data_c30448_6cxq ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID c30448_6cxq _Entry.Title ; HRFLRH peptide NMR structure in the presence of CO2 ; _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 . _Entry.Generated_software_label . _Entry.Generated_date . _Entry.DOI . _Entry.UUID . _Entry.Related_coordinate_file_name . _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_experimental_methods.ID _Entry_experimental_methods.Method _Entry_experimental_methods.Subtype _Entry_experimental_methods.Entry_ID 1 'SOLUTION NMR' 'SOLUTION NMR' c30448_6cxq 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. . . c30448_6cxq 2 L. Arake L. M.R. . . c30448_6cxq 3 L. Silva L. P. . . c30448_6cxq 4 A. Lopez-Castillo A. . . . c30448_6cxq 5 M. Prates M. V. . . c30448_6cxq 6 C. Nascimento C. J. . . c30448_6cxq 7 C. 'Bloch Jr' C. . . . c30448_6cxq stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID 'Amphibian Skin Secretion' . c30448_6cxq 'CO2 affinity' . c30448_6cxq 'METAL BINDING PROTEIN' . c30448_6cxq 'metal affinity' . c30448_6cxq stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 c30448_6cxq stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 28 c30448_6cxq '1H chemical shifts' 48 c30448_6cxq 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 . c30448_6cxq stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 6CXQ . c30448_6cxq stop_ save_ ############### # Citations # ############### save_citation_1 _Citation.Sf_category citations _Citation.Sf_framecode citation_1 _Citation.Entry_ID c30448_6cxq _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. . . c30448_6cxq 1 2 L. Arake L. M.R. . . c30448_6cxq 1 3 L. Silva L. P. . . c30448_6cxq 1 4 A. Lopez-Castillo A. . . . c30448_6cxq 1 5 M. Prates M. V. . . c30448_6cxq 1 6 C. Nascimento C. J. . . c30448_6cxq 1 7 C. 'Bloch Jr' C. . . . c30448_6cxq 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID c30448_6cxq _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 . . . . . . c30448_6cxq 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID c30448_6cxq _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 . c30448_6cxq 1 2 . ARG . c30448_6cxq 1 3 . PHE . c30448_6cxq 1 4 . LEU . c30448_6cxq 1 5 . ARG . c30448_6cxq 1 6 . HIS . c30448_6cxq 1 7 . NH2 . c30448_6cxq 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 c30448_6cxq 1 . ARG 2 2 c30448_6cxq 1 . PHE 3 3 c30448_6cxq 1 . LEU 4 4 c30448_6cxq 1 . ARG 5 5 c30448_6cxq 1 . HIS 6 6 c30448_6cxq 1 . NH2 7 7 c30448_6cxq 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 c30448_6cxq _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 . . . . . . . . . . . . . c30448_6cxq 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 c30448_6cxq _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' . . . . . . . . . . . . . . . . c30448_6cxq 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 c30448_6cxq _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 c30448_6cxq NH2 N SMILES ACDLabs 10.04 c30448_6cxq NH2 QGZKDVFQNNGYKY-UHFFFAOYAF InChIKey InChI 1.02b c30448_6cxq NH2 [NH2] SMILES CACTVS 3.341 c30448_6cxq NH2 [NH2] SMILES 'OpenEye OEToolkits' 1.5.0 c30448_6cxq NH2 [NH2] SMILES_CANONICAL CACTVS 3.341 c30448_6cxq NH2 [NH2] SMILES_CANONICAL 'OpenEye OEToolkits' 1.5.0 c30448_6cxq 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 c30448_6cxq NH2 l^{2}-azane 'SYSTEMATIC NAME' 'OpenEye OEToolkits' 1.5.0 c30448_6cxq 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 . c30448_6cxq NH2 HN1 HN1 HN1 1HN . H . . N 0 . . . 