 1 3 PHE CE2 C -5.904 1.171 1.869 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CE2 . . . . . . . . . c30446_6cxn 1 . 4 . 427 . 1 1 3 PHE CG C -3.886 -0.141 1.835 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CG . . . . . . . . . c30446_6cxn 1 . 4 . 428 . 1 1 3 PHE CZ C -6.648 0.051 1.556 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CZ . . . . . . . . . c30446_6cxn 1 . 4 . 429 . 1 1 3 PHE H H -0.269 -1.711 2.560 . . . 1.0 . . . . . . . . . . . . A . 3 PHE H . . . . . . . . . c30446_6cxn 1 . 4 . 430 . 1 1 3 PHE HA H -2.499 -1.918 0.690 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HA . . . . . . . . . c30446_6cxn 1 . 4 . 431 . 1 1 3 PHE HB2 H -2.180 -0.472 3.027 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HB2 . . . . . . . . . c30446_6cxn 1 . 4 . 432 . 1 1 3 PHE HB3 H -1.972 0.730 1.749 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HB3 . . . . . . . . . c30446_6cxn 1 . 4 . 433 . 1 1 3 PHE HD1 H -4.156 -2.212 1.382 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HD1 . . . . . . . . . c30446_6cxn 1 . 4 . 434 . 1 1 3 PHE HD2 H -3.953 1.951 2.252 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HD2 . . . . . . . . . c30446_6cxn 1 . 4 . 435 . 1 1 3 PHE HE1 H -6.597 -2.044 1.136 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HE1 . . . . . . . . . c30446_6cxn 1 . 4 . 436 . 1 1 3 PHE HE2 H -6.394 2.124 2.006 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HE2 . . . . . . . . . c30446_6cxn 1 . 4 . 437 . 1 1 3 PHE HZ H -7.720 0.125 1.448 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HZ . . . . . . . . . c30446_6cxn 1 . 4 . 438 . 1 1 3 PHE N N -0.830 -2.123 1.870 . . . 1.0 . . . . . . . . . . . . A . 3 PHE N . . . . . . . . . c30446_6cxn 1 . 4 . 439 . 1 1 3 PHE O O 0.217 -0.661 -0.155 . . . 1.0 . . . . . . . . . . . . A . 3 PHE O . . . . . . . . . c30446_6cxn 1 . 4 . 440 . 1 1 4 LEU C C -0.695 2.072 -1.733 . . . 1.0 . . . . . . . . . . . . A . 4 LEU C . . . . . . . . . c30446_6cxn 1 . 4 . 441 . 1 1 4 LEU CA C -1.222 0.690 -2.105 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CA . . . . . . . . . c30446_6cxn 1 . 4 . 442 . 1 1 4 LEU CB C -2.274 0.807 -3.206 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CB . . . . . . . . . c30446_6cxn 1 . 4 . 443 . 1 1 4 LEU CD1 C -4.271 -0.566 -2.597 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CD1 . . . . . . . . . c30446_6cxn 1 . 4 . 444 . 1 1 4 LEU CD2 C -3.438 -0.562 -4.955 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CD2 . . . . . . . . . c30446_6cxn 1 . 4 . 445 . 1 1 4 LEU CG C -3.046 -0.481 -3.487 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CG . . . . . . . . . c30446_6cxn 1 . 4 . 446 . 1 1 4 LEU H H -2.750 0.010 -0.814 . . . 1.0 . . . . . . . . . . . . A . 4 LEU H . . . . . . . . . c30446_6cxn 1 . 4 . 447 . 1 1 4 LEU HA H -0.406 0.090 -2.470 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HA . . . . . . . . . c30446_6cxn 1 . 4 . 448 . 1 1 4 LEU HB2 H -2.980 1.574 -2.922 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HB2 . . . . . . . . . c30446_6cxn 1 . 4 . 449 . 1 1 4 LEU HB3 H -1.782 1.112 -4.117 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HB3 . . . . . . . . . c30446_6cxn 1 . 4 . 450 . 1 1 4 LEU HD11 H -5.084 -1.022 -3.142 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD11 . . . . . . . . . c30446_6cxn 1 . 4 . 451 . 1 1 4 LEU HD12 H -4.555 0.427 -2.285 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD12 . . . . . . . . . c30446_6cxn 1 . 4 . 452 . 1 1 4 LEU HD13 H -4.038 -1.163 -1.729 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD13 . . . . . . . . . c30446_6cxn 1 . 4 . 453 . 1 1 4 LEU HD21 H -2.695 -1.130 -5.496 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD21 . . . . . . . . . c30446_6cxn 1 . 4 . 454 . 1 1 4 LEU HD22 H -3.500 0.435 -5.367 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD22 . . . . . . . . . c30446_6cxn 1 . 4 . 455 . 1 1 4 LEU HD23 H -4.399 -1.048 -5.045 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD23 . . . . . . . . . c30446_6cxn 1 . 4 . 456 . 1 1 4 LEU HG H -2.415 -1.328 -3.259 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HG . . . . . . . . . c30446_6cxn 1 . 4 . 457 . 1 1 4 LEU N N -1.781 0.011 -0.945 . . . 1.0 . . . . . . . . . . . . A . 4 LEU N . . . . . . . . . c30446_6cxn 1 . 4 . 458 . 1 1 4 LEU O O -1.248 2.745 -0.864 . . . 1.0 . . . . . . . . . . . . A . 4 LEU O . . . . . . . . . c30446_6cxn 1 . 4 . 459 . 1 1 5 ARG C C 0.659 4.774 -3.255 . . . 1.0 . . . . . . . . . . . . A . 5 ARG C . . . . . . . . . c30446_6cxn 1 . 4 . 460 . 1 1 5 ARG CA C 0.982 3.790 -2.135 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CA . . . . . . . . . c30446_6cxn 1 . 4 . 461 . 1 1 5 ARG CB C 2.498 3.651 -1.984 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CB . . . . . . . . . c30446_6cxn 1 . 4 . 462 . 1 1 5 ARG CD C 3.771 5.817 -2.036 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CD . . . . . . . . . c30446_6cxn 1 . 4 . 463 . 1 1 5 ARG CG C 3.129 4.758 -1.155 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CG . . . . . . . . . c30446_6cxn 1 . 4 . 464 . 1 1 5 ARG CZ C 6.188 5.395 -1.803 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CZ . . . . . . . . . c30446_6cxn 1 . 4 . 465 . 1 1 5 ARG H H 0.775 1.906 -3.078 . . . 1.0 . . . . . . . . . . . . A . 5 ARG H . . . . . . . . . c30446_6cxn 1 . 4 . 466 . 1 1 5 ARG HA H 0.570 4.166 -1.211 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HA . . . . . . . . . c30446_6cxn 1 . 4 . 467 . 1 1 5 ARG HB2 H 2.716 2.704 -1.505 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HB2 . . . . . . . . . c30446_6cxn 1 . 4 . 468 . 1 1 5 ARG HB3 H 2.949 3.665 -2.970 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HB3 . . . . . . . . . c30446_6cxn 1 . 4 . 469 . 1 1 5 ARG HD2 H 3.120 6.010 -2.876 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HD2 . . . . . . . . . c30446_6cxn 1 . 4 . 470 . 1 1 5 ARG HD3 H 3.891 6.722 -1.460 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HD3 . . . . . . . . . c30446_6cxn 1 . 4 . 471 . 1 1 5 ARG HE H 5.130 5.099 -3.470 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HE . . . . . . . . . c30446_6cxn 1 . 4 . 472 . 1 1 5 ARG HG2 H 2.365 5.222 -0.550 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HG2 . . . . . . . . . c30446_6cxn 1 . 4 . 473 . 1 1 5 ARG HG3 H 3.886 4.328 -0.515 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HG3 . . . . . . . . . c30446_6cxn 1 . 4 . 474 . 1 1 5 ARG HH11 H 5.293 6.092 -0.128 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH11 . . . . . . . . . c30446_6cxn 1 . 4 . 475 . 1 1 5 ARG HH12 H 6.992 5.788 0.009 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH12 . . . . . . . . . c30446_6cxn 1 . 4 . 476 . 1 1 5 ARG HH21 H 7.365 4.698 -3.291 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH21 . . . . . . . . . c30446_6cxn 1 . 4 . 477 . 1 1 5 ARG HH22 H 8.169 4.997 -1.786 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH22 . . . . . . . . . c30446_6cxn 1 . 4 . 478 . 1 1 5 ARG N N 0.379 2.488 -2.397 . . . 1.0 . . . . . . . . . . . . A . 5 ARG N . . . . . . . . . c30446_6cxn 1 . 4 . 479 . 1 1 5 ARG NE N 5.077 5.396 -2.537 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NE . . . . . . . . . c30446_6cxn 1 . 4 . 480 . 1 1 5 ARG NH1 N 6.155 5.791 -0.537 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NH1 . . . . . . . . . c30446_6cxn 1 . 4 . 481 . 1 1 5 ARG NH2 N 7.334 4.997 -2.337 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NH2 . . . . . . . . . c30446_6cxn 1 . 4 . 482 . 1 1 5 ARG O O 0.310 4.374 -4.366 . . . 1.0 . . . . . . . . . . . . A . 5 ARG O . . . . . . . . . c30446_6cxn 1 . 4 . 483 . 1 1 6 HIS C C 1.485 8.262 -3.796 . . . 1.0 . . . . . . . . . . . . A . 6 HIS C . . . . . . . . . c30446_6cxn 1 . 4 . 484 . 1 1 6 HIS CA C 0.500 7.106 -3.936 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CA . . . . . . . . . c30446_6cxn 1 . 4 . 485 . 1 1 6 HIS CB C -0.932 7.618 -3.775 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CB . . . . . . . . . c30446_6cxn 1 . 4 . 486 . 1 1 6 HIS CD2 C -2.002 7.884 -1.426 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CD2 . . . . . . . . . c30446_6cxn 1 . 4 . 487 . 1 1 6 HIS CE1 C -1.005 9.742 -0.829 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CE1 . . . . . . . . . c30446_6cxn 1 . 4 . 488 . 1 1 6 HIS CG C -1.192 8.256 -2.446 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CG . . . . . . . . . c30446_6cxn 1 . 4 . 489 . 1 1 6 HIS H H 1.061 6.320 -2.052 . . . 1.0 . . . . . . . . . . . . A . 6 HIS H . . . . . . . . . c30446_6cxn 1 . 4 . 490 . 1 1 6 HIS HA H 0.610 6.673 -4.919 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HA . . . . . . . . . c30446_6cxn 1 . 4 . 491 . 1 1 6 HIS HB2 H -1.132 8.356 -4.542 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HB2 . . . . . . . . . c30446_6cxn 1 . 4 . 492 . 1 1 6 HIS HB3 H -1.619 6.786 -3.886 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HB3 . . . . . . . . . c30446_6cxn 1 . 4 . 493 . 1 1 6 HIS HD1 H 0.066 9.944 -2.561 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HD1 . . . . . . . . . c30446_6cxn 1 . 4 . 494 . 1 1 6 HIS HD2 H -2.637 7.009 -1.399 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HD2 . . . . . . . . . c30446_6cxn 1 . 4 . 495 . 1 1 6 HIS HE1 H -0.698 10.607 -0.259 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HE1 . . . . . . . . . c30446_6cxn 1 . 4 . 496 . 1 1 6 HIS HE2 H -2.267 8.771 0.458 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HE2 . . . . . . . . . c30446_6cxn 1 . 4 . 497 . 1 1 6 HIS N N 0.779 6.063 -2.955 . . . 1.0 . . . . . . . . . . . . A . 6 HIS N . . . . . . . . . c30446_6cxn 1 . 4 . 498 . 1 1 6 HIS ND1 N -0.582 9.425 -2.040 . . . 1.0 . . . . . . . . . . . . A . 6 HIS ND1 . . . . . . . . . c30446_6cxn 1 . 4 . 499 . 1 1 6 HIS NE2 N -1.867 8.824 -0.435 . . . 1.0 . . . . . . . . . . . . A . 6 HIS NE2 . . . . . . . . . c30446_6cxn 1 . 4 . 500 . 1 1 6 HIS O O 1.571 9.082 -4.734 . . . 1.0 . . . . . . . . . . . . A . 6 HIS O . . . . . . . . . c30446_6cxn 1 . 5 . 501 . 1 1 1 HIS C C 0.565 -6.218 2.925 . . . 1.0 . . . . . . . . . . . . A . 1 HIS C . . . . . . . . . c30446_6cxn 1 . 5 . 502 . 1 1 1 HIS CA C 0.737 -7.641 2.403 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CA . . . . . . . . . c30446_6cxn 1 . 5 . 503 . 1 1 1 HIS CB C 2.049 -7.763 1.626 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CB . . . . . . . . . c30446_6cxn 1 . 5 . 504 . 1 1 1 HIS CD2 C 3.262 -8.663 3.735 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CD2 . . . . . . . . . c30446_6cxn 1 . 5 . 505 . 1 1 1 HIS CE1 C 5.326 -8.495 3.014 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CE1 . . . . . . . . . c30446_6cxn 1 . 5 . 506 . 1 1 1 HIS CG C 3.214 -8.164 2.477 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CG . . . . . . . . . c30446_6cxn 1 . 5 . 507 . 1 1 1 HIS H1 H -0.096 -8.877 0.985 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H1 . . . . . . . . . c30446_6cxn 1 . 5 . 508 . 1 1 1 HIS H2 H -0.553 -7.228 0.855 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H2 . . . . . . . . . c30446_6cxn 1 . 5 . 509 . 1 1 1 HIS H3 H -1.216 -8.208 2.097 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H3 . . . . . . . . . c30446_6cxn 1 . 5 . 510 . 1 1 1 HIS HA H 0.755 -8.323 3.240 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HA . . . . . . . . . c30446_6cxn 1 . 5 . 511 . 1 1 1 HIS HB2 H 1.933 -8.506 0.851 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HB2 . . . . . . . . . c30446_6cxn 1 . 5 . 512 . 1 1 1 HIS HB3 H 2.280 -6.810 1.172 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HB3 . . . . . . . . . c30446_6cxn 1 . 5 . 513 . 1 1 1 HIS HD1 H 4.820 -7.743 1.179 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HD1 . . . . . . . . . c30446_6cxn 1 . 5 . 514 . 1 1 1 HIS HD2 H 2.416 -8.868 4.376 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HD2 . . . . . . . . . c30446_6cxn 1 . 5 . 515 . 1 1 1 HIS HE1 H 6.404 -8.535 2.965 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HE1 . . . . . . . . . c30446_6cxn 1 . 5 . 516 . 1 1 1 HIS HE2 H 4.931 -9.129 4.921 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HE2 . . . . . . . . . c30446_6cxn 1 . 5 . 517 . 1 1 1 HIS N N -0.383 -8.023 1.504 . . . 1.0 . . . . . . . . . . . . A . 1 HIS N . . . . . . . . . c30446_6cxn 1 . 5 . 518 . 1 1 1 HIS ND1 N 4.523 -8.070 2.054 . . . 1.0 . . . . . . . . . . . . A . 1 HIS ND1 . . . . . . . . . c30446_6cxn 1 . 5 . 519 . 1 1 1 HIS NE2 N 4.585 -8.859 4.044 . . . 1.0 . . . . . . . . . . . . A . 1 HIS NE2 . . . . . . . . . c30446_6cxn 1 . 5 . 520 . 1 1 1 HIS O O 0.416 -6.001 4.127 . . . 1.0 . . . . . . . . . . . . A . 1 HIS O . . . . . . . . . c30446_6cxn 1 . 5 . 521 . 1 1 2 ARG C C -0.644 -3.180 1.532 . . . 1.0 . . . . . . . . . . . . A . 2 ARG C . . . . . . . . . c30446_6cxn 1 . 5 . 522 . 1 1 2 ARG CA C 0.431 -3.849 2.380 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CA . . . . . . . . . c30446_6cxn 1 . 5 . 523 . 1 1 2 ARG CB C 1.760 -3.108 2.219 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CB . . . . . . . . . c30446_6cxn 1 . 5 . 524 . 1 1 2 ARG CD C 3.418 -1.572 3.316 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CD . . . . . . . . . c30446_6cxn 1 . 5 . 525 . 1 1 2 ARG CG C 1.960 -1.990 3.229 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CG . . . . . . . . . c30446_6cxn 1 . 5 . 526 . 1 1 2 ARG CZ C 3.621 -0.441 5.496 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CZ . . . . . . . . . c30446_6cxn 1 . 5 . 527 . 1 1 2 ARG H H 0.708 -5.488 1.069 . . . 1.0 . . . . . . . . . . . . A . 2 ARG H . . . . . . . . . c30446_6cxn 1 . 5 . 528 . 1 1 2 ARG HA H 0.130 -3.810 3.416 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HA . . . . . . . . . c30446_6cxn 1 . 5 . 529 . 1 1 2 ARG HB2 H 2.569 -3.815 2.332 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB2 . . . . . . . . . c30446_6cxn 1 . 5 . 530 . 1 1 2 ARG HB3 H 1.803 -2.682 1.228 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB3 . . . . . . . . . c30446_6cxn 1 . 5 . 531 . 1 1 2 ARG HD2 H 3.991 -2.392 3.725 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD2 . . . . . . . . . c30446_6cxn 1 . 5 . 532 . 1 1 2 ARG HD3 H 3.775 -1.345 2.322 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD3 . . . . . . . . . c30446_6cxn 1 . 5 . 533 . 1 1 2 ARG HE H 3.715 0.469 3.722 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HE . . . . . . . . . c30446_6cxn 1 . 5 . 534 . 1 1 2 ARG HG2 H 1.369 -1.137 2.928 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG2 . . . . . . . . . c30446_6cxn 1 . 5 . 535 . 1 1 2 ARG HG3 H 1.633 -2.332 4.200 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG3 . . . . . . . . . c30446_6cxn 1 . 5 . 536 . 1 1 2 ARG HH11 H 3.340 -2.440 5.613 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH11 . . . . . . . . . c30446_6cxn 1 . 5 . 537 . 1 1 2 ARG HH12 H 3.485 -1.621 7.132 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH12 . . . . . . . . . c30446_6cxn 1 . 5 . 538 . 1 1 2 ARG HH21 H 3.907 1.548 5.719 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH21 . . . . . . . . . c30446_6cxn 1 . 5 . 539 . 1 1 2 ARG HH22 H 3.807 0.643 7.192 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH22 . . . . . . . . . c30446_6cxn 1 . 5 . 540 . 1 1 2 ARG N N 0.586 -5.252 2.012 . . . 1.0 . . . . . . . . . . . . A . 2 ARG N . . . . . . . . . c30446_6cxn 1 . 5 . 541 . 1 1 2 ARG NE N 3.601 -0.398 4.166 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NE . . . . . . . . . c30446_6cxn 1 . 5 . 542 . 1 1 2 ARG NH1 N 3.469 -1.596 6.132 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH1 . . . . . . . . . c30446_6cxn 1 . 5 . 543 . 1 1 2 ARG NH2 N 3.793 0.675 6.193 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH2 . . . . . . . . . c30446_6cxn 1 . 5 . 544 . 1 1 2 ARG O O -1.143 -3.764 0.570 . . . 1.0 . . . . . . . . . . . . A . 2 ARG O . . . . . . . . . c30446_6cxn 1 . 5 . 545 . 1 1 3 PHE C C -1.426 -0.518 -0.055 . . . 1.0 . . . . . . . . . . . . A . 3 PHE C . . . . . . . . . c30446_6cxn 1 . 5 . 546 . 1 1 3 PHE CA C -2.017 -1.204 1.171 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CA . . . . . . . . . c30446_6cxn 1 . 5 . 547 . 1 1 3 PHE CB C -2.677 -0.174 2.085 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CB . . . . . . . . . c30446_6cxn 1 . 5 . 548 . 1 1 3 PHE CD1 C -4.880 -1.375 1.845 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CD1 . . . . . . . . . c30446_6cxn 1 . 5 . 549 . 1 1 3 PHE CD2 C -4.901 0.983 2.207 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CD2 . . . . . . . . . c30446_6cxn 1 . 5 . 550 . 1 1 3 PHE CE1 C -6.262 -1.385 1.810 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CE1 . . . . . . . . . c30446_6cxn 1 . 5 . 551 . 1 1 3 PHE CE2 C -6.283 0.978 2.172 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CE2 . . . . . . . . . c30446_6cxn 1 . 5 . 552 . 1 1 3 PHE CG C -4.183 -0.191 2.043 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CG . . . . . . . . . c30446_6cxn 1 . 5 . 553 . 1 1 3 PHE CZ C -6.964 -0.207 1.974 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CZ . . . . . . . . . c30446_6cxn 1 . 5 . 554 . 1 1 3 PHE H H -0.566 -1.541 2.674 . . . 1.0 . . . . . . . . . . . . A . 3 PHE H . . . . . . . . . c30446_6cxn 1 . 5 . 555 . 1 1 3 PHE HA H -2.762 -1.901 0.841 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HA . . . . . . . . . c30446_6cxn 1 . 5 . 556 . 1 1 3 PHE HB2 H -2.371 -0.361 3.107 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HB2 . . . . . . . . . c30446_6cxn 1 . 5 . 557 . 1 1 3 PHE HB3 H -2.350 0.809 1.785 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HB3 . . . . . . . . . c30446_6cxn 1 . 5 . 558 . 1 1 3 PHE HD1 H -4.333 -2.297 1.715 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HD1 . . . . . . . . . c30446_6cxn 1 . 5 . 559 . 1 1 3 PHE HD2 H -4.371 1.910 2.362 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HD2 . . . . . . . . . c30446_6cxn 1 . 5 . 560 . 1 1 3 PHE HE1 H -6.792 -2.313 1.654 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HE1 . . . . . . . . . c30446_6cxn 1 . 5 . 561 . 1 1 3 PHE HE2 H -6.830 1.900 2.301 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HE2 . . . . . . . . . c30446_6cxn 1 . 5 . 562 . 1 1 3 PHE HZ H -8.043 -0.213 1.947 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HZ . . . . . . . . . c30446_6cxn 1 . 5 . 563 . 1 1 3 PHE N N -0.998 -1.952 1.897 . . . 1.0 . . . . . . . . . . . . A . 3 PHE N . . . . . . . . . c30446_6cxn 1 . 5 . 564 . 1 1 3 PHE O O -0.209 -0.484 -0.238 . . . 1.0 . . . . . . . . . . . . A . 3 PHE O . . . . . . . . . c30446_6cxn 1 . 5 . 565 . 1 1 4 LEU C C -1.581 2.171 -1.845 . . . 1.0 . . . . . . . . . . . . A . 4 LEU C . . . . . . . . . c30446_6cxn 1 . 5 . 566 . 1 1 4 LEU CA C -1.877 0.699 -2.111 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CA . . . . . . . . . c30446_6cxn 1 . 5 . 567 . 1 1 4 LEU CB C -2.948 0.565 -3.192 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CB . . . . . . . . . c30446_6cxn 1 . 5 . 568 . 1 1 4 LEU CD1 C -4.733 -0.966 -2.352 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CD1 . . . . . . . . . c30446_6cxn 1 . 5 . 569 . 1 1 4 LEU CD2 C -3.997 -1.107 -4.738 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CD2 . . . . . . . . . c30446_6cxn 1 . 5 . 570 . 1 1 4 LEU CG C -3.563 -0.828 -3.307 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CG . . . . . . . . . c30446_6cxn 1 . 5 . 571 . 1 1 4 LEU H H -3.257 -0.045 -0.694 . . . 1.0 . . . . . . . . . . . . A . 4 LEU H . . . . . . . . . c30446_6cxn 1 . 5 . 572 . 1 1 4 LEU HA H -0.980 0.217 -2.454 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HA . . . . . . . . . c30446_6cxn 1 . 5 . 573 . 1 1 4 LEU HB2 H -3.738 1.271 -2.978 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HB2 . . . . . . . . . c30446_6cxn 1 . 5 . 574 . 1 1 4 LEU HB3 H -2.506 0.820 -4.143 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HB3 . . . . . . . . . c30446_6cxn 1 . 5 . 575 . 1 1 4 LEU HD11 H -5.510 -1.555 -2.815 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD11 . . . . . . . . . c30446_6cxn 1 . 5 . 576 . 1 1 4 LEU HD12 H -5.116 0.014 -2.111 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD12 . . . . . . . . . c30446_6cxn 1 . 5 . 577 . 1 1 4 LEU HD13 H -4.398 -1.454 -1.449 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD13 . . . . . . . . . c30446_6cxn 1 . 5 . 578 . 1 1 4 LEU HD21 H -4.403 -2.105 -4.803 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD21 . . . . . . . . . c30446_6cxn 1 . 5 . 579 . 1 1 4 LEU HD22 H -3.144 -1.022 -5.395 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD22 . . . . . . . . . c30446_6cxn 1 . 5 . 580 . 1 1 4 LEU HD23 H -4.751 -0.391 -5.032 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD23 . . . . . . . . . c30446_6cxn 1 . 5 . 581 . 1 1 4 LEU HG H -2.823 -1.564 -3.027 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HG . . . . . . . . . c30446_6cxn 1 . 5 . 582 . 1 1 4 LEU N N -2.302 0.020 -0.896 . . . 1.0 . . . . . . . . . . . . A . 4 LEU N . . . . . . . . . c30446_6cxn 1 . 5 . 583 . 1 1 4 LEU O O -2.492 2.967 -1.616 . . . 1.0 . . . . . . . . . . . . A . 4 LEU O . . . . . . . . . c30446_6cxn 1 . 5 . 584 . 1 1 5 ARG C C 0.893 4.451 -2.833 . . . 1.0 . . . . . . . . . . . . A . 5 ARG C . . . . . . . . . c30446_6cxn 1 . 5 . 585 . 1 1 5 ARG CA C 0.117 3.904 -1.639 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CA . . . . . . . . . c30446_6cxn 1 . 5 . 586 . 1 1 5 ARG CB C 0.973 3.988 -0.374 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CB . . . . . . . . . c30446_6cxn 1 . 5 . 587 . 1 1 5 ARG CD C 1.548 6.338 0.310 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CD . . . . . . . . . c30446_6cxn 1 . 5 . 588 . 1 1 5 ARG CG C 0.613 5.159 0.526 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CG . . . . . . . . . c30446_6cxn 1 . 5 . 589 . 1 1 5 ARG CZ C 0.277 8.179 1.344 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CZ . . . . . . . . . c30446_6cxn 1 . 5 . 590 . 1 1 5 ARG H H 0.380 1.847 -2.064 . . . 1.0 . . . . . . . . . . . . A . 5 ARG H . . . . . . . . . c30446_6cxn 1 . 5 . 591 . 1 1 5 ARG HA H -0.773 4.500 -1.500 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HA . . . . . . . . . c30446_6cxn 1 . 5 . 592 . 1 1 5 ARG HB2 H 0.846 3.073 0.194 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HB2 . . . . . . . . . c30446_6cxn 1 . 5 . 593 . 1 1 5 ARG HB3 H 2.014 4.088 -0.661 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HB3 . . . . . . . . . c30446_6cxn 1 . 5 . 594 . 1 1 5 ARG HD2 H 2.265 6.364 1.117 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HD2 . . . . . . . . . c30446_6cxn 1 . 5 . 595 . 1 1 5 ARG HD3 H 2.068 6.203 -0.627 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HD3 . . . . . . . . . c30446_6cxn 1 . 5 . 596 . 1 1 5 ARG HE H 0.751 8.061 -0.591 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HE . . . . . . . . . c30446_6cxn 1 . 5 . 597 . 1 1 5 ARG HG2 H -0.398 5.470 0.307 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HG2 . . . . . . . . . c30446_6cxn 1 . 5 . 598 . 1 1 5 ARG HG3 H 0.679 4.842 1.556 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HG3 . . . . . . . . . c30446_6cxn 1 . 5 . 599 . 1 1 5 ARG HH11 H 0.842 6.724 2.631 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH11 . . . . . . . . . c30446_6cxn 1 . 5 . 600 . 1 1 5 ARG HH12 H -0.053 8.029 3.333 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH12 . . . . . . . . . c30446_6cxn 1 . 5 . 601 . 1 1 5 ARG HH21 H -0.427 9.779 0.330 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH21 . . . . . . . . . c30446_6cxn 1 . 5 . 602 . 1 1 5 ARG HH22 H -0.774 9.764 2.027 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH22 . . . . . . . . . c30446_6cxn 1 . 5 . 603 . 1 1 5 ARG N N -0.301 2.527 -1.877 . . . 1.0 . . . . . . . . . . . . A . 5 ARG N . . . . . . . . . c30446_6cxn 1 . 5 . 604 . 1 1 5 ARG NE N 0.828 7.609 0.275 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NE . . . . . . . . . c30446_6cxn 1 . 5 . 605 . 1 1 5 ARG NH1 N 0.362 7.596 2.534 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NH1 . . . . . . . . . c30446_6cxn 1 . 5 . 606 . 1 1 5 ARG NH2 N -0.360 9.335 1.224 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NH2 . . . . . . . . . c30446_6cxn 1 . 5 . 607 . 1 1 5 ARG O O 1.564 3.704 -3.544 . . . 1.0 . . . . . . . . . . . . A . 5 ARG O . . . . . . . . . c30446_6cxn 1 . 5 . 608 . 1 1 6 HIS C C 2.645 7.263 -3.647 . . . 1.0 . . . . . . . . . . . . A . 6 HIS C . . . . . . . . . c30446_6cxn 1 . 5 . 609 . 1 1 6 HIS CA C 1.489 6.407 -4.154 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CA . . . . . . . . . c30446_6cxn 1 . 5 . 610 . 1 1 6 HIS CB C 0.515 7.269 -4.958 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CB . . . . . . . . . c30446_6cxn 1 . 5 . 611 . 1 1 6 HIS CD2 C 0.012 8.852 -2.965 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CD2 . . . . . . . . . c30446_6cxn 1 . 5 . 612 . 1 1 6 HIS CE1 C -2.050 9.381 -3.489 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CE1 . . . . . . . . . c30446_6cxn 1 . 5 . 613 . 1 1 6 HIS CG C -0.297 8.199 -4.111 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CG . . . . . . . . . c30446_6cxn 1 . 5 . 614 . 1 1 6 HIS H H 0.246 6.302 -2.444 . . . 1.0 . . . . . . . . . . . . A . 6 HIS H . . . . . . . . . c30446_6cxn 1 . 5 . 615 . 1 1 6 HIS HA H 1.884 5.633 -4.795 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HA . . . . . . . . . c30446_6cxn 1 . 5 . 616 . 1 1 6 HIS HB2 H 1.075 7.869 -5.666 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HB2 . . . . . . . . . c30446_6cxn 1 . 5 . 617 . 1 1 6 HIS HB3 H -0.170 6.622 -5.495 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HB3 . . . . . . . . . c30446_6cxn 1 . 5 . 618 . 1 1 6 HIS HD1 H -2.108 8.241 -5.188 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HD1 . . . . . . . . . c30446_6cxn 1 . 5 . 619 . 1 1 6 HIS HD2 H 0.954 8.808 -2.436 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HD2 . . . . . . . . . c30446_6cxn 1 . 5 . 620 . 1 1 6 HIS HE1 H -3.036 9.821 -3.466 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HE1 . . . . . . . . . c30446_6cxn 1 . 5 . 621 . 1 1 6 HIS HE2 H -1.196 10.080 -1.765 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HE2 . . . . . . . . . c30446_6cxn 1 . 5 . 622 . 1 1 6 HIS N N 0.796 5.759 -3.046 . . . 1.0 . . . . . . . . . . . . A . 6 HIS N . . . . . . . . . c30446_6cxn 1 . 5 . 623 . 1 1 6 HIS ND1 N -1.596 8.552 -4.412 . . . 1.0 . . . . . . . . . . . . A . 6 HIS ND1 . . . . . . . . . c30446_6cxn 1 . 5 . 624 . 1 1 6 HIS NE2 N -1.095 9.578 -2.600 . . . 1.0 . . . . . . . . . . . . A . 6 HIS NE2 . . . . . . . . . c30446_6cxn 1 . 5 . 625 . 1 1 6 HIS O O 3.336 7.880 -4.485 . . . 1.0 . . . . . . . . . . . . A . 6 HIS O . . . . . . . . . c30446_6cxn 1 . 6 . 626 . 1 1 1 HIS C C -0.462 -6.551 2.641 . . . 1.0 . . . . . . . . . . . . A . 1 HIS C . . . . . . . . . c30446_6cxn 1 . 6 . 627 . 1 1 1 HIS CA C -0.432 -7.977 2.101 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CA . . . . . . . . . c30446_6cxn 1 . 6 . 628 . 1 1 1 HIS CB C -1.741 -8.298 1.375 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CB . . . . . . . . . c30446_6cxn 1 . 6 . 629 . 1 1 1 HIS CD2 C -1.915 -7.560 -1.106 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CD2 . . . . . . . . . c30446_6cxn 1 . 6 . 630 . 1 1 1 HIS CE1 C -1.036 -9.342 -2.032 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CE1 . . . . . . . . . c30446_6cxn 1 . 6 . 631 . 1 1 1 HIS CG C -1.588 -8.417 -0.109 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CG . . . . . . . . . c30446_6cxn 1 . 6 . 632 . 1 1 1 HIS H1 H 0.514 -8.612 3.815 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H1 . . . . . . . . . c30446_6cxn 1 . 6 . 633 . 1 1 1 HIS H2 H 0.012 -9.873 2.765 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H2 . . . . . . . . . c30446_6cxn 1 . 6 . 634 . 1 1 1 HIS H3 H -1.145 -9.034 3.716 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H3 . . . . . . . . . c30446_6cxn 1 . 6 . 635 . 1 1 1 HIS HA H 0.391 -8.074 1.409 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HA . . . . . . . . . c30446_6cxn 1 . 6 . 636 . 1 1 1 HIS HB2 H -2.128 -9.236 1.744 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HB2 . . . . . . . . . c30446_6cxn 1 . 6 . 637 . 1 1 1 HIS HB3 H -2.458 -7.515 1.575 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HB3 . . . . . . . . . c30446_6cxn 1 . 6 . 638 . 1 1 1 HIS HD1 H -0.703 -10.323 -0.268 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HD1 . . . . . . . . . c30446_6cxn 1 . 6 . 639 . 1 1 1 HIS HD2 H -2.369 -6.586 -0.990 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HD2 . . . . . . . . . c30446_6cxn 1 . 6 . 640 . 1 1 1 HIS HE1 H -0.667 -10.043 -2.767 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HE1 . . . . . . . . . c30446_6cxn 1 . 6 . 641 . 1 1 1 HIS HE2 H -1.760 -7.811 -3.184 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HE2 . . . . . . . . . c30446_6cxn 1 . 6 . 642 . 1 1 1 HIS N N -0.246 -8.963 3.198 . . . 1.0 . . . . . . . . . . . . A . 1 HIS N . . . . . . . . . c30446_6cxn 1 . 6 . 643 . 1 1 1 HIS ND1 N -1.040 -9.524 -0.724 . . . 1.0 . . . . . . . . . . . . A . 1 HIS ND1 . . . . . . . . . c30446_6cxn 1 . 6 . 644 . 1 1 1 HIS NE2 N -1.562 -8.159 -2.290 . . . 1.0 . . . . . . . . . . . . A . 1 HIS NE2 . . . . . . . . . c30446_6cxn 1 . 6 . 645 . 1 1 1 HIS O O -1.124 -6.269 3.640 . . . 1.0 . . . . . . . . . . . . A . 1 HIS O . . . . . . . . . c30446_6cxn 1 . 6 . 646 . 1 1 2 ARG C C -0.638 -3.407 1.554 . . . 1.0 . . . . . . . . . . . . A . 2 ARG C . . . . . . . . . c30446_6cxn 1 . 6 . 647 . 1 1 2 ARG CA C 0.314 -4.258 2.387 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CA . . . . . . . . . c30446_6cxn 1 . 6 . 648 . 1 1 2 ARG CB C 1.741 -3.722 2.259 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CB . . . . . . . . . c30446_6cxn 1 . 6 . 649 . 1 1 2 ARG CD C 2.621 -4.829 4.339 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CD . . . . . . . . . c30446_6cxn 1 . 6 . 650 . 1 1 2 ARG CG C 2.795 -4.652 2.839 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CG . . . . . . . . . c30446_6cxn 1 . 6 . 651 . 1 1 2 ARG CZ C 4.363 -3.406 5.346 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CZ . . . . . . . . . c30446_6cxn 1 . 6 . 652 . 1 1 2 ARG H H 0.765 -5.941 1.185 . . . 1.0 . . . . . . . . . . . . A . 2 ARG H . . . . . . . . . c30446_6cxn 1 . 6 . 653 . 1 1 2 ARG HA H 0.011 -4.206 3.422 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HA . . . . . . . . . c30446_6cxn 1 . 6 . 654 . 1 1 2 ARG HB2 H 1.964 -3.569 1.213 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB2 . . . . . . . . . c30446_6cxn 1 . 6 . 655 . 1 1 2 ARG HB3 H 1.805 -2.775 2.774 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB3 . . . . . . . . . c30446_6cxn 1 . 6 . 656 . 1 1 2 ARG HD2 H 1.884 -4.122 4.691 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD2 . . . . . . . . . c30446_6cxn 1 . 6 . 657 . 1 1 2 ARG HD3 H 2.274 -5.834 4.532 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD3 . . . . . . . . . c30446_6cxn 1 . 6 . 658 . 1 1 2 ARG HE H 4.367 -5.402 5.359 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HE . . . . . . . . . c30446_6cxn 1 . 6 . 659 . 1 1 2 ARG HG2 H 2.713 -5.616 2.361 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG2 . . . . . . . . . c30446_6cxn 1 . 6 . 660 . 1 1 2 ARG HG3 H 3.773 -4.235 2.646 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG3 . . . . . . . . . c30446_6cxn 1 . 6 . 661 . 1 1 2 ARG HH11 H 2.858 -2.386 4.459 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH11 . . . . . . . . . c30446_6cxn 1 . 6 . 662 . 1 1 2 ARG HH12 H 4.095 -1.410 5.177 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH12 . . . . . . . . . c30446_6cxn 1 . 6 . 663 . 1 1 2 ARG HH21 H 5.994 -4.119 6.304 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH21 . . . . . . . . . c30446_6cxn 1 . 6 . 664 . 1 1 2 ARG HH22 H 5.875 -2.393 6.224 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH22 . . . . . . . . . c30446_6cxn 1 . 6 . 665 . 1 1 2 ARG N N 0.259 -5.656 1.974 . . . 1.0 . . . . . . . . . . . . A . 2 ARG N . . . . . . . . . c30446_6cxn 1 . 6 . 666 . 1 1 2 ARG NE N 3.870 -4.610 5.065 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NE . . . . . . . . . c30446_6cxn 1 . 6 . 667 . 1 1 2 ARG NH1 N 3.719 -2.311 4.963 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH1 . . . . . . . . . c30446_6cxn 1 . 6 . 668 . 1 1 2 ARG NH2 N 5.504 -3.297 6.013 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH2 . . . . . . . . . c30446_6cxn 1 . 6 . 669 . 1 1 2 ARG O O -1.287 -3.903 0.634 . . . 1.0 . . . . . . . . . . . . A . 2 ARG O . . . . . . . . . c30446_6cxn 1 . 6 . 670 . 1 1 3 PHE C C -0.869 -0.563 -0.010 . . . 1.0 . . . . . . . . . . . . A . 3 PHE C . . . . . . . . . c30446_6cxn 1 . 6 . 671 . 1 1 3 PHE CA C -1.591 -1.203 1.169 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CA . . . . . . . . . c30446_6cxn 1 . 6 . 672 . 1 1 3 PHE CB C -2.117 -0.123 2.113 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CB . . . . . . . . . c30446_6cxn 1 . 6 . 673 . 1 1 3 PHE CD1 C -4.471 -0.948 1.752 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CD1 . . . . . . . . . c30446_6cxn 1 . 6 . 674 . 1 1 3 PHE CD2 C -4.133 1.370 2.201 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CD2 . . . . . . . . . c30446_6cxn 1 . 6 . 675 . 1 1 3 PHE CE1 C -5.834 -0.736 1.669 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CE1 . . . . . . . . . c30446_6cxn 1 . 6 . 676 . 1 1 3 PHE CE2 C -5.496 1.587 2.119 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CE2 . . . . . . . . . c30446_6cxn 1 . 6 . 677 . 1 1 3 PHE CG C -3.604 0.102 2.019 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CG . . . . . . . . . c30446_6cxn 1 . 6 . 678 . 1 1 3 PHE CZ C -6.347 0.533 1.853 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CZ . . . . . . . . . c30446_6cxn 1 . 6 . 679 . 1 1 3 PHE H H -0.175 -1.786 2.630 . . . 1.0 . . . . . . . . . . . . A . 3 PHE H . . . . . . . . . c30446_6cxn 1 . 6 . 680 . 1 1 3 PHE HA H -2.421 -1.766 0.792 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HA . . . . . . . . . c30446_6cxn 1 . 6 . 681 . 1 1 3 PHE HB2 H -1.889 -0.403 3.134 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HB2 . . . . . . . . . c30446_6cxn 1 . 6 . 682 . 1 1 3 PHE HB3 H -1.627 0.808 1.876 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HB3 . . . . . . . . . c30446_6cxn 1 . 6 . 683 . 1 1 3 PHE HD1 H -4.073 -1.941 1.607 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HD1 . . . . . . . . . c30446_6cxn 1 . 6 . 684 . 1 1 3 PHE HD2 H -3.469 2.196 2.410 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HD2 . . . . . . . . . c30446_6cxn 1 . 6 . 685 . 1 1 3 PHE HE1 H -6.498 -1.562 1.460 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HE1 . . . . . . . . . c30446_6cxn 1 . 6 . 686 . 1 1 3 PHE HE2 H -5.894 2.581 2.263 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HE2 . . . . . . . . . c30446_6cxn 1 . 6 . 687 . 1 1 3 PHE HZ H -7.412 0.701 1.788 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HZ . . . . . . . . . c30446_6cxn 1 . 6 . 688 . 1 1 3 PHE N N -0.716 -2.123 1.885 . . . 1.0 . . . . . . . . . . . . A . 3 PHE N . . . . . . . . . c30446_6cxn 1 . 6 . 689 . 1 1 3 PHE O O 0.344 -0.702 -0.163 . . . 1.0 . . . . . . . . . . . . A . 3 PHE O . . . . . . . . . c30446_6cxn 1 . 6 . 690 . 1 1 4 LEU C C -0.586 2.196 -1.684 . . . 1.0 . . . . . . . . . . . . A . 4 LEU C . . . . . . . . . c30446_6cxn 1 . 6 . 691 . 1 1 4 LEU CA C -1.075 0.791 -2.020 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CA . . . . . . . . . c30446_6cxn 1 . 6 . 692 . 1 1 4 LEU CB C -2.118 0.849 -3.135 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CB . . . . . . . . . c30446_6cxn 1 . 6 . 693 . 1 1 4 LEU CD1 C -4.127 -0.440 -2.401 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CD1 . . . . . . . . . c30446_6cxn 1 . 6 . 694 . 1 1 4 LEU CD2 C -3.346 -0.600 -4.772 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CD2 . . . . . . . . . c30446_6cxn 1 . 6 . 695 . 1 1 4 LEU CG C -2.921 -0.437 -3.320 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CG . . . . . . . . . c30446_6cxn 1 . 6 . 696 . 1 1 4 LEU H H -2.591 0.202 -0.671 . . . 1.0 . . . . . . . . . . . . A . 4 LEU H . . . . . . . . . c30446_6cxn 1 . 6 . 697 . 1 1 4 LEU HA H -0.242 0.202 -2.358 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HA . . . . . . . . . c30446_6cxn 1 . 6 . 698 . 1 1 4 LEU HB2 H -2.805 1.654 -2.917 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HB2 . . . . . . . . . c30446_6cxn 1 . 6 . 699 . 1 1 4 LEU HB3 H -1.612 1.069 -4.063 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HB3 . . . . . . . . . c30446_6cxn 1 . 6 . 700 . 1 1 4 LEU HD11 H -4.967 -0.889 -2.907 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD11 . . . . . . . . . c30446_6cxn 1 . 6 . 701 . 1 1 4 LEU HD12 H -4.369 0.575 -2.125 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD12 . . . . . . . . . c30446_6cxn 1 . 6 . 702 . 1 1 4 LEU HD13 H -3.894 -1.007 -1.513 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD13 . . . . . . . . . c30446_6cxn 1 . 6 . 703 . 1 1 4 LEU HD21 H -2.526 -1.010 -5.343 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD21 . . . . . . . . . c30446_6cxn 1 . 6 . 704 . 1 1 4 LEU HD22 H -3.621 0.362 -5.177 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD22 . . . . . . . . . c30446_6cxn 1 . 6 . 705 . 1 1 4 LEU HD23 H -4.192 -1.269 -4.826 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD23 . . . . . . . . . c30446_6cxn 1 . 6 . 706 . 1 1 4 LEU HG H -2.301 -1.280 -3.052 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HG . . . . . . . . . c30446_6cxn 1 . 6 . 707 . 1 1 4 LEU N N -1.631 0.134 -0.846 . . . 1.0 . . . . . . . . . . . . A . 4 LEU N . . . . . . . . . c30446_6cxn 1 . 6 . 708 . 1 1 4 LEU O O -1.172 2.885 -0.849 . . . 1.0 . . . . . . . . . . . . A . 4 LEU O . . . . . . . . . c30446_6cxn 1 . 6 . 709 . 1 1 5 ARG C C 0.692 4.894 -3.239 . . . 1.0 . . . . . . . . . . . . A . 5 ARG C . . . . . . . . . c30446_6cxn 1 . 6 . 710 . 1 1 5 ARG CA C 1.060 3.938 -2.109 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CA . . . . . . . . . c30446_6cxn 1 . 6 . 711 . 1 1 5 ARG CB C 2.581 3.846 -1.977 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CB . . . . . . . . . c30446_6cxn 1 . 6 . 712 . 1 1 5 ARG CD C 3.693 6.071 -1.614 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CD . . . . . . . . . c30446_6cxn 1 . 6 . 713 . 1 1 5 ARG CG C 3.160 4.810 -0.954 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CG . . . . . . . . . c30446_6cxn 1 . 6 . 714 . 1 1 5 ARG CZ C 3.871 7.702 0.225 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CZ . . . . . . . . . c30446_6cxn 1 . 6 . 715 . 1 1 5 ARG H H 0.915 2.020 -2.993 . . . 1.0 . . . . . . . . . . . . A . 5 ARG H . . . . . . . . . c30446_6cxn 1 . 6 . 716 . 1 1 5 ARG HA H 0.650 4.318 -1.185 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HA . . . . . . . . . c30446_6cxn 1 . 6 . 717 . 1 1 5 ARG HB2 H 2.845 2.838 -1.680 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HB2 . . . . . . . . . c30446_6cxn 1 . 6 . 718 . 1 1 5 ARG HB3 H 3.028 4.063 -2.940 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HB3 . . . . . . . . . c30446_6cxn 1 . 6 . 719 . 1 1 5 ARG HD2 H 4.771 6.022 -1.638 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HD2 . . . . . . . . . c30446_6cxn 1 . 6 . 720 . 1 1 5 ARG HD3 H 3.313 6.122 -2.624 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HD3 . . . . . . . . . c30446_6cxn 1 . 6 . 721 . 1 1 5 ARG HE H 2.547 7.798 -1.265 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HE . . . . . . . . . c30446_6cxn 1 . 6 . 722 . 1 1 5 ARG HG2 H 2.385 5.083 -0.253 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HG2 . . . . . . . . . c30446_6cxn 1 . 6 . 723 . 1 1 5 ARG HG3 H 3.967 4.320 -0.429 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HG3 . . . . . . . . . c30446_6cxn 1 . 6 . 724 . 1 1 5 ARG HH11 H 5.208 6.187 0.316 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH11 . . . . . . . . . c30446_6cxn 1 . 6 . 725 . 1 1 5 ARG HH12 H 5.312 7.347 1.598 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH12 . . . . . . . . . c30446_6cxn 1 . 6 . 726 . 1 1 5 ARG HH21 H 2.682 9.325 0.419 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH21 . . . . . . . . . c30446_6cxn 1 . 6 . 727 . 1 1 5 ARG HH22 H 3.878 9.128 1.657 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH22 . . . . . . . . . c30446_6cxn 1 . 6 . 728 . 1 1 5 ARG N N 0.491 2.615 -2.339 . . . 1.0 . . . . . . . . . . . . A . 5 ARG N . . . . . . . . . c30446_6cxn 1 . 6 . 729 . 1 1 5 ARG NE N 3.290 7.277 -0.895 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NE . . . . . . . . . c30446_6cxn 1 . 6 . 730 . 1 1 5 ARG NH1 N 4.879 7.022 0.757 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NH1 . . . . . . . . . c30446_6cxn 1 . 6 . 731 . 1 1 5 ARG NH2 N 3.442 8.809 0.815 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NH2 . . . . . . . . . c30446_6cxn 1 . 6 . 732 . 1 1 5 ARG O O 0.529 4.481 -4.387 . . . 1.0 . . . . . . . . . . . . A . 5 ARG O . . . . . . . . . c30446_6cxn 1 . 6 . 733 . 1 1 6 HIS C C 1.388 8.130 -4.144 . . . 1.0 . . . . . . . . . . . . A . 6 HIS C . . . . . . . . . c30446_6cxn 1 . 6 . 734 . 1 1 6 HIS CA C 0.213 7.190 -3.892 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CA . . . . . . . . . c30446_6cxn 1 . 6 . 735 . 1 1 6 HIS CB C -1.003 7.991 -3.422 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CB . . . . . . . . . c30446_6cxn 1 . 6 . 736 . 1 1 6 HIS CD2 C -1.417 8.445 -0.902 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CD2 . . . . . . . . . c30446_6cxn 1 . 6 . 737 . 1 1 6 HIS CE1 C 0.058 10.041 -0.618 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CE1 . . . . . . . . . c30446_6cxn 1 . 6 . 738 . 1 1 6 HIS CG C -0.807 8.651 -2.093 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CG . . . . . . . . . c30446_6cxn 1 . 6 . 739 . 1 1 6 HIS H H 0.704 6.442 -1.974 . . . 1.0 . . . . . . . . . . . . A . 6 HIS H . . . . . . . . . c30446_6cxn 1 . 6 . 740 . 1 1 6 HIS HA H -0.033 6.686 -4.814 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HA . . . . . . . . . c30446_6cxn 1 . 6 . 741 . 1 1 6 HIS HB2 H -1.219 8.765 -4.149 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HB2 . . . . . . . . . c30446_6cxn 1 . 6 . 742 . 1 1 6 HIS HB3 H -1.855 7.324 -3.342 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HB3 . . . . . . . . . c30446_6cxn 1 . 6 . 743 . 1 1 6 HIS HD1 H 0.714 10.035 -2.556 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HD1 . . . . . . . . . c30446_6cxn 1 . 6 . 744 . 1 1 6 HIS HD2 H -2.197 7.724 -0.697 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HD2 . . . . . . . . . c30446_6cxn 1 . 6 . 745 . 1 1 6 HIS HE1 H 0.663 10.813 -0.165 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HE1 . . . . . . . . . c30446_6cxn 1 . 6 . 746 . 1 1 6 HIS HE2 H -1.048 9.345 0.959 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HE2 . . . . . . . . . c30446_6cxn 1 . 6 . 747 . 1 1 6 HIS N N 0.562 6.174 -2.905 . . . 1.0 . . . . . . . . . . . . A . 6 HIS N . . . . . . . . . c30446_6cxn 1 . 6 . 748 . 1 1 6 HIS ND1 N 0.112 9.658 -1.881 . . . 1.0 . . . . . . . . . . . . A . 6 HIS ND1 . . . . . . . . . c30446_6cxn 1 . 6 . 749 . 1 1 6 HIS NE2 N -0.862 9.321 -0.003 . . . 1.0 . . . . . . . . . . . . A . 6 HIS NE2 . . . . . . . . . c30446_6cxn 1 . 6 . 750 . 1 1 6 HIS O O 1.283 8.975 -5.058 . . . 1.0 . . . . . . . . . . . . A . 6 HIS O . . . . . . . . . c30446_6cxn 1 . 7 . 751 . 1 1 1 HIS C C -0.194 -6.657 2.899 . . . 1.0 . . . . . . . . . . . . A . 1 HIS C . . . . . . . . . c30446_6cxn 1 . 7 . 752 . 1 1 1 HIS CA C -0.447 -8.104 2.490 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CA . . . . . . . . . c30446_6cxn 1 . 7 . 753 . 1 1 1 HIS CB C -1.815 -8.566 2.997 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CB . . . . . . . . . c30446_6cxn 1 . 7 . 754 . 1 1 1 HIS CD2 C -2.104 -10.400 1.185 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CD2 . . . . . . . . . c30446_6cxn 1 . 7 . 755 . 1 1 1 HIS CE1 C -4.276 -10.252 0.925 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CE1 . . . . . . . . . c30446_6cxn 1 . 7 . 756 . 1 1 1 HIS CG C -2.550 -9.437 2.027 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CG . . . . . . . . . c30446_6cxn 1 . 7 . 757 . 1 1 1 HIS H1 H 0.599 -8.890 4.077 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H1 . . . . . . . . . c30446_6cxn 1 . 7 . 758 . 1 1 1 HIS H2 H 1.506 -8.734 2.629 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H2 . . . . . . . . . c30446_6cxn 1 . 7 . 759 . 1 1 1 HIS H3 H 0.339 -9.983 2.782 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H3 . . . . . . . . . c30446_6cxn 1 . 7 . 760 . 1 1 1 HIS HA H -0.425 -8.175 1.413 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HA . . . . . . . . . c30446_6cxn 1 . 7 . 761 . 1 1 1 HIS HB2 H -1.682 -9.126 3.910 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HB2 . . . . . . . . . c30446_6cxn 1 . 7 . 762 . 1 1 1 HIS HB3 H -2.428 -7.699 3.199 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HB3 . . . . . . . . . c30446_6cxn 1 . 7 . 763 . 1 1 1 HIS HD1 H -4.528 -8.763 2.305 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HD1 . . . . . . . . . c30446_6cxn 1 . 7 . 764 . 1 1 1 HIS HD2 H -1.079 -10.722 1.066 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HD2 . . . . . . . . . c30446_6cxn 1 . 7 . 765 . 1 1 1 HIS HE1 H -5.283 -10.423 0.574 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HE1 . . . . . . . . . c30446_6cxn 1 . 7 . 766 . 1 1 1 HIS HE2 H -3.191 -11.655 -0.099 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HE2 . . . . . . . . . c30446_6cxn 1 . 7 . 767 . 1 1 1 HIS N N 0.593 -9.009 3.045 . . . 1.0 . . . . . . . . . . . . A . 1 HIS N . . . . . . . . . c30446_6cxn 1 . 7 . 768 . 1 1 1 HIS ND1 N -3.915 -9.368 1.838 . . . 1.0 . . . . . . . . . . . . A . 1 HIS ND1 . . . . . . . . . c30446_6cxn 1 . 7 . 769 . 1 1 1 HIS NE2 N -3.196 -10.890 0.513 . . . 1.0 . . . . . . . . . . . . A . 1 HIS NE2 . . . . . . . . . c30446_6cxn 1 . 7 . 770 . 1 1 1 HIS O O -0.195 -6.327 4.085 . . . 1.0 . . . . . . . . . . . . A . 1 HIS O . . . . . . . . . c30446_6cxn 1 . 7 . 771 . 1 1 2 ARG C C -0.704 -3.506 1.395 . . . 1.0 . . . . . . . . . . . . A . 2 ARG C . . . . . . . . . c30446_6cxn 1 . 7 . 772 . 1 1 2 ARG CA C 0.276 -4.384 2.166 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CA . . . . . . . . . c30446_6cxn 1 . 7 . 773 . 1 1 2 ARG CB C 1.714 -4.025 1.784 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CB . . . . . . . . . c30446_6cxn 1 . 7 . 774 . 1 1 2 ARG CD C 3.022 -5.383 3.445 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CD . . . . . . . . . c30446_6cxn 1 . 7 . 775 . 1 1 2 ARG CG C 2.666 -3.984 2.968 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CG . . . . . . . . . c30446_6cxn 1 . 7 . 776 . 1 1 2 ARG CZ C 5.193 -5.841 2.375 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CZ . . . . . . . . . c30446_6cxn 1 . 7 . 777 . 1 1 2 ARG H H 0.010 -6.119 0.984 . . . 1.0 . . . . . . . . . . . . A . 2 ARG H . . . . . . . . . c30446_6cxn 1 . 7 . 778 . 1 1 2 ARG HA H 0.140 -4.209 3.223 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HA . . . . . . . . . c30446_6cxn 1 . 7 . 779 . 1 1 2 ARG HB2 H 2.081 -4.757 1.080 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB2 . . . . . . . . . c30446_6cxn 1 . 7 . 780 . 1 1 2 ARG HB3 H 1.719 -3.053 1.313 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB3 . . . . . . . . . c30446_6cxn 1 . 7 . 781 . 1 1 2 ARG HD2 H 3.529 -5.307 4.396 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD2 . . . . . . . . . c30446_6cxn 1 . 7 . 782 . 1 1 2 ARG HD3 H 2.110 -5.949 3.569 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD3 . . . . . . . . . c30446_6cxn 1 . 7 . 783 . 1 1 2 ARG HE H 3.480 -6.763 1.928 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HE . . . . . . . . . c30446_6cxn 1 . 7 . 784 . 1 1 2 ARG HG2 H 3.572 -3.475 2.672 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG2 . . . . . . . . . c30446_6cxn 1 . 7 . 785 . 1 1 2 ARG HG3 H 2.196 -3.445 3.777 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG3 . . . . . . . . . c30446_6cxn 1 . 7 . 786 . 1 1 2 ARG HH11 H 5.248 -4.407 3.800 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH11 . . . . . . . . . c30446_6cxn 1 . 7 . 787 . 1 1 2 ARG HH12 H 6.762 -4.749 3.033 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH12 . . . . . . . . . c30446_6cxn 1 . 7 . 788 . 1 1 2 ARG HH21 H 5.471 -7.215 0.918 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH21 . . . . . . . . . c30446_6cxn 1 . 7 . 789 . 1 1 2 ARG HH22 H 6.889 -6.342 1.396 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH22 . . . . . . . . . c30446_6cxn 1 . 7 . 790 . 1 1 2 ARG N N 0.022 -5.797 1.910 . . . 1.0 . . . . . . . . . . . . A . 2 ARG N . . . . . . . . . c30446_6cxn 1 . 7 . 791 . 1 1 2 ARG NE N 3.890 -6.080 2.500 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NE . . . . . . . . . c30446_6cxn 1 . 7 . 792 . 1 1 2 ARG NH1 N 5.783 -4.924 3.131 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH1 . . . . . . . . . c30446_6cxn 1 . 7 . 793 . 1 1 2 ARG NH2 N 5.910 -6.522 1.491 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH2 . . . . . . . . . c30446_6cxn 1 . 7 . 794 . 1 1 2 ARG O O -1.327 -3.953 0.432 . . . 1.0 . . . . . . . . . . . . A . 2 ARG O . . . . . . . . . c30446_6cxn 1 . 7 . 795 . 1 1 3 PHE C C -1.055 -0.603 0.019 . . . 1.0 . . . . . . . . . . . . A . 3 PHE C . . . . . . . . . c30446_6cxn 1 . 7 . 796 . 1 1 3 PHE CA C -1.742 -1.317 1.176 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CA . . . . . . . . . c30446_6cxn 1 . 7 . 797 . 1 1 3 PHE CB C -2.269 -0.299 2.186 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CB . . . . . . . . . c30446_6cxn 1 . 7 . 798 . 1 1 3 PHE CD1 C -4.602 -1.206 1.893 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CD1 . . . . . . . . . c30446_6cxn 1 . 7 . 799 . 1 1 3 PHE CD2 C -4.337 1.105 2.424 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CD2 . . . . . . . . . c30446_6cxn 1 . 7 . 800 . 1 1 3 PHE CE1 C -5.975 -1.047 1.877 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CE1 . . . . . . . . . c30446_6cxn 1 . 7 . 801 . 1 1 3 PHE CE2 C -5.709 1.268 2.409 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CE2 . . . . . . . . . c30446_6cxn 1 . 7 . 802 . 1 1 3 PHE CG C -3.766 -0.132 2.166 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CG . . . . . . . . . c30446_6cxn 1 . 7 . 803 . 1 1 3 PHE CZ C -6.529 0.191 2.136 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CZ . . . . . . . . . c30446_6cxn 1 . 7 . 804 . 1 1 3 PHE H H -0.314 -1.959 2.599 . . . 1.0 . . . . . . . . . . . . A . 3 PHE H . . . . . . . . . c30446_6cxn 1 . 7 . 805 . 1 1 3 PHE HA H -2.570 -1.876 0.785 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HA . . . . . . . . . c30446_6cxn 1 . 7 . 806 . 1 1 3 PHE HB2 H -1.984 -0.610 3.184 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HB2 . . . . . . . . . c30446_6cxn 1 . 7 . 807 . 1 1 3 PHE HB3 H -1.827 0.661 1.968 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HB3 . . . . . . . . . c30446_6cxn 1 . 7 . 808 . 1 1 3 PHE HD1 H -4.171 -2.175 1.689 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HD1 . . . . . . . . . c30446_6cxn 1 . 7 . 809 . 1 1 3 PHE HD2 H -3.697 1.948 2.638 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HD2 . . . . . . . . . c30446_6cxn 1 . 7 . 810 . 1 1 3 PHE HE1 H -6.614 -1.891 1.663 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HE1 . . . . . . . . . c30446_6cxn 1 . 7 . 811 . 1 1 3 PHE HE2 H -6.140 2.238 2.611 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HE2 . . . . . . . . . c30446_6cxn 1 . 7 . 812 . 1 1 3 PHE HZ H -7.601 0.317 2.124 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HZ . . . . . . . . . c30446_6cxn 1 . 7 . 813 . 1 1 3 PHE N N -0.837 -2.256 1.826 . . . 1.0 . . . . . . . . . . . . A . 3 PHE N . . . . . . . . . c30446_6cxn 1 . 7 . 814 . 1 1 3 PHE O O 0.158 -0.711 -0.160 . . . 1.0 . . . . . . . . . . . . A . 3 PHE O . . . . . . . . . c30446_6cxn 1 . 7 . 815 . 1 1 4 LEU C C -1.013 2.298 -1.554 . . . 1.0 . . . . . . . . . . . . A . 4 LEU C . . . . . . . . . c30446_6cxn 1 . 7 . 816 . 1 1 4 LEU CA C -1.318 0.848 -1.914 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CA . . . . . . . . . c30446_6cxn 1 . 7 . 817 . 1 1 4 LEU CB C -2.309 0.792 -3.075 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CB . . . . . . . . . c30446_6cxn 1 . 7 . 818 . 1 1 4 LEU CD1 C -4.246 -0.594 -2.330 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CD1 . . . . . . . . . c30446_6cxn 1 . 7 . 819 . 1 1 4 LEU CD2 C -3.420 -0.778 -4.684 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CD2 . . . . . . . . . c30446_6cxn 1 . 7 . 820 . 1 1 4 LEU CG C -3.029 -0.545 -3.232 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CG . . . . . . . . . c30446_6cxn 1 . 7 . 821 . 1 1 4 LEU H H -2.801 0.163 -0.573 . . . 1.0 . . . . . . . . . . . . A . 4 LEU H . . . . . . . . . c30446_6cxn 1 . 7 . 822 . 1 1 4 LEU HA H -0.408 0.363 -2.215 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HA . . . . . . . . . c30446_6cxn 1 . 7 . 823 . 1 1 4 LEU HB2 H -3.050 1.565 -2.928 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HB2 . . . . . . . . . c30446_6cxn 1 . 7 . 824 . 1 1 4 LEU HB3 H -1.774 0.998 -3.990 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HB3 . . . . . . . . . c30446_6cxn 1 . 7 . 825 . 1 1 4 LEU HD11 H -3.999 -1.137 -1.431 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD11 . . . . . . . . . c30446_6cxn 1 . 7 . 826 . 1 1 4 LEU HD12 H -5.057 -1.089 -2.842 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD12 . . . . . . . . . c30446_6cxn 1 . 7 . 827 . 1 1 4 LEU HD13 H -4.541 0.412 -2.072 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD13 . . . . . . . . . c30446_6cxn 1 . 7 . 828 . 1 1 4 LEU HD21 H -3.519 0.173 -5.187 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD21 . . . . . . . . . c30446_6cxn 1 . 7 . 829 . 1 1 4 LEU HD22 H -4.361 -1.306 -4.723 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD22 . . . . . . . . . c30446_6cxn 1 . 7 . 830 . 1 1 4 LEU HD23 H -2.657 -1.366 -5.172 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD23 . . . . . . . . . c30446_6cxn 1 . 7 . 831 . 1 1 4 LEU HG H -2.364 -1.340 -2.928 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HG . . . . . . . . . c30446_6cxn 1 . 7 . 832 . 1 1 4 LEU N N -1.843 0.121 -0.767 . . . 1.0 . . . . . . . . . . . . A . 4 LEU N . . . . . . . . . c30446_6cxn 1 . 7 . 833 . 1 1 4 LEU O O -1.683 2.893 -0.710 . . . 1.0 . . . . . . . . . . . . A . 4 LEU O . . . . . . . . . c30446_6cxn 1 . 7 . 834 . 1 1 5 ARG C C 0.737 4.957 -3.253 . . . 1.0 . . . . . . . . . . . . A . 5 ARG C . . . . . . . . . c30446_6cxn 1 . 7 . 835 . 1 1 5 ARG CA C 0.396 4.243 -1.949 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CA . . . . . . . . . c30446_6cxn 1 . 7 . 836 . 1 1 5 ARG CB C 1.595 4.288 -1.000 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CB . . . . . . . . . c30446_6cxn 1 . 7 . 837 . 1 1 5 ARG CD C 2.390 6.618 -0.492 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CD . . . . . . . . . c30446_6cxn 1 . 7 . 838 . 1 1 5 ARG CG C 1.547 5.446 -0.016 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CG . . . . . . . . . c30446_6cxn 1 . 7 . 839 . 1 1 5 ARG CZ C 1.830 8.461 1.045 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CZ . . . . . . . . . c30446_6cxn 1 . 7 . 840 . 1 1 5 ARG H H 0.498 2.336 -2.863 . . . 1.0 . . . . . . . . . . . . A . 5 ARG H . . . . . . . . . c30446_6cxn 1 . 7 . 841 . 1 1 5 ARG HA H -0.438 4.746 -1.484 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HA . . . . . . . . . c30446_6cxn 1 . 7 . 842 . 1 1 5 ARG HB2 H 1.628 3.364 -0.435 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HB2 . . . . . . . . . c30446_6cxn 1 . 7 . 843 . 1 1 5 ARG HB3 H 2.502 4.380 -1.588 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HB3 . . . . . . . . . c30446_6cxn 1 . 7 . 844 . 1 1 5 ARG HD2 H 3.360 6.561 -0.022 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HD2 . . . . . . . . . c30446_6cxn 1 . 7 . 845 . 1 1 5 ARG HD3 H 2.506 6.549 -1.564 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HD3 . . . . . . . . . c30446_6cxn 1 . 7 . 846 . 1 1 5 ARG HE H 1.302 8.374 -0.878 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HE . . . . . . . . . c30446_6cxn 1 . 7 . 847 . 1 1 5 ARG HG2 H 0.523 5.772 0.090 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HG2 . . . . . . . . . c30446_6cxn 1 . 7 . 848 . 1 1 5 ARG HG3 H 1.921 5.109 0.939 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HG3 . . . . . . . . . c30446_6cxn 1 . 7 . 849 . 1 1 5 ARG HH11 H 2.908 6.968 1.883 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH11 . . . . . . . . . c30446_6cxn 1 . 7 . 850 . 1 1 5 ARG HH12 H 2.502 8.276 2.943 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH12 . . . . . . . . . c30446_6cxn 1 . 7 . 851 . 1 1 5 ARG HH21 H 0.767 10.095 0.514 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH21 . . . . . . . . . c30446_6cxn 1 . 7 . 852 . 1 1 5 ARG HH22 H 1.286 10.051 2.166 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH22 . . . . . . . . . c30446_6cxn 1 . 7 . 853 . 1 1 5 ARG N N 0.002 2.862 -2.201 . . . 1.0 . . . . . . . . . . . . A . 5 ARG N . . . . . . . . . c30446_6cxn 1 . 7 . 854 . 1 1 5 ARG NE N 1.777 7.902 -0.162 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NE . . . . . . . . . c30446_6cxn 1 . 7 . 855 . 1 1 5 ARG NH1 N 2.466 7.851 2.038 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NH1 . . . . . . . . . c30446_6cxn 1 . 7 . 856 . 1 1 5 ARG NH2 N 1.246 9.632 1.259 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NH2 . . . . . . . . . c30446_6cxn 1 . 7 . 857 . 1 1 5 ARG O O 0.944 4.320 -4.286 . . . 1.0 . . . . . . . . . . . . A . 5 ARG O . . . . . . . . . c30446_6cxn 1 . 7 . 858 . 1 1 6 HIS C C 1.954 8.298 -3.996 . . . 1.0 . . . . . . . . . . . . A . 6 HIS C . . . . . . . . . c30446_6cxn 1 . 7 . 859 . 1 1 6 HIS CA C 1.110 7.085 -4.374 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CA . . . . . . . . . c30446_6cxn 1 . 7 . 860 . 1 1 6 HIS CB C -0.176 7.541 -5.068 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CB . . . . . . . . . c30446_6cxn 1 . 7 . 861 . 1 1 6 HIS CD2 C -1.518 8.167 -2.938 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CD2 . . . . . . . . . c30446_6cxn 1 . 7 . 862 . 1 1 6 HIS CE1 C -2.320 10.090 -3.619 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CE1 . . . . . . . . . c30446_6cxn 1 . 7 . 863 . 1 1 6 HIS CG C -1.061 8.376 -4.195 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CG . . . . . . . . . c30446_6cxn 1 . 7 . 864 . 1 1 6 HIS H H 0.619 6.735 -2.345 . . . 1.0 . . . . . . . . . . . . A . 6 HIS H . . . . . . . . . c30446_6cxn 1 . 7 . 865 . 1 1 6 HIS HA H 1.675 6.466 -5.055 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HA . . . . . . . . . c30446_6cxn 1 . 7 . 866 . 1 1 6 HIS HB2 H 0.082 8.130 -5.939 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HB2 . . . . . . . . . c30446_6cxn 1 . 7 . 867 . 1 1 6 HIS HB3 H -0.739 6.667 -5.376 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HB3 . . . . . . . . . c30446_6cxn 1 . 7 . 868 . 1 1 6 HIS HD1 H -1.433 10.019 -5.461 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HD1 . . . . . . . . . c30446_6cxn 1 . 7 . 869 . 1 1 6 HIS HD2 H -1.308 7.310 -2.313 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HD2 . . . . . . . . . c30446_6cxn 1 . 7 . 870 . 1 1 6 HIS HE1 H -2.853 11.029 -3.648 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HE1 . . . . . . . . . c30446_6cxn 1 . 7 . 871 . 1 1 6 HIS HE2 H -2.830 9.333 -1.785 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HE2 . . . . . . . . . c30446_6cxn 1 . 7 . 872 . 1 1 6 HIS N N 0.794 6.284 -3.198 . . . 1.0 . . . . . . . . . . . . A . 6 HIS N . . . . . . . . . c30446_6cxn 1 . 7 . 873 . 1 1 6 HIS ND1 N -1.582 9.589 -4.593 . . . 1.0 . . . . . . . . . . . . A . 6 HIS ND1 . . . . . . . . . c30446_6cxn 1 . 7 . 874 . 1 1 6 HIS NE2 N -2.298 9.246 -2.604 . . . 1.0 . . . . . . . . . . . . A . 6 HIS NE2 . . . . . . . . . c30446_6cxn 1 . 7 . 875 . 1 1 6 HIS O O 2.755 8.747 -4.843 . . . 1.0 . . . . . . . . . . . . A . 6 HIS O . . . . . . . . . c30446_6cxn 1 . 8 . 876 . 1 1 1 HIS C C 0.142 -6.367 2.595 . . . 1.0 . . . . . . . . . . . . A . 1 HIS C . . . . . . . . . c30446_6cxn 1 . 8 . 877 . 1 1 1 HIS CA C 0.217 -7.813 2.113 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CA . . . . . . . . . c30446_6cxn 1 . 8 . 878 . 1 1 1 HIS CB C -1.043 -8.176 1.323 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CB . . . . . . . . . c30446_6cxn 1 . 8 . 879 . 1 1 1 HIS CD2 C -1.341 -9.427 -0.930 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CD2 . . . . . . . . . c30446_6cxn 1 . 8 . 880 . 1 1 1 HIS CE1 C 0.192 -8.370 -2.088 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CE1 . . . . . . . . . c30446_6cxn 1 . 8 . 881 . 1 1 1 HIS CG C -0.773 -8.509 -0.112 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CG . . . . . . . . . c30446_6cxn 1 . 8 . 882 . 1 1 1 HIS H1 H 1.018 -8.341 3.933 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H1 . . . . . . . . . c30446_6cxn 1 . 8 . 883 . 1 1 1 HIS H2 H 0.693 -9.660 2.884 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H2 . . . . . . . . . c30446_6cxn 1 . 8 . 884 . 1 1 1 HIS H3 H -0.597 -8.860 3.686 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H3 . . . . . . . . . c30446_6cxn 1 . 8 . 885 . 1 1 1 HIS HA H 1.081 -7.928 1.476 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HA . . . . . . . . . c30446_6cxn 1 . 8 . 886 . 1 1 1 HIS HB2 H -1.511 -9.035 1.780 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HB2 . . . . . . . . . c30446_6cxn 1 . 8 . 887 . 1 1 1 HIS HB3 H -1.730 -7.342 1.348 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HB3 . . . . . . . . . c30446_6cxn 1 . 8 . 888 . 1 1 1 HIS HD1 H 0.769 -7.143 -0.556 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HD1 . . . . . . . . . c30446_6cxn 1 . 8 . 889 . 1 1 1 HIS HD2 H -2.132 -10.115 -0.670 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HD2 . . . . . . . . . c30446_6cxn 1 . 8 . 890 . 1 1 1 HIS HE1 H 0.839 -8.060 -2.896 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HE1 . . . . . . . . . c30446_6cxn 1 . 8 . 891 . 1 1 1 HIS HE2 H -0.864 -9.917 -2.916 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HE2 . . . . . . . . . c30446_6cxn 1 . 8 . 892 . 1 1 1 HIS N N 0.344 -8.753 3.257 . . . 1.0 . . . . . . . . . . . . A . 1 HIS N . . . . . . . . . c30446_6cxn 1 . 8 . 893 . 1 1 1 HIS ND1 N 0.184 -7.864 -0.867 . . . 1.0 . . . . . . . . . . . . A . 1 HIS ND1 . . . . . . . . . c30446_6cxn 1 . 8 . 894 . 1 1 1 HIS NE2 N -0.722 -9.320 -2.152 . . . 1.0 . . . . . . . . . . . . A . 1 HIS NE2 . . . . . . . . . c30446_6cxn 1 . 8 . 895 . 1 1 1 HIS O O -0.262 -6.099 3.726 . . . 1.0 . . . . . . . . . . . . A . 1 HIS O . . . . . . . . . c30446_6cxn 1 . 8 . 896 . 1 1 2 ARG C C -0.656 -3.318 1.387 . . . 1.0 . . . . . . . . . . . . A . 2 ARG C . . . . . . . . . c30446_6cxn 1 . 8 . 897 . 1 1 2 ARG CA C 0.514 -4.021 2.065 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CA . . . . . . . . . c30446_6cxn 1 . 8 . 898 . 1 1 2 ARG CB C 1.833 -3.358 1.658 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CB . . . . . . . . . c30446_6cxn 1 . 8 . 899 . 1 1 2 ARG CD C 3.920 -2.644 2.864 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CD . . . . . . . . . c30446_6cxn 1 . 8 . 900 . 1 1 2 ARG CG C 2.417 -2.456 2.733 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CG . . . . . . . . . c30446_6cxn 1 . 8 . 901 . 1 1 2 ARG CZ C 4.210 -4.033 4.878 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CZ . . . . . . . . . c30446_6cxn 1 . 8 . 902 . 1 1 2 ARG H H 0.848 -5.715 0.841 . . . 1.0 . . . . . . . . . . . . A . 2 ARG H . . . . . . . . . c30446_6cxn 1 . 8 . 903 . 1 1 2 ARG HA H 0.395 -3.936 3.135 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HA . . . . . . . . . c30446_6cxn 1 . 8 . 904 . 1 1 2 ARG HB2 H 2.555 -4.130 1.434 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB2 . . . . . . . . . c30446_6cxn 1 . 8 . 905 . 1 1 2 ARG HB3 H 1.667 -2.764 0.771 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB3 . . . . . . . . . c30446_6cxn 1 . 8 . 906 . 1 1 2 ARG HD2 H 4.355 -2.664 1.876 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD2 . . . . . . . . . c30446_6cxn 1 . 8 . 907 . 1 1 2 ARG HD3 H 4.327 -1.811 3.418 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD3 . . . . . . . . . c30446_6cxn 1 . 8 . 908 . 1 1 2 ARG HE H 4.536 -4.648 3.008 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HE . . . . . . . . . c30446_6cxn 1 . 8 . 909 . 1 1 2 ARG HG2 H 2.215 -1.427 2.475 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG2 . . . . . . . . . c30446_6cxn 1 . 8 . 910 . 1 1 2 ARG HG3 H 1.950 -2.690 3.679 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG3 . . . . . . . . . c30446_6cxn 1 . 8 . 911 . 1 1 2 ARG HH11 H 3.595 -2.142 5.247 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH11 . . . . . . . . . c30446_6cxn 1 . 8 . 912 . 1 1 2 ARG HH12 H 3.805 -3.140 6.646 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH12 . . . . . . . . . c30446_6cxn 1 . 8 . 913 . 1 1 2 ARG HH21 H 4.812 -5.962 4.847 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH21 . . . . . . . . . c30446_6cxn 1 . 8 . 914 . 1 1 2 ARG HH22 H 4.496 -5.309 6.420 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH22 . . . . . . . . . c30446_6cxn 1 . 8 . 915 . 1 1 2 ARG N N 0.536 -5.439 1.728 . . . 1.0 . . . . . . . . . . . . A . 2 ARG N . . . . . . . . . c30446_6cxn 1 . 8 . 916 . 1 1 2 ARG NE N 4.258 -3.885 3.556 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NE . . . . . . . . . c30446_6cxn 1 . 8 . 917 . 1 1 2 ARG NH1 N 3.839 -3.022 5.654 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH1 . . . . . . . . . c30446_6cxn 1 . 8 . 918 . 1 1 2 ARG NH2 N 4.532 -5.197 5.427 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH2 . . . . . . . . . c30446_6cxn 1 . 8 . 919 . 1 1 2 ARG O O -1.403 -3.930 0.624 . . . 1.0 . . . . . . . . . . . . A . 2 ARG O . . . . . . . . . c30446_6cxn 1 . 8 . 920 . 1 1 3 PHE C C -1.408 -0.438 -0.106 . . . 1.0 . . . . . . . . . . . . A . 3 PHE C . . . . . . . . . c30446_6cxn 1 . 8 . 921 . 1 1 3 PHE CA C -1.893 -1.245 1.092 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CA . . . . . . . . . c30446_6cxn 1 . 8 . 922 . 1 1 3 PHE CB C -2.503 -0.317 2.141 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CB . . . . . . . . . c30446_6cxn 1 . 8 . 923 . 1 1 3 PHE CD1 C -4.700 -1.534 1.922 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CD1 . . . . . . . . . c30446_6cxn 1 . 8 . 924 . 1 1 3 PHE CD2 C -4.731 0.768 2.547 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CD2 . . . . . . . . . c30446_6cxn 1 . 8 . 925 . 1 1 3 PHE CE1 C -6.081 -1.572 1.983 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CE1 . . . . . . . . . c30446_6cxn 1 . 8 . 926 . 1 1 3 PHE CE2 C -6.111 0.736 2.608 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CE2 . . . . . . . . . c30446_6cxn 1 . 8 . 927 . 1 1 3 PHE CG C -4.008 -0.364 2.203 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CG . . . . . . . . . c30446_6cxn 1 . 8 . 928 . 1 1 3 PHE CZ C -6.786 -0.435 2.326 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CZ . . . . . . . . . c30446_6cxn 1 . 8 . 929 . 1 1 3 PHE H H -0.185 -1.597 2.290 . . . 1.0 . . . . . . . . . . . . A . 3 PHE H . . . . . . . . . c30446_6cxn 1 . 8 . 930 . 1 1 3 PHE HA H -2.647 -1.927 0.755 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HA . . . . . . . . . c30446_6cxn 1 . 8 . 931 . 1 1 3 PHE HB2 H -2.123 -0.588 3.118 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HB2 . . . . . . . . . c30446_6cxn 1 . 8 . 932 . 1 1 3 PHE HB3 H -2.214 0.697 1.911 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HB3 . . . . . . . . . c30446_6cxn 1 . 8 . 933 . 1 1 3 PHE HD1 H -4.151 -2.424 1.652 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HD1 . . . . . . . . . c30446_6cxn 1 . 8 . 934 . 1 1 3 PHE HD2 H -4.204 1.685 2.767 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HD2 . . . . . . . . . c30446_6cxn 1 . 8 . 935 . 1 1 3 PHE HE1 H -6.607 -2.488 1.762 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HE1 . . . . . . . . . c30446_6cxn 1 . 8 . 936 . 1 1 3 PHE HE2 H -6.661 1.625 2.877 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HE2 . . . . . . . . . c30446_6cxn 1 . 8 . 937 . 1 1 3 PHE HZ H -7.865 -0.463 2.374 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HZ . . . . . . . . . c30446_6cxn 1 . 8 . 938 . 1 1 3 PHE N N -0.811 -2.029 1.673 . . . 1.0 . . . . . . . . . . . . A . 3 PHE N . . . . . . . . . c30446_6cxn 1 . 8 . 939 . 1 1 3 PHE O O -0.209 -0.359 -0.374 . . . 1.0 . . . . . . . . . . . . A . 3 PHE O . . . . . . . . . c30446_6cxn 1 . 8 . 940 . 1 1 4 LEU C C -1.589 2.352 -1.616 . . . 1.0 . . . . . . . . . . . . A . 4 LEU C . . . . . . . . . c30446_6cxn 1 . 8 . 941 . 1 1 4 LEU CA C -2.035 0.946 -2.005 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CA . . . . . . . . . c30446_6cxn 1 . 8 . 942 . 1 1 4 LEU CB C -3.242 1.016 -2.938 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CB . . . . . . . . . c30446_6cxn 1 . 8 . 943 . 1 1 4 LEU CD1 C -4.994 -0.582 -2.150 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CD1 . . . . . . . . . c30446_6cxn 1 . 8 . 944 . 1 1 4 LEU CD2 C -4.518 -0.366 -4.596 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CD2 . . . . . . . . . c30446_6cxn 1 . 8 . 945 . 1 1 4 LEU CG C -3.925 -0.327 -3.195 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CG . . . . . . . . . c30446_6cxn 1 . 8 . 946 . 1 1 4 LEU H H -3.289 0.046 -0.562 . . . 1.0 . . . . . . . . . . . . A . 4 LEU H . . . . . . . . . c30446_6cxn 1 . 8 . 947 . 1 1 4 LEU HA H -1.229 0.453 -2.520 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HA . . . . . . . . . c30446_6cxn 1 . 8 . 948 . 1 1 4 LEU HB2 H -3.967 1.691 -2.506 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HB2 . . . . . . . . . c30446_6cxn 1 . 8 . 949 . 1 1 4 LEU HB3 H -2.918 1.417 -3.886 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HB3 . . . . . . . . . c30446_6cxn 1 . 8 . 950 . 1 1 4 LEU HD11 H -5.832 -1.087 -2.606 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD11 . . . . . . . . . c30446_6cxn 1 . 8 . 951 . 1 1 4 LEU HD12 H -5.320 0.359 -1.734 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD12 . . . . . . . . . c30446_6cxn 1 . 8 . 952 . 1 1 4 LEU HD13 H -4.582 -1.199 -1.366 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD13 . . . . . . . . . c30446_6cxn 1 . 8 . 953 . 1 1 4 LEU HD21 H -3.795 -0.781 -5.282 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD21 . . . . . . . . . c30446_6cxn 1 . 8 . 954 . 1 1 4 LEU HD22 H -4.775 0.636 -4.906 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD22 . . . . . . . . . c30446_6cxn 1 . 8 . 955 . 1 1 4 LEU HD23 H -5.406 -0.981 -4.593 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD23 . . . . . . . . . c30446_6cxn 1 . 8 . 956 . 1 1 4 LEU HG H -3.192 -1.116 -3.116 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HG . . . . . . . . . c30446_6cxn 1 . 8 . 957 . 1 1 4 LEU N N -2.353 0.152 -0.827 . . . 1.0 . . . . . . . . . . . . A . 4 LEU N . . . . . . . . . c30446_6cxn 1 . 8 . 958 . 1 1 4 LEU O O -2.325 3.087 -0.957 . . . 1.0 . . . . . . . . . . . . A . 4 LEU O . . . . . . . . . c30446_6cxn 1 . 8 . 959 . 1 1 5 ARG C C 0.899 4.615 -2.928 . . . 1.0 . . . . . . . . . . . . A . 5 ARG C . . . . . . . . . c30446_6cxn 1 . 8 . 960 . 1 1 5 ARG CA C 0.163 4.038 -1.724 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CA . . . . . . . . . c30446_6cxn 1 . 8 . 961 . 1 1 5 ARG CB C 1.109 3.956 -0.524 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CB . . . . . . . . . c30446_6cxn 1 . 8 . 962 . 1 1 5 ARG CD C 2.169 6.132 0.156 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CD . . . . . . . . . c30446_6cxn 1 . 8 . 963 . 1 1 5 ARG CG C 1.024 5.162 0.399 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CG . . . . . . . . . c30446_6cxn 1 . 8 . 964 . 1 1 5 ARG CZ C 1.576 8.141 1.454 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CZ . . . . . . . . . c30446_6cxn 1 . 8 . 965 . 1 1 5 ARG H H 0.159 2.089 -2.550 . . . 1.0 . . . . . . . . . . . . A . 5 ARG H . . . . . . . . . c30446_6cxn 1 . 8 . 966 . 1 1 5 ARG HA H -0.663 4.687 -1.476 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HA . . . . . . . . . c30446_6cxn 1 . 8 . 967 . 1 1 5 ARG HB2 H 0.865 3.071 0.053 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HB2 . . . . . . . . . c30446_6cxn 1 . 8 . 968 . 1 1 5 ARG HB3 H 2.127 3.877 -0.887 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HB3 . . . . . . . . . c30446_6cxn 1 . 8 . 969 . 1 1 5 ARG HD2 H 2.949 5.935 0.876 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HD2 . . . . . . . . . c30446_6cxn 1 . 8 . 970 . 1 1 5 ARG HD3 H 2.552 5.974 -0.841 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HD3 . . . . . . . . . c30446_6cxn 1 . 8 . 971 . 1 1 5 ARG HE H 1.576 8.025 -0.539 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HE . . . . . . . . . c30446_6cxn 1 . 8 . 972 . 1 1 5 ARG HG2 H 0.089 5.673 0.222 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HG2 . . . . . . . . . c30446_6cxn 1 . 8 . 973 . 1 1 5 ARG HG3 H 1.062 4.822 1.423 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HG3 . . . . . . . . . c30446_6cxn 1 . 8 . 974 . 1 1 5 ARG HH11 H 2.087 6.538 2.577 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH11 . . . . . . . . . c30446_6cxn 1 . 8 . 975 . 1 1 5 ARG HH12 H 1.666 7.964 3.466 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH12 . . . . . . . . . c30446_6cxn 1 . 8 . 976 . 1 1 5 ARG HH21 H 1.022 9.901 0.628 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH21 . . . . . . . . . c30446_6cxn 1 . 8 . 977 . 1 1 5 ARG HH22 H 1.061 9.873 2.360 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH22 . . . . . . . . . c30446_6cxn 1 . 8 . 978 . 1 1 5 ARG N N -0.381 2.719 -2.029 . . . 1.0 . . . . . . . . . . . . A . 5 ARG N . . . . . . . . . c30446_6cxn 1 . 8 . 979 . 1 1 5 ARG NE N 1.744 7.524 0.287 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NE . . . . . . . . . c30446_6cxn 1 . 8 . 980 . 1 1 5 ARG NH1 N 1.794 7.494 2.592 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NH1 . . . . . . . . . c30446_6cxn 1 . 8 . 981 . 1 1 5 ARG NH2 N 1.188 9.409 1.483 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NH2 . . . . . . . . . c30446_6cxn 1 . 8 . 982 . 1 1 5 ARG O O 1.506 3.880 -3.708 . . . 1.0 . . . . . . . . . . . . A . 5 ARG O . . . . . . . . . c30446_6cxn 1 . 8 . 983 . 1 1 6 HIS C C 2.699 7.418 -3.695 . . . 1.0 . . . . . . . . . . . . A . 6 HIS C . . . . . . . . . c30446_6cxn 1 . 8 . 984 . 1 1 6 HIS CA C 1.502 6.611 -4.185 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CA . . . . . . . . . c30446_6cxn 1 . 8 . 985 . 1 1 6 HIS CB C 0.516 7.528 -4.911 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CB . . . . . . . . . c30446_6cxn 1 . 8 . 986 . 1 1 6 HIS CD2 C 0.261 9.102 -2.864 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CD2 . . . . . . . . . c30446_6cxn 1 . 8 . 987 . 1 1 6 HIS CE1 C -1.762 9.838 -3.276 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CE1 . . . . . . . . . c30446_6cxn 1 . 8 . 988 . 1 1 6 HIS CG C -0.162 8.510 -4.007 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CG . . . . . . . . . c30446_6cxn 1 . 8 . 989 . 1 1 6 HIS H H 0.341 6.466 -2.421 . . . 1.0 . . . . . . . . . . . . A . 6 HIS H . . . . . . . . . c30446_6cxn 1 . 8 . 990 . 1 1 6 HIS HA H 1.849 5.855 -4.873 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HA . . . . . . . . . c30446_6cxn 1 . 8 . 991 . 1 1 6 HIS HB2 H 1.047 8.088 -5.670 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HB2 . . . . . . . . . c30446_6cxn 1 . 8 . 992 . 1 1 6 HIS HB3 H -0.251 6.922 -5.380 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HB3 . . . . . . . . . c30446_6cxn 1 . 8 . 993 . 1 1 6 HIS HD1 H -2.009 8.751 -4.992 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HD1 . . . . . . . . . c30446_6cxn 1 . 8 . 994 . 1 1 6 HIS HD2 H 1.218 8.956 -2.383 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HD2 . . . . . . . . . c30446_6cxn 1 . 8 . 995 . 1 1 6 HIS HE1 H -2.699 10.370 -3.196 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HE1 . . . . . . . . . c30446_6cxn 1 . 8 . 996 . 1 1 6 HIS HE2 H -0.765 10.411 -1.582 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HE2 . . . . . . . . . c30446_6cxn 1 . 8 . 997 . 1 1 6 HIS N N 0.840 5.934 -3.075 . . . 1.0 . . . . . . . . . . . . A . 6 HIS N . . . . . . . . . c30446_6cxn 1 . 8 . 998 . 1 1 6 HIS ND1 N -1.434 8.992 -4.237 . . . 1.0 . . . . . . . . . . . . A . 6 HIS ND1 . . . . . . . . . c30446_6cxn 1 . 8 . 999 . 1 1 6 HIS NE2 N -0.752 9.922 -2.431 . . . 1.0 . . . . . . . . . . . . A . 6 HIS NE2 . . . . . . . . . c30446_6cxn 1 . 8 . 1000 . 1 1 6 HIS O O 3.419 7.983 -4.546 . . . 1.0 . . . . . . . . . . . . A . 6 HIS O . . . . . . . . . c30446_6cxn 1 . 9 . 1001 . 1 1 1 HIS C C -0.242 -6.570 2.947 . . . 1.0 . . . . . . . . . . . . A . 1 HIS C . . . . . . . . . c30446_6cxn 1 . 9 . 1002 . 1 1 1 HIS CA C -0.687 -8.024 2.819 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CA . . . . . . . . . c30446_6cxn 1 . 9 . 1003 . 1 1 1 HIS CB C -2.094 -8.099 2.221 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CB . . . . . . . . . c30446_6cxn 1 . 9 . 1004 . 1 1 1 HIS CD2 C -2.653 -10.078 0.640 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CD2 . . . . . . . . . c30446_6cxn 1 . 9 . 1005 . 1 1 1 HIS CE1 C -1.857 -9.236 -1.221 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CE1 . . . . . . . . . c30446_6cxn 1 . 9 . 1006 . 1 1 1 HIS CG C -2.155 -8.852 0.929 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CG . . . . . . . . . c30446_6cxn 1 . 9 . 1007 . 1 1 1 HIS H1 H -1.240 -9.581 4.044 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H1 . . . . . . . . . c30446_6cxn 1 . 9 . 1008 . 1 1 1 HIS H2 H -1.153 -8.054 4.823 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H2 . . . . . . . . . c30446_6cxn 1 . 9 . 1009 . 1 1 1 HIS H3 H 0.287 -8.893 4.410 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H3 . . . . . . . . . c30446_6cxn 1 . 9 . 1010 . 1 1 1 HIS HA H 0.003 -8.547 2.173 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HA . . . . . . . . . c30446_6cxn 1 . 9 . 1011 . 1 1 1 HIS HB2 H -2.749 -8.593 2.923 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HB2 . . . . . . . . . c30446_6cxn 1 . 9 . 1012 . 1 1 1 HIS HB3 H -2.457 -7.098 2.041 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HB3 . . . . . . . . . c30446_6cxn 1 . 9 . 1013 . 1 1 1 HIS HD1 H -1.236 -7.478 -0.378 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HD1 . . . . . . . . . c30446_6cxn 1 . 9 . 1014 . 1 1 1 HIS HD2 H -3.120 -10.761 1.336 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HD2 . . . . . . . . . c30446_6cxn 1 . 9 . 1015 . 1 1 1 HIS HE1 H -1.573 -9.116 -2.256 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HE1 . . . . . . . . . c30446_6cxn 1 . 9 . 1016 . 