1 no no . . . . 9.517 . 8.769 . -7.044 . -0.385 -0.545 -0.771 2 . c30448_6cxq NH2 HN2 HN2 HN2 2HN . H . . N 0 . . . 1 no no . . . . 10.323 . 9.890 . -8.082 . 1.020 0.000 0.000 3 . c30448_6cxq 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 . c30448_6cxq NH2 2 . SING N HN2 no N 2 . c30448_6cxq NH2 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID c30448_6cxq _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details '2 mM [U-13C] Hexapeptide HRFLRH, 2 saturated CO2, 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 HIS-ARG-PHE-LEU-ARG-HIS [U-13C] . . 1 $entity_1 . . 2 . . mM . . . . c30448_6cxq 1 2 CO2 'natural abundance' . . . . . . 2 . . v/v . . . . c30448_6cxq 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 c30448_6cxq _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 c30448_6cxq 1 pH 4.5 . pH c30448_6cxq 1 pressure 1 . atm c30448_6cxq 1 temperature 298 . K c30448_6cxq 1 stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Software.Sf_category software _Software.Sf_framecode software_1 _Software.Entry_ID c30448_6cxq _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' . . c30448_6cxq 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID refinement c30448_6cxq 1 'structure calculation' c30448_6cxq 1 stop_ save_ save_software_2 _Software.Sf_category software _Software.Sf_framecode software_2 _Software.Entry_ID c30448_6cxq _Software.ID 2 _Software.Type . _Software.Name NMRView _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Johnson, One Moon Scientific' . . c30448_6cxq 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' c30448_6cxq 2 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_NMR_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_1 _NMR_spectrometer.Entry_ID c30448_6cxq _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 c30448_6cxq _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 . . . c30448_6cxq 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 c30448_6cxq _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 . . . . . . . . . . . . . . . . c30448_6cxq 1 2 '2D 1H-13C HSQC aliphatic' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . c30448_6cxq 1 3 '2D 1H-13C HSQC aromatic' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . c30448_6cxq 1 4 '2D 1H-1H NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . c30448_6cxq 1 5 '2D 1H-13C HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . c30448_6cxq 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 c30448_6cxq _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 . . . . . c30448_6cxq 1 H 1 DSS 'methyl protons' . . . . ppm 0.000 internal direct 1.0 . . . . . c30448_6cxq 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 c30448_6cxq _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' . . . c30448_6cxq 1 2 '2D 1H-13C HSQC aliphatic' . . . c30448_6cxq 1 3 '2D 1H-13C HSQC aromatic' . . . c30448_6cxq 1 4 '2D 1H-1H NOESY' . . . c30448_6cxq 1 5 '2D 1H-1H TOCSY' . . . c30448_6cxq 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 4.192 . . . . . . . A 1 HIS HA . c30448_6cxq 1 2 . 