1 1 1 HIS HE2 H -2.785 -11.062 -1.211 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HE2 . . . . . . . . . c30446_6cxn 1 . 9 . 1017 . 1 1 1 HIS N N -0.699 -8.699 4.143 . . . 1.0 . . . . . . . . . . . . A . 1 HIS N . . . . . . . . . c30446_6cxn 1 . 9 . 1018 . 1 1 1 HIS ND1 N -1.663 -8.352 -0.258 . . . 1.0 . . . . . . . . . . . . A . 1 HIS ND1 . . . . . . . . . c30446_6cxn 1 . 9 . 1019 . 1 1 1 HIS NE2 N -2.455 -10.292 -0.702 . . . 1.0 . . . . . . . . . . . . A . 1 HIS NE2 . . . . . . . . . c30446_6cxn 1 . 9 . 1020 . 1 1 1 HIS O O -0.214 -6.013 4.044 . . . 1.0 . . . . . . . . . . . . A . 1 HIS O . . . . . . . . . c30446_6cxn 1 . 9 . 1021 . 1 1 2 ARG C C -0.557 -3.651 1.299 . . . 1.0 . . . . . . . . . . . . A . 2 ARG C . . . . . . . . . c30446_6cxn 1 . 9 . 1022 . 1 1 2 ARG CA C 0.549 -4.571 1.805 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CA . . . . . . . . . c30446_6cxn 1 . 9 . 1023 . 1 1 2 ARG CB C 1.795 -4.419 0.930 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CB . . . . . . . . . c30446_6cxn 1 . 9 . 1024 . 1 1 2 ARG CD C 2.239 -6.385 -0.572 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CD . . . . . . . . . c30446_6cxn 1 . 9 . 1025 . 1 1 2 ARG CG C 1.632 -4.995 -0.467 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CG . . . . . . . . . c30446_6cxn 1 . 9 . 1026 . 1 1 2 ARG CZ C 2.164 -8.295 -2.126 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CZ . . . . . . . . . c30446_6cxn 1 . 9 . 1027 . 1 1 2 ARG H H 0.063 -6.457 0.974 . . . 1.0 . . . . . . . . . . . . A . 2 ARG H . . . . . . . . . c30446_6cxn 1 . 9 . 1028 . 1 1 2 ARG HA H 0.795 -4.293 2.818 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HA . . . . . . . . . c30446_6cxn 1 . 9 . 1029 . 1 1 2 ARG HB2 H 2.030 -3.369 0.839 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB2 . . . . . . . . . c30446_6cxn 1 . 9 . 1030 . 1 1 2 ARG HB3 H 2.621 -4.923 1.410 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB3 . . . . . . . . . c30446_6cxn 1 . 9 . 1031 . 1 1 2 ARG HD2 H 3.308 -6.308 -0.440 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD2 . . . . . . . . . c30446_6cxn 1 . 9 . 1032 . 1 1 2 ARG HD3 H 1.825 -7.004 0.210 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD3 . . . . . . . . . c30446_6cxn 1 . 9 . 1033 . 1 1 2 ARG HE H 1.614 -6.431 -2.578 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HE . . . . . . . . . c30446_6cxn 1 . 9 . 1034 . 1 1 2 ARG HG2 H 0.580 -5.054 -0.701 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG2 . . . . . . . . . c30446_6cxn 1 . 9 . 1035 . 1 1 2 ARG HG3 H 2.124 -4.342 -1.174 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG3 . . . . . . . . . c30446_6cxn 1 . 9 . 1036 . 1 1 2 ARG HH11 H 2.848 -8.746 -0.276 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH11 . . . . . . . . . c30446_6cxn 1 . 9 . 1037 . 1 1 2 ARG HH12 H 2.786 -10.072 -1.388 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH12 . . . . . . . . . c30446_6cxn 1 . 9 . 1038 . 1 1 2 ARG HH21 H 1.531 -8.174 -4.041 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH21 . . . . . . . . . c30446_6cxn 1 . 9 . 1039 . 1 1 2 ARG HH22 H 2.039 -9.748 -3.526 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH22 . . . . . . . . . c30446_6cxn 1 . 9 . 1040 . 1 1 2 ARG N N 0.105 -5.961 1.818 . . . 1.0 . . . . . . . . . . . . A . 2 ARG N . . . . . . . . . c30446_6cxn 1 . 9 . 1041 . 1 1 2 ARG NE N 1.965 -7.005 -1.865 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NE . . . . . . . . . c30446_6cxn 1 . 9 . 1042 . 1 1 2 ARG NH1 N 2.639 -9.104 -1.186 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH1 . . . . . . . . . c30446_6cxn 1 . 9 . 1043 . 1 1 2 ARG NH2 N 1.889 -8.779 -3.329 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH2 . . . . . . . . . c30446_6cxn 1 . 9 . 1044 . 1 1 2 ARG O O -1.625 -4.111 0.895 . . . 1.0 . . . . . . . . . . . . A . 2 ARG O . . . . . . . . . c30446_6cxn 1 . 9 . 1045 . 1 1 3 PHE C C -0.756 -0.600 -0.339 . . . 1.0 . . . . . . . . . . . . A . 3 PHE C . . . . . . . . . c30446_6cxn 1 . 9 . 1046 . 1 1 3 PHE CA C -1.268 -1.364 0.875 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CA . . . . . . . . . c30446_6cxn 1 . 9 . 1047 . 1 1 3 PHE CB C -1.609 -0.393 2.004 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CB . . . . . . . . . c30446_6cxn 1 . 9 . 1048 . 1 1 3 PHE CD1 C -3.980 -1.251 2.004 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CD1 . . . . . . . . . c30446_6cxn 1 . 9 . 1049 . 1 1 3 PHE CD2 C -3.582 0.998 2.693 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CD2 . . . . . . . . . c30446_6cxn 1 . 9 . 1050 . 1 1 3 PHE CE1 C -5.334 -1.081 2.222 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CE1 . . . . . . . . . c30446_6cxn 1 . 9 . 1051 . 1 1 3 PHE CE2 C -4.936 1.173 2.911 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CE2 . . . . . . . . . c30446_6cxn 1 . 9 . 1052 . 1 1 3 PHE CG C -3.088 -0.213 2.237 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CG . . . . . . . . . c30446_6cxn 1 . 9 . 1053 . 1 1 3 PHE CZ C -5.813 0.133 2.675 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CZ . . . . . . . . . c30446_6cxn 1 . 9 . 1054 . 1 1 3 PHE H H 0.575 -2.043 1.662 . . . 1.0 . . . . . . . . . . . . A . 3 PHE H . . . . . . . . . c30446_6cxn 1 . 9 . 1055 . 1 1 3 PHE HA H -2.158 -1.889 0.591 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HA . . . . . . . . . c30446_6cxn 1 . 9 . 1056 . 1 1 3 PHE HB2 H -1.171 -0.754 2.927 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HB2 . . . . . . . . . c30446_6cxn 1 . 9 . 1057 . 1 1 3 PHE HB3 H -1.194 0.574 1.763 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HB3 . . . . . . . . . c30446_6cxn 1 . 9 . 1058 . 1 1 3 PHE HD1 H -3.609 -2.200 1.648 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HD1 . . . . . . . . . c30446_6cxn 1 . 9 . 1059 . 1 1 3 PHE HD2 H -2.898 1.813 2.877 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HD2 . . . . . . . . . c30446_6cxn 1 . 9 . 1060 . 1 1 3 PHE HE1 H -6.018 -1.896 2.036 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HE1 . . . . . . . . . c30446_6cxn 1 . 9 . 1061 . 1 1 3 PHE HE2 H -5.307 2.123 3.266 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HE2 . . . . . . . . . c30446_6cxn 1 . 9 . 1062 . 1 1 3 PHE HZ H -6.870 0.268 2.846 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HZ . . . . . . . . . c30446_6cxn 1 . 9 . 1063 . 1 1 3 PHE N N -0.294 -2.349 1.328 . . . 1.0 . . . . . . . . . . . . A . 3 PHE N . . . . . . . . . c30446_6cxn 1 . 9 . 1064 . 1 1 3 PHE O O 0.410 -0.717 -0.717 . . . 1.0 . . . . . . . . . . . . A . 3 PHE O . . . . . . . . . c30446_6cxn 1 . 9 . 1065 . 1 1 4 LEU C C -0.672 2.294 -1.741 . . . 1.0 . . . . . . . . . . . . A . 4 LEU C . . . . . . . . . c30446_6cxn 1 . 9 . 1066 . 1 1 4 LEU CA C -1.294 0.956 -2.129 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CA . . . . . . . . . c30446_6cxn 1 . 9 . 1067 . 1 1 4 LEU CB C -2.531 1.184 -2.996 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CB . . . . . . . . . c30446_6cxn 1 . 9 . 1068 . 1 1 4 LEU CD1 C -4.421 -0.161 -2.070 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CD1 . . . . . . . . . c30446_6cxn 1 . 9 . 1069 . 1 1 4 LEU CD2 C -4.098 -0.012 -4.545 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CD2 . . . . . . . . . c30446_6cxn 1 . 9 . 1070 . 1 1 4 LEU CG C -3.406 -0.053 -3.191 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CG . . . . . . . . . c30446_6cxn 1 . 9 . 1071 . 1 1 4 LEU H H -2.556 0.222 -0.602 . . . 1.0 . . . . . . . . . . . . A . 4 LEU H . . . . . . . . . c30446_6cxn 1 . 9 . 1072 . 1 1 4 LEU HA H -0.577 0.387 -2.693 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HA . . . . . . . . . c30446_6cxn 1 . 9 . 1073 . 1 1 4 LEU HB2 H -3.130 1.958 -2.538 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HB2 . . . . . . . . . c30446_6cxn 1 . 9 . 1074 . 1 1 4 LEU HB3 H -2.208 1.526 -3.967 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HB3 . . . . . . . . . c30446_6cxn 1 . 9 . 1075 . 1 1 4 LEU HD11 H -4.576 0.814 -1.632 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD11 . . . . . . . . . c30446_6cxn 1 . 9 . 1076 . 1 1 4 LEU HD12 H -4.048 -0.838 -1.317 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD12 . . . . . . . . . c30446_6cxn 1 . 9 . 1077 . 1 1 4 LEU HD13 H -5.355 -0.534 -2.462 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD13 . . . . . . . . . c30446_6cxn 1 . 9 . 1078 . 1 1 4 LEU HD21 H -3.509 -0.559 -5.267 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD21 . . . . . . . . . c30446_6cxn 1 . 9 . 1079 . 1 1 4 LEU HD22 H -4.199 1.014 -4.867 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD22 . . . . . . . . . c30446_6cxn 1 . 9 . 1080 . 1 1 4 LEU HD23 H -5.076 -0.462 -4.463 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD23 . . . . . . . . . c30446_6cxn 1 . 9 . 1081 . 1 1 4 LEU HG H -2.783 -0.935 -3.155 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HG . . . . . . . . . c30446_6cxn 1 . 9 . 1082 . 1 1 4 LEU N N -1.643 0.177 -0.950 . . . 1.0 . . . . . . . . . . . . A . 4 LEU N . . . . . . . . . c30446_6cxn 1 . 9 . 1083 . 1 1 4 LEU O O -1.120 2.949 -0.800 . . . 1.0 . . . . . . . . . . . . A . 4 LEU O . . . . . . . . . c30446_6cxn 1 . 9 . 1084 . 1 1 5 ARG C C 0.716 4.989 -3.276 . . . 1.0 . . . . . . . . . . . . A . 5 ARG C . . . . . . . . . c30446_6cxn 1 . 9 . 1085 . 1 1 5 ARG CA C 1.047 3.953 -2.206 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CA . . . . . . . . . c30446_6cxn 1 . 9 . 1086 . 1 1 5 ARG CB C 2.560 3.733 -2.142 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CB . . . . . . . . . c30446_6cxn 1 . 9 . 1087 . 1 1 5 ARG CD C 3.864 5.823 -1.640 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CD . . . . . . . . . c30446_6cxn 1 . 9 . 1088 . 1 1 5 ARG CG C 3.248 4.557 -1.066 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CG . . . . . . . . . c30446_6cxn 1 . 9 . 1089 . 1 1 5 ARG CZ C 4.175 7.243 0.351 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CZ . . . . . . . . . c30446_6cxn 1 . 9 . 1090 . 1 1 5 ARG H H 0.674 2.128 -3.210 . . . 1.0 . . . . . . . . . . . . A . 5 ARG H . . . . . . . . . c30446_6cxn 1 . 9 . 1091 . 1 1 5 ARG HA H 0.705 4.320 -1.250 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HA . . . . . . . . . c30446_6cxn 1 . 9 . 1092 . 1 1 5 ARG HB2 H 2.751 2.685 -1.940 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HB2 . . . . . . . . . c30446_6cxn 1 . 9 . 1093 . 1 1 5 ARG HB3 H 2.992 3.997 -3.100 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HB3 . . . . . . . . . c30446_6cxn 1 . 9 . 1094 . 1 1 5 ARG HD2 H 4.934 5.691 -1.702 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HD2 . . . . . . . . . c30446_6cxn 1 . 9 . 1095 . 1 1 5 ARG HD3 H 3.465 5.987 -2.630 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HD3 . . . . . . . . . c30446_6cxn 1 . 9 . 1096 . 1 1 5 ARG HE H 2.910 7.629 -1.143 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HE . . . . . . . . . c30446_6cxn 1 . 9 . 1097 . 1 1 5 ARG HG2 H 2.520 4.832 -0.316 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HG2 . . . . . . . . . c30446_6cxn 1 . 9 . 1098 . 1 1 5 ARG HG3 H 4.026 3.961 -0.613 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HG3 . . . . . . . . . c30446_6cxn 1 . 9 . 1099 . 1 1 5 ARG HH11 H 5.332 5.584 0.316 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH11 . . . . . . . . . c30446_6cxn 1 . 9 . 1100 . 1 1 5 ARG HH12 H 5.532 6.599 1.705 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH12 . . . . . . . . . c30446_6cxn 1 . 9 . 1101 . 1 1 5 ARG HH21 H 3.171 8.965 0.682 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH21 . . . . . . . . . c30446_6cxn 1 . 9 . 1102 . 1 1 5 ARG HH22 H 4.305 8.518 1.913 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH22 . . . . . . . . . c30446_6cxn 1 . 9 . 1103 . 1 1 5 ARG N N 0.363 2.693 -2.473 . . . 1.0 . . . . . . . . . . . . A . 5 ARG N . . . . . . . . . c30446_6cxn 1 . 9 . 1104 . 1 1 5 ARG NE N 3.580 6.994 -0.813 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NE . . . . . . . . . c30446_6cxn 1 . 9 . 1105 . 1 1 5 ARG NH1 N 5.088 6.406 0.829 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NH1 . . . . . . . . . c30446_6cxn 1 . 9 . 1106 . 1 1 5 ARG NH2 N 3.858 8.331 1.038 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NH2 . . . . . . . . . c30446_6cxn 1 . 9 . 1107 . 1 1 5 ARG O O 0.581 4.657 -4.454 . . . 1.0 . . . . . . . . . . . . A . 5 ARG O . . . . . . . . . c30446_6cxn 1 . 9 . 1108 . 1 1 6 HIS C C 1.201 8.517 -3.560 . . . 1.0 . . . . . . . . . . . . A . 6 HIS C . . . . . . . . . c30446_6cxn 1 . 9 . 1109 . 1 1 6 HIS CA C 0.272 7.328 -3.781 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CA . . . . . . . . . c30446_6cxn 1 . 9 . 1110 . 1 1 6 HIS CB C -1.184 7.764 -3.609 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CB . . . . . . . . . c30446_6cxn 1 . 9 . 1111 . 1 1 6 HIS CD2 C -0.693 8.479 -1.164 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CD2 . . . . . . . . . c30446_6cxn 1 . 9 . 1112 . 1 1 6 HIS CE1 C -2.702 9.167 -0.622 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CE1 . . . . . . . . . c30446_6cxn 1 . 9 . 1113 . 1 1 6 HIS CG C -1.487 8.307 -2.247 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CG . . . . . . . . . c30446_6cxn 1 . 9 . 1114 . 1 1 6 HIS H H 0.707 6.445 -1.906 . . . 1.0 . . . . . . . . . . . . A . 6 HIS H . . . . . . . . . c30446_6cxn 1 . 9 . 1115 . 1 1 6 HIS HA H 0.412 6.959 -4.786 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HA . . . . . . . . . c30446_6cxn 1 . 9 . 1116 . 1 1 6 HIS HB2 H -1.408 8.539 -4.332 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HB2 . . . . . . . . . c30446_6cxn 1 . 9 . 1117 . 1 1 6 HIS HB3 H -1.831 6.911 -3.781 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HB3 . . . . . . . . . c30446_6cxn 1 . 9 . 1118 . 1 1 6 HIS HD1 H -3.538 8.752 -2.443 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HD1 . . . . . . . . . c30446_6cxn 1 . 9 . 1119 . 1 1 6 HIS HD2 H 0.359 8.239 -1.096 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HD2 . . . . . . . . . c30446_6cxn 1 . 9 . 1120 . 1 1 6 HIS HE1 H -3.536 9.567 -0.064 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HE1 . . . . . . . . . c30446_6cxn 1 . 9 . 1121 . 1 1 6 HIS HE2 H -1.189 9.162 0.758 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HE2 . . . . . . . . . c30446_6cxn 1 . 9 . 1122 . 1 1 6 HIS N N 0.587 6.243 -2.858 . . . 1.0 . . . . . . . . . . . . A . 6 HIS N . . . . . . . . . c30446_6cxn 1 . 9 . 1123 . 1 1 6 HIS ND1 N -2.740 8.747 -1.874 . . . 1.0 . . . . . . . . . . . . A . 6 HIS ND1 . . . . . . . . . c30446_6cxn 1 . 9 . 1124 . 1 1 6 HIS NE2 N -1.472 9.014 -0.169 . . . 1.0 . . . . . . . . . . . . A . 6 HIS NE2 . . . . . . . . . c30446_6cxn 1 . 9 . 1125 . 1 1 6 HIS O O 1.113 9.489 -4.340 . . . 1.0 . . . . . . . . . . . . A . 6 HIS O . . . . . . . . . c30446_6cxn 1 . 10 . 1126 . 1 1 1 HIS C C -0.091 -6.419 2.705 . . . 1.0 . . . . . . . . . . . . A . 1 HIS C . . . . . . . . . c30446_6cxn 1 . 10 . 1127 . 1 1 1 HIS CA C -0.209 -7.897 2.344 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CA . . . . . . . . . c30446_6cxn 1 . 10 . 1128 . 1 1 1 HIS CB C -1.528 -8.158 1.615 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CB . . . . . . . . . c30446_6cxn 1 . 10 . 1129 . 1 1 1 HIS CD2 C -1.587 -10.751 1.670 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CD2 . . . . . . . . . c30446_6cxn 1 . 10 . 1130 . 1 1 1 HIS CE1 C -1.890 -11.110 -0.472 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CE1 . . . . . . . . . c30446_6cxn 1 . 10 . 1131 . 1 1 1 HIS CG C -1.640 -9.544 1.059 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CG . . . . . . . . . c30446_6cxn 1 . 10 . 1132 . 1 1 1 HIS H1 H 0.578 -8.375 4.184 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H1 . . . . . . . . . c30446_6cxn 1 . 10 . 1133 . 1 1 1 HIS H2 H 0.058 -9.722 3.256 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H2 . . . . . . . . . c30446_6cxn 1 . 10 . 1134 . 1 1 1 HIS H3 H -1.096 -8.704 4.016 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H3 . . . . . . . . . c30446_6cxn 1 . 10 . 1135 . 1 1 1 HIS HA H 0.614 -8.169 1.701 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HA . . . . . . . . . c30446_6cxn 1 . 10 . 1136 . 1 1 1 HIS HB2 H -2.347 -8.010 2.302 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HB2 . . . . . . . . . c30446_6cxn 1 . 10 . 1137 . 1 1 1 HIS HB3 H -1.622 -7.461 0.795 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HB3 . . . . . . . . . c30446_6cxn 1 . 10 . 1138 . 1 1 1 HIS HD1 H -1.910 -9.131 -0.990 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HD1 . . . . . . . . . c30446_6cxn 1 . 10 . 1139 . 1 1 1 HIS HD2 H -1.446 -10.929 2.727 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HD2 . . . . . . . . . c30446_6cxn 1 . 10 . 1140 . 1 1 1 HIS HE1 H -2.032 -11.605 -1.421 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HE1 . . . . . . . . . c30446_6cxn 1 . 10 . 1141 . 1 1 1 HIS HE2 H -1.835 -12.670 0.854 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HE2 . . . . . . . . . c30446_6cxn 1 . 10 . 1142 . 1 1 1 HIS N N -0.163 -8.751 3.560 . . . 1.0 . . . . . . . . . . . . A . 1 HIS N . . . . . . . . . c30446_6cxn 1 . 10 . 1143 . 1 1 1 HIS ND1 N -1.830 -9.804 -0.283 . . . 1.0 . . . . . . . . . . . . A . 1 HIS ND1 . . . . . . . . . c30446_6cxn 1 . 10 . 1144 . 1 1 1 HIS NE2 N -1.744 -11.707 0.697 . . . 1.0 . . . . . . . . . . . . A . 1 HIS NE2 . . . . . . . . . c30446_6cxn 1 . 10 . 1145 . 1 1 1 HIS O O -0.463 -6.006 3.803 . . . 1.0 . . . . . . . . . . . . A . 1 HIS O . . . . . . . . . c30446_6cxn 1 . 10 . 1146 . 1 1 2 ARG C C -0.542 -3.411 1.347 . . . 1.0 . . . . . . . . . . . . A . 2 ARG C . . . . . . . . . c30446_6cxn 1 . 10 . 1147 . 1 1 2 ARG CA C 0.595 -4.196 1.991 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CA . . . . . . . . . c30446_6cxn 1 . 10 . 1148 . 1 1 2 ARG CB C 1.938 -3.726 1.429 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CB . . . . . . . . . c30446_6cxn 1 . 10 . 1149 . 1 1 2 ARG CD C 3.303 -2.482 3.137 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CD . . . . . . . . . c30446_6cxn 1 . 10 . 1150 . 1 1 2 ARG CG C 3.080 -3.810 2.430 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CG . . . . . . . . . c30446_6cxn 1 . 10 . 1151 . 1 1 2 ARG CZ C 3.497 -1.644 5.446 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CZ . . . . . . . . . c30446_6cxn 1 . 10 . 1152 . 1 1 2 ARG H H 0.706 -6.016 0.916 . . . 1.0 . . . . . . . . . . . . A . 2 ARG H . . . . . . . . . c30446_6cxn 1 . 10 . 1153 . 1 1 2 ARG HA H 0.580 -4.020 3.056 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HA . . . . . . . . . c30446_6cxn 1 . 10 . 1154 . 1 1 2 ARG HB2 H 2.191 -4.336 0.575 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB2 . . . . . . . . . c30446_6cxn 1 . 10 . 1155 . 1 1 2 ARG HB3 H 1.842 -2.698 1.110 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB3 . . . . . . . . . c30446_6cxn 1 . 10 . 1156 . 1 1 2 ARG HD2 H 4.297 -2.129 2.908 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD2 . . . . . . . . . c30446_6cxn 1 . 10 . 1157 . 1 1 2 ARG HD3 H 2.577 -1.768 2.776 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD3 . . . . . . . . . c30446_6cxn 1 . 10 . 1158 . 1 1 2 ARG HE H 2.810 -3.447 4.938 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HE . . . . . . . . . c30446_6cxn 1 . 10 . 1159 . 1 1 2 ARG HG2 H 2.845 -4.563 3.167 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG2 . . . . . . . . . c30446_6cxn 1 . 10 . 1160 . 1 1 2 ARG HG3 H 3.984 -4.085 1.907 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG3 . . . . . . . . . c30446_6cxn 1 . 10 . 1161 . 1 1 2 ARG HH11 H 4.102 -0.336 4.027 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH11 . . . . . . . . . c30446_6cxn 1 . 10 . 1162 . 1 1 2 ARG HH12 H 4.228 0.229 5.658 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH12 . . . . . . . . . c30446_6cxn 1 . 10 . 1163 . 1 1 2 ARG HH21 H 2.975 -2.706 7.085 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH21 . . . . . . . . . c30446_6cxn 1 . 10 . 1164 . 1 1 2 ARG HH22 H 3.589 -1.116 7.395 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH22 . . . . . . . . . c30446_6cxn 1 . 10 . 1165 . 1 1 2 ARG N N 0.429 -5.628 1.772 . . . 1.0 . . . . . . . . . . . . A . 2 ARG N . . . . . . . . . c30446_6cxn 1 . 10 . 1166 . 1 1 2 ARG NE N 3.166 -2.605 4.587 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NE . . . . . . . . . c30446_6cxn 1 . 10 . 1167 . 1 1 2 ARG NH1 N 3.982 -0.489 5.007 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH1 . . . . . . . . . c30446_6cxn 1 . 10 . 1168 . 1 1 2 ARG NH2 N 3.341 -1.837 6.749 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH2 . . . . . . . . . c30446_6cxn 1 . 10 . 1169 . 1 1 2 ARG O O -1.398 -3.981 0.671 . . . 1.0 . . . . . . . . . . . . A . 2 ARG O . . . . . . . . . c30446_6cxn 1 . 10 . 1170 . 1 1 3 PHE C C -1.075 -0.512 -0.240 . . . 1.0 . . . . . . . . . . . . A . 3 PHE C . . . . . . . . . c30446_6cxn 1 . 10 . 1171 . 1 1 3 PHE CA C -1.578 -1.237 1.003 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CA . . . . . . . . . c30446_6cxn 1 . 10 . 1172 . 1 1 3 PHE CB C -2.052 -0.227 2.045 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CB . . . . . . . . . c30446_6cxn 1 . 10 . 1173 . 1 1 3 PHE CD1 C -4.359 -1.238 2.001 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CD1 . . . . . . . . . c30446_6cxn 1 . 10 . 1174 . 1 1 3 PHE CD2 C -4.149 1.099 2.430 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CD2 . . . . . . . . . c30446_6cxn 1 . 10 . 1175 . 1 1 3 PHE CE1 C -5.733 -1.137 2.109 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CE1 . . . . . . . . . c30446_6cxn 1 . 10 . 1176 . 1 1 3 PHE CE2 C -5.522 1.205 2.539 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CE2 . . . . . . . . . c30446_6cxn 1 . 10 . 1177 . 1 1 3 PHE CG C -3.550 -0.122 2.160 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CG . . . . . . . . . c30446_6cxn 1 . 10 . 1178 . 1 1 3 PHE CZ C -6.315 0.086 2.378 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CZ . . . . . . . . . c30446_6cxn 1 . 10 . 1179 . 1 1 3 PHE H H 0.165 -1.703 2.110 . . . 1.0 . . . . . . . . . . . . A . 3 PHE H . . . . . . . . . c30446_6cxn 1 . 10 . 1180 . 1 1 3 PHE HA H -2.406 -1.856 0.721 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HA . . . . . . . . . c30446_6cxn 1 . 10 . 1181 . 1 1 3 PHE HB2 H -1.664 -0.511 3.016 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HB2 . . . . . . . . . c30446_6cxn 1 . 10 . 1182 . 1 1 3 PHE HB3 H -1.673 0.747 1.777 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HB3 . . . . . . . . . c30446_6cxn 1 . 10 . 1183 . 1 1 3 PHE HD1 H -3.906 -2.196 1.790 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HD1 . . . . . . . . . c30446_6cxn 1 . 10 . 1184 . 1 1 3 PHE HD2 H -3.530 1.975 2.556 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HD2 . . . . . . . . . c30446_6cxn 1 . 10 . 1185 . 1 1 3 PHE HE1 H -6.351 -2.014 1.983 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HE1 . . . . . . . . . c30446_6cxn 1 . 10 . 1186 . 1 1 3 PHE HE2 H -5.975 2.163 2.749 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HE2 . . . . . . . . . c30446_6cxn 1 . 10 . 1187 . 1 1 3 PHE HZ H -7.389 0.167 2.463 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HZ . . . . . . . . . c30446_6cxn 1 . 10 . 1188 . 1 1 3 PHE N N -0.545 -2.099 1.562 . . . 1.0 . . . . . . . . . . . . A . 3 PHE N . . . . . . . . . c30446_6cxn 1 . 10 . 1189 . 1 1 3 PHE O O 0.114 -0.548 -0.556 . . . 1.0 . . . . . . . . . . . . A . 3 PHE O . . . . . . . . . c30446_6cxn 1 . 10 . 1190 . 1 1 4 LEU C C -1.346 2.332 -1.853 . . . 1.0 . . . . . . . . . . . . A . 4 LEU C . . . . . . . . . c30446_6cxn 1 . 10 . 1191 . 1 1 4 LEU CA C -1.651 0.869 -2.157 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CA . . . . . . . . . c30446_6cxn 1 . 10 . 1192 . 1 1 4 LEU CB C -2.786 0.770 -3.175 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CB . . . . . . . . . c30446_6cxn 1 . 10 . 1193 . 1 1 4 LEU CD1 C -4.554 -0.691 -2.187 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CD1 . . . . . . . . . c30446_6cxn 1 . 10 . 1194 . 1 1 4 LEU CD2 C -4.031 -0.849 -4.630 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CD2 . . . . . . . . . c30446_6cxn 1 . 10 . 1195 . 1 1 4 LEU CG C -3.466 -0.596 -3.239 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CG . . . . . . . . . c30446_6cxn 1 . 10 . 1196 . 1 1 4 LEU H H -2.923 0.128 -0.641 . . . 1.0 . . . . . . . . . . . . A . 4 LEU H . . . . . . . . . c30446_6cxn 1 . 10 . 1197 . 1 1 4 LEU HA H -0.774 0.409 -2.574 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HA . . . . . . . . . c30446_6cxn 1 . 10 . 1198 . 1 1 4 LEU HB2 H -3.531 1.512 -2.926 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HB2 . . . . . . . . . c30446_6cxn 1 . 10 . 1199 . 1 1 4 LEU HB3 H -2.388 0.996 -4.153 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HB3 . . . . . . . . . c30446_6cxn 1 . 10 . 1200 . 1 1 4 LEU HD11 H -5.501 -0.901 -2.660 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD11 . . . . . . . . . c30446_6cxn 1 . 10 . 1201 . 1 1 4 LEU HD12 H -4.616 0.245 -1.652 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD12 . . . . . . . . . c30446_6cxn 1 . 10 . 1202 . 1 1 4 LEU HD13 H -4.312 -1.484 -1.495 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD13 . . . . . . . . . c30446_6cxn 1 . 10 . 1203 . 1 1 4 LEU HD21 H -3.261 -1.267 -5.261 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD21 . . . . . . . . . c30446_6cxn 1 . 10 . 1204 . 1 1 4 LEU HD22 H -4.376 0.083 -5.053 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD22 . . . . . . . . . c30446_6cxn 1 . 10 . 1205 . 1 1 4 LEU HD23 H -4.856 -1.542 -4.562 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD23 . . . . . . . . . c30446_6cxn 1 . 10 . 1206 . 1 1 4 LEU HG H -2.735 -1.363 -3.027 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HG . . . . . . . . . c30446_6cxn 1 . 10 . 1207 . 1 1 4 LEU N N -1.993 0.141 -0.943 . . . 1.0 . . . . . . . . . . . . A . 4 LEU N . . . . . . . . . c30446_6cxn 1 . 10 . 1208 . 1 1 4 LEU O O -2.249 3.120 -1.576 . . . 1.0 . . . . . . . . . . . . A . 4 LEU O . . . . . . . . . c30446_6cxn 1 . 10 . 1209 . 1 1 5 ARG C C 0.745 4.771 -2.929 . . . 1.0 . . . . . . . . . . . . A . 5 ARG C . . . . . . . . . c30446_6cxn 1 . 10 . 1210 . 1 1 5 ARG CA C 0.358 4.057 -1.638 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CA . . . . . . . . . c30446_6cxn 1 . 10 . 1211 . 1 1 5 ARG CB C 1.536 4.066 -0.662 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CB . . . . . . . . . c30446_6cxn 1 . 10 . 1212 . 1 1 5 ARG CD C 2.322 6.375 -0.052 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CD . . . . . . . . . c30446_6cxn 1 . 10 . 1213 . 1 1 5 ARG CG C 1.468 5.187 0.361 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CG . . . . . . . . . c30446_6cxn 1 . 10 . 1214 . 1 1 5 ARG CZ C 1.268 8.117 1.335 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CZ . . . . . . . . . c30446_6cxn 1 . 10 . 1215 . 1 1 5 ARG H H 0.608 2.015 -2.134 . . . 1.0 . . . . . . . . . . . . A . 5 ARG H . . . . . . . . . c30446_6cxn 1 . 10 . 1216 . 1 1 5 ARG HA H -0.474 4.579 -1.188 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HA . . . . . . . . . c30446_6cxn 1 . 10 . 1217 . 1 1 5 ARG HB2 H 1.555 3.122 -0.130 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HB2 . . . . . . . . . c30446_6cxn 1 . 10 . 1218 . 1 1 5 ARG HB3 H 2.456 4.176 -1.226 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HB3 . . . . . . . . . c30446_6cxn 1 . 10 . 1219 . 1 1 5 ARG HD2 H 3.226 6.376 0.540 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HD2 . . . . . . . . . c30446_6cxn 1 . 10 . 1220 . 1 1 5 ARG HD3 H 2.578 6.273 -1.097 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HD3 . . . . . . . . . c30446_6cxn 1 . 10 . 1221 . 1 1 5 ARG HE H 1.416 8.173 -0.654 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HE . . . . . . . . . c30446_6cxn 1 . 10 . 1222 . 1 1 5 ARG HG2 H 0.442 5.512 0.457 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HG2 . . . . . . . . . c30446_6cxn 1 . 10 . 1223 . 1 1 5 ARG HG3 H 1.820 4.815 1.312 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HG3 . . . . . . . . . c30446_6cxn 1 . 10 . 1224 . 1 1 5 ARG HH11 H 2.013 6.553 2.379 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH11 . . . . . . . . . c30446_6cxn 1 . 10 . 1225 . 1 1 5 ARG HH12 H 1.265 7.791 3.331 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH12 . . . . . . . . . c30446_6cxn 1 . 10 . 1226 . 1 1 5 ARG HH21 H 0.432 9.803 0.597 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH21 . . . . . . . . . c30446_6cxn 1 . 10 . 1227 . 1 1 5 ARG HH22 H 0.367 9.636 2.319 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH22 . . . . . . . . . c30446_6cxn 1 . 10 . 1228 . 1 1 5 ARG N N -0.066 2.688 -1.907 . . . 1.0 . . . . . . . . . . . . A . 5 ARG N . . . . . . . . . c30446_6cxn 1 . 10 . 1229 . 1 1 5 ARG NE N 1.627 7.645 0.144 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NE . . . . . . . . . c30446_6cxn 1 . 10 . 1230 . 1 1 5 ARG NH1 N 1.538 7.430 2.439 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NH1 . . . . . . . . . c30446_6cxn 1 . 10 . 1231 . 1 1 5 ARG NH2 N 0.637 9.281 1.424 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NH2 . . . . . . . . . c30446_6cxn 1 . 10 . 1232 . 1 1 5 ARG O O 1.139 4.136 -3.907 . . . 1.0 . . . . . . . . . . . . A . 5 ARG O . . . . . . . . . c30446_6cxn 1 . 10 . 1233 . 1 1 6 HIS C C 2.266 7.664 -3.874 . . . 1.0 . . . . . . . . . . . . A . 6 HIS C . . . . . . . . . c30446_6cxn 1 . 10 . 1234 . 1 1 6 HIS CA C 0.967 6.896 -4.096 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CA . . . . . . . . . c30446_6cxn 1 . 10 . 1235 . 1 1 6 HIS CB C -0.167 7.871 -4.417 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CB . . . . . . . . . c30446_6cxn 1 . 10 . 1236 . 1 1 6 HIS CD2 C -1.352 8.410 -2.173 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CD2 . . . . . . . . . c30446_6cxn 1 . 10 . 1237 . 1 1 6 HIS CE1 C -0.721 10.500 -1.972 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CE1 . . . . . . . . . c30446_6cxn 1 . 10 . 1238 . 1 1 6 HIS CG C -0.584 8.708 -3.247 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CG . . . . . . . . . c30446_6cxn 1 . 10 . 1239 . 1 1 6 HIS H H 0.309 6.544 -2.115 . . . 1.0 . . . . . . . . . . . . A . 6 HIS H . . . . . . . . . c30446_6cxn 1 . 10 . 1240 . 1 1 6 HIS HA H 1.098 6.223 -4.930 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HA . . . . . . . . . c30446_6cxn 1 . 10 . 1241 . 1 1 6 HIS HB2 H 0.154 8.540 -5.206 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HB2 . . . . . . . . . c30446_6cxn 1 . 10 . 1242 . 1 1 6 HIS HB3 H -1.032 7.308 -4.750 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HB3 . . . . . . . . . c30446_6cxn 1 . 10 . 1243 . 1 1 6 HIS HD1 H 0.359 10.535 -3.709 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HD1 . . . . . . . . . c30446_6cxn 1 . 10 . 1244 . 1 1 6 HIS HD2 H -1.823 7.459 -1.965 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HD2 . . . . . . . . . c30446_6cxn 1 . 10 . 1245 . 1 1 6 HIS HE1 H -0.593 11.503 -1.592 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HE1 . . . . . . . . . c30446_6cxn 1 . 10 . 1246 . 1 1 6 HIS HE2 H -1.980 9.649 -0.598 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HE2 . . . . . . . . . c30446_6cxn 1 . 10 . 1247 . 1 1 6 HIS N N 0.629 6.095 -2.925 . . . 1.0 . . . . . . . . . . . . A . 6 HIS N . . . . . . . . . c30446_6cxn 1 . 10 . 1248 . 1 1 6 HIS ND1 N -0.205 10.025 -3.091 . . . 1.0 . . . . . . . . . . . . A . 6 HIS ND1 . . . . . . . . . c30446_6cxn 1 . 10 . 1249 . 1 1 6 HIS NE2 N -1.422 9.540 -1.396 . . . 1.0 . . . . . . . . . . . . A . 6 HIS NE2 . . . . . . . . . c30446_6cxn 1 . 10 . 1250 . 1 1 6 HIS O O 2.218 8.730 -3.226 . . . 1.0 . . . . . . . . . . . . A . 6 HIS O . . . . . . . . . c30446_6cxn 1 . 11 . 1251 . 1 1 1 HIS C C -0.248 -6.660 2.624 . . . 1.0 . . . . . . . . . . . . A . 1 HIS C . . . . . . . . . c30446_6cxn 1 . 11 . 1252 . 1 1 1 HIS CA C -0.087 -8.024 1.960 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CA . . . . . . . . . c30446_6cxn 1 . 11 . 1253 . 1 1 1 HIS CB C -0.850 -8.059 0.634 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CB . . . . . . . . . c30446_6cxn 1 . 11 . 1254 . 1 1 1 HIS CD2 C 0.417 -10.181 -0.156 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CD2 . . . . . . . . . c30446_6cxn 1 . 11 . 1255 . 1 1 1 HIS CE1 C 0.121 -9.944 -2.316 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CE1 . . . . . . . . . c30446_6cxn 1 . 11 . 1256 . 1 1 1 HIS CG C -0.301 -9.049 -0.347 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CG . . . . . . . . . c30446_6cxn 1 . 11 . 1257 . 1 1 1 HIS H1 H -0.236 -10.012 2.467 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H1 . . . . . . . . . c30446_6cxn 1 . 11 . 1258 . 1 1 1 HIS H2 H -1.642 -9.083 2.791 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H2 . . . . . . . . . c30446_6cxn 1 . 11 . 1259 . 1 1 1 HIS H3 H -0.261 -8.932 3.798 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H3 . . . . . . . . . c30446_6cxn 1 . 11 . 1260 . 1 1 1 HIS HA H 0.962 -8.202 1.772 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HA . . . . . . . . . c30446_6cxn 1 . 11 . 1261 . 1 1 1 HIS HB2 H -1.879 -8.320 0.827 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HB2 . . . . . . . . . c30446_6cxn 1 . 11 . 1262 . 1 1 1 HIS HB3 H -0.810 -7.081 0.178 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HB3 . . . . . . . . . c30446_6cxn 1 . 11 . 1263 . 1 1 1 HIS HD1 H -0.950 -8.207 -2.166 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HD1 . . . . . . . . . c30446_6cxn 1 . 11 . 1264 . 1 1 1 HIS HD2 H 0.736 -10.586 0.794 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HD2 . . . . . . . . . c30446_6cxn 1 . 11 . 1265 . 1 1 1 HIS HE1 H 0.152 -10.112 -3.382 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HE1 . . . . . . . . . c30446_6cxn 1 . 11 . 1266 . 1 1 1 HIS HE2 H 1.093 -11.583 -1.566 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HE2 . . . . . . . . . c30446_6cxn 1 . 11 . 1267 . 1 1 1 HIS N N -0.603 -9.111 2.832 . . . 1.0 . . . . . . . . . . . . A . 1 HIS N . . . . . . . . . c30446_6cxn 1 . 11 . 1268 . 1 1 1 HIS ND1 N -0.469 -8.929 -1.710 . . . 1.0 . . . . . . . . . . . . A . 1 HIS ND1 . . . . . . . . . c30446_6cxn 1 . 11 . 1269 . 1 1 1 HIS NE2 N 0.666 -10.718 -1.395 . . . 1.0 . . . . . . . . . . . . A . 1 HIS NE2 . . . . . . . . . c30446_6cxn 1 . 11 . 1270 . 1 1 1 HIS O O -0.837 -6.548 3.699 . . . 1.0 . . . . . . . . . . . . A . 1 HIS O . . . . . . . . . c30446_6cxn 1 . 11 . 1271 . 1 1 2 ARG C C -0.674 -3.392 1.605 . . . 1.0 . . . . . . . . . . . . A . 2 ARG C . . . . . . . . . c30446_6cxn 1 . 11 . 1272 . 1 1 2 ARG CA C 0.191 -4.269 2.503 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CA . . . . . . . . . c30446_6cxn 1 . 11 . 1273 . 1 1 2 ARG CB C 1.588 -3.661 2.636 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CB . . . . . . . . . c30446_6cxn 1 . 11 . 1274 . 1 1 2 ARG CD C 3.285 -5.147 3.744 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CD . . . . . . . . . c30446_6cxn 1 . 11 . 1275 . 1 1 2 ARG CG C 2.286 -4.018 3.938 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CG . . . . . . . . . c30446_6cxn 1 . 11 . 1276 . 1 1 2 ARG CZ C 4.583 -6.665 5.188 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CZ . . . . . . . . . c30446_6cxn 1 . 11 . 1277 . 1 1 2 ARG H H 0.735 -5.779 1.122 . . . 1.0 . . . . . . . . . . . . A . 2 ARG H . . . . . . . . . c30446_6cxn 1 . 11 . 1278 . 1 1 2 ARG HA H -0.263 -4.322 3.481 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HA . . . . . . . . . c30446_6cxn 1 . 11 . 1279 . 1 1 2 ARG HB2 H 2.200 -4.010 1.817 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB2 . . . . . . . . . c30446_6cxn 1 . 11 . 1280 . 1 1 2 ARG HB3 H 1.506 -2.585 2.579 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB3 . . . . . . . . . c30446_6cxn 1 . 11 . 1281 . 1 1 2 ARG HD2 H 2.899 -5.828 2.999 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD2 . . . . . . . . . c30446_6cxn 1 . 11 . 1282 . 1 1 2 ARG HD3 H 4.219 -4.729 3.399 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD3 . . . . . . . . . c30446_6cxn 1 . 11 . 1283 . 1 1 2 ARG HE H 2.859 -5.797 5.697 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HE . . . . . . . . . c30446_6cxn 1 . 11 . 1284 . 1 1 2 ARG HG2 H 2.809 -3.148 4.305 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG2 . . . . . . . . . c30446_6cxn 1 . 11 . 1285 . 1 1 2 ARG HG3 H 1.544 -4.325 4.660 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG3 . . . . . . . . . c30446_6cxn 1 . 11 . 1286 . 1 1 2 ARG HH11 H 5.403 -6.334 3.369 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH11 . . . . . . . . . c30446_6cxn 1 . 11 . 1287 . 1 1 2 ARG HH12 H 6.296 -7.397 4.403 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH12 . . . . . . . . . c30446_6cxn 1 . 11 . 1288 . 1 1 2 ARG HH21 H 4.033 -7.195 7.059 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH21 . . . . . . . . . c30446_6cxn 1 . 11 . 1289 . 1 1 2 ARG HH22 H 5.518 -7.886 6.498 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH22 . . . . . . . . . c30446_6cxn 1 . 11 . 1290 . 1 1 2 ARG N N 0.278 -5.626 1.976 . . . 1.0 . . . . . . . . . . . . A . 2 ARG N . . . . . . . . . c30446_6cxn 1 . 11 . 1291 . 1 1 2 ARG NE N 3.523 -5.886 4.982 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NE . . . . . . . . . c30446_6cxn 1 . 11 . 1292 . 1 1 2 ARG NH1 N 5.503 -6.810 4.242 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH1 . . . . . . . . . c30446_6cxn 1 . 11 . 1293 . 1 1 2 ARG NH2 N 4.723 -7.301 6.343 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH2 . . . . . . . . . c30446_6cxn 1 . 11 . 1294 . 1 1 2 ARG O O -1.149 -3.834 0.559 . . . 1.0 . . . . . . . . . . . . A . 2 ARG O . . . . . . . . . c30446_6cxn 1 . 11 . 1295 . 1 1 3 PHE C C -0.870 -0.571 0.133 . . . 1.0 . . . . . . . . . . . . A . 3 PHE C . . . . . . . . . c30446_6cxn 1 . 11 . 1296 . 1 1 3 PHE CA C -1.684 -1.206 1.253 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CA . . . . . . . . . c30446_6cxn 1 . 11 . 1297 . 1 1 3 PHE CB C -2.254 -0.124 2.167 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CB . . . . . . . . . c30446_6cxn 1 . 11 . 1298 . 1 1 3 PHE CD1 C -4.600 -0.904 1.681 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CD1 . . . . . . . . . c30446_6cxn 1 . 11 . 1299 . 1 1 3 PHE CD2 C -4.231 1.419 2.076 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CD2 . . . . . . . . . c30446_6cxn 1 . 11 . 1300 . 1 1 3 PHE CE1 C -5.949 -0.663 1.503 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CE1 . . . . . . . . . c30446_6cxn 1 . 11 . 1301 . 1 1 3 PHE CE2 C -5.579 1.666 1.899 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CE2 . . . . . . . . . c30446_6cxn 1 . 11 . 1302 . 1 1 3 PHE CG C -3.725 0.133 1.970 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CG . . . . . . . . . c30446_6cxn 1 . 11 . 1303 . 1 1 3 PHE CZ C -6.439 0.624 1.612 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CZ . . . . . . . . . c30446_6cxn 1 . 11 . 1304 . 1 1 3 PHE H H -0.470 -1.851 2.863 . . . 1.0 . . . . . . . . . . . . A . 3 PHE H . . . . . . . . . c30446_6cxn 1 . 11 . 1305 . 1 1 3 PHE HA H -2.497 -1.752 0.816 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HA . . . . . . . . . c30446_6cxn 1 . 11 . 1306 . 1 1 3 PHE HB2 H -2.105 -0.417 3.199 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HB2 . . . . . . . . . c30446_6cxn 1 . 11 . 1307 . 1 1 3 PHE HB3 H -1.729 0.798 1.975 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HB3 . . . . . . . . . c30446_6cxn 1 . 11 . 1308 . 1 1 3 PHE HD1 H -4.218 -1.911 1.595 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HD1 . . . . . . . . . c30446_6cxn 1 . 11 . 1309 . 1 1 3 PHE HD2 H -3.560 2.235 2.300 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HD2 . . . . . . . . . c30446_6cxn 1 . 11 . 1310 . 1 1 3 PHE HE1 H -6.619 -1.479 1.279 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HE1 . . . . . . . . . c30446_6cxn 1 . 11 . 1311 . 1 1 3 PHE HE2 H -5.960 2.673 1.984 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HE2 . . . . . . . . . c30446_6cxn 1 . 11 . 1312 . 1 1 3 PHE HZ H -7.493 0.815 1.473 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HZ . . . . . . . . . c30446_6cxn 1 . 11 . 1313 . 1 1 3 PHE N N -0.876 -2.146 2.021 . . . 1.0 . . . . . . . . . . . . A . 3 PHE N . . . . . . . . . c30446_6cxn 1 . 11 . 1314 . 1 1 3 PHE O O 0.349 -0.729 0.069 . . . 1.0 . . . . . . . . . . . . A . 3 PHE O . . . . . . . . . c30446_6cxn 1 . 11 . 1315 . 1 1 4 LEU C C -0.685 2.281 -1.603 . . . 1.0 . . . . . . . . . . . . A . 4 LEU C . . . . . . . . . c30446_6cxn 1 . 11 . 1316 . 1 1 4 LEU CA C -0.902 0.797 -1.878 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CA . . . . . . . . . c30446_6cxn 1 . 11 . 1317 . 1 1 4 LEU CB C -1.726 0.615 -3.151 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CB . . . . . . . . . c30446_6cxn 1 . 11 . 1318 . 1 1 4 LEU CD1 C -3.757 -0.676 -2.492 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CD1 . . . . . . . . . c30446_6cxn 1 . 11 . 1319 . 1 1 4 LEU CD2 C -2.684 -1.098 -4.712 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CD2 . . . . . . . . . c30446_6cxn 1 . 11 . 1320 . 1 1 4 LEU CG C -2.449 -0.726 -3.255 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CG . . . . . . . . . c30446_6cxn 1 . 11 . 1321 . 1 1 4 LEU H H -2.524 0.226 -0.651 . . . 1.0 . . . . . . . . . . . . A . 4 LEU H . . . . . . . . . c30446_6cxn 1 . 11 . 1322 . 1 1 4 LEU HA H 0.053 0.323 -2.016 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HA . . . . . . . . . c30446_6cxn 1 . 11 . 1323 . 1 1 4 LEU HB2 H -2.463 1.405 -3.195 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HB2 . . . . . . . . . c30446_6cxn 1 . 11 . 1324 . 1 1 4 LEU HB3 H -1.067 0.711 -4.001 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HB3 . . . . . . . . . c30446_6cxn 1 . 11 . 1325 . 1 1 4 LEU HD11 H -4.048 0.354 -2.348 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD11 . . . . . . . . . c30446_6cxn 1 . 11 . 1326 . 1 1 4 LEU HD12 H -3.625 -1.149 -1.531 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD12 . . . . . . . . . c30446_6cxn 1 . 11 . 1327 . 1 1 4 LEU HD13 H -4.523 -1.194 -3.049 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD13 . . . . . . . . . c30446_6cxn 1 . 11 . 1328 . 1 1 4 LEU HD21 H -2.960 -2.140 -4.777 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD21 . . . . . . . . . c30446_6cxn 1 . 11 . 1329 . 1 1 4 LEU HD22 H -1.779 -0.930 -5.277 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD22 . . . . . . . . . c30446_6cxn 1 . 11 . 1330 . 1 1 4 LEU HD23 H -3.479 -0.489 -5.115 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD23 . . . . . . . . . c30446_6cxn 1 . 11 . 1331 . 1 1 4 LEU HG H -1.835 -1.491 -2.804 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HG . . . . . . . . . c30446_6cxn 1 . 11 . 1332 . 1 1 4 LEU N N -1.556 0.142 -0.753 . . . 1.0 . . . . . . . . . . . . A . 4 LEU N . . . . . . . . . c30446_6cxn 1 . 11 . 1333 . 1 1 4 LEU O O -1.549 2.950 -1.037 . . . 1.0 . . . . . . . . . . . . A . 4 LEU O . . . . . . . . . c30446_6cxn 1 . 11 . 1334 . 1 1 5 ARG C C 1.035 4.897 -3.143 . . . 1.0 . . . . . . . . . . . . A . 5 ARG C . . . . . . . . . c30446_6cxn 1 . 11 . 1335 . 1 1 5 ARG CA C 0.805 4.196 -1.808 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CA . . . . . . . . . c30446_6cxn 1 . 11 . 1336 . 1 1 5 ARG CB C 2.048 4.329 -0.928 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CB . . . . . . . . . c30446_6cxn 1 . 11 . 1337 . 1 1 5 ARG CD C 2.738 6.718 -0.556 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CD . . . . . . . . . c30446_6cxn 1 . 11 . 1338 . 1 1 5 ARG CG C 1.996 5.520 0.015 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CG . . . . . . . . . c30446_6cxn 1 . 11 . 1339 . 1 1 5 ARG CZ C 1.852 8.655 0.683 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CZ . . . . . . . . . c30446_6cxn 1 . 11 . 1340 . 1 1 5 ARG H H 1.122 2.206 -2.455 . . . 1.0 . . . . . . . . . . . . A . 5 ARG H . . . . . . . . . c30446_6cxn 1 . 11 . 1341 . 1 1 5 ARG HA H -0.030 4.665 -1.308 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HA . . . . . . . . . c30446_6cxn 1 . 11 . 1342 . 1 1 5 ARG HB2 H 2.153 3.430 -0.333 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HB2 . . . . . . . . . c30446_6cxn 1 . 11 . 1343 . 1 1 5 ARG HB3 H 2.917 4.440 -1.566 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HB3 . . . . . . . . . c30446_6cxn 1 . 11 . 1344 . 1 1 5 ARG HD2 H 3.667 6.839 -0.019 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HD2 . . . . . . . . . c30446_6cxn 1 . 11 . 1345 . 1 1 5 ARG HD3 H 2.948 6.533 -1.599 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HD3 . . . . . . . . . c30446_6cxn 1 . 11 . 1346 . 1 1 5 ARG HE H 1.495 8.268 -1.242 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HE . . . . . . . . . c30446_6cxn 1 . 11 . 1347 . 1 1 5 ARG HG2 H 0.964 5.794 0.177 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HG2 . . . . . . . . . c30446_6cxn 1 . 11 . 1348 . 1 1 5 ARG HG3 H 2.448 5.242 0.955 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HG3 . . . . . . . . . c30446_6cxn 1 . 11 . 1349 . 1 1 5 ARG HH11 H 3.021 7.422 1.781 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH11 . . . . . . . . . c30446_6cxn 1 . 11 . 1350 . 1 1 5 ARG HH12 H 2.384 8.790 2.629 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH12 . . . . . . . . . c30446_6cxn 1 . 11 . 1351 . 1 1 5 ARG HH21 H 0.656 10.068 -0.128 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH21 . . . . . . . . . c30446_6cxn 1 . 11 . 1352 . 1 1 5 ARG HH22 H 1.040 10.293 1.546 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH22 . . . . . . . . . c30446_6cxn 1 . 11 . 1353 . 1 1 5 ARG N N 0.474 2.790 -2.009 . . . 1.0 . . . . . . . . . . . . A . 5 ARG N . . . . . . . . . c30446_6cxn 1 . 11 . 1354 . 1 1 5 ARG NE N 1.961 7.950 -0.440 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NE . . . . . . . . . c30446_6cxn 1 . 11 . 1355 . 1 1 5 ARG NH1 N 2.469 8.256 1.788 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NH1 . . . . . . . . . c30446_6cxn 1 . 11 . 1356 . 1 1 5 ARG NH2 N 1.123 9.763 0.702 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NH2 . . . . . . . . . c30446_6cxn 1 . 11 . 1357 . 1 1 5 ARG O O 1.703 4.363 -4.028 . . . 1.0 . . . . . . . . . . . . A . 5 ARG O . . . . . . . . . c30446_6cxn 1 . 11 . 1358 . 1 1 6 HIS C C 1.036 8.303 -4.202 . . . 1.0 . . . . . . . . . . . . A . 6 HIS C . . . . . . . . . c30446_6cxn 1 . 11 . 1359 . 1 1 6 HIS CA C 0.620 6.868 -4.509 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CA . . . . . . . . . c30446_6cxn 1 . 11 . 1360 . 1 1 6 HIS CB C -0.690 6.863 -5.297 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CB . . . . . . . . . c30446_6cxn 1 . 11 . 1361 . 1 1 6 HIS CD2 C -1.895 8.045 -3.328 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CD2 . . . . . . . . . c30446_6cxn 1 . 11 . 1362 . 1 1 6 HIS CE1 C -3.929 8.041 -4.148 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CE1 . . . . . . . . . c30446_6cxn 1 . 11 . 1363 . 1 1 6 HIS CG C -1.843 7.449 -4.543 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CG . . . . . . . . . c30446_6cxn 1 . 11 . 1364 . 1 1 6 HIS H H -0.046 6.467 -2.540 . . . 1.0 . . . . . . . . . . . . A . 6 HIS H . . . . . . . . . c30446_6cxn 1 . 11 . 1365 . 1 1 6 HIS HA H 1.391 6.402 -5.105 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HA . . . . . . . . . c30446_6cxn 1 . 11 . 1366 . 1 1 6 HIS HB2 H -0.560 7.441 -6.204 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HB2 . . . . . . . . . c30446_6cxn 1 . 11 . 1367 . 1 1 6 HIS HB3 H -0.944 5.840 -5.554 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HB3 . . . . . . . . . c30446_6cxn 1 . 11 . 1368 . 1 1 6 HIS HD1 H -3.423 7.099 -5.893 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HD1 . . . . . . . . . c30446_6cxn 1 . 11 . 1369 . 1 1 6 HIS HD2 H -1.063 8.209 -2.657 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HD2 . . . . . . . . . c30446_6cxn 1 . 11 . 1370 . 1 1 6 HIS HE1 H -4.992 8.191 -4.259 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HE1 . . . . . . . . . c30446_6cxn 1 . 11 . 1371 . 1 1 6 HIS HE2 H -3.557 8.776 -2.273 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HE2 . . . . . . . . . c30446_6cxn 1 . 11 . 1372 . 1 1 6 HIS N N 0.476 6.095 -3.281 . . . 1.0 . . . . . . . . . . . . A . 6 HIS N . . . . . . . . . c30446_6cxn 1 . 11 . 1373 . 1 1 6 HIS ND1 N -3.133 7.461 -5.029 . . . 1.0 . . . . . . . . . . . . A . 6 HIS ND1 . . . . . . . . . c30446_6cxn 1 . 11 . 1374 . 1 1 6 HIS NE2 N -3.202 8.403 -3.107 . . . 1.0 . . . . . . . . . . . . A . 6 HIS NE2 . . . . . . . . . c30446_6cxn 1 . 11 . 1375 . 1 1 6 HIS O O 1.158 8.640 -3.006 . . . 1.0 . . . . . . . . . . . . A . 6 HIS O . . . . . . . . . c30446_6cxn 1 . 12 . 1376 . 1 1 1 HIS C C 0.049 -6.476 2.813 . . . 1.0 . . . . . . . . . . . . A . 1 HIS C . . . . . . . . . c30446_6cxn 1 . 12 . 1377 . 1 1 1 HIS CA C -0.327 -7.948 2.672 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CA . . . . . . . . . c30446_6cxn 1 . 12 . 1378 . 1 1 1 HIS CB C -1.769 -8.079 2.179 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CB . . . . . . . . . c30446_6cxn 1 . 12 . 1379 . 1 1 1 HIS CD2 C -2.250 -10.573 2.706 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CD2 . . . . . . . . . c30446_6cxn 1 . 12 . 1380 . 1 1 1 HIS CE1 C -2.876 -11.209 0.704 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CE1 . . . . . . . . . c30446_6cxn 1 . 12 . 1381 . 1 1 1 HIS CG C -2.179 -9.491 1.895 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CG . . . . . . . . . c30446_6cxn 1 . 12 . 1382 . 1 1 1 HIS H1 H 0.671 -8.336 4.428 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H1 . . . . . . . . . c30446_6cxn 1 . 12 . 1383 . 1 1 1 HIS H2 H -0.167 -9.681 3.769 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H2 . . . . . . . . . c30446_6cxn 1 . 12 . 1384 . 1 1 1 HIS H3 H -1.037 -8.421 4.544 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H3 . . . . . . . . . c30446_6cxn 1 . 12 . 1385 . 1 1 1 HIS HA H 0.336 -8.414 1.959 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HA . . . . . . . . . c30446_6cxn 1 . 12 . 1386 . 1 1 1 HIS HB2 H -2.437 -7.685 2.930 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HB2 . . . . . . . . . c30446_6cxn 1 . 12 . 1387 . 1 1 1 HIS HB3 H -1.884 -7.509 1.268 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HB3 . . . . . . . . . c30446_6cxn 1 . 12 . 1388 . 1 1 1 HIS HD1 H -2.633 -9.369 -0.159 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HD1 . . . . . . . . . c30446_6cxn 1 . 12 . 1389 . 1 1 1 HIS HD2 H -2.008 -10.602 3.759 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HD2 . . . . . . . . . c30446_6cxn 1 . 12 . 1390 . 1 1 1 HIS HE1 H -3.217 -11.815 -0.122 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HE1 . . . . . . . . . c30446_6cxn 1 . 12 . 1391 . 1 1 1 HIS HE2 H -2.913 -12.519 2.278 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HE2 . . . . . . . . . c30446_6cxn 1 . 12 . 1392 . 1 1 1 HIS N N -0.204 -8.661 3.970 . . . 1.0 . . . . . . . . . . . . A . 1 HIS N . . . . . . . . . c30446_6cxn 1 . 12 . 1393 . 1 1 1 HIS ND1 N -2.577 -9.923 0.647 . . . 1.0 . . . . . . . . . . . . A . 1 HIS ND1 . . . . . . . . . c30446_6cxn 1 . 12 . 1394 . 1 1 1 HIS NE2 N -2.685 -11.627 1.941 . . . 1.0 . . . . . . . . . . . . A . 1 HIS NE2 . . . . . . . . . c30446_6cxn 1 . 12 . 1395 . 1 1 1 HIS O O 0.168 -5.960 3.924 . . . 1.0 . . . . . . . . . . . . A . 1 HIS O . . . . . . . . . c30446_6cxn 1 . 12 . 1396 . 1 1 2 ARG C C -0.534 -3.544 1.109 . . . 1.0 . . . . . . . . . . . . A . 2 ARG C . . . . . . . . . c30446_6cxn 1 . 12 . 1397 . 1 1 2 ARG CA C 0.596 -4.394 1.677 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CA . . . . . . . . . c30446_6cxn 1 . 12 . 1398 . 1 1 2 ARG CB C 1.874 -4.176 0.865 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CB . . . . . . . . . c30446_6cxn 1 . 12 . 1399 . 1 1 2 ARG CD C 3.943 -2.800 0.487 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CD . . . . . . . . . c30446_6cxn 1 . 12 . 1400 . 1 1 2 ARG CG C 2.638 -2.922 1.258 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CG . . . . . . . . . c30446_6cxn 1 . 12 . 1401 . 1 1 2 ARG CZ C 6.140 -1.735 0.816 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CZ . . . . . . . . . c30446_6cxn 1 . 12 . 1402 . 1 1 2 ARG H H 0.124 -6.274 0.826 . . . 1.0 . . . . . . . . . . . . A . 2 ARG H . . . . . . . . . c30446_6cxn 1 . 12 . 1403 . 1 1 2 ARG HA H 0.775 -4.096 2.699 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HA . . . . . . . . . c30446_6cxn 1 . 12 . 1404 . 1 1 2 ARG HB2 H 2.525 -5.026 1.003 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB2 . . . . . . . . . c30446_6cxn 1 . 12 . 1405 . 1 1 2 ARG HB3 H 1.613 -4.099 -0.181 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB3 . . . . . . . . . c30446_6cxn 1 . 12 . 1406 . 1 1 2 ARG HD2 H 4.236 -3.781 0.144 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD2 . . . . . . . . . c30446_6cxn 1 . 12 . 1407 . 1 1 2 ARG HD3 H 3.784 -2.155 -0.364 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD3 . . . . . . . . . c30446_6cxn 1 . 12 . 1408 . 1 1 2 ARG HE H 4.891 -2.256 2.282 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HE . . . . . . . . . c30446_6cxn 1 . 12 . 1409 . 1 1 2 ARG HG2 H 2.026 -2.058 1.048 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG2 . . . . . . . . . c30446_6cxn 1 . 12 . 1410 . 1 1 2 ARG HG3 H 2.857 -2.962 2.315 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG3 . . . . . . . . . c30446_6cxn 1 . 12 . 1411 . 1 1 2 ARG HH11 H 5.651 -2.067 -1.118 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH11 . . . . . . . . . c30446_6cxn 1 . 12 . 1412 . 1 1 2 ARG HH12 H 7.191 -1.318 -0.860 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH12 . . . . . . . . . c30446_6cxn 1 . 12 . 1413 . 1 1 2 ARG HH21 H 6.916 -1.271 2.624 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH21 . . . . . . . . . c30446_6cxn 1 . 12 . 1414 . 1 1 2 ARG HH22 H 7.910 -0.867 1.264 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH22 . . . . . . . . . c30446_6cxn 1 . 12 . 1415 . 1 1 2 ARG N N 0.234 -5.807 1.680 . . . 1.0 . . . . . . . . . . . . A . 2 ARG N . . . . . . . . . c30446_6cxn 1 . 12 . 1416 . 1 1 2 ARG NE N 5.015 -2.246 1.310 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NE . . . . . . . . . c30446_6cxn 1 . 12 . 1417 . 1 1 2 ARG NH1 N 6.344 -1.704 -0.495 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH1 . . . . . . . . . c30446_6cxn 1 . 12 . 1418 . 1 1 2 ARG NH2 N 7.064 -1.251 1.635 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH2 . . . . . . . . . c30446_6cxn 1 . 12 . 1419 . 1 1 2 ARG O O -1.403 -4.045 0.395 . . . 1.0 . . . . . . . . . . . . A . 2 ARG O . . . . . . . . . c30446_6cxn 1 . 12 . 1420 . 1 1 3 PHE C C -1.059 -0.560 -0.266 . . . 1.0 . . . . . . . . . . . . A . 3 PHE C . . . . . . . . . c30446_6cxn 1 . 12 . 1421 . 1 1 3 PHE CA C -1.542 -1.335 0.953 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CA . . . . . . . . . c30446_6cxn 1 . 12 . 1422 . 1 1 3 PHE CB C -1.954 -0.370 2.064 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CB . . . . . . . . . c30446_6cxn 1 . 12 . 1423 . 1 1 3 PHE CD1 C -4.258 -1.391 2.093 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CD1 . . . . . . . . . c30446_6cxn 1 . 12 . 1424 . 1 1 3 PHE CD2 C -4.023 0.908 2.686 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CD2 . . . . . . . . . c30446_6cxn 1 . 12 . 1425 . 1 1 3 PHE CE1 C -5.622 -1.308 2.298 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CE1 . . . . . . . . . c30446_6cxn 1 . 12 . 1426 . 1 1 3 PHE CE2 C -5.387 0.996 2.892 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CE2 . . . . . . . . . c30446_6cxn 1 . 12 . 1427 . 1 1 3 PHE CG C -3.442 -0.285 2.284 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CG . . . . . . . . . c30446_6cxn 1 . 12 . 1428 . 1 1 3 PHE CZ C -6.187 -0.113 2.698 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CZ . . . . . . . . . c30446_6cxn 1 . 12 . 1429 . 1 1 3 PHE H H 0.201 -1.915 2.005 . . . 1.0 . . . . . . . . . . . . A . 3 PHE H . . . . . . . . . c30446_6cxn 1 . 12 . 1430 . 1 1 3 PHE HA H -2.397 -1.917 0.666 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HA . . . . . . . . . c30446_6cxn 1 . 12 . 1431 . 1 1 3 PHE HB2 H -1.499 -0.686 2.994 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HB2 . . . . . . . . . c30446_6cxn 1 . 12 . 1432 . 1 1 3 PHE HB3 H -1.601 0.618 1.808 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HB3 . . . . . . . . . c30446_6cxn 1 . 12 . 1433 . 1 1 3 PHE HD1 H -3.818 -2.326 1.779 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HD1 . . . . . . . . . c30446_6cxn 1 . 12 . 1434 . 1 1 3 PHE HD2 H -3.399 1.776 2.838 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HD2 . . . . . . . . . c30446_6cxn 1 . 12 . 1435 . 1 1 3 PHE HE1 H -6.246 -2.176 2.146 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HE1 . . . . . . . . . c30446_6cxn 1 . 12 . 1436 . 1 1 3 PHE HE2 H -5.826 1.932 3.205 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HE2 . . . . . . . . . c30446_6cxn 1 . 12 . 1437 . 1 1 3 PHE HZ H -7.253 -0.045 2.859 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HZ . . . . . . . . . c30446_6cxn 1 . 12 . 1438 . 1 1 3 PHE N N -0.517 -2.255 1.431 . . . 1.0 . . . . . . . . . . . . A . 3 PHE N . . . . . . . . . c30446_6cxn 1 . 12 . 1439 . 1 1 3 PHE O O 0.117 -0.614 -0.626 . . . 1.0 . . . . . . . . . . . . A . 3 PHE O . . . . . . . . . c30446_6cxn 1 . 12 . 1440 . 1 1 4 LEU C C -1.297 2.371 -1.721 . . . 1.0 . . . . . . . . . . . . A . 4 LEU C . . . . . . . . . c30446_6cxn 1 . 12 . 1441 . 1 1 4 LEU CA C -1.657 0.935 -2.088 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CA . . . . . . . . . c30446_6cxn 1 . 12 . 1442 . 1 1 4 LEU CB C -2.828 0.922 -3.069 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CB . . . . . . . . . c30446_6cxn 1 . 12 . 1443 . 1 1 4 LEU CD1 C -4.608 -0.536 -2.095 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CD1 . . . . . . . . . c30446_6cxn 1 . 12 . 1444 . 1 1 4 LEU CD2 C -4.169 -0.585 -4.559 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CD2 . . . . . . . . . c30446_6cxn 1 . 12 . 1445 . 1 1 4 LEU CG C -3.552 -0.419 -3.178 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CG . . . . . . . . . c30446_6cxn 1 . 12 . 1446 . 1 1 4 LEU H H -2.899 0.151 -0.568 . . . 1.0 . . . . . . . . . . . . A . 4 LEU H . . . . . . . . . c30446_6cxn 1 . 12 . 1447 . 1 1 4 LEU HA H -0.809 0.472 -2.559 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HA . . . . . . . . . c30446_6cxn 1 . 12 . 1448 . 1 1 4 LEU HB2 H -3.542 1.671 -2.757 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HB2 . . . . . . . . . c30446_6cxn 1 . 12 . 1449 . 1 1 4 LEU HB3 H -2.457 1.186 -4.047 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HB3 . . . . . . . . . c30446_6cxn 1 . 12 . 1450 . 1 1 4 LEU HD11 H -4.368 -1.370 -1.453 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD11 . . . . . . . . . c30446_6cxn 1 . 12 . 1451 . 1 1 4 LEU HD12 H -5.576 -0.692 -2.546 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD12 . . . . . . . . . c30446_6cxn 1 . 12 . 1452 . 1 1 4 LEU HD13 H -4.622 0.372 -1.511 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD13 . . . . . . . . . c30446_6cxn 1 . 12 . 1453 . 1 1 4 LEU HD21 H -5.103 -1.121 -4.474 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD21 . . . . . . . . . c30446_6cxn 1 . 12 . 1454 . 1 1 4 LEU HD22 H -3.492 -1.138 -5.192 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD22 . . . . . . . . . c30446_6cxn 1 . 12 . 1455 . 1 1 4 LEU HD23 H -4.351 0.389 -4.991 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD23 . . . . . . . . . c30446_6cxn 1 . 12 . 1456 . 1 1 4 LEU HG H -2.839 -1.217 -3.029 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HG . . . . . . . . . c30446_6cxn 1 . 12 . 1457 . 1 1 4 LEU N N -1.980 0.154 -0.903 . . . 1.0 . . . . . . . . . . . . A . 4 LEU N . . . . . . . . . c30446_6cxn 1 . 12 . 1458 . 1 1 4 LEU O O -2.123 3.111 -1.186 . . . 1.0 . . . . . . . . . . . . A . 4 LEU O . . . . . . . . . c30446_6cxn 1 . 12 . 1459 . 1 1 5 ARG C C 0.880 4.812 -2.979 . . . 1.0 . . . . . . . . . . . . A . 5 ARG C . . . . . . . . . c30446_6cxn 1 . 12 . 1460 . 1 1 5 ARG CA C 0.412 4.105 -1.711 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CA . . . . . . . . . c30446_6cxn 1 . 12 . 1461 . 1 1 5 ARG CB C 1.551 4.055 -0.691 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CB . . . . . . . . . c30446_6cxn 1 . 12 . 1462 . 1 1 5 ARG CD C 2.586 6.296 -0.221 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CD . . . . . . . . . c30446_6cxn 1 . 12 . 1463 . 1 1 5 ARG CG C 1.581 5.254 0.243 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CG . . . . . . . . . c30446_6cxn 1 . 12 . 1464 . 1 1 5 ARG CZ C 2.122 8.269 1.182 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CZ . . . . . . . . . c30446_6cxn 1 . 12 . 1465 . 1 1 5 ARG H H 0.553 2.122 -2.437 . . . 1.0 . . . . . . . . . . . . A . 5 ARG H . . . . . . . . . c30446_6cxn 1 . 12 . 1466 . 1 1 5 ARG HA H -0.414 4.658 -1.289 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HA . . . . . . . . . c30446_6cxn 1 . 12 . 1467 . 1 1 5 ARG HB2 H 1.441 3.160 -0.090 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HB2 . . . . . . . . . c30446_6cxn 1 . 12 . 1468 . 1 1 5 ARG HB3 H 2.494 4.015 -1.224 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HB3 . . . . . . . . . c30446_6cxn 1 . 12 . 1469 . 1 1 5 ARG HD2 H 3.507 6.159 0.326 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HD2 . . . . . . . . . c30446_6cxn 1 . 12 . 1470 . 1 1 5 ARG HD3 H 2.770 6.156 -1.276 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HD3 . . . . . . . . . c30446_6cxn 1 . 12 . 1471 . 1 1 5 ARG HE H 1.747 8.142 -0.774 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HE . . . . . . . . . c30446_6cxn 1 . 12 . 1472 . 1 1 5 ARG HG2 H 0.599 5.702 0.270 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HG2 . . . . . . . . . c30446_6cxn 1 . 12 . 1473 . 1 1 5 ARG HG3 H 1.853 4.919 1.233 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HG3 . . . . . . . . . c30446_6cxn 1 . 12 . 1474 . 1 1 5 ARG HH11 H 2.945 6.710 2.174 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH11 . . . . . . . . . c30446_6cxn 1 . 12 . 1475 . 1 1 5 ARG HH12 H 2.609 8.109 3.138 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH12 . . . . . . . . . c30446_6cxn 1 . 12 . 1476 . 1 1 5 ARG HH21 H 1.304 9.983 0.491 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH21 . . . . . . . . . c30446_6cxn 1 . 12 . 1477 . 1 1 5 ARG HH22 H 1.677 9.967 2.183 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH22 . . . . . . . . . c30446_6cxn 1 . 12 . 1478 . 1 1 5 ARG N N -0.059 2.758 -2.011 . . . 1.0 . . . . . . . . . . . . A . 5 ARG N . . . . . . . . . c30446_6cxn 1 . 12 . 1479 . 1 1 5 ARG NE N 2.103 7.658 -0.001 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NE . . . . . . . . . c30446_6cxn 1 . 12 . 1480 . 1 1 5 ARG NH1 N 2.597 7.644 2.252 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NH1 . . . . . . . . . c30446_6cxn 1 . 12 . 1481 . 1 1 5 ARG NH2 N 1.664 9.508 1.295 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NH2 . . . . . . . . . c30446_6cxn 1 . 12 . 1482 . 1 1 5 ARG O O 1.380 4.177 -3.907 . . . 1.0 . . . . . . . . . . . . A . 5 ARG O . . . . . . . . . c30446_6cxn 1 . 12 . 1483 . 1 1 6 HIS C C 1.906 8.155 -3.730 . . . 1.0 . . . . . . . . . . . . A . 6 HIS C . . . . . . . . . c30446_6cxn 1 . 12 . 1484 . 1 1 6 HIS CA C 1.119 6.923 -4.166 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CA . . . . . . . . . c30446_6cxn 1 . 12 . 1485 . 1 1 6 HIS CB C -0.108 7.348 -4.975 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CB . . . . . . . . . c30446_6cxn 1 . 12 . 1486 . 1 1 6 HIS CD2 C -1.974 7.691 -3.206 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CD2 . . . . . . . . . c30446_6cxn 1 . 12 . 1487 . 1 1 6 HIS CE1 C -2.289 9.843 -3.485 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CE1 . . . . . . . . . c30446_6cxn 1 . 12 . 1488 . 1 1 6 HIS CG C -1.120 8.105 -4.173 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CG . . . . . . . . . c30446_6cxn 1 . 12 . 1489 . 1 1 6 HIS H H 0.308 6.580 -2.241 . . . 1.0 . . . . . . . . . . . . A . 6 HIS H . . . . . . . . . c30446_6cxn 1 . 12 . 1490 . 1 1 6 HIS HA H 1.752 6.307 -4.786 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HA . . . . . . . . . c30446_6cxn 1 . 12 . 1491 . 1 1 6 HIS HB2 H 0.211 7.985 -5.792 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HB2 . . . . . . . . . c30446_6cxn 1 . 12 . 1492 . 1 1 6 HIS HB3 H -0.591 6.464 -5.374 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HB3 . . . . . . . . . c30446_6cxn 1 . 12 . 1493 . 1 1 6 HIS HD1 H -0.877 10.048 -4.952 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HD1 . . . . . . . . . c30446_6cxn 1 . 12 . 1494 . 1 1 6 HIS HD2 H -2.074 6.683 -2.828 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HD2 . . . . . . . . . c30446_6cxn 1 . 12 . 1495 . 1 1 6 HIS HE1 H -2.671 10.847 -3.382 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HE1 . . . . . . . . . c30446_6cxn 1 . 12 . 1496 . 1 1 6 HIS HE2 H -3.440 8.778 -2.168 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HE2 . . . . . . . . . c30446_6cxn 1 . 12 . 1497 . 1 1 6 HIS N N 0.713 6.130 -3.011 . . . 1.0 . . . . . . . . . . . . A . 6 HIS N . . . . . . . . . c30446_6cxn 1 . 12 . 1498 . 1 1 6 HIS ND1 N -1.343 9.457 -4.324 . . . 1.0 . . . . . . . . . . . . A . 6 HIS ND1 . . . . . . . . . c30446_6cxn 1 . 12 . 1499 . 1 1 6 HIS NE2 N -2.688 8.790 -2.796 . . . 1.0 . . . . . . . . . . . . A . 6 HIS NE2 . . . . . . . . . c30446_6cxn 1 . 12 . 1500 . 1 1 6 HIS O O 1.717 8.600 -2.579 . . . 1.0 . . . . . . . . . . . . A . 6 HIS O . . . . . . . . . c30446_6cxn 1 . 13 . 1501 . 1 1 1 HIS C C -0.779 -6.672 2.628 . . . 1.0 . . . . . . . . . . . . A . 1 HIS C . . . . . . . . . c30446_6cxn 1 . 13 . 1502 . 1 1 1 HIS CA C -0.857 -8.079 2.044 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CA . . . . . . . . . c30446_6cxn 1 . 13 . 1503 . 1 1 1 HIS CB C -2.297 -8.405 1.643 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CB . . . . . . . . . c30446_6cxn 1 . 13 . 1504 . 1 1 1 HIS CD2 C -2.910 -6.153 0.511 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CD2 . . . . . . . . . c30446_6cxn 1 . 13 . 1505 . 1 1 1 HIS CE1 C -3.787 -6.949 -1.334 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CE1 . . . . . . . . . c30446_6cxn 1 . 13 . 1506 . 1 1 1 HIS CG C -2.840 -7.503 0.578 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CG . . . . . . . . . c30446_6cxn 1 . 13 . 1507 . 1 1 1 HIS H1 H 0.603 -8.906 3.233 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H1 . . . . . . . . . c30446_6cxn 1 . 13 . 1508 . 1 1 1 HIS H2 H -0.522 -10.033 2.593 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H2 . . . . . . . . . c30446_6cxn 1 . 13 . 1509 . 1 1 1 HIS H3 H -0.981 -8.996 3.881 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H3 . . . . . . . . . c30446_6cxn 1 . 13 . 1510 . 1 1 1 HIS HA H -0.224 -8.134 1.171 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HA . . . . . . . . . c30446_6cxn 1 . 13 . 1511 . 1 1 1 HIS HB2 H -2.340 -9.418 1.273 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HB2 . . . . . . . . . c30446_6cxn 1 . 13 . 1512 . 1 1 1 HIS HB3 H -2.934 -8.317 2.511 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HB3 . . . . . . . . . c30446_6cxn 1 . 13 . 1513 . 1 1 1 HIS HD1 H -3.495 -8.915 -0.844 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HD1 . . . . . . . . . c30446_6cxn 1 . 13 . 1514 . 1 1 1 HIS HD2 H -2.564 -5.455 1.260 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HD2 . . . . . . . . . c30446_6cxn 1 . 13 . 1515 . 1 1 1 HIS HE1 H -4.258 -7.014 -2.304 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HE1 . . . . . . . . . c30446_6cxn 1 . 13 . 1516 . 1 1 1 HIS HE2 H -3.763 -4.934 -0.971 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HE2 . . . . . . . . . c30446_6cxn 1 . 13 . 1517 . 1 1 1 HIS N N -0.398 -9.095 3.026 . . . 1.0 . . . . . . . . . . . . A . 1 HIS N . . . . . . . . . c30446_6cxn 1 . 13 . 1518 . 1 1 1 HIS ND1 N -3.398 -7.972 -0.593 . . . 1.0 . . . . . . . . . . . . A . 1 HIS ND1 . . . . . . . . . c30446_6cxn 1 . 13 . 1519 . 1 1 1 HIS NE2 N -3.502 -5.835 -0.687 . . . 1.0 . . . . . . . . . . . . A . 1 HIS NE2 . . . . . . . . . c30446_6cxn 1 . 13 . 1520 . 1 1 1 HIS O O -1.426 -6.369 3.630 . . . 1.0 . . . . . . . . . . . . A . 1 HIS O . . . . . . . . . c30446_6cxn 1 . 13 . 1521 . 1 1 2 ARG C C -0.590 -3.477 1.556 . . . 1.0 . . . . . . . . . . . . A . 2 ARG C . . . . . . . . . c30446_6cxn 1 . 13 . 1522 . 1 1 2 ARG CA C 0.180 -4.442 2.451 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CA . . . . . . . . . c30446_6cxn 1 . 13 . 1523 . 1 1 2 ARG CB C 1.661 -4.063 2.475 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CB . . . . . . . . . c30446_6cxn 1 . 13 . 1524 . 1 1 2 ARG CD C 3.817 -5.091 3.257 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CD . . . . . . . . . c30446_6cxn 1 . 13 . 1525 . 1 1 2 ARG CG C 2.420 -4.645 3.656 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CG . . . . . . . . . c30446_6cxn 1 . 13 . 1526 . 1 1 2 ARG CZ C 5.233 -4.558 5.202 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CZ . . . . . . . . . c30446_6cxn 1 . 13 . 1527 . 1 1 2 ARG H H 0.507 -6.118 1.200 . . . 1.0 . . . . . . . . . . . . A . 2 ARG H . . . . . . . . . c30446_6cxn 1 . 13 . 1528 . 1 1 2 ARG HA H -0.215 -4.377 3.454 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HA . . . . . . . . . c30446_6cxn 1 . 13 . 1529 . 1 1 2 ARG HB2 H 2.126 -4.416 1.566 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB2 . . . . . . . . . c30446_6cxn 1 . 13 . 1530 . 1 1 2 ARG HB3 H 1.745 -2.987 2.516 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB3 . . . . . . . . . c30446_6cxn 1 . 13 . 1531 . 1 1 2 ARG HD2 H 3.735 -5.951 2.609 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD2 . . . . . . . . . c30446_6cxn 1 . 13 . 1532 . 1 1 2 ARG HD3 H 4.300 -4.285 2.725 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD3 . . . . . . . . . c30446_6cxn 1 . 13 . 1533 . 1 1 2 ARG HE H 4.733 -6.401 4.622 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HE . . . . . . . . . c30446_6cxn 1 . 13 . 1534 . 1 1 2 ARG HG2 H 2.500 -3.893 4.427 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG2 . . . . . . . . . c30446_6cxn 1 . 13 . 1535 . 1 1 2 ARG HG3 H 1.874 -5.497 4.037 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG3 . . . . . . . . . c30446_6cxn 1 . 13 . 1536 . 1 1 2 ARG HH11 H 4.574 -2.943 4.178 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH11 . . . . . . . . . c30446_6cxn 1 . 13 . 1537 . 1 1 2 ARG HH12 H 5.571 -2.595 5.550 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH12 . . . . . . . . . c30446_6cxn 1 . 13 . 1538 . 1 1 2 ARG HH21 H 6.045 -5.945 6.427 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH21 . . . . . . . . . c30446_6cxn 1 . 13 . 1539 . 1 1 2 ARG HH22 H 6.407 -4.299 6.827 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH22 . . . . . . . . . c30446_6cxn 1 . 13 . 1540 . 1 1 2 ARG N N 0.017 -5.817 1.994 . . . 1.0 . . . . . . . . . . . . A . 2 ARG N . . . . . . . . . c30446_6cxn 1 . 13 . 1541 . 1 1 2 ARG NE N 4.630 -5.448 4.417 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NE . . . . . . . . . c30446_6cxn 1 . 13 . 1542 . 1 1 2 ARG NH1 N 5.116 -3.259 4.956 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH1 . . . . . . . . . c30446_6cxn 1 . 13 . 1543 . 1 1 2 ARG NH2 N 5.954 -4.968 6.237 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH2 . . . . . . . . . c30446_6cxn 1 . 13 . 1544 . 1 1 2 ARG O O -1.057 -3.851 0.480 . . . 1.0 . . . . . . . . . . . . A . 2 ARG O . . . . . . . . . c30446_6cxn 1 . 13 . 1545 . 1 1 3 PHE C C -0.543 -0.619 0.162 . . . 1.0 . . . . . . . . . . . . A . 3 PHE C . . . . . . . . . c30446_6cxn 1 . 13 . 1546 . 1 1 3 PHE CA C -1.433 -1.215 1.246 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CA . . . . . . . . . c30446_6cxn 1 . 13 . 1547 . 1 1 3 PHE CB C -1.942 -0.114 2.176 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CB . . . . . . . . . c30446_6cxn 1 . 13 . 1548 . 1 1 3 PHE CD1 C -4.315 -0.853 1.771 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CD1 . . . . . . . . . c30446_6cxn 1 . 13 . 1549 . 1 1 3 PHE CD2 C -3.900 1.457 2.196 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CD2 . . . . . . . . . c30446_6cxn 1 . 13 . 1550 . 1 1 3 PHE CE1 C -5.667 -0.591 1.652 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CE1 . . . . . . . . . c30446_6cxn 1 . 13 . 1551 . 1 1 3 PHE CE2 C -5.250 1.725 2.078 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CE2 . . . . . . . . . c30446_6cxn 1 . 13 . 1552 . 1 1 3 PHE CG C -3.415 0.167 2.043 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CG . . . . . . . . . c30446_6cxn 1 . 13 . 1553 . 1 1 3 PHE CZ C -6.135 0.700 1.806 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CZ . . . . . . . . . c30446_6cxn 1 . 13 . 1554 . 1 1 3 PHE H H -0.326 -1.996 2.872 . . . 1.0 . . . . . . . . . . . . A . 3 PHE H . . . . . . . . . c30446_6cxn 1 . 13 . 1555 . 1 1 3 PHE HA H -2.275 -1.686 0.774 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HA . . . . . . . . . c30446_6cxn 1 . 13 . 1556 . 1 1 3 PHE HB2 H -1.750 -0.401 3.203 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HB2 . . . . . . . . . c30446_6cxn 1 . 13 . 1557 . 1 1 3 PHE HB3 H -1.410 0.799 1.952 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HB3 . . . . . . . . . c30446_6cxn 1 . 13 . 1558 . 1 1 3 PHE HD1 H -3.952 -1.862 1.649 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HD1 . . . . . . . . . c30446_6cxn 1 . 13 . 1559 . 1 1 3 PHE HD2 H -3.209 2.260 2.408 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HD2 . . . . . . . . . c30446_6cxn 1 . 13 . 1560 . 1 1 3 PHE HE1 H -6.357 -1.394 1.439 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HE1 . . . . . . . . . c30446_6cxn 1 . 13 . 1561 . 1 1 3 PHE HE2 H -5.614 2.735 2.198 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HE2 . . . . . . . . . c30446_6cxn 1 . 13 . 1562 . 1 1 3 PHE HZ H -7.191 0.907 1.713 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HZ . . . . . . . . . c30446_6cxn 1 . 13 . 1563 . 1 1 3 PHE N N -0.720 -2.234 2.007 . . . 1.0 . . . . . . . . . . . . A . 3 PHE N . . . . . . . . . c30446_6cxn 1 . 13 . 1564 . 1 1 3 PHE O O 0.661 -0.872 0.122 . . . 1.0 . . . . . . . . . . . . A . 3 PHE O . . . . . . . . . c30446_6cxn 1 . 13 . 1565 . 1 1 4 LEU C C -0.241 2.293 -1.567 . . . 1.0 . . . . . . . . . . . . A . 4 LEU C . . . . . . . . . c30446_6cxn 1 . 13 . 1566 . 1 1 4 LEU CA C -0.416 0.798 -1.811 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CA . . . . . . . . . c30446_6cxn 1 . 13 . 1567 . 1 1 4 LEU CB C -1.131 0.564 -3.142 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CB . . . . . . . . . c30446_6cxn 1 . 13 . 1568 . 1 1 4 LEU CD1 C -3.288 -0.543 -2.557 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CD1 . . . . . . . . . c30446_6cxn 1 . 13 . 1569 . 1 1 4 LEU CD2 C -2.090 -1.189 -4.658 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CD2 . . . . . . . . . c30446_6cxn 1 . 13 . 1570 . 1 1 4 LEU CG C -1.935 -0.732 -3.214 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CG . . . . . . . . . c30446_6cxn 1 . 13 . 1571 . 1 1 4 LEU H H -2.110 0.328 -0.636 . . . 1.0 . . . . . . . . . . . . A . 4 LEU H . . . . . . . . . c30446_6cxn 1 . 13 . 1572 . 1 1 4 LEU HA H 0.552 0.336 -1.857 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HA . . . . . . . . . c30446_6cxn 1 . 13 . 1573 . 1 1 4 LEU HB2 H -1.802 1.392 -3.318 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HB2 . . . . . . . . . c30446_6cxn 1 . 13 . 1574 . 1 1 4 LEU HB3 H -0.391 0.547 -3.928 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HB3 . . . . . . . . . c30446_6cxn 1 . 13 . 1575 . 1 1 4 LEU HD11 H -4.069 -0.658 -3.293 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD11 . . . . . . . . . c30446_6cxn 1 . 13 . 1576 . 1 1 4 LEU HD12 H -3.339 0.446 -2.126 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD12 . . . . . . . . . c30446_6cxn 1 . 13 . 1577 . 1 1 4 LEU HD13 H -3.413 -1.280 -1.779 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD13 . . . . . . . . . c30446_6cxn 1 . 13 . 1578 . 1 1 4 LEU HD21 H -3.043 -1.682 -4.779 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD21 . . . . . . . . . c30446_6cxn 1 . 13 . 1579 . 1 1 4 LEU HD22 H -1.295 -1.878 -4.905 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD22 . . . . . . . . . c30446_6cxn 1 . 13 . 1580 . 1 1 4 LEU HD23 H -2.041 -0.333 -5.314 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD23 . . . . . . . . . c30446_6cxn 1 . 13 . 1581 . 1 1 4 LEU HG H -1.409 -1.503 -2.669 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HG . . . . . . . . . c30446_6cxn 1 . 13 . 1582 . 1 1 4 LEU N N -1.148 0.169 -0.720 . . . 1.0 . . . . . . . . . . . . A . 4 LEU N . . . . . . . . . c30446_6cxn 1 . 13 . 1583 . 1 1 4 LEU O O -1.058 2.921 -0.895 . . . 1.0 . . . . . . . . . . . . A . 4 LEU O . . . . . . . . . c30446_6cxn 1 . 13 . 1584 . 1 1 5 ARG C C 1.006 5.006 -3.296 . . . 1.0 . . . . . . . . . . . . A . 5 ARG C . . . . . . . . . c30446_6cxn 1 . 13 . 1585 . 1 1 5 ARG CA C 1.111 4.279 -1.960 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CA . . . . . . . . . c30446_6cxn 1 . 13 . 1586 . 1 1 5 ARG CB C 2.506 4.481 -1.365 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CB . . . . . . . . . c30446_6cxn 1 . 13 . 1587 . 1 1 5 ARG CD C 3.377 6.831 -1.546 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CD . . . . . . . . . c30446_6cxn 1 . 13 . 1588 . 1 1 5 ARG CG C 2.676 5.816 -0.659 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CG . . . . . . . . . c30446_6cxn 1 . 13 . 1589 . 1 1 5 ARG CZ C 5.616 6.904 -0.519 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CZ . . . . . . . . . c30446_6cxn 1 . 13 . 1590 . 1 1 5 ARG H H 1.444 2.303 -2.643 . . . 1.0 . . . . . . . . . . . . A . 5 ARG H . . . . . . . . . c30446_6cxn 1 . 13 . 1591 . 1 1 5 ARG HA H 0.378 4.689 -1.281 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HA . . . . . . . . . c30446_6cxn 1 . 13 . 1592 . 1 1 5 ARG HB2 H 2.697 3.691 -0.648 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HB2 . . . . . . . . . c30446_6cxn 1 . 13 . 1593 . 1 1 5 ARG HB3 H 3.237 4.423 -2.163 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HB3 . . . . . . . . . c30446_6cxn 1 . 13 . 1594 . 1 1 5 ARG HD2 H 3.003 6.727 -2.554 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HD2 . . . . . . . . . c30446_6cxn 1 . 13 . 1595 . 1 1 5 ARG HD3 H 3.156 7.823 -1.181 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HD3 . . . . . . . . . c30446_6cxn 1 . 13 . 1596 . 1 1 5 ARG HE H 5.231 6.298 -2.381 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HE . . . . . . . . . c30446_6cxn 1 . 13 . 1597 . 1 1 5 ARG HG2 H 1.701 6.198 -0.393 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HG2 . . . . . . . . . c30446_6cxn 1 . 13 . 1598 . 1 1 5 ARG HG3 H 3.262 5.666 0.236 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HG3 . . . . . . . . . c30446_6cxn 1 . 13 . 1599 . 1 1 5 ARG HH11 H 4.117 7.522 0.692 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH11 . . . . . . . . . c30446_6cxn 1 . 13 . 1600 . 1 1 5 ARG HH12 H 5.701 7.564 1.390 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH12 . . . . . . . . . c30446_6cxn 1 . 13 . 1601 . 1 1 5 ARG HH21 H 7.315 6.352 -1.464 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH21 . . . . . . . . . c30446_6cxn 1 . 13 . 1602 . 1 1 5 ARG HH22 H 7.517 6.900 0.167 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH22 . . . . . . . . . c30446_6cxn 1 . 13 . 1603 . 1 1 5 ARG N N 0.829 2.857 -2.118 . . . 1.0 . . . . . . . . . . . . A . 5 ARG N . . . . . . . . . c30446_6cxn 1 . 13 . 1604 . 1 1 5 ARG NE N 4.826 6.640 -1.557 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NE . . . . . . . . . c30446_6cxn 1 . 13 . 1605 . 1 1 5 ARG NH1 N 5.102 7.368 0.614 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NH1 . . . . . . . . . c30446_6cxn 1 . 13 . 1606 . 1 1 5 ARG NH2 N 6.923 6.702 -0.613 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NH2 . . . . . . . . . c30446_6cxn 1 . 13 . 1607 . 1 1 5 ARG O O 1.480 4.516 -4.320 . . . 1.0 . . . . . . . . . . . . A . 5 ARG O . . . . . . . . . c30446_6cxn 1 . 13 . 1608 . 1 1 6 HIS C C 0.122 8.460 -4.156 . . . 1.0 . . . . . . . . . . . . A . 6 HIS C . . . . . . . . . c30446_6cxn 1 . 13 . 1609 . 1 1 6 HIS CA C 0.212 6.974 -4.489 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CA . . . . . . . . . c30446_6cxn 1 . 13 . 1610 . 1 1 6 HIS CB C -1.042 6.531 -5.244 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CB . . . . . . . . . c30446_6cxn 1 . 13 . 1611 . 1 1 6 HIS CD2 C -2.549 7.321 -3.286 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CD2 . . . . . . . . . c30446_6cxn 1 . 13 . 1612 . 1 1 6 HIS CE1 C -4.418 6.361 -3.913 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CE1 . . . . . . . . . c30446_6cxn 1 . 13 . 1613 . 1 1 6 HIS CG C -2.299 6.662 -4.442 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CG . . . . . . . . . c30446_6cxn 1 . 13 . 1614 . 1 1 6 HIS H H 0.023 6.517 -2.431 . . . 1.0 . . . . . . . . . . . . A . 6 HIS H . . . . . . . . . c30446_6cxn 1 . 13 . 1615 . 1 1 6 HIS HA H 1.076 6.810 -5.115 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HA . . . . . . . . . c30446_6cxn 1 . 13 . 1616 . 1 1 6 HIS HB2 H -1.151 7.139 -6.134 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HB2 . . . . . . . . . c30446_6cxn 1 . 13 . 1617 . 1 1 6 HIS HB3 H -0.934 5.491 -5.529 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HB3 . . . . . . . . . c30446_6cxn 1 . 13 . 1618 . 1 1 6 HIS HD1 H -3.635 5.521 -5.606 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HD1 . . . . . . . . . c30446_6cxn 1 . 13 . 1619 . 1 1 6 HIS HD2 H -1.838 7.899 -2.711 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HD2 . . . . . . . . . c30446_6cxn 1 . 13 . 1620 . 1 1 6 HIS HE1 H -5.446 6.034 -3.939 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HE1 . . . . . . . . . c30446_6cxn 1 . 13 . 1621 . 1 1 6 HIS HE2 H -4.314 7.402 -2.152 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HE2 . . . . . . . . . c30446_6cxn 1 . 13 . 1622 . 1 1 6 HIS N N 0.380 6.179 -3.278 . . . 1.0 . . . . . . . . . . . . A . 6 HIS N . . . . . . . . . c30446_6cxn 1 . 13 . 1623 . 1 1 6 HIS ND1 N -3.491 6.071 -4.808 . . . 1.0 . . . . . . . . . . . . A . 6 HIS ND1 . . . . . . . . . c30446_6cxn 1 . 13 . 1624 . 1 1 6 HIS NE2 N -3.872 7.118 -2.979 . . . 1.0 . . . . . . . . . . . . A . 6 HIS NE2 . . . . . . . . . c30446_6cxn 1 . 13 . 1625 . 1 1 6 HIS O O 0.205 8.803 -2.958 . . . 1.0 . . . . . . . . . . . . A . 6 HIS O . . . . . . . . . c30446_6cxn 1 . 14 . 1626 . 1 1 1 HIS C C 0.124 -6.381 2.651 . . . 1.0 . . . . . . . . . . . . A . 1 HIS C . . . . . . . . . c30446_6cxn 1 . 14 . 1627 . 1 1 1 HIS CA C -0.062 -7.863 2.340 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CA . . . . . . . . . c30446_6cxn 1 . 14 . 1628 . 1 1 1 HIS CB C -1.487 -8.123 1.848 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CB . . . . . . . . . c30446_6cxn 1 . 14 . 1629 . 1 1 1 HIS CD2 C -3.263 -8.710 3.645 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CD2 . . . . . . . . . c30446_6cxn 1 . 14 . 1630 . 1 1 1 HIS CE1 C -3.875 -6.671 4.168 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CE1 . . . . . . . . . c30446_6cxn 1 . 14 . 1631 . 1 1 1 HIS CG C -2.536 -7.859 2.883 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CG . . . . . . . . . c30446_6cxn 1 . 14 . 1632 . 1 1 1 HIS H1 H 1.192 -8.625 3.782 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H1 . . . . . . . . . c30446_6cxn 1 . 14 . 1633 . 1 1 1 HIS H2 H -0.078 -9.678 3.309 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H2 . . . . . . . . . c30446_6cxn 1 . 14 . 1634 . 1 1 1 HIS H3 H -0.410 -8.327 4.314 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H3 . . . . . . . . . c30446_6cxn 1 . 14 . 1635 . 1 1 1 HIS HA H 0.639 -8.153 1.572 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HA . . . . . . . . . c30446_6cxn 1 . 14 . 1636 . 1 1 1 HIS HB2 H -1.689 -7.486 1.000 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HB2 . . . . . . . . . c30446_6cxn 1 . 14 . 1637 . 1 1 1 HIS HB3 H -1.571 -9.157 1.544 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HB3 . . . . . . . . . c30446_6cxn 1 . 14 . 1638 . 1 1 1 HIS HD1 H -2.601 -5.753 2.856 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HD1 . . . . . . . . . c30446_6cxn 1 . 14 . 1639 . 1 1 1 HIS HD2 H -3.206 -9.789 3.634 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HD2 . . . . . . . . . c30446_6cxn 1 . 14 . 1640 . 1 1 1 HIS HE1 H -4.378 -5.836 4.633 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HE1 . . . . . . . . . c30446_6cxn 1 . 14 . 1641 . 1 1 1 HIS HE2 H -4.790 -8.291 5.024 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HE2 . . . . . . . . . c30446_6cxn 1 . 14 . 1642 . 1 1 1 HIS N N 0.182 -8.698 3.545 . . . 1.0 . . . . . . . . . . . . A . 1 HIS N . . . . . . . . . c30446_6cxn 1 . 14 . 1643 . 1 1 1 HIS ND1 N -2.944 -6.589 3.234 . . . 1.0 . . . . . . . . . . . . A . 1 HIS ND1 . . . . . . . . . c30446_6cxn 1 . 14 . 1644 . 1 1 1 HIS NE2 N -4.087 -7.946 4.434 . . . 1.0 . . . . . . . . . . . . A . 1 HIS NE2 . . . . . . . . . c30446_6cxn 1 . 14 . 1645 . 1 1 1 HIS O O -0.011 -5.955 3.798 . . . 1.0 . . . . . . . . . . . . A . 1 HIS O . . . . . . . . . c30446_6cxn 1 . 14 . 1646 . 1 1 2 ARG C C -0.555 -3.383 1.248 . . . 1.0 . . . . . . . . . . . . A . 2 ARG C . . . . . . . . . c30446_6cxn 1 . 14 . 1647 . 1 1 2 ARG CA C 0.639 -4.166 1.785 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CA . . . . . . . . . c30446_6cxn 1 . 14 . 1648 . 1 1 2 ARG CB C 1.920 -3.727 1.071 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CB . . . . . . . . . c30446_6cxn 1 . 14 . 1649 . 1 1 2 ARG CD C 3.769 -2.025 1.132 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CD . . . . . . . . . c30446_6cxn 1 . 14 . 1650 . 1 1 2 ARG CG C 2.864 -2.927 1.955 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CG . . . . . . . . . c30446_6cxn 1 . 14 . 1651 . 1 1 2 ARG CZ C 4.914 0.135 1.441 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CZ . . . . . . . . . c30446_6cxn 1 . 14 . 1652 . 1 1 2 ARG H H 0.529 -5.998 0.730 . . . 1.0 . . . . . . . . . . . . A . 2 ARG H . . . . . . . . . c30446_6cxn 1 . 14 . 1653 . 1 1 2 ARG HA H 0.739 -3.965 2.841 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HA . . . . . . . . . c30446_6cxn 1 . 14 . 1654 . 1 1 2 ARG HB2 H 2.445 -4.606 0.725 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB2 . . . . . . . . . c30446_6cxn 1 . 14 . 1655 . 1 1 2 ARG HB3 H 1.656 -3.118 0.219 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB3 . . . . . . . . . c30446_6cxn 1 . 14 . 1656 . 1 1 2 ARG HD2 H 4.740 -2.490 1.048 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD2 . . . . . . . . . c30446_6cxn 1 . 14 . 1657 . 1 1 2 ARG HD3 H 3.341 -1.908 0.147 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD3 . . . . . . . . . c30446_6cxn 1 . 14 . 1658 . 1 1 2 ARG HE H 3.264 -0.434 2.408 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HE . . . . . . . . . c30446_6cxn 1 . 14 . 1659 . 1 1 2 ARG HG2 H 2.281 -2.317 2.628 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG2 . . . . . . . . . c30446_6cxn 1 . 14 . 1660 . 1 1 2 ARG HG3 H 3.475 -3.612 2.525 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG3 . . . . . . . . . c30446_6cxn 1 . 14 . 1661 . 1 1 2 ARG HH11 H 5.785 -1.088 0.085 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH11 . . . . . . . . . c30446_6cxn 1 . 14 . 1662 . 1 1 2 ARG HH12 H 6.570 0.438 0.321 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH12 . . . . . . . . . c30446_6cxn 1 . 14 . 1663 . 1 1 2 ARG HH21 H 4.295 1.573 2.719 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH21 . . . . . . . . . c30446_6cxn 1 . 14 . 1664 . 1 1 2 ARG HH22 H 5.725 1.948 1.817 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH22 . . . . . . . . . c30446_6cxn 1 . 14 . 1665 . 1 1 2 ARG N N 0.435 -5.600 1.621 . . . 1.0 . . . . . . . . . . . . A . 2 ARG N . . . . . . . . . c30446_6cxn 1 . 14 . 1666 . 1 1 2 ARG NE N 3.928 -0.706 1.740 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NE . . . . . . . . . c30446_6cxn 1 . 14 . 1667 . 1 1 2 ARG NH1 N 5.832 -0.199 0.542 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH1 . . . . . . . . . c30446_6cxn 1 . 14 . 1668 . 1 1 2 ARG NH2 N 4.984 1.315 2.042 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH2 . . . . . . . . . c30446_6cxn 1 . 14 . 1669 . 1 1 2 ARG O O -1.437 -3.944 0.599 . . . 1.0 . . . . . . . . . . . . A . 2 ARG O . . . . . . . . . c30446_6cxn 1 . 14 . 1670 . 1 1 3 PHE C C -1.272 -0.465 -0.192 . . . 1.0 . . . . . . . . . . . . A . 3 PHE C . . . . . . . . . c30446_6cxn 1 . 14 . 1671 . 1 1 3 PHE CA C -1.662 -1.224 1.071 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CA . . . . . . . . . c30446_6cxn 1 . 14 . 1672 . 1 1 3 PHE CB C -2.062 -0.243 2.171 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CB . . . . . . . . . c30446_6cxn 1 . 14 . 1673 . 1 1 3 PHE CD1 C -4.343 -1.305 2.309 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CD1 . . . . . . . . . c30446_6cxn 1 . 14 . 1674 . 1 1 3 PHE CD2 C -4.143 1.027 2.771 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CD2 . . . . . . . . . c30446_6cxn 1 . 14 . 1675 . 1 1 3 PHE CE1 C -5.704 -1.237 2.541 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CE1 . . . . . . . . . c30446_6cxn 1 . 14 . 1676 . 1 1 3 PHE CE2 C -5.503 1.100 3.004 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CE2 . . . . . . . . . c30446_6cxn 1 . 14 . 1677 . 1 1 3 PHE CG C -3.546 -0.174 2.421 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CG . . . . . . . . . c30446_6cxn 1 . 14 . 1678 . 1 1 3 PHE CZ C -6.284 -0.033 2.889 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CZ . . . . . . . . . c30446_6cxn 1 . 14 . 1679 . 1 1 3 PHE H H 0.156 -1.693 2.047 . . . 1.0 . . . . . . . . . . . . A . 3 PHE H . . . . . . . . . c30446_6cxn 1 . 14 . 1680 . 1 1 3 PHE HA H -2.503 -1.849 0.843 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HA . . . . . . . . . c30446_6cxn 1 . 14 . 1681 . 1 1 3 PHE HB2 H -1.583 -0.536 3.098 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HB2 . . . . . . . . . c30446_6cxn 1 . 14 . 1682 . 1 1 3 PHE HB3 H -1.729 0.743 1.889 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HB3 . . . . . . . . . c30446_6cxn 1 . 14 . 1683 . 1 1 3 PHE HD1 H -3.892 -2.247 2.036 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HD1 . . . . . . . . . c30446_6cxn 1 . 14 . 1684 . 1 1 3 PHE HD2 H -3.533 1.914 2.862 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HD2 . . . . . . . . . c30446_6cxn 1 . 14 . 1685 . 1 1 3 PHE HE1 H -6.313 -2.124 2.450 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HE1 . . . . . . . . . c30446_6cxn 1 . 14 . 1686 . 1 1 3 PHE HE2 H -5.954 2.043 3.276 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HE2 . . . . . . . . . c30446_6cxn 1 . 14 . 1687 . 1 1 3 PHE HZ H -7.347 0.023 3.071 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HZ . . . . . . . . . c30446_6cxn 1 . 14 . 1688 . 1 1 3 PHE N N -0.576 -2.083 1.525 . . . 1.0 . . . . . . . . . . . . A . 3 PHE N . . . . . . . . . c30446_6cxn 1 . 14 . 1689 . 1 1 3 PHE O O -0.112 -0.478 -0.605 . . . 1.0 . . . . . . . . . . . . A . 3 PHE O . . . . . . . . . c30446_6cxn 1 . 14 . 1690 . 1 1 4 LEU C C -1.741 2.415 -1.716 . . . 1.0 . . . . . . . . . . . . A . 4 LEU C . . . . . . . . . c30446_6cxn 1 . 14 . 1691 . 1 1 4 LEU CA C -2.020 0.948 -2.025 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CA . . . . . . . . . c30446_6cxn 1 . 14 . 1692 . 1 1 4 LEU CB C -3.221 0.829 -2.963 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CB . . . . . . . . . c30446_6cxn 1 . 14 . 1693 . 1 1 4 LEU CD1 C -4.879 -0.677 -1.858 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CD1 . . . . . . . . . c30446_6cxn 1 . 14 . 1694 . 1 1 4 LEU CD2 C -4.539 -0.805 -4.334 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CD2 . . . . . . . . . c30446_6cxn 1 . 14 . 1695 . 1 1 4 LEU CG C -3.875 -0.551 -2.988 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CG . . . . . . . . . c30446_6cxn 1 . 14 . 1696 . 1 1 4 LEU H H -3.155 0.156 -0.426 . . . 1.0 . . . . . . . . . . . . A . 4 LEU H . . . . . . . . . c30446_6cxn 1 . 14 . 1697 . 1 1 4 LEU HA H -1.161 0.523 -2.510 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HA . . . . . . . . . c30446_6cxn 1 . 14 . 1698 . 1 1 4 LEU HB2 H -3.963 1.554 -2.659 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HB2 . . . . . . . . . c30446_6cxn 1 . 14 . 1699 . 1 1 4 LEU HB3 H -2.896 1.068 -3.964 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HB3 . . . . . . . . . c30446_6cxn 1 . 14 . 1700 . 1 1 4 LEU HD11 H -4.913 0.250 -1.306 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD11 . . . . . . . . . c30446_6cxn 1 . 14 . 1701 . 1 1 4 LEU HD12 H -4.574 -1.475 -1.199 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD12 . . . . . . . . . c30446_6cxn 1 . 14 . 1702 . 1 1 4 LEU HD13 H -5.856 -0.894 -2.261 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD13 . . . . . . . . . c30446_6cxn 1 . 14 . 1703 . 1 1 4 LEU HD21 H -4.654 -1.869 -4.483 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD21 . . . . . . . . . c30446_6cxn 1 . 14 . 1704 . 1 1 4 LEU HD22 H -3.923 -0.396 -5.122 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD22 . . . . . . . . . c30446_6cxn 1 . 14 . 1705 . 1 1 4 LEU HD23 H -5.509 -0.332 -4.353 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD23 . . . . . . . . . c30446_6cxn 1 . 14 . 1706 . 1 1 4 LEU HG H -3.115 -1.304 -2.838 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HG . . . . . . . . . c30446_6cxn 1 . 14 . 1707 . 1 1 4 LEU N N -2.253 0.189 -0.804 . . . 1.0 . . . . . . . . . . . . A . 4 LEU N . . . . . . . . . c30446_6cxn 1 . 14 . 1708 . 1 1 4 LEU O O -2.633 3.153 -1.297 . . . 1.0 . . . . . . . . . . . . A . 4 LEU O . . . . . . . . . c30446_6cxn 1 . 14 . 1709 . 1 1 5 ARG C C 1.062 4.618 -2.572 . . . 1.0 . . . . . . . . . . . . A . 5 ARG C . . . . . . . . . c30446_6cxn 1 . 14 . 1710 . 1 1 5 ARG CA C -0.098 4.211 -1.669 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CA . . . . . . . . . c30446_6cxn 1 . 14 . 1711 . 1 1 5 ARG CB C 0.296 4.386 -0.202 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CB . . . . . . . . . c30446_6cxn 1 . 14 . 1712 . 1 1 5 ARG CD C 1.386 6.592 0.311 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CD . . . . . . . . . c30446_6cxn 1 . 14 . 1713 . 1 1 5 ARG CG C 0.089 5.800 0.317 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CG . . . . . . . . . c30446_6cxn 1 . 14 . 1714 . 1 1 5 ARG CZ C 1.996 6.824 2.687 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CZ . . . . . . . . . c30446_6cxn 1 . 14 . 1715 . 1 1 5 ARG H H 0.171 2.196 -2.260 . . . 1.0 . . . . . . . . . . . . A . 5 ARG H . . . . . . . . . c30446_6cxn 1 . 14 . 1716 . 1 1 5 ARG HA H -0.945 4.845 -1.883 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HA . . . . . . . . . c30446_6cxn 1 . 14 . 1717 . 1 1 5 ARG HB2 H -0.301 3.713 0.403 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HB2 . . . . . . . . . c30446_6cxn 1 . 14 . 1718 . 1 1 5 ARG HB3 H 1.344 4.134 -0.090 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HB3 . . . . . . . . . c30446_6cxn 1 . 14 . 1719 . 1 1 5 ARG HD2 H 1.942 6.341 -0.580 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HD2 . . . . . . . . . c30446_6cxn 1 . 14 . 1720 . 1 1 5 ARG HD3 H 1.149 7.646 0.301 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HD3 . . . . . . . . . c30446_6cxn 1 . 14 . 1721 . 1 1 5 ARG HE H 2.964 5.687 1.363 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HE . . . . . . . . . c30446_6cxn 1 . 14 . 1722 . 1 1 5 ARG HG2 H -0.631 6.302 -0.312 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HG2 . . . . . . . . . c30446_6cxn 1 . 14 . 1723 . 1 1 5 ARG HG3 H -0.288 5.750 1.328 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HG3 . . . . . . . . . c30446_6cxn 1 . 14 . 1724 . 1 1 5 ARG HH11 H 0.382 7.906 2.127 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH11 . . . . . . . . . c30446_6cxn 1 . 14 . 1725 . 1 1 5 ARG HH12 H 0.831 8.050 3.793 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH12 . . . . . . . . . c30446_6cxn 1 . 14 . 1726 . 1 1 5 ARG HH21 H 3.556 5.875 3.554 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH21 . . . . . . . . . c30446_6cxn 1 . 14 . 1727 . 1 1 5 ARG HH22 H 2.633 6.898 4.604 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH22 . . . . . . . . . c30446_6cxn 1 . 14 . 1728 . 1 1 5 ARG N N -0.496 2.831 -1.925 . . . 1.0 . . . . . . . . . . . . A . 5 ARG N . . . . . . . . . c30446_6cxn 1 . 14 . 1729 . 1 1 5 ARG NE N 2.211 6.302 1.481 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NE . . . . . . . . . c30446_6cxn 1 . 14 . 1730 . 1 1 5 ARG NH1 N 0.987 7.662 2.885 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NH1 . . . . . . . . . c30446_6cxn 1 . 14 . 1731 . 1 1 5 ARG NH2 N 2.794 6.506 3.698 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NH2 . . . . . . . . . c30446_6cxn 1 . 14 . 1732 . 1 1 5 ARG O O 2.010 3.857 -2.762 . . . 1.0 . . . . . . . . . . . . A . 5 ARG O . . . . . . . . . c30446_6cxn 1 . 14 . 1733 . 1 1 6 HIS C C 2.021 7.857 -4.030 . . . 1.0 . . . . . . . . . . . . A . 6 HIS C . . . . . . . . . c30446_6cxn 1 . 14 . 1734 . 1 1 6 HIS CA C 2.023 6.332 -4.007 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CA . . . . . . . . . c30446_6cxn 1 . 14 . 1735 . 1 1 6 HIS CB C 1.831 5.789 -5.424 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CB . . . . . . . . . c30446_6cxn 1 . 14 . 1736 . 1 1 6 HIS CD2 C -0.727 5.796 -5.852 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CD2 . . . . . . . . . c30446_6cxn 1 . 14 . 1737 . 1 1 6 HIS CE1 C -0.790 7.349 -7.398 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CE1 . . . . . . . . . c30446_6cxn 1 . 14 . 1738 . 1 1 6 HIS CG C 0.544 6.216 -6.058 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CG . . . . . . . . . c30446_6cxn 1 . 14 . 1739 . 1 1 6 HIS H H 0.199 6.385 -2.935 . . . 1.0 . . . . . . . . . . . . A . 6 HIS H . . . . . . . . . c30446_6cxn 1 . 14 . 1740 . 1 1 6 HIS HA H 2.974 5.991 -3.627 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HA . . . . . . . . . c30446_6cxn 1 . 14 . 1741 . 1 1 6 HIS HB2 H 2.642 6.141 -6.051 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HB2 . . . . . . . . . c30446_6cxn 1 . 14 . 1742 . 1 1 6 HIS HB3 H 1.844 4.705 -5.392 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HB3 . . . . . . . . . c30446_6cxn 1 . 14 . 1743 . 1 1 6 HIS HD1 H 1.228 7.688 -7.402 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HD1 . . . . . . . . . c30446_6cxn 1 . 14 . 1744 . 1 1 6 HIS HD2 H -1.046 5.036 -5.153 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HD2 . . . . . . . . . c30446_6cxn 1 . 14 . 1745 . 1 1 6 HIS HE1 H -1.148 8.043 -8.144 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HE1 . . . . . . . . . c30446_6cxn 1 . 14 . 1746 . 1 1 6 HIS HE2 H -2.495 6.368 -6.830 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HE2 . . . . . . . . . c30446_6cxn 1 . 14 . 1747 . 1 1 6 HIS N N 0.980 5.824 -3.125 . . . 1.0 . . . . . . . . . . . . A . 6 HIS N . . . . . . . . . c30446_6cxn 1 . 14 . 1748 . 1 1 6 HIS ND1 N 0.470 7.189 -7.033 . . . 1.0 . . . . . . . . . . . . A . 6 HIS ND1 . . . . . . . . . c30446_6cxn 1 . 14 . 1749 . 1 1 6 HIS NE2 N -1.536 6.516 -6.697 . . . 1.0 . . . . . . . . . . . . A . 6 HIS NE2 . . . . . . . . . c30446_6cxn 1 . 14 . 1750 . 1 1 6 HIS O O 2.821 8.438 -4.794 . . . 1.0 . . . . . . . . . . . . A . 6 HIS O . . . . . . . . . c30446_6cxn 1 . 15 . 1751 . 1 1 1 HIS C C 0.212 -6.566 2.865 . . . 1.0 . . . . . . . . . . . . A . 1 HIS C . . . . . . . . . c30446_6cxn 1 . 15 . 1752 . 1 1 1 HIS CA C -0.117 -8.004 2.478 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CA . . . . . . . . . c30446_6cxn 1 . 15 . 1753 . 1 1 1 HIS CB C -0.983 -8.657 3.557 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CB . . . . . . . . . c30446_6cxn 1 . 15 . 1754 . 1 1 1 HIS CD2 C -1.519 -10.666 2.006 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CD2 . . . . . . . . . c30446_6cxn 1 . 15 . 1755 . 1 1 1 HIS CE1 C -3.276 -11.432 3.071 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CE1 . . . . . . . . . c30446_6cxn 1 . 15 . 1756 . 1 1 1 HIS CG C -1.728 -9.864 3.077 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CG . . . . . . . . . c30446_6cxn 1 . 15 . 1757 . 1 1 1 HIS H1 H 0.846 -9.815 2.303 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H1 . . . . . . . . . c30446_6cxn 1 . 15 . 1758 . 1 1 1 HIS H2 H 1.747 -8.600 3.115 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H2 . . . . . . . . . c30446_6cxn 1 . 15 . 1759 . 1 1 1 HIS H3 H 1.559 -8.538 1.410 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H3 . . . . . . . . . c30446_6cxn 1 . 15 . 1760 . 1 1 1 HIS HA H -0.655 -8.003 1.542 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HA . . . . . . . . . c30446_6cxn 1 . 15 . 1761 . 1 1 1 HIS HB2 H -0.353 -8.961 4.379 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HB2 . . . . . . . . . c30446_6cxn 1 . 15 . 1762 . 1 1 1 HIS HB3 H -1.707 -7.937 3.911 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HB3 . . . . . . . . . c30446_6cxn 1 . 15 . 1763 . 1 1 1 HIS HD1 H -3.240 -10.006 4.538 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HD1 . . . . . . . . . c30446_6cxn 1 . 15 . 1764 . 1 1 1 HIS HD2 H -0.732 -10.565 1.273 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HD2 . . . . . . . . . c30446_6cxn 1 . 15 . 1765 . 1 1 1 HIS HE1 H -4.130 -12.034 3.347 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HE1 . . . . . . . . . c30446_6cxn 1 . 15 . 1766 . 1 1 1 HIS HE2 H -2.545 -12.403 1.423 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HE2 . . . . . . . . . c30446_6cxn 1 . 15 . 1767 . 1 1 1 HIS N N 1.120 -8.812 2.312 . . . 1.0 . . . . . . . . . . . . A . 1 HIS N . . . . . . . . . c30446_6cxn 1 . 15 . 1768 . 1 1 1 HIS ND1 N -2.836 -10.370 3.723 . . . 1.0 . . . . . . . . . . . . A . 1 HIS ND1 . . . . . . . . . c30446_6cxn 1 . 15 . 1769 . 1 1 1 HIS NE2 N -2.495 -11.632 2.026 . . . 1.0 . . . . . . . . . . . . A . 1 HIS NE2 . . . . . . . . . c30446_6cxn 1 . 15 . 1770 . 1 1 1 HIS O O 0.779 -6.313 3.928 . . . 1.0 . . . . . . . . . . . . A . 1 HIS O . . . . . . . . . c30446_6cxn 1 . 15 . 1771 . 1 1 2 ARG C C -0.942 -3.342 1.565 . . . 1.0 . . . . . . . . . . . . A . 2 ARG C . . . . . . . . . c30446_6cxn 1 . 15 . 1772 . 1 1 2 ARG CA C 0.108 -4.215 2.246 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CA . . . . . . . . . c30446_6cxn 1 . 15 . 1773 . 1 1 2 ARG CB C 1.504 -3.833 1.751 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CB . . . . . . . . . c30446_6cxn 1 . 15 . 1774 . 1 1 2 ARG CD C 3.333 -3.422 3.428 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CD . . . . . . . . . c30446_6cxn 1 . 15 . 1775 . 1 1 2 ARG CG C 2.199 -2.802 2.627 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CG . . . . . . . . . c30446_6cxn 1 . 15 . 1776 . 1 1 2 ARG CZ C 3.715 -1.772 5.217 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CZ . . . . . . . . . c30446_6cxn 1 . 15 . 1777 . 1 1 2 ARG H H -0.597 -5.892 1.165 . . . 1.0 . . . . . . . . . . . . A . 2 ARG H . . . . . . . . . c30446_6cxn 1 . 15 . 1778 . 1 1 2 ARG HA H 0.057 -4.052 3.312 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HA . . . . . . . . . c30446_6cxn 1 . 15 . 1779 . 1 1 2 ARG HB2 H 2.118 -4.721 1.719 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB2 . . . . . . . . . c30446_6cxn 1 . 15 . 1780 . 1 1 2 ARG HB3 H 1.421 -3.428 0.753 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB3 . . . . . . . . . c30446_6cxn 1 . 15 . 1781 . 1 1 2 ARG HD2 H 2.914 -4.102 4.154 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD2 . . . . . . . . . c30446_6cxn 1 . 15 . 1782 . 1 1 2 ARG HD3 H 3.976 -3.969 2.753 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD3 . . . . . . . . . c30446_6cxn 1 . 15 . 1783 . 1 1 2 ARG HE H 5.012 -2.202 3.762 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HE . . . . . . . . . c30446_6cxn 1 . 15 . 1784 . 1 1 2 ARG HG2 H 2.602 -2.022 1.998 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG2 . . . . . . . . . c30446_6cxn 1 . 15 . 1785 . 1 1 2 ARG HG3 H 1.477 -2.379 3.310 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG3 . . . . . . . . . c30446_6cxn 1 . 15 . 1786 . 1 1 2 ARG HH11 H 1.926 -2.711 5.311 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH11 . . . . . . . . . c30446_6cxn 1 . 15 . 1787 . 1 1 2 ARG HH12 H 2.219 -1.545 6.558 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH12 . . . . . . . . . c30446_6cxn 1 . 15 . 1788 . 1 1 2 ARG HH21 H 5.399 -0.670 5.402 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH21 . . . . . . . . . c30446_6cxn 1 . 15 . 1789 . 1 1 2 ARG HH22 H 4.190 -0.386 6.609 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH22 . . . . . . . . . c30446_6cxn 1 . 15 . 1790 . 1 1 2 ARG N N -0.148 -5.628 1.995 . . . 1.0 . . . . . . . . . . . . A . 2 ARG N . . . . . . . . . c30446_6cxn 1 . 15 . 1791 . 1 1 2 ARG NE N 4.126 -2.413 4.126 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NE . . . . . . . . . c30446_6cxn 1 . 15 . 1792 . 1 1 2 ARG NH1 N 2.522 -2.031 5.738 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH1 . . . . . . . . . c30446_6cxn 1 . 15 . 1793 . 1 1 2 ARG NH2 N 4.499 -0.869 5.790 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH2 . . . . . . . . . c30446_6cxn 1 . 15 . 1794 . 1 1 2 ARG O O -1.790 -3.839 0.824 . . . 1.0 . . . . . . . . . . . . A . 2 ARG O . . . . . . . . . c30446_6cxn 1 . 15 . 1795 . 1 1 3 PHE C C -1.260 -0.483 -0.042 . . . 1.0 . . . . . . . . . . . . A . 3 PHE C . . . . . . . . . c30446_6cxn 1 . 15 . 1796 . 1 1 3 PHE CA C -1.823 -1.098 1.233 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CA . . . . . . . . . c30446_6cxn 1 . 15 . 1797 . 1 1 3 PHE CB C -2.176 -0.001 2.235 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CB . . . . . . . . . c30446_6cxn 1 . 15 . 1798 . 1 1 3 PHE CD1 C -4.561 -0.807 2.316 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CD1 . . . . . . . . . c30446_6cxn 1 . 15 . 1799 . 1 1 3 PHE CD2 C -4.137 1.525 2.586 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CD2 . . . . . . . . . c30446_6cxn 1 . 15 . 1800 . 1 1 3 PHE CE1 C -5.917 -0.579 2.452 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CE1 . . . . . . . . . c30446_6cxn 1 . 15 . 1801 . 1 1 3 PHE CE2 C -5.493 1.758 2.723 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CE2 . . . . . . . . . c30446_6cxn 1 . 15 . 1802 . 1 1 3 PHE CG C -3.655 0.242 2.381 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CG . . . . . . . . . c30446_6cxn 1 . 15 . 1803 . 1 1 3 PHE CZ C -6.384 0.705 2.656 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CZ . . . . . . . . . c30446_6cxn 1 . 15 . 1804 . 1 1 3 PHE H H -0.179 -1.704 2.420 . . . 1.0 . . . . . . . . . . . . A . 3 PHE H . . . . . . . . . c30446_6cxn 1 . 15 . 1805 . 1 1 3 PHE HA H -2.715 -1.639 0.984 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HA . . . . . . . . . c30446_6cxn 1 . 15 . 1806 . 1 1 3 PHE HB2 H -1.787 -0.272 3.209 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HB2 . . . . . . . . . c30446_6cxn 1 . 15 . 1807 . 1 1 3 PHE HB3 H -1.720 0.921 1.909 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HB3 . . . . . . . . . c30446_6cxn 1 . 15 . 1808 . 1 1 3 PHE HD1 H -4.199 -1.811 2.155 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HD1 . . . . . . . . . c30446_6cxn 1 . 15 . 1809 . 1 1 3 PHE HD2 H -3.442 2.350 2.639 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HD2 . . . . . . . . . c30446_6cxn 1 . 15 . 1810 . 1 1 3 PHE HE1 H -6.612 -1.404 2.399 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HE1 . . . . . . . . . c30446_6cxn 1 . 15 . 1811 . 1 1 3 PHE HE2 H -5.855 2.763 2.882 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HE2 . . . . . . . . . c30446_6cxn 1 . 15 . 1812 . 1 1 3 PHE HZ H -7.443 0.885 2.762 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HZ . . . . . . . . . c30446_6cxn 1 . 15 . 1813 . 1 1 3 PHE N N -0.878 -2.040 1.822 . . . 1.0 . . . . . . . . . . . . A . 3 PHE N . . . . . . . . . c30446_6cxn 1 . 15 . 1814 . 1 1 3 PHE O O -0.084 -0.656 -0.362 . . . 1.0 . . . . . . . . . . . . A . 3 PHE O . . . . . . . . . c30446_6cxn 1 . 15 . 1815 . 1 1 4 LEU C C -1.449 2.359 -1.811 . . . 1.0 . . . . . . . . . . . . A . 4 LEU C . . . . . . . . . c30446_6cxn 1 . 15 . 1816 . 1 1 4 LEU CA C -1.704 0.870 -2.015 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CA . . . . . . . . . c30446_6cxn 1 . 15 . 1817 . 1 1 4 LEU CB C -2.765 0.662 -3.096 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CB . . . . . . . . . c30446_6cxn 1 . 15 . 1818 . 1 1 4 LEU CD1 C -4.644 -0.562 -1.999 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CD1 . . . . . . . . . c30446_6cxn 1 . 15 . 1819 . 1 1 4 LEU CD2 C -4.044 -1.075 -4.374 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CD2 . . . . . . . . . c30446_6cxn 1 . 15 . 1820 . 1 1 4 LEU CG C -3.516 -0.665 -3.007 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CG . . . . . . . . . c30446_6cxn 1 . 15 . 1821 . 1 1 4 LEU H H -3.034 0.329 -0.463 . . . 1.0 . . . . . . . . . . . . A . 4 LEU H . . . . . . . . . c30446_6cxn 1 . 15 . 1822 . 1 1 4 LEU HA H -0.792 0.400 -2.333 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HA . . . . . . . . . c30446_6cxn 1 . 15 . 1823 . 1 1 4 LEU HB2 H -3.483 1.466 -3.026 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HB2 . . . . . . . . . c30446_6cxn 1 . 15 . 1824 . 1 1 4 LEU HB3 H -2.283 0.714 -4.060 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HB3 . . . . . . . . . c30446_6cxn 1 . 15 . 1825 . 1 1 4 LEU HD11 H -4.494 -1.293 -1.220 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD11 . . . . . . . . . c30446_6cxn 1 . 15 . 1826 . 1 1 4 LEU HD12 H -5.588 -0.744 -2.490 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD12 . . . . . . . . . c30446_6cxn 1 . 15 . 1827 . 1 1 4 LEU HD13 H -4.645 0.428 -1.567 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD13 . . . . . . . . . c30446_6cxn 1 . 15 . 1828 . 1 1 4 LEU HD21 H -4.950 -1.650 -4.252 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD21 . . . . . . . . . c30446_6cxn 1 . 15 . 1829 . 1 1 4 LEU HD22 H -3.302 -1.675 -4.882 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD22 . . . . . . . . . c30446_6cxn 1 . 15 . 1830 . 1 1 4 LEU HD23 H -4.254 -0.192 -4.959 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD23 . . . . . . . . . c30446_6cxn 1 . 15 . 1831 . 1 1 4 LEU HG H -2.836 -1.431 -2.663 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HG . . . . . . . . . c30446_6cxn 1 . 15 . 1832 . 1 1 4 LEU N N -2.111 0.232 -0.770 . . . 1.0 . . . . . . . . . . . . A . 4 LEU N . . . . . . . . . c30446_6cxn 1 . 15 . 1833 . 1 1 4 LEU O O -2.374 3.127 -1.546 . . . 1.0 . . . . . . . . . . . . A . 4 LEU O . . . . . . . . . c30446_6cxn 1 . 15 . 1834 . 1 1 5 ARG C C 0.991 4.657 -2.965 . . . 1.0 . . . . . . . . . . . . A . 5 ARG C . . . . . . . . . c30446_6cxn 1 . 15 . 1835 . 1 1 5 ARG CA C 0.188 4.160 -1.767 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CA . . . . . . . . . c30446_6cxn 1 . 15 . 1836 . 1 1 5 ARG CB C 1.002 4.338 -0.484 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CB . . . . . . . . . c30446_6cxn 1 . 15 . 1837 . 1 1 5 ARG CD C 1.845 6.683 -0.156 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CD . . . . . . . . . c30446_6cxn 1 . 15 . 1838 . 1 1 5 ARG CG C 0.766 5.674 0.201 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CG . . . . . . . . . c30446_6cxn 1 . 15 . 1839 . 1 1 5 ARG CZ C 0.945 8.856 0.577 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CZ . . . . . . . . . c30446_6cxn 1 . 15 . 1840 . 1 1 5 ARG H H 0.504 2.102 -2.150 . . . 1.0 . . . . . . . . . . . . A . 5 ARG H . . . . . . . . . c30446_6cxn 1 . 15 . 1841 . 1 1 5 ARG HA H -0.718 4.741 -1.691 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HA . . . . . . . . . c30446_6cxn 1 . 15 . 1842 . 1 1 5 ARG HB2 H 0.736 3.549 0.210 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HB2 . . . . . . . . . c30446_6cxn 1 . 15 . 1843 . 1 1 5 ARG HB3 H 2.056 4.262 -0.726 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HB3 . . . . . . . . . c30446_6cxn 1 . 15 . 1844 . 1 1 5 ARG HD2 H 2.553 6.737 0.658 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HD2 . . . . . . . . . c30446_6cxn 1 . 15 . 1845 . 1 1 5 ARG HD3 H 2.351 6.348 -1.050 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HD3 . . . . . . . . . c30446_6cxn 1 . 15 . 1846 . 1 1 5 ARG HE H 1.176 8.296 -1.325 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HE . . . . . . . . . c30446_6cxn 1 . 15 . 1847 . 1 1 5 ARG HG2 H -0.192 6.063 -0.110 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HG2 . . . . . . . . . c30446_6cxn 1 . 15 . 1848 . 1 1 5 ARG HG3 H 0.765 5.523 1.270 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HG3 . . . . . . . . . c30446_6cxn 1 . 15 . 1849 . 1 1 5 ARG HH11 H 1.462 7.612 2.086 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH11 . . . . . . . . . c30446_6cxn 1 . 15 . 1850 . 1 1 5 ARG HH12 H 0.826 9.147 2.574 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH12 . . . . . . . . . c30446_6cxn 1 . 15 . 1851 . 1 1 5 ARG HH21 H 0.340 10.315 -0.684 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH21 . . . . . . . . . c30446_6cxn 1 . 15 . 1852 . 1 1 5 ARG HH22 H 0.189 10.682 1.002 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH22 . . . . . . . . . c30446_6cxn 1 . 15 . 1853 . 1 1 5 ARG N N -0.189 2.762 -1.937 . . . 1.0 . . . . . . . . . . . . A . 5 ARG N . . . . . . . . . c30446_6cxn 1 . 15 . 1854 . 1 1 5 ARG NE N 1.294 8.014 -0.393 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NE . . . . . . . . . c30446_6cxn 1 . 15 . 1855 . 1 1 5 ARG NH1 N 1.090 8.510 1.850 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NH1 . . . . . . . . . c30446_6cxn 1 . 15 . 1856 . 1 1 5 ARG NH2 N 0.451 10.049 0.273 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NH2 . . . . . . . . . c30446_6cxn 1 . 15 . 1857 . 1 1 5 ARG O O 1.640 3.874 -3.659 . . . 1.0 . . . . . . . . . . . . A . 5 ARG O . . . . . . . . . c30446_6cxn 1 . 15 . 1858 . 1 1 6 HIS C C 2.121 7.980 -3.969 . . . 1.0 . . . . . . . . . . . . A . 6 HIS C . . . . . . . . . c30446_6cxn 1 . 15 . 1859 . 1 1 6 HIS CA C 1.667 6.566 -4.316 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CA . . . . . . . . . c30446_6cxn 1 . 15 . 1860 . 1 1 6 HIS CB C 0.787 6.593 -5.567 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CB . . . . . . . . . c30446_6cxn 1 . 15 . 1861 . 1 1 6 HIS CD2 C -1.578 6.990 -4.579 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CD2 . . . . . . . . . c30446_6cxn 1 . 15 . 1862 . 1 1 6 HIS CE1 C -2.058 8.850 -5.636 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CE1 . . . . . . . . . c30446_6cxn 1 . 15 . 1863 . 1 1 6 HIS CG C -0.518 7.297 -5.364 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CG . . . . . . . . . c30446_6cxn 1 . 15 . 1864 . 1 1 6 HIS H H 0.409 6.537 -2.614 . . . 1.0 . . . . . . . . . . . . A . 6 HIS H . . . . . . . . . c30446_6cxn 1 . 15 . 1865 . 1 1 6 HIS HA H 2.538 5.959 -4.512 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HA . . . . . . . . . c30446_6cxn 1 . 15 . 1866 . 1 1 6 HIS HB2 H 1.319 7.103 -6.362 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HB2 . . . . . . . . . c30446_6cxn 1 . 15 . 1867 . 1 1 6 HIS HB3 H 0.574 5.574 -5.871 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HB3 . . . . . . . . . c30446_6cxn 1 . 15 . 1868 . 1 1 6 HIS HD1 H -0.287 8.947 -6.655 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HD1 . . . . . . . . . c30446_6cxn 1 . 15 . 1869 . 1 1 6 HIS HD2 H -1.666 6.133 -3.927 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HD2 . . . . . . . . . c30446_6cxn 1 . 15 . 1870 . 1 1 6 HIS HE1 H -2.579 9.732 -5.980 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HE1 . . . . . . . . . c30446_6cxn 1 . 15 . 1871 . 1 1 6 HIS HE2 H -3.358 8.059 -4.264 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HE2 . . . . . . . . . c30446_6cxn 1 . 15 . 1872 . 1 1 6 HIS N N 0.943 5.964 -3.202 . . . 1.0 . . . . . . . . . . . . A . 6 HIS N . . . . . . . . . c30446_6cxn 1 . 15 . 1873 . 1 1 6 HIS ND1 N -0.852 8.468 -6.013 . . . 1.0 . . . . . . . . . . . . A . 6 HIS ND1 . . . . . . . . . c30446_6cxn 1 . 15 . 1874 . 1 1 6 HIS NE2 N -2.521 7.971 -4.767 . . . 1.0 . . . . . . . . . . . . A . 6 HIS NE2 . . . . . . . . . c30446_6cxn 1 . 15 . 1875 . 1 1 6 HIS O O 1.259 8.884 -3.925 . . . 1.0 . . . . . . . . . . . . A . 6 HIS O . . . . . . . . . c30446_6cxn 1 . 16 . 1876 . 1 1 1 HIS C C 0.026 -6.565 3.052 . . . 1.0 . . . . . . . . . . . . A . 1 HIS C . . . . . . . . . c30446_6cxn 1 . 16 . 1877 . 1 1 1 HIS CA C -0.329 -8.022 2.774 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CA . . . . . . . . . c30446_6cxn 1 . 16 . 1878 . 1 1 1 HIS CB C -1.125 -8.604 3.944 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CB . . . . . . . . . c30446_6cxn 1 . 16 . 1879 . 1 1 1 HIS CD2 C -2.378 -10.816 4.454 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CD2 . . . . . . . . . c30446_6cxn 1 . 16 . 1880 . 1 1 1 HIS CE1 C -2.302 -11.697 2.448 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CE1 . . . . . . . . . c30446_6cxn 1 . 16 . 1881 . 1 1 1 HIS CG C -1.727 -9.942 3.651 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CG . . . . . . . . . c30446_6cxn 1 . 16 . 1882 . 1 1 1 HIS H1 H 1.528 -8.323 1.941 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H1 . . . . . . . . . c30446_6cxn 1 . 16 . 1883 . 1 1 1 HIS H2 H 0.601 -9.751 2.159 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H2 . . . . . . . . . c30446_6cxn 1 . 16 . 1884 . 1 1 1 HIS H3 H 1.333 -8.986 3.509 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H3 . . . . . . . . . c30446_6cxn 1 . 16 . 1885 . 1 1 1 HIS HA H -0.927 -8.074 1.877 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HA . . . . . . . . . c30446_6cxn 1 . 16 . 1886 . 1 1 1 HIS HB2 H -0.471 -8.714 4.796 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HB2 . . . . . . . . . c30446_6cxn 1 . 16 . 1887 . 1 1 1 HIS HB3 H -1.927 -7.925 4.197 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HB3 . . . . . . . . . c30446_6cxn 1 . 16 . 1888 . 1 1 1 HIS HD1 H -1.290 -10.135 1.598 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HD1 . . . . . . . . . c30446_6cxn 1 . 16 . 1889 . 1 1 1 HIS HD2 H -2.587 -10.687 5.507 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HD2 . . . . . . . . . c30446_6cxn 1 . 16 . 1890 . 1 1 1 HIS HE1 H -2.430 -12.376 1.618 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HE1 . . . . . . . . . c30446_6cxn 1 . 16 . 1891 . 1 1 1 HIS HE2 H -3.282 -12.650 3.973 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HE2 . . . . . . . . . c30446_6cxn 1 . 16 . 1892 . 1 1 1 HIS N N 0.894 -8.844 2.578 . . . 1.0 . . . . . . . . . . . . A . 1 HIS N . . . . . . . . . c30446_6cxn 1 . 16 . 1893 . 1 1 1 HIS ND1 N -1.696 -10.524 2.401 . . . 1.0 . . . . . . . . . . . . A . 1 HIS ND1 . . . . . . . . . c30446_6cxn 1 . 16 . 1894 . 1 1 1 HIS NE2 N -2.725 -11.898 3.682 . . . 1.0 . . . . . . . . . . . . A . 1 HIS NE2 . . . . . . . . . c30446_6cxn 1 . 16 . 1895 . 1 1 1 HIS O O 0.459 -6.220 4.151 . . . 1.0 . . . . . . . . . . . . A . 1 HIS O . . . . . . . . . c30446_6cxn 1 . 16 . 1896 . 1 1 2 ARG C C -0.938 -3.442 1.522 . . . 1.0 . . . . . . . . . . . . A . 2 ARG C . . . . . . . . . c30446_6cxn 1 . 16 . 1897 . 1 1 2 ARG CA C 0.140 -4.294 2.185 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CA . . . . . . . . . c30446_6cxn 1 . 16 . 1898 . 1 1 2 ARG CB C 1.507 -3.980 1.574 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CB . . . . . . . . . c30446_6cxn 1 . 16 . 1899 . 1 1 2 ARG CD C 2.571 -2.473 3.279 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CD . . . . . . . . . c30446_6cxn 1 . 16 . 1900 . 1 1 2 ARG CG C 2.614 -3.834 2.605 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CG . . . . . . . . . c30446_6cxn 1 . 16 . 1901 . 1 1 2 ARG CZ C 3.676 -2.868 5.445 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CZ . . . . . . . . . c30446_6cxn 1 . 16 . 1902 . 1 1 2 ARG H H -0.509 -6.049 1.196 . . . 1.0 . . . . . . . . . . . . A . 2 ARG H . . . . . . . . . c30446_6cxn 1 . 16 . 1903 . 1 1 2 ARG HA H 0.165 -4.061 3.239 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HA . . . . . . . . . c30446_6cxn 1 . 16 . 1904 . 1 1 2 ARG HB2 H 1.778 -4.778 0.898 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB2 . . . . . . . . . c30446_6cxn 1 . 16 . 1905 . 1 1 2 ARG HB3 H 1.439 -3.057 1.018 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB3 . . . . . . . . . c30446_6cxn 1 . 16 . 1906 . 1 1 2 ARG HD2 H 2.651 -1.707 2.521 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD2 . . . . . . . . . c30446_6cxn 1 . 16 . 1907 . 1 1 2 ARG HD3 H 1.627 -2.370 3.794 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD3 . . . . . . . . . c30446_6cxn 1 . 16 . 1908 . 1 1 2 ARG HE H 4.414 -1.739 3.974 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HE . . . . . . . . . c30446_6cxn 1 . 16 . 1909 . 1 1 2 ARG HG2 H 2.496 -4.600 3.357 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG2 . . . . . . . . . c30446_6cxn 1 . 16 . 1910 . 1 1 2 ARG HG3 H 3.569 -3.953 2.113 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG3 . . . . . . . . . c30446_6cxn 1 . 16 . 1911 . 1 1 2 ARG HH11 H 1.893 -3.798 5.231 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH11 . . . . . . . . . c30446_6cxn 1 . 16 . 1912 . 1 1 2 ARG HH12 H 2.690 -4.060 6.746 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH12 . . . . . . . . . c30446_6cxn 1 . 16 . 1913 . 1 1 2 ARG HH21 H 5.465 -2.084 5.966 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH21 . . . . . . . . . c30446_6cxn 1 . 16 . 1914 . 1 1 2 ARG HH22 H 4.717 -3.087 7.163 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH22 . . . . . . . . . c30446_6cxn 1 . 16 . 1915 . 1 1 2 ARG N N -0.161 -5.714 2.049 . . . 1.0 . . . . . . . . . . . . A . 2 ARG N . . . . . . . . . c30446_6cxn 1 . 16 . 1916 . 1 1 2 ARG NE N 3.658 -2.303 4.240 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NE . . . . . . . . . c30446_6cxn 1 . 16 . 1917 . 1 1 2 ARG NH1 N 2.670 -3.638 5.840 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH1 . . . . . . . . . c30446_6cxn 1 . 16 . 1918 . 1 1 2 ARG NH2 N 4.704 -2.663 6.258 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH2 . . . . . . . . . c30446_6cxn 1 . 16 . 1919 . 1 1 2 ARG O O -1.875 -3.967 0.920 . . . 1.0 . . . . . . . . . . . . A . 2 ARG O . . . . . . . . . c30446_6cxn 1 . 16 . 1920 . 1 1 3 PHE C C -1.170 -0.491 -0.160 . . . 1.0 . . . . . . . . . . . . A . 3 PHE C . . . . . . . . . c30446_6cxn 1 . 16 . 1921 . 1 1 3 PHE CA C -1.760 -1.202 1.051 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CA . . . . . . . . . c30446_6cxn 1 . 16 . 1922 . 1 1 3 PHE CB C -2.224 -0.182 2.089 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CB . . . . . . . . . c30446_6cxn 1 . 16 . 1923 . 1 1 3 PHE CD1 C -4.571 -1.084 1.923 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CD1 . . . . . . . . . c30446_6cxn 1 . 16 . 1924 . 1 1 3 PHE CD2 C -4.273 1.219 2.469 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CD2 . . . . . . . . . c30446_6cxn 1 . 16 . 1925 . 1 1 3 PHE CE1 C -5.942 -0.925 1.991 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CE1 . . . . . . . . . c30446_6cxn 1 . 16 . 1926 . 1 1 3 PHE CE2 C -5.643 1.382 2.539 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CE2 . . . . . . . . . c30446_6cxn 1 . 16 . 1927 . 1 1 3 PHE CG C -3.719 -0.014 2.160 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CG . . . . . . . . . c30446_6cxn 1 . 16 . 1928 . 1 1 3 PHE CZ C -6.479 0.309 2.300 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CZ . . . . . . . . . c30446_6cxn 1 . 16 . 1929 . 1 1 3 PHE H H -0.030 -1.768 2.131 . . . 1.0 . . . . . . . . . . . . A . 3 PHE H . . . . . . . . . c30446_6cxn 1 . 16 . 1930 . 1 1 3 PHE HA H -2.607 -1.773 0.726 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HA . . . . . . . . . c30446_6cxn 1 . 16 . 1931 . 1 1 3 PHE HB2 H -1.878 -0.490 3.068 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HB2 . . . . . . . . . c30446_6cxn 1 . 16 . 1932 . 1 1 3 PHE HB3 H -1.796 0.778 1.842 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HB3 . . . . . . . . . c30446_6cxn 1 . 16 . 1933 . 1 1 3 PHE HD1 H -4.154 -2.050 1.680 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HD1 . . . . . . . . . c30446_6cxn 1 . 16 . 1934 . 1 1 3 PHE HD2 H -3.621 2.059 2.657 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HD2 . . . . . . . . . c30446_6cxn 1 . 16 . 1935 . 1 1 3 PHE HE1 H -6.594 -1.766 1.804 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HE1 . . . . . . . . . c30446_6cxn 1 . 16 . 1936 . 1 1 3 PHE HE2 H -6.060 2.349 2.780 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HE2 . . . . . . . . . c30446_6cxn 1 . 16 . 1937 . 1 1 3 PHE HZ H -7.550 0.435 2.354 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HZ . . . . . . . . . c30446_6cxn 1 . 16 . 1938 . 1 1 3 PHE N N -0.798 -2.126 1.638 . . . 1.0 . . . . . . . . . . . . A . 3 PHE N . . . . . . . . . c30446_6cxn 1 . 16 . 1939 . 1 1 3 PHE O O 0.027 -0.589 -0.431 . . . 1.0 . . . . . . . . . . . . A . 3 PHE O . . . . . . . . . c30446_6cxn 1 . 16 . 1940 . 1 1 4 LEU C C -1.050 2.320 -1.718 . . . 1.0 . . . . . . . . . . . . A . 4 LEU C . . . . . . . . . c30446_6cxn 1 . 16 . 1941 . 1 1 4 LEU CA C -1.596 0.942 -2.078 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CA . . . . . . . . . c30446_6cxn 1 . 16 . 1942 . 1 1 4 LEU CB C -2.756 1.076 -3.062 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CB . . . . . . . . . c30446_6cxn 1 . 16 . 1943 . 1 1 4 LEU CD1 C -4.683 -0.260 -2.194 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CD1 . . . . . . . . . c30446_6cxn 1 . 16 . 1944 . 1 1 4 LEU CD2 C -4.174 -0.254 -4.646 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CD2 . . . . . . . . . c30446_6cxn 1 . 16 . 1945 . 1 1 4 LEU CG C -3.587 -0.193 -3.243 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CG . . . . . . . . . c30446_6cxn 1 . 16 . 1946 . 1 1 4 LEU H H -2.964 0.254 -0.621 . . . 1.0 . . . . . . . . . . . . A . 4 LEU H . . . . . . . . . c30446_6cxn 1 . 16 . 1947 . 1 1 4 LEU HA H -0.815 0.367 -2.542 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HA . . . . . . . . . c30446_6cxn 1 . 16 . 1948 . 1 1 4 LEU HB2 H -3.408 1.865 -2.715 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HB2 . . . . . . . . . c30446_6cxn 1 . 16 . 1949 . 1 1 4 LEU HB3 H -2.356 1.357 -4.024 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HB3 . . . . . . . . . c30446_6cxn 1 . 16 . 1950 . 1 1 4 LEU HD11 H -4.520 -1.120 -1.564 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD11 . . . . . . . . . c30446_6cxn 1 . 16 . 1951 . 1 1 4 LEU HD12 H -5.644 -0.343 -2.678 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD12 . . . . . . . . . c30446_6cxn 1 . 16 . 1952 . 1 1 4 LEU HD13 H -4.656 0.636 -1.592 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD13 . . . . . . . . . c30446_6cxn 1 . 16 . 1953 . 1 1 4 LEU HD21 H -3.561 0.329 -5.317 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD21 . . . . . . . . . c30446_6cxn 1 . 16 . 1954 . 1 1 4 LEU HD22 H -5.177 0.146 -4.634 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD22 . . . . . . . . . c30446_6cxn 1 . 16 . 1955 . 1 1 4 LEU HD23 H -4.199 -1.280 -4.981 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD23 . . . . . . . . . c30446_6cxn 1 . 16 . 1956 . 1 1 4 LEU HG H -2.949 -1.055 -3.106 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HG . . . . . . . . . c30446_6cxn 1 . 16 . 1957 . 1 1 4 LEU N N -2.023 0.219 -0.888 . . . 1.0 . . . . . . . . . . . . A . 4 LEU N . . . . . . . . . c30446_6cxn 1 . 16 . 1958 . 1 1 4 LEU O O -1.697 3.090 -1.010 . . . 1.0 . . . . . . . . . . . . A . 4 LEU O . . . . . . . . . c30446_6cxn 1 . 16 . 1959 . 1 1 5 ARG C C 0.817 4.772 -3.196 . . . 1.0 . . . . . . . . . . . . A . 5 ARG C . . . . . . . . . c30446_6cxn 1 . 16 . 1960 . 1 1 5 ARG CA C 0.783 3.906 -1.941 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CA . . . . . . . . . c30446_6cxn 1 . 16 . 1961 . 1 1 5 ARG CB C 2.205 3.693 -1.417 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CB . . . . . . . . . c30446_6cxn 1 . 16 . 1962 . 1 1 5 ARG CD C 3.514 5.818 -1.130 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CD . . . . . . . . . c30446_6cxn 1 . 16 . 1963 . 1 1 5 ARG CG C 2.659 4.766 -0.441 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CG . . . . . . . . . c30446_6cxn 1 . 16 . 1964 . 1 1 5 ARG CZ C 4.033 7.324 0.750 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CZ . . . . . . . . . c30446_6cxn 1 . 16 . 1965 . 1 1 5 ARG H H 0.614 1.965 -2.768 . . . 1.0 . . . . . . . . . . . . A . 5 ARG H . . . . . . . . . c30446_6cxn 1 . 16 . 1966 . 1 1 5 ARG HA H 0.202 4.411 -1.185 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HA . . . . . . . . . c30446_6cxn 1 . 16 . 1967 . 1 1 5 ARG HB2 H 2.250 2.735 -0.911 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HB2 . . . . . . . . . c30446_6cxn 1 . 16 . 1968 . 1 1 5 ARG HB3 H 2.889 3.686 -2.257 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HB3 . . . . . . . . . c30446_6cxn 1 . 16 . 1969 . 1 1 5 ARG HD2 H 4.536 5.471 -1.157 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HD2 . . . . . . . . . c30446_6cxn 1 . 16 . 1970 . 1 1 5 ARG HD3 H 3.153 5.952 -2.139 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HD3 . . . . . . . . . c30446_6cxn 1 . 16 . 1971 . 1 1 5 ARG HE H 2.991 7.838 -0.873 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HE . . . . . . . . . c30446_6cxn 1 . 16 . 1972 . 1 1 5 ARG HG2 H 1.789 5.245 -0.017 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HG2 . . . . . . . . . c30446_6cxn 1 . 16 . 1973 . 1 1 5 ARG HG3 H 3.237 4.303 0.345 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HG3 . . . . . . . . . c30446_6cxn 1 . 16 . 1974 . 1 1 5 ARG HH11 H 4.755 5.446 0.956 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH11 . . . . . . . . . c30446_6cxn 1 . 16 . 1975 . 1 1 5 ARG HH12 H 5.109 6.525 2.263 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH12 . . . . . . . . . c30446_6cxn 1 . 16 . 1976 . 1 1 5 ARG HH21 H 3.456 9.259 0.845 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH21 . . . . . . . . . c30446_6cxn 1 . 16 . 1977 . 1 1 5 ARG HH22 H 4.372 8.690 2.201 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH22 . . . . . . . . . c30446_6cxn 1 . 16 . 1978 . 1 1 5 ARG N N 0.147 2.622 -2.211 . . . 1.0 . . . . . . . . . . . . A . 5 ARG N . . . . . . . . . c30446_6cxn 1 . 16 . 1979 . 1 1 5 ARG NE N 3.468 7.102 -0.434 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NE . . . . . . . . . c30446_6cxn 1 . 16 . 1980 . 1 1 5 ARG NH1 N 4.686 6.352 1.374 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NH1 . . . . . . . . . c30446_6cxn 1 . 16 . 1981 . 1 1 5 ARG NH2 N 3.947 8.523 1.311 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NH2 . . . . . . . . . c30446_6cxn 1 . 16 . 1982 . 1 1 5 ARG O O 0.763 4.262 -4.316 . . . 1.0 . . . . . . . . . . . . A . 5 ARG O . . . . . . . . . c30446_6cxn 1 . 16 . 1983 . 1 1 6 HIS C C 1.895 8.179 -3.819 . . . 1.0 . . . . . . . . . . . . A . 6 HIS C . . . . . . . . . c30446_6cxn 1 . 16 . 1984 . 1 1 6 HIS CA C 0.948 7.021 -4.117 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CA . . . . . . . . . c30446_6cxn 1 . 16 . 1985 . 1 1 6 HIS CB C -0.453 7.555 -4.414 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CB . . . . . . . . . c30446_6cxn 1 . 16 . 1986 . 1 1 6 HIS CD2 C -1.246 7.935 -1.973 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CD2 . . . . . . . . . c30446_6cxn 1 . 16 . 1987 . 1 1 6 HIS CE1 C -2.053 9.960 -2.211 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CE1 . . . . . . . . . c30446_6cxn 1 . 16 . 1988 . 1 1 6 HIS CG C -1.066 8.296 -3.266 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CG . . . . . . . . . c30446_6cxn 1 . 16 . 1989 . 1 1 6 HIS H H 0.947 6.429 -2.085 . . . 1.0 . . . . . . . . . . . . A . 6 HIS H . . . . . . . . . c30446_6cxn 1 . 16 . 1990 . 1 1 6 HIS HA H 1.312 6.489 -4.984 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HA . . . . . . . . . c30446_6cxn 1 . 16 . 1991 . 1 1 6 HIS HB2 H -0.401 8.234 -5.257 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HB2 . . . . . . . . . c30446_6cxn 1 . 16 . 1992 . 1 1 6 HIS HB3 H -1.103 6.723 -4.661 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HB3 . . . . . . . . . c30446_6cxn 1 . 16 . 1993 . 1 1 6 HIS HD1 H -1.602 10.108 -4.201 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HD1 . . . . . . . . . c30446_6cxn 1 . 16 . 1994 . 1 1 6 HIS HD2 H -0.959 6.995 -1.524 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HD2 . . . . . . . . . c30446_6cxn 1 . 16 . 1995 . 1 1 6 HIS HE1 H -2.516 10.913 -2.001 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HE1 . . . . . . . . . c30446_6cxn 1 . 16 . 1996 . 1 1 6 HIS HE2 H -2.192 8.981 -0.417 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HE2 . . . . . . . . . c30446_6cxn 1 . 16 . 1997 . 1 1 6 HIS N N 0.907 6.083 -3.001 . . . 1.0 . . . . . . . . . . . . A . 6 HIS N . . . . . . . . . c30446_6cxn 1 . 16 . 1998 . 1 1 6 HIS ND1 N -1.583 9.569 -3.382 . . . 1.0 . . . . . . . . . . . . A . 6 HIS ND1 . . . . . . . . . c30446_6cxn 1 . 16 . 1999 . 1 1 6 HIS NE2 N -1.861 8.987 -1.340 . . . 1.0 . . . . . . . . . . . . A . 6 HIS NE2 . . . . . . . . . c30446_6cxn 1 . 16 . 2000 . 1 1 6 HIS O O 1.693 8.857 -2.790 . . . 1.0 . . . . . . . . . . . . A . 6 HIS O . . . . . . . . . c30446_6cxn 1 . 17 . 2001 . 1 1 1 HIS C C 0.197 -6.476 3.114 . . . 1.0 . . . . . . . . . . . . A . 1 HIS C . . . . . . . . . c30446_6cxn 1 . 17 . 2002 . 1 1 1 HIS CA C 0.390 -7.889 2.572 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CA . . . . . . . . . c30446_6cxn 1 . 17 . 2003 . 1 1 1 HIS CB C 1.871 -8.269 2.604 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CB . . . . . . . . . c30446_6cxn 1 . 17 . 2004 . 1 1 1 HIS CD2 C 1.880 -8.704 5.162 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CD2 . . . . . . . . . c30446_6cxn 1 . 17 . 2005 . 1 1 1 HIS CE1 C 3.429 -10.254 5.218 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CE1 . . . . . . . . . c30446_6cxn 1 . 17 . 2006 . 1 1 1 HIS CG C 2.298 -8.908 3.890 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CG . . . . . . . . . c30446_6cxn 1 . 17 . 2007 . 1 1 1 HIS H1 H -0.228 -9.006 0.959 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H1 . . . . . . . . . c30446_6cxn 1 . 17 . 2008 . 1 1 1 HIS H2 H 0.625 -7.574 0.553 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H2 . . . . . . . . . c30446_6cxn 1 . 17 . 2009 . 1 1 1 HIS H3 H -0.996 -7.481 1.107 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H3 . . . . . . . . . c30446_6cxn 1 . 17 . 2010 . 1 1 1 HIS HA H -0.169 -8.580 3.184 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HA . . . . . . . . . c30446_6cxn 1 . 17 . 2011 . 1 1 1 HIS HB2 H 2.074 -8.966 1.805 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HB2 . . . . . . . . . c30446_6cxn 1 . 17 . 2012 . 1 1 1 HIS HB3 H 2.467 -7.380 2.460 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HB3 . . . . . . . . . c30446_6cxn 1 . 17 . 2013 . 1 1 1 HIS HD1 H 3.766 -10.252 3.200 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HD1 . . . . . . . . . c30446_6cxn 1 . 17 . 2014 . 1 1 1 HIS HD2 H 1.122 -8.003 5.483 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HD2 . . . . . . . . . c30446_6cxn 1 . 17 . 2015 . 1 1 1 HIS HE1 H 4.122 -11.002 5.573 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HE1 . . . . . . . . . c30446_6cxn 1 . 17 . 2016 . 1 1 1 HIS HE2 H 2.573 -9.566 6.946 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HE2 . . . . . . . . . c30446_6cxn 1 . 17 . 2017 . 1 1 1 HIS N N -0.096 -7.997 1.171 . . . 1.0 . . . . . . . . . . . . A . 1 HIS N . . . . . . . . . c30446_6cxn 1 . 17 . 2018 . 1 1 1 HIS ND1 N 3.269 -9.884 3.960 . . . 1.0 . . . . . . . . . . . . A . 1 HIS ND1 . . . . . . . . . c30446_6cxn 1 . 17 . 2019 . 1 1 1 HIS NE2 N 2.599 -9.553 5.967 . . . 1.0 . . . . . . . . . . . . A . 1 HIS NE2 . . . . . . . . . c30446_6cxn 1 . 17 . 2020 . 1 1 1 HIS O O -0.046 -6.286 4.306 . . . 1.0 . . . . . . . . . . . . A . 1 HIS O . . . . . . . . . c30446_6cxn 1 . 17 . 2021 . 1 1 2 ARG C C -0.797 -3.368 1.668 . . . 1.0 . . . . . . . . . . . . A . 2 ARG C . . . . . . . . . c30446_6cxn 1 . 17 . 2022 . 1 1 2 ARG CA C 0.146 -4.093 2.622 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CA . . . . . . . . . c30446_6cxn 1 . 17 . 2023 . 1 1 2 ARG CB C 1.503 -3.388 2.652 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CB . . . . . . . . . c30446_6cxn 1 . 17 . 2024 . 1 1 2 ARG CD C 2.718 -2.358 4.600 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CD . . . . . . . . . c30446_6cxn 1 . 17 . 2025 . 1 1 2 ARG CG C 1.561 -2.219 3.623 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CG . . . . . . . . . c30446_6cxn 1 . 17 . 2026 . 1 1 2 ARG CZ C 3.741 -0.993 6.379 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CZ . . . . . . . . . c30446_6cxn 1 . 17 . 2027 . 1 1 2 ARG H H 0.503 -5.704 1.296 . . . 1.0 . . . . . . . . . . . . A . 2 ARG H . . . . . . . . . c30446_6cxn 1 . 17 . 2028 . 1 1 2 ARG HA H -0.282 -4.074 3.613 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HA . . . . . . . . . c30446_6cxn 1 . 17 . 2029 . 1 1 2 ARG HB2 H 2.261 -4.104 2.935 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB2 . . . . . . . . . c30446_6cxn 1 . 17 . 2030 . 1 1 2 ARG HB3 H 1.724 -3.017 1.662 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB3 . . . . . . . . . c30446_6cxn 1 . 17 . 2031 . 1 1 2 ARG HD2 H 2.450 -3.083 5.354 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD2 . . . . . . . . . c30446_6cxn 1 . 17 . 2032 . 1 1 2 ARG HD3 H 3.587 -2.704 4.061 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD3 . . . . . . . . . c30446_6cxn 1 . 17 . 2033 . 1 1 2 ARG HE H 2.711 -0.269 4.831 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HE . . . . . . . . . c30446_6cxn 1 . 17 . 2034 . 1 1 2 ARG HG2 H 1.684 -1.304 3.063 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG2 . . . . . . . . . c30446_6cxn 1 . 17 . 2035 . 1 1 2 ARG HG3 H 0.635 -2.180 4.179 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG3 . . . . . . . . . c30446_6cxn 1 . 17 . 2036 . 1 1 2 ARG HH11 H 4.018 -2.986 6.588 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH11 . . . . . . . . . c30446_6cxn 1 . 17 . 2037 . 1 1 2 ARG HH12 H 4.728 -2.004 7.825 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH12 . . . . . . . . . c30446_6cxn 1 . 17 . 2038 . 1 1 2 ARG HH21 H 3.644 1.024 6.457 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH21 . . . . . . . . . c30446_6cxn 1 . 17 . 2039 . 1 1 2 ARG HH22 H 4.515 0.272 7.751 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH22 . . . . . . . . . c30446_6cxn 1 . 17 . 2040 . 1 1 2 ARG N N 0.308 -5.489 2.232 . . . 1.0 . . . . . . . . . . . . A . 2 ARG N . . . . . . . . . c30446_6cxn 1 . 17 . 2041 . 1 1 2 ARG NE N 3.038 -1.091 5.253 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NE . . . . . . . . . c30446_6cxn 1 . 17 . 2042 . 1 1 2 ARG NH1 N 4.200 -2.085 6.979 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH1 . . . . . . . . . c30446_6cxn 1 . 17 . 2043 . 1 1 2 ARG NH2 N 3.987 0.198 6.905 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH2 . . . . . . . . . c30446_6cxn 1 . 17 . 2044 . 1 1 2 ARG O O -1.226 -3.927 0.659 . . . 1.0 . . . . . . . . . . . . A . 2 ARG O . . . . . . . . . c30446_6cxn 1 . 17 . 2045 . 1 1 3 PHE C C -1.243 -0.612 0.056 . . . 1.0 . . . . . . . . . . . . A . 3 PHE C . . . . . . . . . c30446_6cxn 1 . 17 . 2046 . 1 1 3 PHE CA C -2.009 -1.319 1.167 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CA . . . . . . . . . c30446_6cxn 1 . 17 . 2047 . 1 1 3 PHE CB C -2.759 -0.300 2.022 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CB . . . . . . . . . c30446_6cxn 1 . 17 . 2048 . 1 1 3 PHE CD1 C -4.939 -1.424 1.439 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CD1 . . . . . . . . . c30446_6cxn 1 . 17 . 2049 . 1 1 3 PHE CD2 C -4.952 0.915 1.904 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CD2 . . . . . . . . . c30446_6cxn 1 . 17 . 2050 . 1 1 3 PHE CE1 C -6.304 -1.392 1.223 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CE1 . . . . . . . . . c30446_6cxn 1 . 17 . 2051 . 1 1 3 PHE CE2 C -6.317 0.953 1.688 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CE2 . . . . . . . . . c30446_6cxn 1 . 17 . 2052 . 1 1 3 PHE CG C -4.247 -0.271 1.782 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CG . . . . . . . . . c30446_6cxn 1 . 17 . 2053 . 1 1 3 PHE CZ C -6.993 -0.202 1.347 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CZ . . . . . . . . . c30446_6cxn 1 . 17 . 2054 . 1 1 3 PHE H H -0.743 -1.729 2.812 . . . 1.0 . . . . . . . . . . . . A . 3 PHE H . . . . . . . . . c30446_6cxn 1 . 17 . 2055 . 1 1 3 PHE HA H -2.720 -1.982 0.717 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HA . . . . . . . . . c30446_6cxn 1 . 17 . 2056 . 1 1 3 PHE HB2 H -2.597 -0.528 3.069 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HB2 . . . . . . . . . c30446_6cxn 1 . 17 . 2057 . 1 1 3 PHE HB3 H -2.371 0.683 1.804 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HB3 . . . . . . . . . c30446_6cxn 1 . 17 . 2058 . 1 1 3 PHE HD1 H -4.402 -2.356 1.340 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HD1 . . . . . . . . . c30446_6cxn 1 . 17 . 2059 . 1 1 3 PHE HD2 H -4.426 1.820 2.170 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HD2 . . . . . . . . . c30446_6cxn 1 . 17 . 2060 . 1 1 3 PHE HE1 H -6.830 -2.296 0.956 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HE1 . . . . . . . . . c30446_6cxn 1 . 17 . 2061 . 1 1 3 PHE HE2 H -6.854 1.885 1.785 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HE2 . . . . . . . . . c30446_6cxn 1 . 17 . 2062 . 1 1 3 PHE HZ H -8.060 -0.175 1.178 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HZ . . . . . . . . . c30446_6cxn 1 . 17 . 2063 . 1 1 3 PHE N N -1.116 -2.120 1.994 . . . 1.0 . . . . . . . . . . . . A . 3 PHE N . . . . . . . . . c30446_6cxn 1 . 17 . 2064 . 1 1 3 PHE O O -0.012 -0.611 0.037 . . . 1.0 . . . . . . . . . . . . A . 3 PHE O . . . . . . . . . c30446_6cxn 1 . 17 . 2065 . 1 1 4 LEU C C -1.008 2.112 -1.615 . . . 1.0 . . . . . . . . . . . . A . 4 LEU C . . . . . . . . . c30446_6cxn 1 . 17 . 2066 . 1 1 4 LEU CA C -1.383 0.684 -1.997 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CA . . . . . . . . . c30446_6cxn 1 . 17 . 2067 . 1 1 4 LEU CB C -2.337 0.692 -3.190 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CB . . . . . . . . . c30446_6cxn 1 . 17 . 2068 . 1 1 4 LEU CD1 C -4.296 -0.767 -2.658 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CD1 . . . . . . . . . c30446_6cxn 1 . 17 . 2069 . 1 1 4 LEU CD2 C -3.304 -0.801 -4.956 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CD2 . . . . . . . . . c30446_6cxn 1 . 17 . 2070 . 1 1 4 LEU CG C -3.019 -0.646 -3.470 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CG . . . . . . . . . c30446_6cxn 1 . 17 . 2071 . 1 1 4 LEU H H -2.959 -0.062 -0.802 . . . 1.0 . . . . . . . . . . . . A . 4 LEU H . . . . . . . . . c30446_6cxn 1 . 17 . 2072 . 1 1 4 LEU HA H -0.491 0.151 -2.273 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HA . . . . . . . . . c30446_6cxn 1 . 17 . 2073 . 1 1 4 LEU HB2 H -3.102 1.434 -3.009 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HB2 . . . . . . . . . c30446_6cxn 1 . 17 . 2074 . 1 1 4 LEU HB3 H -1.780 0.979 -4.069 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HB3 . . . . . . . . . c30446_6cxn 1 . 17 . 2075 . 1 1 4 LEU HD11 H -4.447 0.140 -2.093 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD11 . . . . . . . . . c30446_6cxn 1 . 17 . 2076 . 1 1 4 LEU HD12 H -4.208 -1.602 -1.979 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD12 . . . . . . . . . c30446_6cxn 1 . 17 . 2077 . 1 1 4 LEU HD13 H -5.133 -0.926 -3.320 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD13 . . . . . . . . . c30446_6cxn 1 . 17 . 2078 . 1 1 4 LEU HD21 H -3.172 -1.834 -5.242 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD21 . . . . . . . . . c30446_6cxn 1 . 17 . 2079 . 1 1 4 LEU HD22 H -2.622 -0.182 -5.520 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD22 . . . . . . . . . c30446_6cxn 1 . 17 . 2080 . 1 1 4 LEU HD23 H -4.319 -0.497 -5.162 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD23 . . . . . . . . . c30446_6cxn 1 . 17 . 2081 . 1 1 4 LEU HG H -2.359 -1.447 -3.167 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HG . . . . . . . . . c30446_6cxn 1 . 17 . 2082 . 1 1 4 LEU N N -1.984 -0.020 -0.873 . . . 1.0 . . . . . . . . . . . . A . 4 LEU N . . . . . . . . . c30446_6cxn 1 . 17 . 2083 . 1 1 4 LEU O O -1.725 2.773 -0.864 . . . 1.0 . . . . . . . . . . . . A . 4 LEU O . . . . . . . . . c30446_6cxn 1 . 17 . 2084 . 1 1 5 ARG C C 0.800 4.721 -3.138 . . . 1.0 . . . . . . . . . . . . A . 5 ARG C . . . . . . . . . c30446_6cxn 1 . 17 . 2085 . 1 1 5 ARG CA C 0.593 3.932 -1.849 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CA . . . . . . . . . c30446_6cxn 1 . 17 . 2086 . 1 1 5 ARG CB C 1.899 3.879 -1.054 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CB . . . . . . . . . c30446_6cxn 1 . 17 . 2087 . 1 1 5 ARG CD C 3.123 6.070 -0.932 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CD . . . . . . . . . c30446_6cxn 1 . 17 . 2088 . 1 1 5 ARG CG C 2.157 5.130 -0.230 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CG . . . . . . . . . c30446_6cxn 1 . 17 . 2089 . 1 1 5 ARG CZ C 3.791 7.695 0.796 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CZ . . . . . . . . . c30446_6cxn 1 . 17 . 2090 . 1 1 5 ARG H H 0.650 2.006 -2.727 . . . 1.0 . . . . . . . . . . . . A . 5 ARG H . . . . . . . . . c30446_6cxn 1 . 17 . 2091 . 1 1 5 ARG HA H -0.160 4.427 -1.255 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HA . . . . . . . . . c30446_6cxn 1 . 17 . 2092 . 1 1 5 ARG HB2 H 1.863 3.031 -0.380 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HB2 . . . . . . . . . c30446_6cxn 1 . 17 . 2093 . 1 1 5 ARG HB3 H 2.723 3.752 -1.746 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HB3 . . . . . . . . . c30446_6cxn 1 . 17 . 2094 . 1 1 5 ARG HD2 H 4.117 5.651 -0.877 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HD2 . . . . . . . . . c30446_6cxn 1 . 17 . 2095 . 1 1 5 ARG HD3 H 2.829 6.162 -1.967 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HD3 . . . . . . . . . c30446_6cxn 1 . 17 . 2096 . 1 1 5 ARG HE H 2.627 8.106 -0.772 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HE . . . . . . . . . c30446_6cxn 1 . 17 . 2097 . 1 1 5 ARG HG2 H 1.221 5.645 -0.072 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HG2 . . . . . . . . . c30446_6cxn 1 . 17 . 2098 . 1 1 5 ARG HG3 H 2.577 4.841 0.722 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HG3 . . . . . . . . . c30446_6cxn 1 . 17 . 2099 . 1 1 5 ARG HH11 H 4.526 5.830 1.071 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH11 . . . . . . . . . c30446_6cxn 1 . 17 . 2100 . 1 1 5 ARG HH12 H 4.981 6.991 2.272 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH12 . . . . . . . . . c30446_6cxn 1 . 17 . 2101 . 1 1 5 ARG HH21 H 3.225 9.634 0.807 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH21 . . . . . . . . . c30446_6cxn 1 . 17 . 2102 . 1 1 5 ARG HH22 H 4.242 9.151 2.123 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH22 . . . . . . . . . c30446_6cxn 1 . 17 . 2103 . 1 1 5 ARG N N 0.121 2.582 -2.136 . . . 1.0 . . . . . . . . . . . . A . 5 ARG N . . . . . . . . . c30446_6cxn 1 . 17 . 2104 . 1 1 5 ARG NE N 3.135 7.398 -0.323 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NE . . . . . . . . . c30446_6cxn 1 . 17 . 2105 . 1 1 5 ARG NH1 N 4.490 6.762 1.432 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NH1 . . . . . . . . . c30446_6cxn 1 . 17 . 2106 . 1 1 5 ARG NH2 N 3.749 8.928 1.282 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NH2 . . . . . . . . . c30446_6cxn 1 . 17 . 2107 . 1 1 5 ARG O O 1.020 4.144 -4.203 . . . 1.0 . . . . . . . . . . . . A . 5 ARG O . . . . . . . . . c30446_6cxn 1 . 17 . 2108 . 1 1 6 HIS C C 2.173 7.755 -4.046 . . . 1.0 . . . . . . . . . . . . A . 6 HIS C . . . . . . . . . c30446_6cxn 1 . 17 . 2109 . 1 1 6 HIS CA C 0.908 6.915 -4.189 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CA . . . . . . . . . c30446_6cxn 1 . 17 . 2110 . 1 1 6 HIS CB C -0.307 7.827 -4.362 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CB . . . . . . . . . c30446_6cxn 1 . 17 . 2111 . 1 1 6 HIS CD2 C -1.477 8.165 -2.071 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CD2 . . . . . . . . . c30446_6cxn 1 . 17 . 2112 . 1 1 6 HIS CE1 C -0.767 10.195 -1.646 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CE1 . . . . . . . . . c30446_6cxn 1 . 17 . 2113 . 1 1 6 HIS CG C -0.695 8.548 -3.108 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CG . . . . . . . . . c30446_6cxn 1 . 17 . 2114 . 1 1 6 HIS H H 0.551 6.445 -2.156 . . . 1.0 . . . . . . . . . . . . A . 6 HIS H . . . . . . . . . c30446_6cxn 1 . 17 . 2115 . 1 1 6 HIS HA H 1.004 6.288 -5.064 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HA . . . . . . . . . c30446_6cxn 1 . 17 . 2116 . 1 1 6 HIS HB2 H -0.087 8.571 -5.118 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HB2 . . . . . . . . . c30446_6cxn 1 . 17 . 2117 . 1 1 6 HIS HB3 H -1.155 7.230 -4.679 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HB3 . . . . . . . . . c30446_6cxn 1 . 17 . 2118 . 1 1 6 HIS HD1 H 0.318 10.377 -3.371 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HD1 . . . . . . . . . c30446_6cxn 1 . 17 . 2119 . 1 1 6 HIS HD2 H -1.984 7.216 -1.967 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HD2 . . . . . . . . . c30446_6cxn 1 . 17 . 2120 . 1 1 6 HIS HE1 H -0.602 11.145 -1.160 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HE1 . . . . . . . . . c30446_6cxn 1 . 17 . 2121 . 1 1 6 HIS HE2 H -2.062 9.250 -0.371 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HE2 . . . . . . . . . c30446_6cxn 1 . 17 . 2122 . 1 1 6 HIS N N 0.728 6.044 -3.033 . . . 1.0 . . . . . . . . . . . . A . 6 HIS N . . . . . . . . . c30446_6cxn 1 . 17 . 2123 . 1 1 6 HIS ND1 N -0.267 9.825 -2.811 . . . 1.0 . . . . . . . . . . . . A . 6 HIS ND1 . . . . . . . . . c30446_6cxn 1 . 17 . 2124 . 1 1 6 HIS NE2 N -1.506 9.206 -1.177 . . . 1.0 . . . . . . . . . . . . A . 6 HIS NE2 . . . . . . . . . c30446_6cxn 1 . 17 . 2125 . 1 1 6 HIS O O 2.243 8.558 -3.091 . . . 1.0 . . . . . . . . . . . . A . 6 HIS O . . . . . . . . . c30446_6cxn 1 . 18 . 2126 . 1 1 1 HIS C C -0.168 -6.764 3.312 . . . 1.0 . . . . . . . . . . . . A . 1 HIS C . . . . . . . . . c30446_6cxn 1 . 18 . 2127 . 1 1 1 HIS CA C -0.706 -8.184 3.172 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CA . . . . . . . . . c30446_6cxn 1 . 18 . 2128 . 1 1 1 HIS CB C -0.912 -8.808 4.553 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CB . . . . . . . . . c30446_6cxn 1 . 18 . 2129 . 1 1 1 HIS CD2 C -1.313 -11.281 5.228 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CD2 . . . . . . . . . c30446_6cxn 1 . 18 . 2130 . 1 1 1 HIS CE1 C -2.946 -11.731 3.837 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CE1 . . . . . . . . . c30446_6cxn 1 . 18 . 2131 . 1 1 1 HIS CG C -1.556 -10.159 4.509 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CG . . . . . . . . . c30446_6cxn 1 . 18 . 2132 . 1 1 1 HIS H1 H 1.106 -9.133 2.954 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H1 . . . . . . . . . c30446_6cxn 1 . 18 . 2133 . 1 1 1 HIS H2 H 0.411 -8.572 1.489 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H2 . . . . . . . . . c30446_6cxn 1 . 18 . 2134 . 1 1 1 HIS H3 H -0.224 -9.965 2.263 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H3 . . . . . . . . . c30446_6cxn 1 . 18 . 2135 . 1 1 1 HIS HA H -1.652 -8.152 2.652 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HA . . . . . . . . . c30446_6cxn 1 . 18 . 2136 . 1 1 1 HIS HB2 H 0.046 -8.914 5.039 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HB2 . . . . . . . . . c30446_6cxn 1 . 18 . 2137 . 1 1 1 HIS HB3 H -1.540 -8.158 5.145 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HB3 . . . . . . . . . c30446_6cxn 1 . 18 . 2138 . 1 1 1 HIS HD1 H -2.989 -9.868 2.992 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HD1 . . . . . . . . . c30446_6cxn 1 . 18 . 2139 . 1 1 1 HIS HD2 H -0.568 -11.397 6.002 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HD2 . . . . . . . . . c30446_6cxn 1 . 18 . 2140 . 1 1 1 HIS HE1 H -3.727 -12.252 3.302 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HE1 . . . . . . . . . c30446_6cxn 1 . 18 . 2141 . 1 1 1 HIS HE2 H -2.306 -13.131 5.188 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HE2 . . . . . . . . . c30446_6cxn 1 . 18 . 2142 . 1 1 1 HIS N N 0.231 -9.041 2.400 . . . 1.0 . . . . . . . . . . . . A . 1 HIS N . . . . . . . . . c30446_6cxn 1 . 18 . 2143 . 1 1 1 HIS ND1 N -2.584 -10.475 3.646 . . . 1.0 . . . . . . . . . . . . A . 1 HIS ND1 . . . . . . . . . c30446_6cxn 1 . 18 . 2144 . 1 1 1 HIS NE2 N -2.190 -12.242 4.790 . . . 1.0 . . . . . . . . . . . . A . 1 HIS NE2 . . . . . . . . . c30446_6cxn 1 . 18 . 2145 . 1 1 1 HIS O O 0.382 -6.397 4.351 . . . 1.0 . . . . . . . . . . . . A . 1 HIS O . . . . . . . . . c30446_6cxn 1 . 18 . 2146 . 1 1 2 ARG C C -0.815 -3.685 1.492 . . . 1.0 . . . . . . . . . . . . A . 2 ARG C . . . . . . . . . c30446_6cxn 1 . 18 . 2147 . 1 1 2 ARG CA C 0.141 -4.588 2.265 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CA . . . . . . . . . c30446_6cxn 1 . 18 . 2148 . 1 1 2 ARG CB C 1.544 -4.502 1.661 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CB . . . . . . . . . c30446_6cxn 1 . 18 . 2149 . 1 1 2 ARG CD C 3.812 -5.582 1.725 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CD . . . . . . . . . c30446_6cxn 1 . 18 . 2150 . 1 1 2 ARG CG C 2.625 -5.102 2.545 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CG . . . . . . . . . c30446_6cxn 1 . 18 . 2151 . 1 1 2 ARG CZ C 4.117 -7.939 2.376 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CZ . . . . . . . . . c30446_6cxn 1 . 18 . 2152 . 1 1 2 ARG H H -0.776 -6.318 1.460 . . . 1.0 . . . . . . . . . . . . A . 2 ARG H . . . . . . . . . c30446_6cxn 1 . 18 . 2153 . 1 1 2 ARG HA H 0.179 -4.255 3.292 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HA . . . . . . . . . c30446_6cxn 1 . 18 . 2154 . 1 1 2 ARG HB2 H 1.549 -5.026 0.717 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB2 . . . . . . . . . c30446_6cxn 1 . 18 . 2155 . 1 1 2 ARG HB3 H 1.786 -3.464 1.488 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB3 . . . . . . . . . c30446_6cxn 1 . 18 . 2156 . 1 1 2 ARG HD2 H 3.455 -5.926 0.766 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD2 . . . . . . . . . c30446_6cxn 1 . 18 . 2157 . 1 1 2 ARG HD3 H 4.490 -4.754 1.580 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD3 . . . . . . . . . c30446_6cxn 1 . 18 . 2158 . 1 1 2 ARG HE H 5.357 -6.450 2.854 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HE . . . . . . . . . c30446_6cxn 1 . 18 . 2159 . 1 1 2 ARG HG2 H 2.963 -4.352 3.244 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG2 . . . . . . . . . c30446_6cxn 1 . 18 . 2160 . 1 1 2 ARG HG3 H 2.210 -5.940 3.086 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG3 . . . . . . . . . c30446_6cxn 1 . 18 . 2161 . 1 1 2 ARG HH11 H 2.459 -7.582 1.274 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH11 . . . . . . . . . c30446_6cxn 1 . 18 . 2162 . 1 1 2 ARG HH12 H 2.696 -9.232 1.746 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH12 . . . . . . . . . c30446_6cxn 1 . 18 . 2163 . 1 1 2 ARG HH21 H 5.671 -8.619 3.476 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH21 . . . . . . . . . c30446_6cxn 1 . 18 . 2164 . 1 1 2 ARG HH22 H 4.519 -9.820 2.996 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH22 . . . . . . . . . c30446_6cxn 1 . 18 . 2165 . 1 1 2 ARG N N -0.329 -5.968 2.260 . . . 1.0 . . . . . . . . . . . . A . 2 ARG N . . . . . . . . . c30446_6cxn 1 . 18 . 2166 . 1 1 2 ARG NE N 4.527 -6.673 2.383 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NE . . . . . . . . . c30446_6cxn 1 . 18 . 2167 . 1 1 2 ARG NH1 N 2.999 -8.278 1.747 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH1 . . . . . . . . . c30446_6cxn 1 . 18 . 2168 . 1 1 2 ARG NH2 N 4.827 -8.869 3.000 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH2 . . . . . . . . . c30446_6cxn 1 . 18 . 2169 . 1 1 2 ARG O O -1.669 -4.163 0.746 . . . 1.0 . . . . . . . . . . . . A . 2 ARG O . . . . . . . . . c30446_6cxn 1 . 18 . 2170 . 1 1 3 PHE C C -0.747 -0.678 -0.098 . . . 1.0 . . . . . . . . . . . . A . 3 PHE C . . . . . . . . . c30446_6cxn 1 . 18 . 2171 . 1 1 3 PHE CA C -1.515 -1.407 0.997 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CA . . . . . . . . . c30446_6cxn 1 . 18 . 2172 . 1 1 3 PHE CB C -2.086 -0.404 1.998 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CB . . . . . . . . . c30446_6cxn 1 . 18 . 2173 . 1 1 3 PHE CD1 C -4.413 -1.267 1.565 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CD1 . . . . . . . . . c30446_6cxn 1 . 18 . 2174 . 1 1 3 PHE CD2 C -4.136 1.040 2.106 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CD2 . . . . . . . . . c30446_6cxn 1 . 18 . 2175 . 1 1 3 PHE CE1 C -5.779 -1.083 1.466 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CE1 . . . . . . . . . c30446_6cxn 1 . 18 . 2176 . 1 1 3 PHE CE2 C -5.502 1.229 2.008 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CE2 . . . . . . . . . c30446_6cxn 1 . 18 . 2177 . 1 1 3 PHE CG C -3.575 -0.208 1.886 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CG . . . . . . . . . c30446_6cxn 1 . 18 . 2178 . 1 1 3 PHE CZ C -6.324 0.167 1.687 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CZ . . . . . . . . . c30446_6cxn 1 . 18 . 2179 . 1 1 3 PHE H H 0.033 -2.057 2.286 . . . 1.0 . . . . . . . . . . . . A . 3 PHE H . . . . . . . . . c30446_6cxn 1 . 18 . 2180 . 1 1 3 PHE HA H -2.327 -1.942 0.544 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HA . . . . . . . . . c30446_6cxn 1 . 18 . 2181 . 1 1 3 PHE HB2 H -1.871 -0.745 3.004 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HB2 . . . . . . . . . c30446_6cxn 1 . 18 . 2182 . 1 1 3 PHE HB3 H -1.614 0.552 1.833 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HB3 . . . . . . . . . c30446_6cxn 1 . 18 . 2183 . 1 1 3 PHE HD1 H -3.988 -2.244 1.391 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HD1 . . . . . . . . . c30446_6cxn 1 . 18 . 2184 . 1 1 3 PHE HD2 H -3.495 1.872 2.357 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HD2 . . . . . . . . . c30446_6cxn 1 . 18 . 2185 . 1 1 3 PHE HE1 H -6.419 -1.915 1.214 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HE1 . . . . . . . . . c30446_6cxn 1 . 18 . 2186 . 1 1 3 PHE HE2 H -5.925 2.207 2.181 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HE2 . . . . . . . . . c30446_6cxn 1 . 18 . 2187 . 1 1 3 PHE HZ H -7.391 0.313 1.610 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HZ . . . . . . . . . c30446_6cxn 1 . 18 . 2188 . 1 1 3 PHE N N -0.665 -2.377 1.677 . . . 1.0 . . . . . . . . . . . . A . 3 PHE N . . . . . . . . . c30446_6cxn 1 . 18 . 2189 . 1 1 3 PHE O O 0.473 -0.803 -0.206 . . . 1.0 . . . . . . . . . . . . A . 3 PHE O . . . . . . . . . c30446_6cxn 1 . 18 . 2190 . 1 1 4 LEU C C -0.660 2.288 -1.627 . . . 1.0 . . . . . . . . . . . . A . 4 LEU C . . . . . . . . . c30446_6cxn 1 . 18 . 2191 . 1 1 4 LEU CA C -0.865 0.826 -2.007 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CA . . . . . . . . . c30446_6cxn 1 . 18 . 2192 . 1 1 4 LEU CB C -1.725 0.725 -3.266 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CB . . . . . . . . . c30446_6cxn 1 . 18 . 2193 . 1 1 4 LEU CD1 C -3.734 -0.621 -2.647 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CD1 . . . . . . . . . c30446_6cxn 1 . 18 . 2194 . 1 1 4 LEU CD2 C -2.711 -0.885 -4.917 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CD2 . . . . . . . . . c30446_6cxn 1 . 18 . 2195 . 1 1 4 LEU CG C -2.443 -0.611 -3.444 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CG . . . . . . . . . c30446_6cxn 1 . 18 . 2196 . 1 1 4 LEU H H -2.440 0.134 -0.777 . . . 1.0 . . . . . . . . . . . . A . 4 LEU H . . . . . . . . . c30446_6cxn 1 . 18 . 2197 . 1 1 4 LEU HA H 0.092 0.380 -2.207 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HA . . . . . . . . . c30446_6cxn 1 . 18 . 2198 . 1 1 4 LEU HB2 H -2.466 1.510 -3.235 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HB2 . . . . . . . . . c30446_6cxn 1 . 18 . 2199 . 1 1 4 LEU HB3 H -1.091 0.884 -4.125 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HB3 . . . . . . . . . c30446_6cxn 1 . 18 . 2200 . 1 1 4 LEU HD11 H -3.701 -1.423 -1.926 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD11 . . . . . . . . . c30446_6cxn 1 . 18 . 2201 . 1 1 4 LEU HD12 H -4.571 -0.767 -3.313 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD12 . . . . . . . . . c30446_6cxn 1 . 18 . 2202 . 1 1 4 LEU HD13 H -3.841 0.321 -2.131 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD13 . . . . . . . . . c30446_6cxn 1 . 18 . 2203 . 1 1 4 LEU HD21 H -1.882 -0.523 -5.507 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD21 . . . . . . . . . c30446_6cxn 1 . 18 . 2204 . 1 1 4 LEU HD22 H -3.616 -0.379 -5.218 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD22 . . . . . . . . . c30446_6cxn 1 . 18 . 2205 . 1 1 4 LEU HD23 H -2.825 -1.948 -5.070 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD23 . . . . . . . . . c30446_6cxn 1 . 18 . 2206 . 1 1 4 LEU HG H -1.815 -1.402 -3.061 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HG . . . . . . . . . c30446_6cxn 1 . 18 . 2207 . 1 1 4 LEU N N -1.473 0.080 -0.913 . . . 1.0 . . . . . . . . . . . . A . 4 LEU N . . . . . . . . . c30446_6cxn 1 . 18 . 2208 . 1 1 4 LEU O O -1.348 2.816 -0.753 . . . 1.0 . . . . . . . . . . . . A . 4 LEU O . . . . . . . . . c30446_6cxn 1 . 18 . 2209 . 1 1 5 ARG C C 0.657 5.141 -3.320 . . . 1.0 . . . . . . . . . . . . A . 5 ARG C . . . . . . . . . c30446_6cxn 1 . 18 . 2210 . 1 1 5 ARG CA C 0.587 4.341 -2.022 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CA . . . . . . . . . c30446_6cxn 1 . 18 . 2211 . 1 1 5 ARG CB C 1.907 4.468 -1.260 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CB . . . . . . . . . c30446_6cxn 1 . 18 . 2212 . 1 1 5 ARG CD C 2.729 6.760 -0.643 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CD . . . . . . . . . c30446_6cxn 1 . 18 . 2213 . 1 1 5 ARG CG C 1.899 5.565 -0.208 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CG . . . . . . . . . c30446_6cxn 1 . 18 . 2214 . 1 1 5 ARG CZ C 4.875 6.375 0.504 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CZ . . . . . . . . . c30446_6cxn 1 . 18 . 2215 . 1 1 5 ARG H H 0.806 2.464 -2.976 . . . 1.0 . . . . . . . . . . . . A . 5 ARG H . . . . . . . . . c30446_6cxn 1 . 18 . 2216 . 1 1 5 ARG HA H -0.210 4.738 -1.412 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HA . . . . . . . . . c30446_6cxn 1 . 18 . 2217 . 1 1 5 ARG HB2 H 2.116 3.528 -0.766 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HB2 . . . . . . . . . c30446_6cxn 1 . 18 . 2218 . 1 1 5 ARG HB3 H 2.700 4.683 -1.969 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HB3 . . . . . . . . . c30446_6cxn 1 . 18 . 2219 . 1 1 5 ARG HD2 H 2.447 7.029 -1.650 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HD2 . . . . . . . . . c30446_6cxn 1 . 18 . 2220 . 1 1 5 ARG HD3 H 2.523 7.586 0.021 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HD3 . . . . . . . . . c30446_6cxn 1 . 18 . 2221 . 1 1 5 ARG HE H 4.614 6.347 -1.474 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HE . . . . . . . . . c30446_6cxn 1 . 18 . 2222 . 1 1 5 ARG HG2 H 0.881 5.886 -0.045 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HG2 . . . . . . . . . c30446_6cxn 1 . 18 . 2223 . 1 1 5 ARG HG3 H 2.305 5.171 0.712 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HG3 . . . . . . . . . c30446_6cxn 1 . 18 . 2224 . 1 1 5 ARG HH11 H 3.317 6.738 1.742 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH11 . . . . . . . . . c30446_6cxn 1 . 18 . 2225 . 1 1 5 ARG HH12 H 4.838 6.465 2.523 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH12 . . . . . . . . . c30446_6cxn 1 . 18 . 2226 . 1 1 5 ARG HH21 H 6.615 5.987 -0.448 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH21 . . . . . . . . . c30446_6cxn 1 . 18 . 2227 . 1 1 5 ARG HH22 H 6.711 6.039 1.280 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH22 . . . . . . . . . c30446_6cxn 1 . 18 . 2228 . 1 1 5 ARG N N 0.291 2.939 -2.290 . . . 1.0 . . . . . . . . . . . . A . 5 ARG N . . . . . . . . . c30446_6cxn 1 . 18 . 2229 . 1 1 5 ARG NE N 4.161 6.473 -0.615 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NE . . . . . . . . . c30446_6cxn 1 . 18 . 2230 . 1 1 5 ARG NH1 N 4.295 6.540 1.687 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NH1 . . . . . . . . . c30446_6cxn 1 . 18 . 2231 . 1 1 5 ARG NH2 N 6.173 6.112 0.440 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NH2 . . . . . . . . . c30446_6cxn 1 . 18 . 2232 . 1 1 5 ARG O O 0.730 4.571 -4.408 . . . 1.0 . . . . . . . . . . . . A . 5 ARG O . . . . . . . . . c30446_6cxn 1 . 18 . 2233 . 1 1 6 HIS C C 1.435 8.634 -4.026 . . . 1.0 . . . . . . . . . . . . A . 6 HIS C . . . . . . . . . c30446_6cxn 1 . 18 . 2234 . 1 1 6 HIS CA C 0.697 7.342 -4.358 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CA . . . . . . . . . c30446_6cxn 1 . 18 . 2235 . 1 1 6 HIS CB C -0.713 7.660 -4.858 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CB . . . . . . . . . c30446_6cxn 1 . 18 . 2236 . 1 1 6 HIS CD2 C -1.312 9.000 -2.719 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CD2 . . . . . . . . . c30446_6cxn 1 . 18 . 2237 . 1 1 6 HIS CE1 C -3.484 8.704 -2.755 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CE1 . . . . . . . . . c30446_6cxn 1 . 18 . 2238 . 1 1 6 HIS CG C -1.602 8.245 -3.806 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CG . . . . . . . . . c30446_6cxn 1 . 18 . 2239 . 1 1 6 HIS H H 0.576 6.859 -2.301 . . . 1.0 . . . . . . . . . . . . A . 6 HIS H . . . . . . . . . c30446_6cxn 1 . 18 . 2240 . 1 1 6 HIS HA H 1.237 6.823 -5.136 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HA . . . . . . . . . c30446_6cxn 1 . 18 . 2241 . 1 1 6 HIS HB2 H -0.647 8.373 -5.671 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HB2 . . . . . . . . . c30446_6cxn 1 . 18 . 2242 . 1 1 6 HIS HB3 H -1.175 6.746 -5.216 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HB3 . . . . . . . . . c30446_6cxn 1 . 18 . 2243 . 1 1 6 HIS HD1 H -3.490 7.574 -4.460 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HD1 . . . . . . . . . c30446_6cxn 1 . 18 . 2244 . 1 1 6 HIS HD2 H -0.330 9.328 -2.410 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HD2 . . . . . . . . . c30446_6cxn 1 . 18 . 2245 . 1 1 6 HIS HE1 H -4.532 8.744 -2.494 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HE1 . . . . . . . . . c30446_6cxn 1 . 18 . 2246 . 1 1 6 HIS HE2 H -2.610 9.871 -1.317 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HE2 . . . . . . . . . c30446_6cxn 1 . 18 . 2247 . 1 1 6 HIS N N 0.635 6.464 -3.195 . . . 1.0 . . . . . . . . . . . . A . 6 HIS N . . . . . . . . . c30446_6cxn 1 . 18 . 2248 . 1 1 6 HIS ND1 N -2.971 8.077 -3.798 . . . 1.0 . . . . . . . . . . . . A . 6 HIS ND1 . . . . . . . . . c30446_6cxn 1 . 18 . 2249 . 1 1 6 HIS NE2 N -2.499 9.272 -2.084 . . . 1.0 . . . . . . . . . . . . A . 6 HIS NE2 . . . . . . . . . c30446_6cxn 1 . 18 . 2250 . 1 1 6 HIS O O 1.629 9.457 -4.945 . . . 1.0 . . . . . . . . . . . . A . 6 HIS O . . . . . . . . . c30446_6cxn 1 . 19 . 2251 . 1 1 1 HIS C C 0.254 -6.476 3.155 . . . 1.0 . . . . . . . . . . . . A . 1 HIS C . . . . . . . . . c30446_6cxn 1 . 19 . 2252 . 1 1 1 HIS CA C -0.224 -7.925 3.159 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CA . . . . . . . . . c30446_6cxn 1 . 19 . 2253 . 1 1 1 HIS CB C -0.381 -8.427 4.596 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CB . . . . . . . . . c30446_6cxn 1 . 19 . 2254 . 1 1 1 HIS CD2 C -2.951 -8.699 4.369 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CD2 . . . . . . . . . c30446_6cxn 1 . 19 . 2255 . 1 1 1 HIS CE1 C -3.491 -8.413 6.475 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CE1 . . . . . . . . . c30446_6cxn 1 . 19 . 2256 . 1 1 1 HIS CG C -1.805 -8.484 5.057 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CG . . . . . . . . . c30446_6cxn 1 . 19 . 2257 . 1 1 1 HIS H1 H 1.694 -8.559 2.772 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H1 . . . . . . . . . c30446_6cxn 1 . 19 . 2258 . 1 1 1 HIS H2 H 0.627 -8.645 1.430 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H2 . . . . . . . . . c30446_6cxn 1 . 19 . 2259 . 1 1 1 HIS H3 H 0.506 -9.793 2.701 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H3 . . . . . . . . . c30446_6cxn 1 . 19 . 2260 . 1 1 1 HIS HA H -1.178 -7.982 2.657 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HA . . . . . . . . . c30446_6cxn 1 . 19 . 2261 . 1 1 1 HIS HB2 H 0.031 -9.422 4.669 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HB2 . . . . . . . . . c30446_6cxn 1 . 19 . 2262 . 1 1 1 HIS HB3 H 0.159 -7.769 5.262 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HB3 . . . . . . . . . c30446_6cxn 1 . 19 . 2263 . 1 1 1 HIS HD1 H -1.570 -8.132 7.122 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HD1 . . . . . . . . . c30446_6cxn 1 . 19 . 2264 . 1 1 1 HIS HD2 H -3.038 -8.876 3.306 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HD2 . . . . . . . . . c30446_6cxn 1 . 19 . 2265 . 1 1 1 HIS HE1 H -4.064 -8.320 7.386 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HE1 . . . . . . . . . c30446_6cxn 1 . 19 . 2266 . 1 1 1 HIS HE2 H -4.938 -8.685 5.051 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HE2 . . . . . . . . . c30446_6cxn 1 . 19 . 2267 . 1 1 1 HIS N N 0.737 -8.810 2.452 . . . 1.0 . . . . . . . . . . . . A . 1 HIS N . . . . . . . . . c30446_6cxn 1 . 19 . 2268 . 1 1 1 HIS ND1 N -2.178 -8.307 6.373 . . . 1.0 . . . . . . . . . . . . A . 1 HIS ND1 . . . . . . . . . c30446_6cxn 1 . 19 . 2269 . 1 1 1 HIS NE2 N -3.984 -8.649 5.273 . . . 1.0 . . . . . . . . . . . . A . 1 HIS NE2 . . . . . . . . . c30446_6cxn 1 . 19 . 2270 . 1 1 1 HIS O O 0.951 -6.040 4.071 . . . 1.0 . . . . . . . . . . . . A . 1 HIS O . . . . . . . . . c30446_6cxn 1 . 19 . 2271 . 1 1 2 ARG C C -0.889 -3.496 1.457 . . . 1.0 . . . . . . . . . . . . A . 2 ARG C . . . . . . . . . c30446_6cxn 1 . 19 . 2272 . 1 1 2 ARG CA C 0.263 -4.336 1.997 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CA . . . . . . . . . c30446_6cxn 1 . 19 . 2273 . 1 1 2 ARG CB C 1.481 -4.201 1.081 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CB . . . . . . . . . c30446_6cxn 1 . 19 . 2274 . 1 1 2 ARG CD C 3.414 -5.672 1.725 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CD . . . . . . . . . c30446_6cxn 1 . 19 . 2275 . 1 1 2 ARG CG C 2.808 -4.281 1.817 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CG . . . . . . . . . c30446_6cxn 1 . 19 . 2276 . 1 1 2 ARG CZ C 4.052 -7.262 -0.047 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CZ . . . . . . . . . c30446_6cxn 1 . 19 . 2277 . 1 1 2 ARG H H -0.683 -6.140 1.421 . . . 1.0 . . . . . . . . . . . . A . 2 ARG H . . . . . . . . . c30446_6cxn 1 . 19 . 2278 . 1 1 2 ARG HA H 0.522 -3.977 2.981 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HA . . . . . . . . . c30446_6cxn 1 . 19 . 2279 . 1 1 2 ARG HB2 H 1.453 -4.992 0.345 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB2 . . . . . . . . . c30446_6cxn 1 . 19 . 2280 . 1 1 2 ARG HB3 H 1.432 -3.249 0.574 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB3 . . . . . . . . . c30446_6cxn 1 . 19 . 2281 . 1 1 2 ARG HD2 H 4.300 -5.707 2.341 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD2 . . . . . . . . . c30446_6cxn 1 . 19 . 2282 . 1 1 2 ARG HD3 H 2.694 -6.390 2.091 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD3 . . . . . . . . . c30446_6cxn 1 . 19 . 2283 . 1 1 2 ARG HE H 3.820 -5.296 -0.303 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HE . . . . . . . . . c30446_6cxn 1 . 19 . 2284 . 1 1 2 ARG HG2 H 3.495 -3.571 1.380 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG2 . . . . . . . . . c30446_6cxn 1 . 19 . 2285 . 1 1 2 ARG HG3 H 2.647 -4.036 2.857 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG3 . . . . . . . . . c30446_6cxn 1 . 19 . 2286 . 1 1 2 ARG HH11 H 3.764 -8.103 1.771 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH11 . . . . . . . . . c30446_6cxn 1 . 19 . 2287 . 1 1 2 ARG HH12 H 4.213 -9.200 0.508 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH12 . . . . . . . . . c30446_6cxn 1 . 19 . 2288 . 1 1 2 ARG HH21 H 4.410 -6.739 -1.966 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH21 . . . . . . . . . c30446_6cxn 1 . 19 . 2289 . 1 1 2 ARG HH22 H 4.579 -8.426 -1.613 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH22 . . . . . . . . . c30446_6cxn 1 . 19 . 2290 . 1 1 2 ARG N N -0.127 -5.736 2.119 . . . 1.0 . . . . . . . . . . . . A . 2 ARG N . . . . . . . . . c30446_6cxn 1 . 19 . 2291 . 1 1 2 ARG NE N 3.778 -6.023 0.354 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NE . . . . . . . . . c30446_6cxn 1 . 19 . 2292 . 1 1 2 ARG NH1 N 4.006 -8.271 0.815 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH1 . . . . . . . . . c30446_6cxn 1 . 19 . 2293 . 1 1 2 ARG NH2 N 4.373 -7.495 -1.312 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH2 . . . . . . . . . c30446_6cxn 1 . 19 . 2294 . 1 1 2 ARG O O -1.936 -4.026 1.084 . . . 1.0 . . . . . . . . . . . . A . 2 ARG O . . . . . . . . . c30446_6cxn 1 . 19 . 2295 . 1 1 3 PHE C C -1.219 -0.500 -0.293 . . . 1.0 . . . . . . . . . . . . A . 3 PHE C . . . . . . . . . c30446_6cxn 1 . 19 . 2296 . 1 1 3 PHE CA C -1.712 -1.269 0.926 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CA . . . . . . . . . c30446_6cxn 1 . 19 . 2297 . 1 1 3 PHE CB C -2.136 -0.297 2.026 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CB . . . . . . . . . c30446_6cxn 1 . 19 . 2298 . 1 1 3 PHE CD1 C -4.444 -1.313 2.018 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CD1 . . . . . . . . . c30446_6cxn 1 . 19 . 2299 . 1 1 3 PHE CD2 C -4.211 0.980 2.633 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CD2 . . . . . . . . . c30446_6cxn 1 . 19 . 2300 . 1 1 3 PHE CE1 C -5.810 -1.228 2.206 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CE1 . . . . . . . . . c30446_6cxn 1 . 19 . 2301 . 1 1 3 PHE CE2 C -5.577 1.070 2.823 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CE2 . . . . . . . . . c30446_6cxn 1 . 19 . 2302 . 1 1 3 PHE CG C -3.627 -0.210 2.228 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CG . . . . . . . . . c30446_6cxn 1 . 19 . 2303 . 1 1 3 PHE CZ C -6.377 -0.035 2.609 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CZ . . . . . . . . . c30446_6cxn 1 . 19 . 2304 . 1 1 3 PHE H H 0.166 -1.820 1.731 . . . 1.0 . . . . . . . . . . . . A . 3 PHE H . . . . . . . . . c30446_6cxn 1 . 19 . 2305 . 1 1 3 PHE HA H -2.562 -1.854 0.635 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HA . . . . . . . . . c30446_6cxn 1 . 19 . 2306 . 1 1 3 PHE HB2 H -1.693 -0.610 2.964 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HB2 . . . . . . . . . c30446_6cxn 1 . 19 . 2307 . 1 1 3 PHE HB3 H -1.780 0.689 1.771 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HB3 . . . . . . . . . c30446_6cxn 1 . 19 . 2308 . 1 1 3 PHE HD1 H -4.002 -2.247 1.701 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HD1 . . . . . . . . . c30446_6cxn 1 . 19 . 2309 . 1 1 3 PHE HD2 H -3.587 1.845 2.800 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HD2 . . . . . . . . . c30446_6cxn 1 . 19 . 2310 . 1 1 3 PHE HE1 H -6.434 -2.094 2.038 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HE1 . . . . . . . . . c30446_6cxn 1 . 19 . 2311 . 1 1 3 PHE HE2 H -6.018 2.004 3.137 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HE2 . . . . . . . . . c30446_6cxn 1 . 19 . 2312 . 1 1 3 PHE HZ H -7.445 0.033 2.757 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HZ . . . . . . . . . c30446_6cxn 1 . 19 . 2313 . 1 1 3 PHE N N -0.689 -2.183 1.419 . . . 1.0 . . . . . . . . . . . . A . 3 PHE N . . . . . . . . . c30446_6cxn 1 . 19 . 2314 . 1 1 3 PHE O O -0.040 -0.555 -0.643 . . . 1.0 . . . . . . . . . . . . A . 3 PHE O . . . . . . . . . c30446_6cxn 1 . 19 . 2315 . 1 1 4 LEU C C -1.360 2.392 -1.761 . . . 1.0 . . . . . . . . . . . . A . 4 LEU C . . . . . . . . . c30446_6cxn 1 . 19 . 2316 . 1 1 4 LEU CA C -1.807 0.982 -2.129 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CA . . . . . . . . . c30446_6cxn 1 . 19 . 2317 . 1 1 4 LEU CB C -3.006 1.039 -3.073 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CB . . . . . . . . . c30446_6cxn 1 . 19 . 2318 . 1 1 4 LEU CD1 C -4.807 -0.416 -2.135 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CD1 . . . . . . . . . c30446_6cxn 1 . 19 . 2319 . 1 1 4 LEU CD2 C -4.394 -0.385 -4.601 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CD2 . . . . . . . . . c30446_6cxn 1 . 19 . 2320 . 1 1 4 LEU CG C -3.759 -0.282 -3.223 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CG . . . . . . . . . c30446_6cxn 1 . 19 . 2321 . 1 1 4 LEU H H -3.059 0.205 -0.614 . . . 1.0 . . . . . . . . . . . . A . 4 LEU H . . . . . . . . . c30446_6cxn 1 . 19 . 2322 . 1 1 4 LEU HA H -1.000 0.478 -2.629 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HA . . . . . . . . . c30446_6cxn 1 . 19 . 2323 . 1 1 4 LEU HB2 H -3.695 1.785 -2.703 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HB2 . . . . . . . . . c30446_6cxn 1 . 19 . 2324 . 1 1 4 LEU HB3 H -2.659 1.343 -4.048 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HB3 . . . . . . . . . c30446_6cxn 1 . 19 . 2325 . 1 1 4 LEU HD11 H -5.055 0.563 -1.755 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD11 . . . . . . . . . c30446_6cxn 1 . 19 . 2326 . 1 1 4 LEU HD12 H -4.411 -1.022 -1.335 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD12 . . . . . . . . . c30446_6cxn 1 . 19 . 2327 . 1 1 4 LEU HD13 H -5.692 -0.882 -2.540 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD13 . . . . . . . . . c30446_6cxn 1 . 19 . 2328 . 1 1 4 LEU HD21 H -3.719 -0.898 -5.271 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD21 . . . . . . . . . c30446_6cxn 1 . 19 . 2329 . 1 1 4 LEU HD22 H -4.593 0.606 -4.981 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD22 . . . . . . . . . c30446_6cxn 1 . 19 . 2330 . 1 1 4 LEU HD23 H -5.320 -0.936 -4.531 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD23 . . . . . . . . . c30446_6cxn 1 . 19 . 2331 . 1 1 4 LEU HG H -3.062 -1.099 -3.109 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HG . . . . . . . . . c30446_6cxn 1 . 19 . 2332 . 1 1 4 LEU N N -2.137 0.208 -0.941 . . . 1.0 . . . . . . . . . . . . A . 4 LEU N . . . . . . . . . c30446_6cxn 1 . 19 . 2333 . 1 1 4 LEU O O -2.129 3.172 -1.200 . . . 1.0 . . . . . . . . . . . . A . 4 LEU O . . . . . . . . . c30446_6cxn 1 . 19 . 2334 . 1 1 5 ARG C C 0.927 4.716 -3.056 . . . 1.0 . . . . . . . . . . . . A . 5 ARG C . . . . . . . . . c30446_6cxn 1 . 19 . 2335 . 1 1 5 ARG CA C 0.442 4.029 -1.783 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CA . . . . . . . . . c30446_6cxn 1 . 19 . 2336 . 1 1 5 ARG CB C 1.594 3.906 -0.782 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CB . . . . . . . . . c30446_6cxn 1 . 19 . 2337 . 1 1 5 ARG CD C 2.261 6.059 0.337 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CD . . . . . . . . . c30446_6cxn 1 . 19 . 2338 . 1 1 5 ARG CG C 1.428 4.791 0.444 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CG . . . . . . . . . c30446_6cxn 1 . 19 . 2339 . 1 1 5 ARG CZ C 0.722 7.634 1.442 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CZ . . . . . . . . . c30446_6cxn 1 . 19 . 2340 . 1 1 5 ARG H H 0.455 2.047 -2.525 . . . 1.0 . . . . . . . . . . . . A . 5 ARG H . . . . . . . . . c30446_6cxn 1 . 19 . 2341 . 1 1 5 ARG HA H -0.342 4.626 -1.342 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HA . . . . . . . . . c30446_6cxn 1 . 19 . 2342 . 1 1 5 ARG HB2 H 1.657 2.877 -0.449 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HB2 . . . . . . . . . c30446_6cxn 1 . 19 . 2343 . 1 1 5 ARG HB3 H 2.519 4.180 -1.276 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HB3 . . . . . . . . . c30446_6cxn 1 . 19 . 2344 . 1 1 5 ARG HD2 H 2.960 6.086 1.159 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HD2 . . . . . . . . . c30446_6cxn 1 . 19 . 2345 . 1 1 5 ARG HD3 H 2.805 6.042 -0.597 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HD3 . . . . . . . . . c30446_6cxn 1 . 19 . 2346 . 1 1 5 ARG HE H 1.402 7.820 -0.424 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HE . . . . . . . . . c30446_6cxn 1 . 19 . 2347 . 1 1 5 ARG HG2 H 0.388 5.063 0.541 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HG2 . . . . . . . . . c30446_6cxn 1 . 19 . 2348 . 1 1 5 ARG HG3 H 1.741 4.239 1.318 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HG3 . . . . . . . . . c30446_6cxn 1 . 19 . 2349 . 1 1 5 ARG HH11 H 1.288 6.069 2.592 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH11 . . . . . . . . . c30446_6cxn 1 . 19 . 2350 . 1 1 5 ARG HH12 H 0.204 7.189 3.345 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH12 . . . . . . . . . c30446_6cxn 1 . 19 . 2351 . 1 1 5 ARG HH21 H -0.024 9.295 0.565 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH21 . . . . . . . . . c30446_6cxn 1 . 19 . 2352 . 1 1 5 ARG HH22 H -0.542 9.020 2.195 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH22 . . . . . . . . . c30446_6cxn 1 . 19 . 2353 . 1 1 5 ARG N N -0.110 2.713 -2.080 . . . 1.0 . . . . . . . . . . . . A . 5 ARG N . . . . . . . . . c30446_6cxn 1 . 19 . 2354 . 1 1 5 ARG NE N 1.432 7.262 0.380 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NE . . . . . . . . . c30446_6cxn 1 . 19 . 2355 . 1 1 5 ARG NH1 N 0.739 6.904 2.551 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NH1 . . . . . . . . . c30446_6cxn 1 . 19 . 2356 . 1 1 5 ARG NH2 N -0.008 8.740 1.397 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NH2 . . . . . . . . . c30446_6cxn 1 . 19 . 2357 . 1 1 5 ARG O O 1.231 4.058 -4.051 . . . 1.0 . . . . . . . . . . . . A . 5 ARG O . . . . . . . . . c30446_6cxn 1 . 19 . 2358 . 1 1 6 HIS C C 1.942 8.194 -3.736 . . . 1.0 . . . . . . . . . . . . A . 6 HIS C . . . . . . . . . c30446_6cxn 1 . 19 . 2359 . 1 1 6 HIS CA C 1.444 6.819 -4.168 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CA . . . . . . . . . c30446_6cxn 1 . 19 . 2360 . 1 1 6 HIS CB C 0.307 6.969 -5.181 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CB . . . . . . . . . c30446_6cxn 1 . 19 . 2361 . 1 1 6 HIS CD2 C -1.427 7.768 -3.424 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CD2 . . . . . . . . . c30446_6cxn 1 . 19 . 2362 . 1 1 6 HIS CE1 C -2.566 9.140 -4.699 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CE1 . . . . . . . . . c30446_6cxn 1 . 19 . 2363 . 1 1 6 HIS CG C -0.865 7.740 -4.656 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CG . . . . . . . . . c30446_6cxn 1 . 19 . 2364 . 1 1 6 HIS H H 0.740 6.511 -2.196 . . . 1.0 . . . . . . . . . . . . A . 6 HIS H . . . . . . . . . c30446_6cxn 1 . 19 . 2365 . 1 1 6 HIS HA H 2.258 6.283 -4.631 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HA . . . . . . . . . c30446_6cxn 1 . 19 . 2366 . 1 1 6 HIS HB2 H 0.680 7.488 -6.056 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HB2 . . . . . . . . . c30446_6cxn 1 . 19 . 2367 . 1 1 6 HIS HB3 H -0.043 5.984 -5.467 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HB3 . . . . . . . . . c30446_6cxn 1 . 19 . 2368 . 1 1 6 HIS HD1 H -1.443 8.809 -6.377 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HD1 . . . . . . . . . c30446_6cxn 1 . 19 . 2369 . 1 1 6 HIS HD2 H -1.105 7.204 -2.559 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HD2 . . . . . . . . . c30446_6cxn 1 . 19 . 2370 . 1 1 6 HIS HE1 H -3.300 9.855 -5.042 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HE1 . . . . . . . . . c30446_6cxn 1 . 19 . 2371 . 1 1 6 HIS HE2 H -3.130 8.801 -2.760 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HE2 . . . . . . . . . c30446_6cxn 1 . 19 . 2372 . 1 1 6 HIS N N 0.996 6.043 -3.017 . . . 1.0 . . . . . . . . . . . . A . 6 HIS N . . . . . . . . . c30446_6cxn 1 . 19 . 2373 . 1 1 6 HIS ND1 N -1.602 8.610 -5.431 . . . 1.0 . . . . . . . . . . . . A . 6 HIS ND1 . . . . . . . . . c30446_6cxn 1 . 19 . 2374 . 1 1 6 HIS NE2 N -2.482 8.645 -3.478 . . . 1.0 . . . . . . . . . . . . A . 6 HIS NE2 . . . . . . . . . c30446_6cxn 1 . 19 . 2375 . 1 1 6 HIS O O 1.898 9.126 -4.566 . . . 1.0 . . . . . . . . . . . . A . 6 HIS O . . . . . . . . . c30446_6cxn 1 . 20 . 2376 . 1 1 1 HIS C C 0.002 -6.624 3.206 . . . 1.0 . . . . . . . . . . . . A . 1 HIS C . . . . . . . . . c30446_6cxn 1 . 20 . 2377 . 1 1 1 HIS CA C -0.169 -8.086 2.804 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CA . . . . . . . . . c30446_6cxn 1 . 20 . 2378 . 1 1 1 HIS CB C 1.058 -8.570 2.027 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CB . . . . . . . . . c30446_6cxn 1 . 20 . 2379 . 1 1 1 HIS CD2 C 1.611 -11.104 2.089 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CD2 . . . . . . . . . c30446_6cxn 1 . 20 . 2380 . 1 1 1 HIS CE1 C 2.763 -11.135 3.954 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CE1 . . . . . . . . . c30446_6cxn 1 . 20 . 2381 . 1 1 1 HIS CG C 1.646 -9.837 2.567 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CG . . . . . . . . . c30446_6cxn 1 . 20 . 2382 . 1 1 1 HIS H1 H -2.168 -7.793 2.419 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H1 . . . . . . . . . c30446_6cxn 1 . 20 . 2383 . 1 1 1 HIS H2 H -1.544 -9.293 1.864 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H2 . . . . . . . . . c30446_6cxn 1 . 20 . 2384 . 1 1 1 HIS H3 H -1.173 -7.842 1.025 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H3 . . . . . . . . . c30446_6cxn 1 . 20 . 2385 . 1 1 1 HIS HA H -0.285 -8.685 3.695 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HA . . . . . . . . . c30446_6cxn 1 . 20 . 2386 . 1 1 1 HIS HB2 H 0.777 -8.747 1.000 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HB2 . . . . . . . . . c30446_6cxn 1 . 20 . 2387 . 1 1 1 HIS HB3 H 1.822 -7.807 2.060 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HB3 . . . . . . . . . c30446_6cxn 1 . 20 . 2388 . 1 1 1 HIS HD1 H 2.577 -9.130 4.320 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HD1 . . . . . . . . . c30446_6cxn 1 . 20 . 2389 . 1 1 1 HIS HD2 H 1.123 -11.434 1.183 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HD2 . . . . . . . . . c30446_6cxn 1 . 20 . 2390 . 1 1 1 HIS HE1 H 3.349 -11.475 4.795 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HE1 . . . . . . . . . c30446_6cxn 1 . 20 . 2391 . 1 1 1 HIS HE2 H 2.533 -12.835 2.837 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HE2 . . . . . . . . . c30446_6cxn 1 . 20 . 2392 . 1 1 1 HIS N N -1.372 -8.270 1.951 . . . 1.0 . . . . . . . . . . . . A . 1 HIS N . . . . . . . . . c30446_6cxn 1 . 20 . 2393 . 1 1 1 HIS ND1 N 2.374 -9.891 3.736 . . . 1.0 . . . . . . . . . . . . A . 1 HIS ND1 . . . . . . . . . c30446_6cxn 1 . 20 . 2394 . 1 1 1 HIS NE2 N 2.312 -11.890 2.970 . . . 1.0 . . . . . . . . . . . . A . 1 HIS NE2 . . . . . . . . . c30446_6cxn 1 . 20 . 2395 . 1 1 1 HIS O O -0.004 -6.292 4.391 . . . 1.0 . . . . . . . . . . . . A . 1 HIS O . . . . . . . . . c30446_6cxn 1 . 20 . 2396 . 1 1 2 ARG C C -0.595 -3.505 1.571 . . . 1.0 . . . . . . . . . . . . A . 2 ARG C . . . . . . . . . c30446_6cxn 1 . 20 . 2397 . 1 1 2 ARG CA C 0.328 -4.330 2.461 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CA . . . . . . . . . c30446_6cxn 1 . 20 . 2398 . 1 1 2 ARG CB C 1.783 -3.922 2.224 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CB . . . . . . . . . c30446_6cxn 1 . 20 . 2399 . 1 1 2 ARG CD C 3.879 -4.547 0.986 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CD . . . . . . . . . c30446_6cxn 1 . 20 . 2400 . 1 1 2 ARG CG C 2.363 -4.462 0.926 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CG . . . . . . . . . c30446_6cxn 1 . 20 . 2401 . 1 1 2 ARG CZ C 5.724 -5.263 -0.484 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CZ . . . . . . . . . c30446_6cxn 1 . 20 . 2402 . 1 1 2 ARG H H 0.151 -6.082 1.287 . . . 1.0 . . . . . . . . . . . . A . 2 ARG H . . . . . . . . . c30446_6cxn 1 . 20 . 2403 . 1 1 2 ARG HA H 0.074 -4.141 3.494 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HA . . . . . . . . . c30446_6cxn 1 . 20 . 2404 . 1 1 2 ARG HB2 H 1.844 -2.844 2.199 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB2 . . . . . . . . . c30446_6cxn 1 . 20 . 2405 . 1 1 2 ARG HB3 H 2.385 -4.289 3.042 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB3 . . . . . . . . . c30446_6cxn 1 . 20 . 2406 . 1 1 2 ARG HD2 H 4.283 -3.546 0.998 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD2 . . . . . . . . . c30446_6cxn 1 . 20 . 2407 . 1 1 2 ARG HD3 H 4.163 -5.060 1.893 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD3 . . . . . . . . . c30446_6cxn 1 . 20 . 2408 . 1 1 2 ARG HE H 3.810 -5.780 -0.714 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HE . . . . . . . . . c30446_6cxn 1 . 20 . 2409 . 1 1 2 ARG HG2 H 1.964 -5.450 0.749 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG2 . . . . . . . . . c30446_6cxn 1 . 20 . 2410 . 1 1 2 ARG HG3 H 2.079 -3.806 0.116 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG3 . . . . . . . . . c30446_6cxn 1 . 20 . 2411 . 1 1 2 ARG HH11 H 6.287 -4.059 1.041 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH11 . . . . . . . . . c30446_6cxn 1 . 20 . 2412 . 1 1 2 ARG HH12 H 7.565 -4.578 -0.006 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH12 . . . . . . . . . c30446_6cxn 1 . 20 . 2413 . 1 1 2 ARG HH21 H 5.490 -6.465 -2.092 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH21 . . . . . . . . . c30446_6cxn 1 . 20 . 2414 . 1 1 2 ARG HH22 H 7.113 -5.944 -1.785 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH22 . . . . . . . . . c30446_6cxn 1 . 20 . 2415 . 1 1 2 ARG N N 0.155 -5.756 2.211 . . . 1.0 . . . . . . . . . . . . A . 2 ARG N . . . . . . . . . c30446_6cxn 1 . 20 . 2416 . 1 1 2 ARG NE N 4.433 -5.267 -0.159 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NE . . . . . . . . . c30446_6cxn 1 . 20 . 2417 . 1 1 2 ARG NH1 N 6.597 -4.577 0.244 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH1 . . . . . . . . . c30446_6cxn 1 . 20 . 2418 . 1 1 2 ARG NH2 N 6.143 -5.946 -1.540 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH2 . . . . . . . . . c30446_6cxn 1 . 20 . 2419 . 1 1 2 ARG O O -1.215 -4.031 0.647 . . . 1.0 . . . . . . . . . . . . A . 2 ARG O . . . . . . . . . c30446_6cxn 1 . 20 . 2420 . 1 1 3 PHE C C -0.744 -0.645 -0.038 . . . 1.0 . . . . . . . . . . . . A . 3 PHE C . . . . . . . . . c30446_6cxn 1 . 20 . 2421 . 1 1 3 PHE CA C -1.530 -1.313 1.082 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CA . . . . . . . . . c30446_6cxn 1 . 20 . 2422 . 1 1 3 PHE CB C -2.160 -0.257 1.988 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CB . . . . . . . . . c30446_6cxn 1 . 20 . 2423 . 1 1 3 PHE CD1 C -4.449 -1.189 1.491 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CD1 . . . . . . . . . c30446_6cxn 1 . 20 . 2424 . 1 1 3 PHE CD2 C -4.245 1.141 1.962 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CD2 . . . . . . . . . c30446_6cxn 1 . 20 . 2425 . 1 1 3 PHE CE1 C -5.813 -1.041 1.332 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CE1 . . . . . . . . . c30446_6cxn 1 . 20 . 2426 . 1 1 3 PHE CE2 C -5.609 1.294 1.802 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CE2 . . . . . . . . . c30446_6cxn 1 . 20 . 2427 . 1 1 3 PHE CG C -3.648 -0.100 1.808 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CG . . . . . . . . . c30446_6cxn 1 . 20 . 2428 . 1 1 3 PHE CZ C -6.394 0.202 1.487 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CZ . . . . . . . . . c30446_6cxn 1 . 20 . 2429 . 1 1 3 PHE H H -0.164 -1.850 2.606 . . . 1.0 . . . . . . . . . . . . A . 3 PHE H . . . . . . . . . c30446_6cxn 1 . 20 . 2430 . 1 1 3 PHE HA H -2.312 -1.901 0.642 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HA . . . . . . . . . c30446_6cxn 1 . 20 . 2431 . 1 1 3 PHE HB2 H -1.977 -0.523 3.022 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HB2 . . . . . . . . . c30446_6cxn 1 . 20 . 2432 . 1 1 3 PHE HB3 H -1.700 0.696 1.774 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HB3 . . . . . . . . . c30446_6cxn 1 . 20 . 2433 . 1 1 3 PHE HD1 H -3.997 -2.162 1.367 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HD1 . . . . . . . . . c30446_6cxn 1 . 20 . 2434 . 1 1 3 PHE HD2 H -3.633 1.996 2.207 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HD2 . . . . . . . . . c30446_6cxn 1 . 20 . 2435 . 1 1 3 PHE HE1 H -6.424 -1.896 1.085 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HE1 . . . . . . . . . c30446_6cxn 1 . 20 . 2436 . 1 1 3 PHE HE2 H -6.062 2.267 1.924 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HE2 . . . . . . . . . c30446_6cxn 1 . 20 . 2437 . 1 1 3 PHE HZ H -7.460 0.320 1.363 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HZ . . . . . . . . . c30446_6cxn 1 . 20 . 2438 . 1 1 3 PHE N N -0.682 -2.210 1.857 . . . 1.0 . . . . . . . . . . . . A . 3 PHE N . . . . . . . . . c30446_6cxn 1 . 20 . 2439 . 1 1 3 PHE O O 0.481 -0.747 -0.101 . . . 1.0 . . . . . . . . . . . . A . 3 PHE O . . . . . . . . . c30446_6cxn 1 . 20 . 2440 . 1 1 4 LEU C C -0.441 2.140 -1.683 . . . 1.0 . . . . . . . . . . . . A . 4 LEU C . . . . . . . . . c30446_6cxn 1 . 20 . 2441 . 1 1 4 LEU CA C -0.840 0.716 -2.053 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CA . . . . . . . . . c30446_6cxn 1 . 20 . 2442 . 1 1 4 LEU CB C -1.786 0.730 -3.253 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CB . . . . . . . . . c30446_6cxn 1 . 20 . 2443 . 1 1 4 LEU CD1 C -3.816 -0.598 -2.652 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CD1 . . . . . . . . . c30446_6cxn 1 . 20 . 2444 . 1 1 4 LEU CD2 C -2.858 -0.763 -4.959 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CD2 . . . . . . . . . c30446_6cxn 1 . 20 . 2445 . 1 1 4 LEU CG C -2.545 -0.576 -3.481 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CG . . . . . . . . . c30446_6cxn 1 . 20 . 2446 . 1 1 4 LEU H H -2.434 0.074 -0.821 . . . 1.0 . . . . . . . . . . . . A . 4 LEU H . . . . . . . . . c30446_6cxn 1 . 20 . 2447 . 1 1 4 LEU HA H 0.043 0.162 -2.317 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HA . . . . . . . . . c30446_6cxn 1 . 20 . 2448 . 1 1 4 LEU HB2 H -2.506 1.523 -3.109 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HB2 . . . . . . . . . c30446_6cxn 1 . 20 . 2449 . 1 1 4 LEU HB3 H -1.209 0.945 -4.139 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HB3 . . . . . . . . . c30446_6cxn 1 . 20 . 2450 . 1 1 4 LEU HD11 H -3.907 0.334 -2.115 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD11 . . . . . . . . . c30446_6cxn 1 . 20 . 2451 . 1 1 4 LEU HD12 H -3.767 -1.415 -1.948 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD12 . . . . . . . . . c30446_6cxn 1 . 20 . 2452 . 1 1 4 LEU HD13 H -4.670 -0.728 -3.299 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD13 . . . . . . . . . c30446_6cxn 1 . 20 . 2453 . 1 1 4 LEU HD21 H -2.774 -1.808 -5.215 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD21 . . . . . . . . . c30446_6cxn 1 . 20 . 2454 . 1 1 4 LEU HD22 H -2.158 -0.190 -5.550 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD22 . . . . . . . . . c30446_6cxn 1 . 20 . 2455 . 1 1 4 LEU HD23 H -3.862 -0.421 -5.160 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD23 . . . . . . . . . c30446_6cxn 1 . 20 . 2456 . 1 1 4 LEU HG H -1.929 -1.403 -3.159 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HG . . . . . . . . . c30446_6cxn 1 . 20 . 2457 . 1 1 4 LEU N N -1.462 0.034 -0.926 . . . 1.0 . . . . . . . . . . . . A . 4 LEU N . . . . . . . . . c30446_6cxn 1 . 20 . 2458 . 1 1 4 LEU O O -1.066 2.769 -0.829 . . . 1.0 . . . . . . . . . . . . A . 4 LEU O . . . . . . . . . c30446_6cxn 1 . 20 . 2459 . 1 1 5 ARG C C 0.944 4.872 -3.311 . . . 1.0 . . . . . . . . . . . . A . 5 ARG C . . . . . . . . . c30446_6cxn 1 . 20 . 2460 . 1 1 5 ARG CA C 1.088 3.995 -2.072 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CA . . . . . . . . . c30446_6cxn 1 . 20 . 2461 . 1 1 5 ARG CB C 2.549 3.958 -1.626 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CB . . . . . . . . . c30446_6cxn 1 . 20 . 2462 . 1 1 5 ARG CD C 3.694 6.191 -1.730 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CD . . . . . . . . . c30446_6cxn 1 . 20 . 2463 . 1 1 5 ARG CG C 2.972 5.190 -0.843 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CG . . . . . . . . . c30446_6cxn 1 . 20 . 2464 . 1 1 5 ARG CZ C 4.708 7.812 -0.174 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CZ . . . . . . . . . c30446_6cxn 1 . 20 . 2465 . 1 1 5 ARG H H 1.061 2.094 -3.002 . . . 1.0 . . . . . . . . . . . . A . 5 ARG H . . . . . . . . . c30446_6cxn 1 . 20 . 2466 . 1 1 5 ARG HA H 0.490 4.415 -1.277 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HA . . . . . . . . . c30446_6cxn 1 . 20 . 2467 . 1 1 5 ARG HB2 H 2.701 3.089 -0.996 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HB2 . . . . . . . . . c30446_6cxn 1 . 20 . 2468 . 1 1 5 ARG HB3 H 3.181 3.880 -2.503 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HB3 . . . . . . . . . c30446_6cxn 1 . 20 . 2469 . 1 1 5 ARG HD2 H 4.687 5.820 -1.936 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HD2 . . . . . . . . . c30446_6cxn 1 . 20 . 2470 . 1 1 5 ARG HD3 H 3.148 6.291 -2.656 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HD3 . . . . . . . . . c30446_6cxn 1 . 20 . 2471 . 1 1 5 ARG HE H 3.162 8.194 -1.377 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HE . . . . . . . . . c30446_6cxn 1 . 20 . 2472 . 1 1 5 ARG HG2 H 2.092 5.661 -0.429 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HG2 . . . . . . . . . c30446_6cxn 1 . 20 . 2473 . 1 1 5 ARG HG3 H 3.630 4.888 -0.044 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HG3 . . . . . . . . . c30446_6cxn 1 . 20 . 2474 . 1 1 5 ARG HH11 H 5.578 5.986 -0.164 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH11 . . . . . . . . . c30446_6cxn 1 . 20 . 2475 . 1 1 5 ARG HH12 H 6.268 7.143 0.924 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH12 . . . . . . . . . c30446_6cxn 1 . 20 . 2476 . 1 1 5 ARG HH21 H 4.071 9.716 0.050 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH21 . . . . . . . . . c30446_6cxn 1 . 20 . 2477 . 1 1 5 ARG HH22 H 5.414 9.261 1.045 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH22 . . . . . . . . . c30446_6cxn 1 . 20 . 2478 . 1 1 5 ARG N N 0.604 2.644 -2.332 . . . 1.0 . . . . . . . . . . . . A . 5 ARG N . . . . . . . . . c30446_6cxn 1 . 20 . 2479 . 1 1 5 ARG NE N 3.801 7.504 -1.098 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NE . . . . . . . . . c30446_6cxn 1 . 20 . 2480 . 1 1 5 ARG NH1 N 5.590 6.905 0.228 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NH1 . . . . . . . . . c30446_6cxn 1 . 20 . 2481 . 1 1 5 ARG NH2 N 4.733 9.029 0.350 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NH2 . . . . . . . . . c30446_6cxn 1 . 20 . 2482 . 1 1 5 ARG O O 1.177 4.423 -4.433 . . . 1.0 . . . . . . . . . . . . A . 5 ARG O . . . . . . . . . c30446_6cxn 1 . 20 . 2483 . 1 1 6 HIS C C 0.506 8.507 -3.709 . . . 1.0 . . . . . . . . . . . . A . 6 HIS C . . . . . . . . . c30446_6cxn 1 . 20 . 2484 . 1 1 6 HIS CA C 0.384 7.068 -4.200 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CA . . . . . . . . . c30446_6cxn 1 . 20 . 2485 . 1 1 6 HIS CB C -0.976 6.857 -4.867 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CB . . . . . . . . . c30446_6cxn 1 . 20 . 2486 . 1 1 6 HIS CD2 C -2.460 6.580 -2.757 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CD2 . . . . . . . . . c30446_6cxn 1 . 20 . 2487 . 1 1 6 HIS CE1 C -4.008 8.049 -3.259 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CE1 . . . . . . . . . c30446_6cxn 1 . 20 . 2488 . 1 1 6 HIS CG C -2.135 7.119 -3.956 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CG . . . . . . . . . c30446_6cxn 1 . 20 . 2489 . 1 1 6 HIS H H 0.387 6.427 -2.183 . . . 1.0 . . . . . . . . . . . . A . 6 HIS H . . . . . . . . . c30446_6cxn 1 . 20 . 2490 . 1 1 6 HIS HA H 1.162 6.879 -4.924 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HA . . . . . . . . . c30446_6cxn 1 . 20 . 2491 . 1 1 6 HIS HB2 H -1.062 7.526 -5.714 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HB2 . . . . . . . . . c30446_6cxn 1 . 20 . 2492 . 1 1 6 HIS HB3 H -1.046 5.830 -5.210 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HB3 . . . . . . . . . c30446_6cxn 1 . 20 . 2493 . 1 1 6 HIS HD1 H -3.174 8.594 -5.046 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HD1 . . . . . . . . . c30446_6cxn 1 . 20 . 2494 . 1 1 6 HIS HD2 H -1.904 5.822 -2.223 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HD2 . . . . . . . . . c30446_6cxn 1 . 20 . 2495 . 1 1 6 HIS HE1 H -4.891 8.670 -3.210 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HE1 . . . . . . . . . c30446_6cxn 1 . 20 . 2496 . 1 1 6 HIS HE2 H -4.150 6.918 -1.558 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HE2 . . . . . . . . . c30446_6cxn 1 . 20 . 2497 . 1 1 6 HIS N N 0.558 6.127 -3.100 . . . 1.0 . . . . . . . . . . . . A . 6 HIS N . . . . . . . . . c30446_6cxn 1 . 20 . 2498 . 1 1 6 HIS ND1 N -3.126 8.036 -4.242 . . . 1.0 . . . . . . . . . . . . A . 6 HIS ND1 . . . . . . . . . c30446_6cxn 1 . 20 . 2499 . 1 1 6 HIS NE2 N -3.628 7.175 -2.346 . . . 1.0 . . . . . . . . . . . . A . 6 HIS NE2 . . . . . . . . . c30446_6cxn 1 . 20 . 2500 . 1 1 6 HIS O O 1.464 9.193 -4.124 . . . 1.0 . . . . . . . . . . . . A . 6 HIS O . . . . . . . . . c30446_6cxn 1 stop_ save_ ########################### # Constraint Statistics # ########################### save_constraint_statistics _Constraint_stat_list.Sf_framecode constraint_statistics _Constraint_stat_list.Sf_category constraint_statistics _Constraint_stat_list.Entry_ID c30446_6cxn _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 6cxn.mr . . 'MR format' 1 comment 'Not applicable' 'Not applicable' 0 c30446_6cxn 1 1 6cxn.mr . . XPLOR/CNS 2 distance NOE simple 126 c30446_6cxn 1 1 6cxn.mr . . 'MR format' 3 'nomenclature mapping' 'Not applicable' 'Not applicable' 0 c30446_6cxn 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 c30446_6cxn _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 . . . . c30446_6cxn 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 1 1 HIS HD2 H . . . 1 1 1 1 HIS HB2 H . . . . . 3.4 1.8 3.4 . . . . . A . 1 HIS HD2 . . A . 1 HIS HB2 . . . 1 . HD2 . . . . . 1 . HB# . . c30446_6cxn 1 1 2 OR . 1 1 1 1 HIS HD2 H . . . 1 1 1 1 HIS HB3 H . . . . . 3.4 1.8 3.4 . . . . . A . 1 HIS HD2 . . A . 1 HIS HB3 . . . 1 . HD2 . . . . . 1 . HB# . . c30446_6cxn 1 2 1 OR . 1 1 3 3 PHE H H . . . 1 1 2 2 ARG HB2 H . . . . . 5.0 1.8 5.0 . . . . . A . 3 PHE H . . A . 2 ARG HB2 . . . 3 . HN . . . . . 2 . HB# . . c30446_6cxn 1 2 2 OR . 1 1 3 3 PHE H H . . . 1 1 2 2 ARG HB3 H . . . . . 5.0 1.8 5.0 . . . . . A . 3 PHE H . . A . 2 ARG HB3 . . . 3 . HN . . . . . 2 . HB# . . c30446_6cxn 1 3 1 OR . 1 1 5 5 ARG HE H . . . 1 1 5 5 ARG HD2 H . . . . . 3.4 1.8 3.4 . . . . . A . 5 ARG HE . . A . 5 ARG HD2 . . . 5 . HE . . . . . 5 . HD# . . c30446_6cxn 1 3 2 OR . 1 1 5 5 ARG HE H . . . 1 1 5 5 ARG HD3 H . . . . . 3.4 1.8 3.4 . . . . . A . 5 ARG HE . . A . 5 ARG HD3 . . . 5 . HE . . . . . 5 . HD# . . c30446_6cxn 1 4 1 OR . 1 1 5 5 ARG HE H . . . 1 1 5 5 ARG HD2 H . . . . . 3.4 1.8 3.4 . . . . . A . 5 ARG HE . . A . 5 ARG HD2 . . . 5 . HE . . . . . 5 . HD# . . c30446_6cxn 1 4 2 OR . 1 1 5 5 ARG HE H . . . 1 1 5 5 ARG HD3 H . . . . . 3.4 1.8 3.4 . . . . . A . 5 ARG HE . . A . 5 ARG HD3 . . . 5 . HE . . . . . 5 . HD# . . c30446_6cxn 1 5 1 OR . 1 1 2 2 ARG HE H . . . 1 1 2 2 ARG HD2 H . . . . . 3.4 1.8 3.4 . . . . . A . 2 ARG HE . . A . 2 ARG HD2 . . . 2 . HE . . . . . 2 . HD# . . c30446_6cxn 1 5 2 OR . 1 1 2 2 ARG HE H . . . 1 1 2 2 ARG HD3 H . . . . . 3.4 1.8 3.4 . . . . . A . 2 ARG HE . . A . 2 ARG HD3 . . . 2 . HE . . . . . 2 . HD# . . c30446_6cxn 1 6 1 OR . 1 1 2 2 ARG HE H . . . 1 1 2 2 ARG HD2 H . . . . . 3.4 1.8 3.4 . . . . . A . 2 ARG HE . . A . 2 ARG HD2 . . . 2 . HE . . . . . 2 . HD# . . c30446_6cxn 1 6 2 OR . 1 1 2 2 ARG HE H . . . 1 1 2 2 ARG HD3 H . . . . . 3.4 1.8 3.4 . . . . . A . 2 ARG HE . . A . 2 ARG HD3 . . . 2 . HE . . . . . 2 . HD# . . c30446_6cxn 1 7 1 OR . 1 1 4 4 LEU H H . . . 1 1 4 4 LEU HB2 H . . . . . 3.4 1.8 3.4 . . . . . A . 4 LEU H . . A . 4 LEU HB2 . . . 4 . HN . . . . . 4 . HB# . . c30446_6cxn 1 7 2 OR . 1 1 4 4 LEU HB3 H . . . 1 1 4 4 LEU H H . . . . . 3.4 1.8 3.4 . . . . . A . 4 LEU HB3 . . A . 4 LEU H . . . 4 . HB# . . . . . 4 . HN . . c30446_6cxn 1 8 1 OR . 1 1 1 1 HIS HD2 H . . . 1 1 1 1 HIS HB2 H . . . . . 5.0 1.8 5.0 . . . . . A . 1 HIS HD2 . . A . 1 HIS HB2 . . . 1 . HD2 . . . . . 1 . HB# . . c30446_6cxn 1 8 2 OR . 1 1 1 1 HIS HD2 H . . . 1 1 1 1 HIS HB3 H . . . . . 5.0 1.8 5.0 . . . . . A . 1 HIS HD2 . . A . 1 HIS HB3 . . . 1 . HD2 . . . . . 1 . HB# . . c30446_6cxn 1 9 1 OR . 1 1 2 2 ARG HE H . . . 1 1 2 2 ARG HD2 H . . . . . 5.0 1.8 5.0 . . . . . A . 2 ARG HE . . A . 2 ARG HD2 . . . 2 . HE . . . . . 2 . HD# . . c30446_6cxn 1 9 2 OR . 1 1 2 2 ARG HE H . . . 1 1 2 2 ARG HD3 H . . . . . 5.0 1.8 5.0 . . . . . A . 2 ARG HE . . A . 2 ARG HD3 . . . 2 . HE . . . . . 2 . HD# . . c30446_6cxn 1 10 1 OR . 1 1 5 5 ARG HE H . . . 1 1 5 5 ARG HD2 H . . . . . 5.0 1.8 5.0 . . . . . A . 5 ARG HE . . A . 5 ARG HD2 . . . 5 . HE . . . . . 5 . HD# . . c30446_6cxn 1 10 2 OR . 1 1 5 5 ARG HE H . . . 1 1 5 5 ARG HD3 H . . . . . 5.0 1.8 5.0 . . . . . A . 5 ARG HE . . A . 5 ARG HD3 . . . 5 . HE . . . . . 5 . HD# . . c30446_6cxn 1 11 1 OR . 1 1 5 5 ARG HE H . . . 1 1 5 5 ARG HD2 H . . . . . 5.0 1.8 5.0 . . . . . A . 5 ARG HE . . A . 5 ARG HD2 . . . 5 . HE . . . . . 5 . HD# . . c30446_6cxn 1 11 2 OR . 1 1 5 5 ARG HE H . . . 1 1 5 5 ARG HD3 H . . . . . 5.0 1.8 5.0 . . . . . A . 5 ARG HE . . A . 5 ARG HD3 . . . 5 . HE . . . . . 5 . HD# . . c30446_6cxn 1 12 1 OR . 1 1 3 3 PHE HB2 H . . . 1 1 3 3 PHE HD1 H . . . . . 2.8 1.8 2.8 . . . . . A . 3 PHE HB2 . . A . 3 PHE HD1 . . . 3 . HB2 . . . . . 3 . HD# . . c30446_6cxn 1 12 2 OR . 1 1 3 3 PHE HB2 H . . . 1 1 3 3 PHE HD2 H . . . . . 2.8 1.8 2.8 . . . . . A . 3 PHE HB2 . . A . 3 PHE HD2 . . . 3 . HB2 . . . . . 3 . HD# . . c30446_6cxn 1 13 1 OR . 1 1 3 3 PHE HB3 H . . . 1 1 3 3 PHE HD1 H . . . . . 2.8 1.8 2.8 . . . . . A . 3 PHE HB3 . . A . 3 PHE HD1 . . . 3 . HB1 . . . . . 3 . HD# . . c30446_6cxn 1 13 2 OR . 1 1 3 3 PHE HB3 H . . . 1 1 3 3 PHE HD2 H . . . . . 2.8 1.8 2.8 . . . . . A . 3 PHE HB3 . . A . 3 PHE HD2 . . . 3 . HB1 . . . . . 3 . HD# . . c30446_6cxn 1 14 1 OR . 1 1 1 1 HIS HA H . . . 1 1 1 1 HIS HB2 H . . . . . 5.0 1.8 5.0 . . . . . A . 1 HIS HA . . A . 1 HIS HB2 . . . 1 . HA . . . . . 1 . HB# . . c30446_6cxn 1 14 2 OR . 1 1 1 1 HIS HB3 H . . . 1 1 1 1 HIS HA H . . . . . 5.0 1.8 5.0 . . . . . A . 1 HIS HB3 . . A . 1 HIS HA . . . 1 . HB# . . . . . 1 . HA . . c30446_6cxn 1 15 1 OR . 1 1 5 5 ARG HA H . . . 1 1 5 5 ARG HD2 H . . . . . 3.4 1.8 3.4 . . . . . A . 5 ARG HA . . A . 5 ARG HD2 . . . 5 . HA . . . . . 5 . HD# . . c30446_6cxn 1 15 2 OR . 1 1 5 5 ARG HD3 H . . . 1 1 5 5 ARG HA H . . . . . 3.4 1.8 3.4 . . . . . A . 5 ARG HD3 . . A . 5 ARG HA . . . 5 . HD# . . . . . 5 . HA . . c30446_6cxn 1 16 1 OR . 1 1 4 4 LEU HA H . . . 1 1 4 4 LEU HB2 H . . . . . 3.4 1.8 3.4 . . . . . A . 4 LEU HA . . A . 4 LEU HB2 . . . 4 . HA . . . . . 4 . HB# . . c30446_6cxn 1 16 2 OR . 1 1 4 4 LEU HB3 H . . . 1 1 4 4 LEU HA H . . . . . 3.4 1.8 3.4 . . . . . A . 4 LEU HB3 . . A . 4 LEU HA . . . 4 . HB# . . . . . 4 . HA . . c30446_6cxn 1 17 1 OR . 1 1 2 2 ARG HA H . . . 1 1 2 2 ARG HG2 H . . . . . 5.0 1.8 5.0 . . . . . A . 2 ARG HA . . A . 2 ARG HG2 . . . 2 . HA . . . . . 2 . HG# . . c30446_6cxn 1 17 2 OR . 1 1 2 2 ARG HG3 H . . . 1 1 2 2 ARG HA H . . . . . 5.0 1.8 5.0 . . . . . A . 2 ARG HG3 . . A . 2 ARG HA . . . 2 . HG# . . . . . 2 . HA . . c30446_6cxn 1 18 1 OR . 1 1 1 1 HIS HA H . . . 1 1 2 2 ARG HB2 H . . . . . 5.0 1.8 5.0 . . . . . A . 1 HIS HA . . A . 2 ARG HB2 . . . 1 . HA . . . . . 2 . HB# . . c30446_6cxn 1 18 2 OR . 1 1 2 2 ARG HB3 H . . . 1 1 1 1 HIS HA H . . . . . 5.0 1.8 5.0 . . . . . A . 2 ARG HB3 . . A . 1 HIS HA . . . 2 . HB# . . . . . 1 . HA . . c30446_6cxn 1 19 1 OR . 1 1 2 2 ARG HA H . . . 1 1 2 2 ARG HB2 H . . . . . 2.8 1.8 2.8 . . . . . A . 2 ARG HA . . A . 2 ARG HB2 . . . 2 . HA . . . . . 2 . HB# . . c30446_6cxn 1 19 2 OR . 1 1 2 2 ARG HB3 H . . . 1 1 2 2 ARG HA H . . . . . 2.8 1.8 2.8 . . . . . A . 2 ARG HB3 . . A . 2 ARG HA . . . 2 . HB# . . . . . 2 . HA . . c30446_6cxn 1 20 1 OR . 1 1 5 5 ARG HB2 H . . . 1 1 5 5 ARG HD2 H . . . . . 3.4 1.8 3.4 . . . . . A . 5 ARG HB2 . . A . 5 ARG HD2 . . . 5 . HB2 . . . . . 5 . HD# . . c30446_6cxn 1 20 2 OR . 1 1 5 5 ARG HD3 H . . . 1 1 5 5 ARG HB2 H . . . . . 3.4 1.8 3.4 . . . . . A . 5 ARG HD3 . . A . 5 ARG HB2 . . . 5 . HD# . . . . . 5 . HB2 . . c30446_6cxn 1 21 1 OR . 1 1 5 5 ARG HB3 H . . . 1 1 5 5 ARG HD2 H . . . . . 2.8 1.8 2.8 . . . . . A . 5 ARG HB3 . . A . 5 ARG HD2 . . . 5 . HB1 . . . . . 5 . HD# . . c30446_6cxn 1 21 2 OR . 1 1 5 5 ARG HD3 H . . . 1 1 5 5 ARG HB3 H . . . . . 2.8 1.8 2.8 . . . . . A . 5 ARG HD3 . . A . 5 ARG HB3 . . . 5 . HD# . . . . . 5 . HB1 . . c30446_6cxn 1 22 1 OR . 1 1 2 2 ARG HB3 H . . . 1 1 2 2 ARG HD2 H . . . . . 2.8 1.8 2.8 . . . . . A . 2 ARG HB3 . . A . 2 ARG HD2 . . . 2 . HB# . . . . . 2 . HD# . . c30446_6cxn 1 22 2 OR . 1 1 2 2 ARG HB2 H . . . 1 1 2 2 ARG HD2 H . . . . . 2.8 1.8 2.8 . . . . . A . 2 ARG HB2 . . A . 2 ARG HD2 . . . 2 . HB# . . . . . 2 . HD# . . c30446_6cxn 1 22 3 OR . 1 1 2 2 ARG HD3 H . . . 1 1 2 2 ARG HB2 H . . . . . 2.8 1.8 2.8 . . . . . A . 2 ARG HD3 . . A . 2 ARG HB2 . . . 2 . HD# . . . . . 2 . HB# . . c30446_6cxn 1 22 4 OR . 1 1 2 2 ARG HB3 H . . . 1 1 2 2 ARG HD3 H . . . . . 2.8 1.8 2.8 . . . . . A . 2 ARG HB3 . . A . 2 ARG HD3 . . . 2 . HB# . . . . . 2 . HD# . . c30446_6cxn 1 23 1 OR . 1 1 5 5 ARG HG2 H . . . 1 1 5 5 ARG HD2 H . . . . . 5.0 1.8 5.0 . . . . . A . 5 ARG HG2 . . A . 5 ARG HD2 . . . 5 . HG2 . . . . . 5 . HD# . . c30446_6cxn 1 23 2 OR . 1 1 5 5 ARG HD3 H . . . 1 1 5 5 ARG HG2 H . . . . . 5.0 1.8 5.0 . . . . . A . 5 ARG HD3 . . A . 5 ARG HG2 . . . 5 . HD# . . . . . 5 . HG2 . . c30446_6cxn 1 24 1 OR . 1 1 2 2 ARG HD2 H . . . 1 1 2 2 ARG HG2 H . . . . . 2.8 1.8 2.8 . . . . . A . 2 ARG HD2 . . A . 2 ARG HG2 . . . 2 . HD# . . . . . 2 . HG# . . c30446_6cxn 1 24 2 OR . 1 1 2 2 ARG HD3 H . . . 1 1 2 2 ARG HG2 H . . . . . 2.8 1.8 2.8 . . . . . A . 2 ARG HD3 . . A . 2 ARG HG2 . . . 2 . HD# . . . . . 2 . HG# . . c30446_6cxn 1 24 3 OR . 1 1 2 2 ARG HG3 H . . . 1 1 2 2 ARG HD2 H . . . . . 2.8 1.8 2.8 . . . . . A . 2 ARG HG3 . . A . 2 ARG HD2 . . . 2 . HG# . . . . . 2 . HD# . . c30446_6cxn 1 24 4 OR . 1 1 2 2 ARG HD3 H . . . 1 1 2 2 ARG HG3 H . . . . . 2.8 1.8 2.8 . . . . . A . 2 ARG HD3 . . A . 2 ARG HG3 . . . 2 . HD# . . . . . 2 . HG# . . c30446_6cxn 1 25 1 OR . 1 1 5 5 ARG HG3 H . . . 1 1 5 5 ARG HD2 H . . . . . 3.4 1.8 3.4 . . . . . A . 5 ARG HG3 . . A . 5 ARG HD2 . . . 5 . HG1 . . . . . 5 . HD# . . c30446_6cxn 1 25 2 OR . 1 1 5 5 ARG HD3 H . . . 1 1 5 5 ARG HG3 H . . . . . 3.4 1.8 3.4 . . . . . A . 5 ARG HD3 . . A . 5 ARG HG3 . . . 5 . HD# . . . . . 5 . HG1 . . c30446_6cxn 1 26 1 OR . 1 1 4 4 LEU MD1 H . . . 1 1 4 4 LEU HB2 H . . . . . 3.4 1.8 3.4 . . . . . A . 4 LEU MD1 . . A . 4 LEU HB2 . . . 4 . HD1# . . . . . 4 . HB# . . c30446_6cxn 1 26 2 OR . 1 1 4 4 LEU HB3 H . . . 1 1 4 4 LEU MD1 H . . . . . 3.4 1.8 3.4 . . . . . A . 4 LEU HB3 . . A . 4 LEU MD1 . . . 4 . HB# . . . . . 4 . HD1# . . c30446_6cxn 1 27 1 OR . 1 1 4 4 LEU MD2 H . . . 1 1 4 4 LEU HB2 H . . . . . 2.8 1.8 2.8 . . . . . A . 4 LEU MD2 . . A . 4 LEU HB2 . . . 4 . HD2# . . . . . 4 . HB# . . c30446_6cxn 1 27 2 OR . 1 1 4 4 LEU HB3 H . . . 1 1 4 4 LEU MD2 H . . . . . 2.8 1.8 2.8 . . . . . A . 4 LEU HB3 . . A . 4 LEU MD2 . . . 4 . HB# . . . . . 4 . HD2# . . c30446_6cxn 1 28 1 OR . 1 1 4 4 LEU MD1 H . . . 1 1 4 4 LEU HB2 H . . . . . 3.4 1.8 3.4 . . . . . A . 4 LEU MD1 . . A . 4 LEU HB2 . . . 4 . HD1# . . . . . 4 . HB# . . c30446_6cxn 1 28 2 OR . 1 1 4 4 LEU HB3 H . . . 1 1 4 4 LEU MD1 H . . . . . 3.4 1.8 3.4 . . . . . A . 4 LEU HB3 . . A . 4 LEU MD1 . . . 4 . HB# . . . . . 4 . HD1# . . c30446_6cxn 1 29 1 OR . 1 1 5 5 ARG HB3 H . . . 1 1 5 5 ARG HD2 H . . . . . 3.4 1.8 3.4 . . . . . A . 5 ARG HB3 . . A . 5 ARG HD2 . . . 5 . HB1 . . . . . 5 . HD# . . c30446_6cxn 1 29 2 OR . 1 1 5 5 ARG HD3 H . . . 1 1 5 5 ARG HB3 H . . . . . 3.4 1.8 3.4 . . . . . A . 5 ARG HD3 . . A . 5 ARG HB3 . . . 5 . HD# . . . . . 5 . HB1 . . c30446_6cxn 1 30 1 OR . 1 1 5 5 ARG HB2 H . . . 1 1 5 5 ARG HD2 H . . . . . 3.4 1.8 3.4 . . . . . A . 5 ARG HB2 . . A . 5 ARG HD2 . . . 5 . HB2 . . . . . 5 . HD# . . c30446_6cxn 1 30 2 OR . 1 1 5 5 ARG HD3 H . . . 1 1 5 5 ARG HB2 H . . . . . 3.4 1.8 3.4 . . . . . A . 5 ARG HD3 . . A . 5 ARG HB2 . . . 5 . HD# . . . . . 5 . HB2 . . c30446_6cxn 1 31 1 OR . 1 1 2 2 ARG HB2 H . . . 1 1 2 2 ARG HD2 H . . . . . 2.8 1.8 2.8 . . . . . A . 2 ARG HB2 . . A . 2 ARG HD2 . . . 2 . HB# . . . . . 2 . HD# . . c30446_6cxn 1 31 2 OR . 1 1 2 2 ARG HB3 H . . . 1 1 2 2 ARG HD2 H . . . . . 2.8 1.8 2.8 . . . . . A . 2 ARG HB3 . . A . 2 ARG HD2 . . . 2 . HB# . . . . . 2 . HD# . . c30446_6cxn 1 31 3 OR . 1 1 2 2 ARG HD3 H . . . 1 1 2 2 ARG HB2 H . . . . . 2.8 1.8 2.8 . . . . . A . 2 ARG HD3 . . A . 2 ARG HB2 . . . 2 . HD# . . . . . 2 . HB# . . c30446_6cxn 1 31 4 OR . 1 1 2 2 ARG HB3 H . . . 1 1 2 2 ARG HD3 H . . . . . 2.8 1.8 2.8 . . . . . A . 2 ARG HB3 . . A . 2 ARG HD3 . . . 2 . HB# . . . . . 2 . HD# . . c30446_6cxn 1 32 1 OR . 1 1 5 5 ARG HG2 H . . . 1 1 5 5 ARG HD2 H . . . . . 3.4 1.8 3.4 . . . . . A . 5 ARG HG2 . . A . 5 ARG HD2 . . . 5 . HG2 . . . . . 5 . HD# . . c30446_6cxn 1 32 2 OR . 1 1 5 5 ARG HD3 H . . . 1 1 5 5 ARG HG2 H . . . . . 3.4 1.8 3.4 . . . . . A . 5 ARG HD3 . . A . 5 ARG HG2 . . . 5 . HD# . . . . . 5 . HG2 . . c30446_6cxn 1 33 1 OR . 1 1 2 2 ARG HD2 H . . . 1 1 2 2 ARG HG2 H . . . . . 2.8 1.8 2.8 . . . . . A . 2 ARG HD2 . . A . 2 ARG HG2 . . . 2 . HD# . . . . . 2 . HG# . . c30446_6cxn 1 33 2 OR . 1 1 2 2 ARG HD3 H . . . 1 1 2 2 ARG HG2 H . . . . . 2.8 1.8 2.8 . . . . . A . 2 ARG HD3 . . A . 2 ARG HG2 . . . 2 . HD# . . . . . 2 . HG# . . c30446_6cxn 1 33 3 OR . 1 1 2 2 ARG HG3 H . . . 1 1 2 2 ARG HD2 H . . . . . 2.8 1.8 2.8 . . . . . A . 2 ARG HG3 . . A . 2 ARG HD2 . . . 2 . HG# . . . . . 2 . HD# . . c30446_6cxn 1 33 4 OR . 1 1 2 2 ARG HD3 H . . . 1 1 2 2 ARG HG3 H . . . . . 2.8 1.8 2.8 . . . . . A . 2 ARG HD3 . . A . 2 ARG HG3 . . . 2 . HD# . . . . . 2 . HG# . . c30446_6cxn 1 34 1 OR . 1 1 5 5 ARG HG3 H . . . 1 1 5 5 ARG HD2 H . . . . . 3.4 1.8 3.4 . . . . . A . 5 ARG HG3 . . A . 5 ARG HD2 . . . 5 . HG1 . . . . . 5 . HD# . . c30446_6cxn 1 34 2 OR . 1 1 5 5 ARG HD3 H . . . 1 1 5 5 ARG HG3 H . . . . . 3.4 1.8 3.4 . . . . . A . 5 ARG HD3 . . A . 5 ARG HG3 . . . 5 . HD# . . . . . 5 . HG1 . . c30446_6cxn 1 35 1 OR . 1 1 2 2 ARG HA H . . . 1 1 2 2 ARG HB2 H . . . . . 2.8 1.8 2.8 . . . . . A . 2 ARG HA . . A . 2 ARG HB2 . . . 2 . HA . . . . . 2 . HB# . . c30446_6cxn 1 35 2 OR . 1 1 2 2 ARG HB3 H . . . 1 1 2 2 ARG HA H . . . . . 2.8 1.8 2.8 . . . . . A . 2 ARG HB3 . . A . 2 ARG HA . . . 2 . HB# . . . . . 2 . HA . . c30446_6cxn 1 36 1 OR . 1 1 4 4 LEU HA H . . . 1 1 4 4 LEU HB2 H . . . . . 2.8 1.8 2.8 . . . . . A . 4 LEU HA . . A . 4 LEU HB2 . . . 4 . HA . . . . . 4 . HB# . . c30446_6cxn 1 36 2 OR . 1 1 4 4 LEU HB3 H . . . 1 1 4 4 LEU HA H . . . . . 2.8 1.8 2.8 . . . . . A . 4 LEU HB3 . . A . 4 LEU HA . . . 4 . HB# . . . . . 4 . HA . . c30446_6cxn 1 37 1 OR . 1 1 2 2 ARG HA H . . . 1 1 2 2 ARG HG2 H . . . . . 5.0 1.8 5.0 . . . . . A . 2 ARG HA . . A . 2 ARG HG2 . . . 2 . HA . . . . . 2 . HG# . . c30446_6cxn 1 37 2 OR . 1 1 2 2 ARG HG3 H . . . 1 1 2 2 ARG HA H . . . . . 5.0 1.8 5.0 . . . . . A . 2 ARG HG3 . . A . 2 ARG HA . . . 2 . HG# . . . . . 2 . HA . . c30446_6cxn 1 38 1 OR . 1 1 4 4 LEU MD2 H . . . 1 1 4 4 LEU HB2 H . . . . . 3.4 1.8 3.4 . . . . . A . 4 LEU MD2 . . A . 4 LEU HB2 . . . 4 . HD2# . . . . . 4 . HB# . . c30446_6cxn 1 38 2 OR . 1 1 4 4 LEU HB3 H . . . 1 1 4 4 LEU MD2 H . . . . . 3.4 1.8 3.4 . . . . . A . 4 LEU HB3 . . A . 4 LEU MD2 . . . 4 . HB# . . . . . 4 . HD2# . . c30446_6cxn 1 39 1 OR . 1 1 1 1 HIS HA H . . . 1 1 1 1 HIS HB2 H . . . . . 2.8 1.8 2.8 . . . . . A . 1 HIS HA . . A . 1 HIS HB2 . . . 1 . HA . . . . . 1 . HB# . . c30446_6cxn 1 39 2 OR . 1 1 1 1 HIS HB3 H . . . 1 1 1 1 HIS HA H . . . . . 2.8 1.8 2.8 . . . . . A . 1 HIS HB3 . . A . 1 HIS HA . . . 1 . HB# . . . . . 1 . HA . . c30446_6cxn 1 40 1 OR . 1 1 2 2 ARG HA H . . . 1 1 2 2 ARG HD2 H . . . . . 5.0 1.8 5.0 . . . . . A . 2 ARG HA . . A . 2 ARG HD2 . . . 2 . HA . . . . . 2 . HD# . . c30446_6cxn 1 40 2 OR . 1 1 2 2 ARG HD3 H . . . 1 1 2 2 ARG HA H . . . . . 5.0 1.8 5.0 . . . . . A . 2 ARG HD3 . . A . 2 ARG HA . . . 2 . HD# . . . . . 2 . HA . . c30446_6cxn 1 41 1 OR . 1 1 2 2 ARG HA H . . . 1 1 2 2 ARG HD2 H . . . . . 5.0 1.8 5.0 . . . . . A . 2 ARG HA . . A . 2 ARG HD2 . . . 2 . HA . . . . . 2 . HD# . . c30446_6cxn 1 41 2 OR . 1 1 2 2 ARG HD3 H . . . 1 1 2 2 ARG HA H . . . . . 5.0 1.8 5.0 . . . . . A . 2 ARG HD3 . . A . 2 ARG HA . . . 2 . HD# . . . . . 2 . HA . . c30446_6cxn 1 42 1 OR . 1 1 3 3 PHE H H . . . 1 1 3 3 PHE HD1 H . . . . . 5.0 1.8 5.0 . . . . . A . 3 PHE H . . A . 3 PHE HD1 . . . 3 . HN . . . . . 3 . HD# . . c30446_6cxn 1 42 2 OR . 1 1 3 3 PHE H H . . . 1 1 3 3 PHE HD2 H . . . . . 5.0 1.8 5.0 . . . . . A . 3 PHE H . . A . 3 PHE HD2 . . . 3 . HN . . . . . 3 . HD# . . c30446_6cxn 1 43 1 . . 1 1 3 3 PHE HZ H . . . 1 1 3 3 PHE QE H . . . . . 2.8 1.8 2.8 . . . . . A . 3 PHE HZ . . A . 3 PHE QE . . . 3 . HZ . . . . . 3 . HE# . . c30446_6cxn 1 44 1 . . 1 1 3 3 PHE HZ H . . . 1 1 3 3 PHE QE H . . . . . 2.8 1.8 2.8 . . . . . A . 3 PHE HZ . . A . 3 PHE QE . . . 3 . HZ . . . . . 3 . HE# . . c30446_6cxn 1 45 1 OR . 1 1 5 5 ARG HA H . . . 1 1 5 5 ARG HD2 H . . . . . 5.0 1.8 5.0 . . . . . A . 5 ARG HA . . A . 5 ARG HD2 . . . 5 . HA . . . . . 5 . HD# . . c30446_6cxn 1 45 2 OR . 1 1 5 5 ARG HD3 H . . . 1 1 5 5 ARG HA H . . . . . 5.0 1.8 5.0 . . . . . A . 5 ARG HD3 . . A . 5 ARG HA . . . 5 . HD# . . . . . 5 . HA . . c30446_6cxn 1 46 1 . . 1 1 1 1 HIS HD2 H . . . 1 1 1 1 HIS HA H . . . . . 5.0 1.8 5.0 . . . . . A . 1 HIS HD2 . . A . 1 HIS HA . . . 1 . HD2 . . . . . 1 . HA . . c30446_6cxn 1 47 1 . . 1 1 1 1 HIS HA H . . . 1 1 2 2 ARG H H . . . . . 5.0 1.8 5.0 . . . . . A . 1 HIS HA . . A . 2 ARG H . . . 1 . HA . . . . . 2 . HN . . c30446_6cxn 1 48 1 . . 1 1 2 2 ARG HA H . . . 1 1 3 3 PHE HD1 H . . . . . 5.0 1.8 5.0 . . . . . A . 2 ARG HA . . A . 3 PHE HD1 . . . 2 . HA . . . . . 3 . HD1 . . c30446_6cxn 1 49 1 . . 1 1 3 3 PHE H H . . . 1 1 2 2 ARG HA H . . . . . 2.8 1.8 2.8 . . . . . A . 3 PHE H . . A . 2 ARG HA . . . 3 . HN . . . . . 2 . HA . . c30446_6cxn 1 50 1 . . 1 1 3 3 PHE H H . . . 1 1 2 2 ARG HA H . . . . . 2.8 1.8 2.8 . . . . . A . 3 PHE H . . A . 2 ARG HA . . . 3 . HN . . . . . 2 . HA . . c30446_6cxn 1 51 1 . . 1 1 3 3 PHE HB3 H . . . 1 1 3 3 PHE HA H . . . . . 2.8 1.8 2.8 . . . . . A . 3 PHE HB3 . . A . 3 PHE HA . . . 3 . HB1 . . . . . 3 . HA . . c30446_6cxn 1 52 1 . . 1 1 3 3 PHE HB3 H . . . 1 1 3 3 PHE HA H . . . . . 5.0 1.8 5.0 . . . . . A . 3 PHE HB3 . . A . 3 PHE HA . . . 3 . HB1 . . . . . 3 . HA . . c30446_6cxn 1 53 1 . . 1 1 3 3 PHE HB2 H . . . 1 1 3 3 PHE HA H . . . . . 2.8 1.8 2.8 . . . . . A . 3 PHE HB2 . . A . 3 PHE HA . . . 3 . HB2 . . . . . 3 . HA . . c30446_6cxn 1 54 1 . . 1 1 3 3 PHE HB2 H . . . 1 1 3 3 PHE HA H . . . . . 5.0 1.8 5.0 . . . . . A . 3 PHE HB2 . . A . 3 PHE HA . . . 3 . HB2 . . . . . 3 . HA . . c30446_6cxn 1 55 1 . . 1 1 3 3 PHE HB2 H . . . 1 1 3 3 PHE HB3 H . . . . . 2.8 1.8 2.8 . . . . . A . 3 PHE HB2 . . A . 3 PHE HB3 . . . 3 . HB2 . . . . . 3 . HB1 . . c30446_6cxn 1 56 1 . . 1 1 3 3 PHE HB2 H . . . 1 1 3 3 PHE HB3 H . . . . . 2.8 1.8 2.8 . . . . . A . 3 PHE HB2 . . A . 3 PHE HB3 . . . 3 . HB2 . . . . . 3 . HB1 . . c30446_6cxn 1 57 1 . . 1 1 3 3 PHE H H . . . 1 1 3 3 PHE HA H . . . . . 5.0 1.8 5.0 . . . . . A . 3 PHE H . . A . 3 PHE HA . . . 3 . HN . . . . . 3 . HA . . c30446_6cxn 1 58 1 . . 1 1 3 3 PHE H H . . . 1 1 3 3 PHE HB3 H . . . . . 3.4 1.8 3.4 . . . . . A . 3 PHE H . . A . 3 PHE HB3 . . . 3 . HN . . . . . 3 . HB1 . . c30446_6cxn 1 59 1 . . 1 1 3 3 PHE H H . . . 1 1 3 3 PHE HB3 H . . . . . 5.0 1.8 5.0 . . . . . A . 3 PHE H . . A . 3 PHE HB3 . . . 3 . HN . . . . . 3 . HB1 . . c30446_6cxn 1 60 1 . . 1 1 3 3 PHE H H . . . 1 1 3 3 PHE HB2 H . . . . . 3.4 1.8 3.4 . . . . . A . 3 PHE H . . A . 3 PHE HB2 . . . 3 . HN . . . . . 3 . HB2 . . c30446_6cxn 1 61 1 . . 1 1 3 3 PHE H H . . . 1 1 3 3 PHE HB2 H . . . . . 5.0 1.8 5.0 . . . . . A . 3 PHE H . . A . 3 PHE HB2 . . . 3 . HN . . . . . 3 . HB2 . . c30446_6cxn 1 62 1 . . 1 1 3 3 PHE HD1 H . . . 1 1 4 4 LEU HG H . . . . . 5.0 1.8 5.0 . . . . . A . 3 PHE HD1 . . A . 4 LEU HG . . . 3 . HD1 . . . . . 4 . HG . . c30446_6cxn 1 63 1 . . 1 1 4 4 LEU H H . . . 1 1 3 3 PHE HA H . . . . . 2.8 1.8 2.8 . . . . . A . 4 LEU H . . A . 3 PHE HA . . . 4 . HN . . . . . 3 . HA . . c30446_6cxn 1 64 1 . . 1 1 4 4 LEU H H . . . 1 1 3 3 PHE HA H . . . . . 5.0 1.8 5.0 . . . . . A . 4 LEU H . . A . 3 PHE HA . . . 4 . HN . . . . . 3 . HA . . c30446_6cxn 1 65 1 . . 1 1 4 4 LEU H H . . . 1 1 3 3 PHE HB3 H . . . . . 5.0 1.8 5.0 . . . . . A . 4 LEU H . . A . 3 PHE HB3 . . . 4 . HN . . . . . 3 . HB1 . . c30446_6cxn 1 66 1 . . 1 1 4 4 LEU H H . . . 1 1 3 3 PHE HB2 H . . . . . 5.0 1.8 5.0 . . . . . A . 4 LEU H . . A . 3 PHE HB2 . . . 4 . HN . . . . . 3 . HB2 . . c30446_6cxn 1 67 1 . . 1 1 4 4 LEU HA H . . . 1 1 4 4 LEU MD1 H . . . . . 3.4 1.8 3.4 . . . . . A . 4 LEU HA . . A . 4 LEU MD1 . . . 4 . HA . . . . . 4 . HD1# . . c30446_6cxn 1 68 1 . . 1 1 4 4 LEU HA H . . . 1 1 4 4 LEU MD1 H . . . . . 5.0 1.8 5.0 . . . . . A . 4 LEU HA . . A . 4 LEU MD1 . . . 4 . HA . . . . . 4 . HD1# . . c30446_6cxn 1 69 1 . . 1 1 4 4 LEU HA H . . . 1 1 4 4 LEU MD2 H . . . . . 5.0 1.8 5.0 . . . . . A . 4 LEU HA . . A . 4 LEU MD2 . . . 4 . HA . . . . . 4 . HD2# . . c30446_6cxn 1 70 1 . . 1 1 4 4 LEU HA H . . . 1 1 4 4 LEU MD2 H . . . . . 5.0 1.8 5.0 . . . . . A . 4 LEU HA . . A . 4 LEU MD2 . . . 4 . HA . . . . . 4 . HD2# . . c30446_6cxn 1 71 1 . . 1 1 4 4 LEU HA H . . . 1 1 4 4 LEU HG H . . . . . 3.4 1.8 3.4 . . . . . A . 4 LEU HA . . A . 4 LEU HG . . . 4 . HA . . . . . 4 . HG . . c30446_6cxn 1 72 1 . . 1 1 4 4 LEU HA H . . . 1 1 4 4 LEU HG H . . . . . 2.8 1.8 2.8 . . . . . A . 4 LEU HA . . A . 4 LEU HG . . . 4 . HA . . . . . 4 . HG . . c30446_6cxn 1 73 1 . . 1 1 4 4 LEU MD1 H . . . 1 1 4 4 LEU HG H . . . . . 2.8 1.8 2.8 . . . . . A . 4 LEU MD1 . . A . 4 LEU HG . . . 4 . HD1# . . . . . 4 . HG . . c30446_6cxn 1 74 1 . . 1 1 4 4 LEU MD1 H . . . 1 1 4 4 LEU HG H . . . . . 3.4 1.8 3.4 . . . . . A . 4 LEU MD1 . . A . 4 LEU HG . . . 4 . HD1# . . . . . 4 . HG . . c30446_6cxn 1 75 1 . . 1 1 4 4 LEU MD2 H . . . 1 1 4 4 LEU HG H . . . . . 2.8 1.8 2.8 . . . . . A . 4 LEU MD2 . . A . 4 LEU HG . . . 4 . HD2# . . . . . 4 . HG . . c30446_6cxn 1 76 1 . . 1 1 4 4 LEU MD2 H . . . 1 1 4 4 LEU HG H . . . . . 2.8 1.8 2.8 . . . . . A . 4 LEU MD2 . . A . 4 LEU HG . . . 4 . HD2# . . . . . 4 . HG . . c30446_6cxn 1 77 1 . . 1 1 4 4 LEU H H . . . 1 1 4 4 LEU HA H . . . . . 3.4 1.8 3.4 . . . . . A . 4 LEU H . . A . 4 LEU HA . . . 4 . HN . . . . . 4 . HA . . c30446_6cxn 1 78 1 . . 1 1 4 4 LEU H H . . . 1 1 4 4 LEU HG H . . . . . 2.8 1.8 2.8 . . . . . A . 4 LEU H . . A . 4 LEU HG . . . 4 . HN . . . . . 4 . HG . . c30446_6cxn 1 79 1 . . 1 1 4 4 LEU H H . . . 1 1 4 4 LEU HG H . . . . . 3.4 1.8 3.4 . . . . . A . 4 LEU H . . A . 4 LEU HG . . . 4 . HN . . . . . 4 . HG . . c30446_6cxn 1 80 1 . . 1 1 4 4 LEU HA H . . . 1 1 5 5 ARG H H . . . . . 2.8 1.8 2.8 . . . . . A . 4 LEU HA . . A . 5 ARG H . . . 4 . HA . . . . . 5 . HN . . c30446_6cxn 1 81 1 . . 1 1 4 4 LEU HA H . . . 1 1 5 5 ARG H H . . . . . 2.8 1.8 2.8 . . . . . A . 4 LEU HA . . A . 5 ARG H . . . 4 . HA . . . . . 5 . HN . . c30446_6cxn 1 82 1 . . 1 1 5 5 ARG HA H . . . 1 1 5 5 ARG HB3 H . . . . . 3.4 1.8 3.4 . . . . . A . 5 ARG HA . . A . 5 ARG HB3 . . . 5 . HA . . . . . 5 . HB1 . . c30446_6cxn 1 83 1 . . 1 1 5 5 ARG HA H . . . 1 1 5 5 ARG HB3 H . . . . . 5.0 1.8 5.0 . . . . . A . 5 ARG HA . . A . 5 ARG HB3 . . . 5 . HA . . . . . 5 . HB1 . . c30446_6cxn 1 84 1 . . 1 1 5 5 ARG HA H . . . 1 1 5 5 ARG HB2 H . . . . . 3.4 1.8 3.4 . . . . . A . 5 ARG HA . . A . 5 ARG HB2 . . . 5 . HA . . . . . 5 . HB2 . . c30446_6cxn 1 85 1 . . 1 1 5 5 ARG HA H . . . 1 1 5 5 ARG HB2 H . . . . . 2.8 1.8 2.8 . . . . . A . 5 ARG HA . . A . 5 ARG HB2 . . . 5 . HA . . . . . 5 . HB2 . . c30446_6cxn 1 86 1 . . 1 1 5 5 ARG HB2 H . . . 1 1 5 5 ARG HB3 H . . . . . 3.4 1.8 3.4 . . . . . A . 5 ARG HB2 . . A . 5 ARG HB3 . . . 5 . HB2 . . . . . 5 . HB1 . . c30446_6cxn 1 87 1 . . 1 1 5 5 ARG HB2 H . . . 1 1 5 5 ARG HB3 H . . . . . 5.0 1.8 5.0 . . . . . A . 5 ARG HB2 . . A . 5 ARG HB3 . . . 5 . HB2 . . . . . 5 . HB1 . . c30446_6cxn 1 88 1 . . 1 1 5 5 ARG HA H . . . 1 1 5 5 ARG HG3 H . . . . . 3.4 1.8 3.4 . . . . . A . 5 ARG HA . . A . 5 ARG HG3 . . . 5 . HA . . . . . 5 . HG1 . . c30446_6cxn 1 89 1 . . 1 1 5 5 ARG HA H . . . 1 1 5 5 ARG HG3 H . . . . . 3.4 1.8 3.4 . . . . . A . 5 ARG HA . . A . 5 ARG HG3 . . . 5 . HA . . . . . 5 . HG1 . . c30446_6cxn 1 90 1 . . 1 1 5 5 ARG HB2 H . . . 1 1 5 5 ARG HG3 H . . . . . 2.8 1.8 2.8 . . . . . A . 5 ARG HB2 . . A . 5 ARG HG3 . . . 5 . HB2 . . . . . 5 . HG1 . . c30446_6cxn 1 91 1 . . 1 1 5 5 ARG HB2 H . . . 1 1 5 5 ARG HG3 H . . . . . 2.8 1.8 2.8 . . . . . A . 5 ARG HB2 . . A . 5 ARG HG3 . . . 5 . HB2 . . . . . 5 . HG1 . . c30446_6cxn 1 92 1 . . 1 1 5 5 ARG HE H . . . 1 1 5 5 ARG HG3 H . . . . . 5.0 1.8 5.0 . . . . . A . 5 ARG HE . . A . 5 ARG HG3 . . . 5 . HE . . . . . 5 . HG1 . . c30446_6cxn 1 93 1 . . 1 1 5 5 ARG HA H . . . 1 1 5 5 ARG HG2 H . . . . . 3.4 1.8 3.4 . . . . . A . 5 ARG HA . . A . 5 ARG HG2 . . . 5 . HA . . . . . 5 . HG2 . . c30446_6cxn 1 94 1 . . 1 1 5 5 ARG HA H . . . 1 1 5 5 ARG HG2 H . . . . . 5.0 1.8 5.0 . . . . . A . 5 ARG HA . . A . 5 ARG HG2 . . . 5 . HA . . . . . 5 . HG2 . . c30446_6cxn 1 95 1 . . 1 1 5 5 ARG HB2 H . . . 1 1 5 5 ARG HG2 H . . . . . 2.8 1.8 2.8 . . . . . A . 5 ARG HB2 . . A . 5 ARG HG2 . . . 5 . HB2 . . . . . 5 . HG2 . . c30446_6cxn 1 96 1 . . 1 1 5 5 ARG HB2 H . . . 1 1 5 5 ARG HG2 H . . . . . 2.8 1.8 2.8 . . . . . A . 5 ARG HB2 . . A . 5 ARG HG2 . . . 5 . HB2 . . . . . 5 . HG2 . . c30446_6cxn 1 97 1 . . 1 1 5 5 ARG HE H . . . 1 1 5 5 ARG HG2 H . . . . . 5.0 1.8 5.0 . . . . . A . 5 ARG HE . . A . 5 ARG HG2 . . . 5 . HE . . . . . 5 . HG2 . . c30446_6cxn 1 98 1 . . 1 1 5 5 ARG HA H . . . 1 1 5 5 ARG H H . . . . . 5.0 1.8 5.0 . . . . . A . 5 ARG HA . . A . 5 ARG H . . . 5 . HA . . . . . 5 . HN . . c30446_6cxn 1 99 1 . . 1 1 5 5 ARG HA H . . . 1 1 5 5 ARG H H . . . . . 3.4 1.8 3.4 . . . . . A . 5 ARG HA . . A . 5 ARG H . . . 5 . HA . . . . . 5 . HN . . c30446_6cxn 1 100 1 . . 1 1 5 5 ARG HB3 H . . . 1 1 5 5 ARG H H . . . . . 5.0 1.8 5.0 . . . . . A . 5 ARG HB3 . . A . 5 ARG H . . . 5 . HB1 . . . . . 5 . HN . . c30446_6cxn 1 101 1 . . 1 1 5 5 ARG HB3 H . . . 1 1 5 5 ARG H H . . . . . 3.4 1.8 3.4 . . . . . A . 5 ARG HB3 . . A . 5 ARG H . . . 5 . HB1 . . . . . 5 . HN . . c30446_6cxn 1 102 1 . . 1 1 5 5 ARG HB2 H . . . 1 1 5 5 ARG H H . . . . . 5.0 1.8 5.0 . . . . . A . 5 ARG HB2 . . A . 5 ARG H . . . 5 . HB2 . . . . . 5 . HN . . c30446_6cxn 1 103 1 . . 1 1 5 5 ARG HB2 H . . . 1 1 5 5 ARG H H . . . . . 5.0 1.8 5.0 . . . . . A . 5 ARG HB2 . . A . 5 ARG H . . . 5 . HB2 . . . . . 5 . HN . . c30446_6cxn 1 104 1 . . 1 1 5 5 ARG HG2 H . . . 1 1 5 5 ARG H H . . . . . 5.0 1.8 5.0 . . . . . A . 5 ARG HG2 . . A . 5 ARG H . . . 5 . HG2 . . . . . 5 . HN . . c30446_6cxn 1 105 1 . . 1 1 5 5 ARG HE H . . . 1 1 6 6 HIS HA H . . . . . 5.0 1.8 5.0 . . . . . A . 5 ARG HE . . A . 6 HIS HA . . . 5 . HE . . . . . 6 . HA . . c30446_6cxn 1 106 1 . . 1 1 5 5 ARG HA H . . . 1 1 6 6 HIS HD2 H . . . . . 5.0 1.8 5.0 . . . . . A . 5 ARG HA . . A . 6 HIS HD2 . . . 5 . HA . . . . . 6 . HD2 . . c30446_6cxn 1 107 1 . . 1 1 5 5 ARG HA H . . . 1 1 6 6 HIS H H . . . . . 2.8 1.8 2.8 . . . . . A . 5 ARG HA . . A . 6 HIS H . . . 5 . HA . . . . . 6 . HN . . c30446_6cxn 1 108 1 . . 1 1 5 5 ARG HA H . . . 1 1 6 6 HIS H H . . . . . 2.8 1.8 2.8 . . . . . A . 5 ARG HA . . A . 6 HIS H . . . 5 . HA . . . . . 6 . HN . . c30446_6cxn 1 109 1 . . 1 1 5 5 ARG HB3 H . . . 1 1 6 6 HIS H H . . . . . 5.0 1.8 5.0 . . . . . A . 5 ARG HB3 . . A . 6 HIS H . . . 5 . HB1 . . . . . 6 . HN . . c30446_6cxn 1 110 1 . . 1 1 6 6 HIS HA H . . . 1 1 6 6 HIS HB3 H . . . . . 2.8 1.8 2.8 . . . . . A . 6 HIS HA . . A . 6 HIS HB3 . . . 6 . HA . . . . . 6 . HB1 . . c30446_6cxn 1 111 1 . . 1 1 6 6 HIS HA H . . . 1 1 6 6 HIS HB3 H . . . . . 5.0 1.8 5.0 . . . . . A . 6 HIS HA . . A . 6 HIS HB3 . . . 6 . HA . . . . . 6 . HB1 . . c30446_6cxn 1 112 1 . . 1 1 6 6 HIS HA H . . . 1 1 6 6 HIS HB2 H . . . . . 2.8 1.8 2.8 . . . . . A . 6 HIS HA . . A . 6 HIS HB2 . . . 6 . HA . . . . . 6 . HB2 . . c30446_6cxn 1 113 1 . . 1 1 6 6 HIS HA H . . . 1 1 6 6 HIS HB2 H . . . . . 5.0 1.8 5.0 . . . . . A . 6 HIS HA . . A . 6 HIS HB2 . . . 6 . HA . . . . . 6 . HB2 . . c30446_6cxn 1 114 1 . . 1 1 6 6 HIS HB3 H . . . 1 1 6 6 HIS HB2 H . . . . . 2.8 1.8 2.8 . . . . . A . 6 HIS HB3 . . A . 6 HIS HB2 . . . 6 . HB1 . . . . . 6 . HB2 . . c30446_6cxn 1 115 1 . . 1 1 6 6 HIS HB3 H . . . 1 1 6 6 HIS HB2 H . . . . . 2.8 1.8 2.8 . . . . . A . 6 HIS HB3 . . A . 6 HIS HB2 . . . 6 . HB1 . . . . . 6 . HB2 . . c30446_6cxn 1 116 1 . . 1 1 6 6 HIS HA H . . . 1 1 6 6 HIS HD2 H . . . . . 5.0 1.8 5.0 . . . . . A . 6 HIS HA . . A . 6 HIS HD2 . . . 6 . HA . . . . . 6 . HD2 . . c30446_6cxn 1 117 1 . . 1 1 6 6 HIS HA H . . . 1 1 6 6 HIS HD2 H . . . . . 5.0 1.8 5.0 . . . . . A . 6 HIS HA . . A . 6 HIS HD2 . . . 6 . HA . . . . . 6 . HD2 . . c30446_6cxn 1 118 1 . . 1 1 6 6 HIS HD2 H . . . 1 1 6 6 HIS HB3 H . . . . . 5.0 1.8 5.0 . . . . . A . 6 HIS HD2 . . A . 6 HIS HB3 . . . 6 . HD2 . . . . . 6 . HB1 . . c30446_6cxn 1 119 1 . . 1 1 6 6 HIS HD2 H . . . 1 1 6 6 HIS HB2 H . . . . . 5.0 1.8 5.0 . . . . . A . 6 HIS HD2 . . A . 6 HIS HB2 . . . 6 . HD2 . . . . . 6 . HB2 . . c30446_6cxn 1 120 1 . . 1 1 6 6 HIS HD2 H . . . 1 1 6 6 HIS HB2 H . . . . . 5.0 1.8 5.0 . . . . . A . 6 HIS HD2 . . A . 6 HIS HB2 . . . 6 . HD2 . . . . . 6 . HB2 . . c30446_6cxn 1 121 1 . . 1 1 6 6 HIS HD2 H . . . 1 1 6 6 HIS HE1 H . . . . . 5.0 1.8 5.0 . . . . . A . 6 HIS HD2 . . A . 6 HIS HE1 . . . 6 . HD2 . . . . . 6 . HE1 . . c30446_6cxn 1 122 1 . . 1 1 6 6 HIS HA H . . . 1 1 6 6 HIS H H . . . . . 5.0 1.8 5.0 . . . . . A . 6 HIS HA . . A . 6 HIS H . . . 6 . HA . . . . . 6 . HN . . c30446_6cxn 1 123 1 . . 1 1 6 6 HIS H H . . . 1 1 6 6 HIS HB3 H . . . . . 3.4 1.8 3.4 . . . . . A . 6 HIS H . . A . 6 HIS HB3 . . . 6 . HN . . . . . 6 . HB1 . . c30446_6cxn 1 124 1 . . 1 1 6 6 HIS H H . . . 1 1 6 6 HIS HB3 H . . . . . 5.0 1.8 5.0 . . . . . A . 6 HIS H . . A . 6 HIS HB3 . . . 6 . HN . . . . . 6 . HB1 . . c30446_6cxn 1 125 1 . . 1 1 6 6 HIS H H . . . 1 1 6 6 HIS HB2 H . . . . . 5.0 1.8 5.0 . . . . . A . 6 HIS H . . A . 6 HIS HB2 . . . 6 . HN . . . . . 6 . HB2 . . c30446_6cxn 1 126 1 . . 1 1 6 6 HIS H H . . . 1 1 6 6 HIS HB2 H . . . . . 5.0 1.8 5.0 . . . . . A . 6 HIS H . . A . 6 HIS HB2 . . . 6 . HN . . . . . 6 . HB2 . . c30446_6cxn 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 noe4.14 2 68 2 81 c30446_6cxn 1 2 noe4.21 3 67 3 81 c30446_6cxn 1 3 noe4.31 4 67 4 81 c30446_6cxn 1 4 noe4.32 5 67 5 81 c30446_6cxn 1 5 noe4.33 6 67 6 81 c30446_6cxn 1 6 noe4.34 7 67 7 81 c30446_6cxn 1 7 noe4.73 8 67 8 81 c30446_6cxn 1 8 noe4.76 9 68 9 81 c30446_6cxn 1 9 noe4.77 10 67 10 81 c30446_6cxn 1 10 noe4.78 11 67 11 81 c30446_6cxn 1 11 noe4.79 12 67 12 81 c30446_6cxn 1 12 noe4.80 13 68 13 81 c30446_6cxn 1 13 noe4.81 14 68 14 81 c30446_6cxn 1 14 noe4.88 15 67 15 81 c30446_6cxn 1 15 noe4.89 16 67 16 81 c30446_6cxn 1 16 noe4.94 17 67 17 81 c30446_6cxn 1 17 noe4.95 18 67 18 81 c30446_6cxn 1 18 noe4.99 19 67 19 81 c30446_6cxn 1 19 noe4.100 20 67 20 82 c30446_6cxn 1 20 noe4.105 21 68 21 82 c30446_6cxn 1 21 noe4.106 22 68 22 82 c30446_6cxn 1 22 noe4.107 23 68 23 82 c30446_6cxn 1 23 noe4.108 24 68 24 82 c30446_6cxn 1 24 noe4.109 25 68 25 82 c30446_6cxn 1 25 noe4.110 26 68 26 82 c30446_6cxn 1 26 noe4.113 27 69 27 82 c30446_6cxn 1 27 noe4.114 28 69 28 82 c30446_6cxn 1 28 noe4.116 29 69 29 82 c30446_6cxn 1 29 noe4.118 30 68 30 82 c30446_6cxn 1 30 noe4.119 31 68 31 82 c30446_6cxn 1 31 noe4.120 32 68 32 82 c30446_6cxn 1 32 noe4.121 33 68 33 82 c30446_6cxn 1 33 noe4.122 34 68 34 82 c30446_6cxn 1 34 noe4.123 35 68 35 82 c30446_6cxn 1 35 noe4.128 36 67 36 82 c30446_6cxn 1 36 noe4.130 37 67 37 82 c30446_6cxn 1 37 noe4.131 38 67 38 82 c30446_6cxn 1 38 noe4.144 39 69 39 82 c30446_6cxn 1 39 noe4.147 40 67 40 82 c30446_6cxn 1 40 noe4.152 41 67 41 82 c30446_6cxn 1 41 noe4.164 42 67 42 82 c30446_6cxn 1 42 noe4.178 43 67 43 82 c30446_6cxn 1 43 noe4.186 44 67 44 82 c30446_6cxn 1 44 noe4.187 45 67 45 82 c30446_6cxn 1 45 noe4.190 46 67 46 82 c30446_6cxn 1 46 noe4.10 47 67 47 81 c30446_6cxn 1 47 noe4.11 48 66 48 81 c30446_6cxn 1 48 noe4.136 49 67 49 82 c30446_6cxn 1 49 noe4.5 50 66 50 80 c30446_6cxn 1 50 noe4.64 51 66 51 81 c30446_6cxn 1 51 noe4.85 52 67 52 81 c30446_6cxn 1 52 noe4.181 53 67 53 82 c30446_6cxn 1 53 noe4.84 54 67 54 81 c30446_6cxn 1 54 noe4.151 55 67 55 82 c30446_6cxn 1 55 noe4.183 56 68 56 82 c30446_6cxn 1 56 noe4.184 57 68 57 82 c30446_6cxn 1 57 noe4.3 58 66 58 80 c30446_6cxn 1 58 noe4.24 59 67 59 81 c30446_6cxn 1 59 noe4.69 60 67 60 81 c30446_6cxn 1 60 noe4.25 61 67 61 81 c30446_6cxn 1 61 noe4.68 62 67 62 81 c30446_6cxn 1 62 noe4.41 63 67 63 81 c30446_6cxn 1 63 noe4.4 64 66 64 80 c30446_6cxn 1 64 noe4.182 65 66 65 82 c30446_6cxn 1 65 noe4.28 66 67 66 81 c30446_6cxn 1 66 noe4.29 67 67 67 81 c30446_6cxn 1 67 noe4.102 68 68 68 82 c30446_6cxn 1 68 noe4.133 69 68 69 82 c30446_6cxn 1 69 noe4.101 70 68 70 82 c30446_6cxn 1 70 noe4.132 71 68 71 82 c30446_6cxn 1 71 noe4.141 72 66 72 82 c30446_6cxn 1 72 noe4.146 73 66 73 82 c30446_6cxn 1 73 noe4.115 74 68 74 82 c30446_6cxn 1 74 noe4.143 75 68 75 82 c30446_6cxn 1 75 noe4.112 76 68 76 82 c30446_6cxn 1 76 noe4.117 77 68 77 82 c30446_6cxn 1 77 noe4.2 78 66 78 80 c30446_6cxn 1 78 noe4.19 79 66 79 81 c30446_6cxn 1 79 noe4.72 80 66 80 81 c30446_6cxn 1 80 noe4.6 81 66 81 80 c30446_6cxn 1 81 noe4.62 82 66 82 81 c30446_6cxn 1 82 noe4.127 83 67 83 82 c30446_6cxn 1 83 noe4.142 84 67 84 82 c30446_6cxn 1 84 noe4.98 85 67 85 81 c30446_6cxn 1 85 noe4.126 86 67 86 82 c30446_6cxn 1 86 noe4.166 87 68 87 82 c30446_6cxn 1 87 noe4.167 88 68 88 82 c30446_6cxn 1 88 noe4.96 89 67 89 81 c30446_6cxn 1 89 noe4.145 90 67 90 82 c30446_6cxn 1 90 noe4.172 91 68 91 82 c30446_6cxn 1 91 noe4.173 92 68 92 82 c30446_6cxn 1 92 noe4.192 93 67 93 82 c30446_6cxn 1 93 noe4.97 94 67 94 81 c30446_6cxn 1 94 noe4.129 95 67 95 82 c30446_6cxn 1 95 noe4.169 96 68 96 82 c30446_6cxn 1 96 noe4.171 97 68 97 82 c30446_6cxn 1 97 noe4.191 98 67 98 82 c30446_6cxn 1 98 noe4.7 99 66 99 80 c30446_6cxn 1 99 noe4.63 100 66 100 81 c30446_6cxn 1 100 noe4.71 101 67 101 81 c30446_6cxn 1 101 noe4.135 102 67 102 82 c30446_6cxn 1 102 noe4.20 103 67 103 81 c30446_6cxn 1 103 noe4.70 104 67 104 81 c30446_6cxn 1 104 noe4.165 105 67 105 82 c30446_6cxn 1 105 noe4.52 106 66 106 81 c30446_6cxn 1 106 noe4.54 107 67 107 81 c30446_6cxn 1 107 noe4.8 108 66 108 80 c30446_6cxn 1 108 noe4.65 109 66 109 81 c30446_6cxn 1 109 noe4.48 110 67 110 81 c30446_6cxn 1 110 noe4.83 111 67 111 81 c30446_6cxn 1 111 noe4.150 112 67 112 82 c30446_6cxn 1 112 noe4.82 113 67 113 81 c30446_6cxn 1 113 noe4.149 114 67 114 82 c30446_6cxn 1 114 noe4.153 115 68 115 82 c30446_6cxn 1 115 noe4.154 116 68 116 82 c30446_6cxn 1 116 noe4.49 117 67 117 81 c30446_6cxn 1 117 noe4.50 118 67 118 81 c30446_6cxn 1 118 noe4.12 119 68 119 81 c30446_6cxn 1 119 noe4.13 120 68 120 81 c30446_6cxn 1 120 noe4.193 121 68 121 82 c30446_6cxn 1 121 noe4.185 122 68 122 82 c30446_6cxn 1 122 noe4.9 123 66 123 80 c30446_6cxn 1 123 noe4.26 124 67 124 81 c30446_6cxn 1 124 noe4.67 125 67 125 81 c30446_6cxn 1 125 noe4.27 126 67 126 81 c30446_6cxn 1 126 noe4.66 127 67 127 81 c30446_6cxn 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: noe4.tbl' 1 1 1 29 c30446_6cxn 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 c30446_6cxn _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 METAL BINDING PROTEIN 03-APR-18 6CXN *TITLE HRFLRH PEPTIDE NMR STRUCTURE *COMPND MOL_ID: 1; *COMPND 2 MOLECULE: HEXAPEPTIDE HRFLRH; *COMPND 3 CHAIN: A; *COMPND 4 ENGINEERED: YES *SOURCE MOL_ID: 1; *SOURCE 2 SYNTHETIC: YES; *SOURCE 3 ORGANISM_SCIENTIFIC: PHYLLOMEDUSA CENTRALIS; *SOURCE 4 ORGANISM_COMMON: MATO GROSSO LEAF FROG; *SOURCE 5 ORGANISM_TAXID: 536631 *KEYWDS AMPHIBIAN SKIN SECRETION, METAL AFFINITY AND CO2 AFFINITY, METAL *KEYWDS 2 BINDING PROTEIN *EXPDTA SOLUTION NMR *NUMMDL 20 *AUTHOR D.A.T.PIRES,L.M.R.ARAKE,L.P.SILVA,A.LOPEZ-CASTILLO,M.V.PRATES, *AUTHOR 2 C.J.NASCIMENTO,C.BLOCH JR *REVDAT 1 04-JUL-18 6CXN 0' save_