1 1 1 1 HIS HB2 H 1 3.183 . . . . . . . A 1 HIS HB2 . c30448_6cxq 1 3 . 1 1 1 1 HIS HB3 H 1 3.183 . . . . . . . A 1 HIS HB3 . c30448_6cxq 1 4 . 1 1 1 1 HIS HD2 H 1 7.043 . . . . . . . A 1 HIS HD2 . c30448_6cxq 1 5 . 1 1 1 1 HIS HE1 H 1 8.296 . . . . . . . A 1 HIS HE1 . c30448_6cxq 1 6 . 1 1 1 1 HIS CA C 13 55.493 . . . . . . . A 1 HIS CA . c30448_6cxq 1 7 . 1 1 1 1 HIS CB C 13 29.866 . . . . . . . A 1 HIS CB . c30448_6cxq 1 8 . 1 1 1 1 HIS CD2 C 13 120.605 . . . . . . . A 1 HIS CD2 . c30448_6cxq 1 9 . 1 1 1 1 HIS CE1 C 13 137.871 . . . . . . . A 1 HIS CE1 . c30448_6cxq 1 10 . 1 1 2 2 ARG HA H 1 4.305 . . . . . . . A 2 ARG HA . c30448_6cxq 1 11 . 1 1 2 2 ARG HB2 H 1 1.679 . . . . . . . A 2 ARG HB2 . c30448_6cxq 1 12 . 1 1 2 2 ARG HB3 H 1 1.679 . . . . . . . A 2 ARG HB3 . c30448_6cxq 1 13 . 1 1 2 2 ARG HG2 H 1 1.526 . . . . . . . A 2 ARG HG2 . c30448_6cxq 1 14 . 1 1 2 2 ARG HG3 H 1 1.466 . . . . . . . A 2 ARG HG3 . c30448_6cxq 1 15 . 1 1 2 2 ARG HD2 H 1 3.118 . . . . . . . A 2 ARG HD2 . c30448_6cxq 1 16 . 1 1 2 2 ARG HD3 H 1 3.118 . . . . . . . A 2 ARG HD3 . c30448_6cxq 1 17 . 1 1 2 2 ARG HE H 1 7.125 . . . . . . . A 2 ARG HE . c30448_6cxq 1 18 . 1 1 2 2 ARG CA C 13 56.114 . . . . . . . A 2 ARG CA . c30448_6cxq 1 19 . 1 1 2 2 ARG CB C 13 31.116 . . . . . . . A 2 ARG CB . c30448_6cxq 1 20 . 1 1 2 2 ARG CG C 13 27.026 . . . . . . . A 2 ARG CG . c30448_6cxq 1 21 . 1 1 2 2 ARG CD C 13 43.563 . . . . . . . A 2 ARG CD . c30448_6cxq 1 22 . 1 1 3 3 PHE H H 1 8.594 . . . . . . . A 3 PHE H . c30448_6cxq 1 23 . 1 1 3 3 PHE HA H 1 4.602 . . . . . . . A 3 PHE HA . c30448_6cxq 1 24 . 1 1 3 3 PHE HB2 H 1 3.053 . . . . . . . A 3 PHE HB2 . c30448_6cxq 1 25 . 1 1 3 3 PHE HB3 H 1 2.970 . . . . . . . A 3 PHE HB3 . c30448_6cxq 1 26 . 1 1 3 3 PHE HD1 H 1 7.221 . . . . . . . A 3 PHE HD1 . c30448_6cxq 1 27 . 1 1 3 3 PHE HD2 H 1 7.221 . . . . . . . A 3 PHE HD2 . c30448_6cxq 1 28 . 1 1 3 3 PHE HE1 H 1 7.221 . . . . . . . A 3 PHE HE1 . c30448_6cxq 1 29 . 1 1 3 3 PHE HE2 H 1 7.221 . . . . . . . A 3 PHE HE2 . c30448_6cxq 1 30 . 1 1 3 3 PHE HZ H 1 7.291 . . . . . . . A 3 PHE HZ . c30448_6cxq 1 31 . 1 1 3 3 PHE CA C 13 57.369 . . . . . . . A 3 PHE CA . c30448_6cxq 1 32 . 1 1 3 3 PHE CB C 13 39.827 . . . . . . . A 3 PHE CB . c30448_6cxq 1 33 . 1 1 3 3 PHE CD1 C 13 131.792 . . . . . . . A 3 PHE CD1 . c30448_6cxq 1 34 . 1 1 3 3 PHE CD2 C 13 131.792 . . . . . . . A 3 PHE CD2 . c30448_6cxq 1 35 . 1 1 3 3 PHE CE1 C 13 129.894 . . . . . . . A 3 PHE CE1 . c30448_6cxq 1 36 . 1 1 3 3 PHE CE2 C 13 129.894 . . . . . . . A 3 PHE CE2 . c30448_6cxq 1 37 . 1 1 3 3 PHE CZ C 13 131.323 . . . . . . . A 3 PHE CZ . c30448_6cxq 1 38 . 1 1 4 4 LEU H H 1 8.247 . . . . . . . A 4 LEU H . c30448_6cxq 1 39 . 1 1 4 4 LEU HA H 1 4.301 . . . . . . . A 4 LEU HA . c30448_6cxq 1 40 . 1 1 4 4 LEU HB2 H 1 1.446 . . . . . . . A 4 LEU HB2 . c30448_6cxq 1 41 . 1 1 4 4 LEU HB3 H 1 1.446 . . . . . . . A 4 LEU HB3 . c30448_6cxq 1 42 . 1 1 4 4 LEU HG H 1 1.494 . . . . . . . A 4 LEU HG . c30448_6cxq 1 43 . 1 1 4 4 LEU HD11 H 1 0.778 . . . . . . . A 4 LEU HD11 . c30448_6cxq 1 44 . 1 1 4 4 LEU HD12 H 1 0.778 . . . . . . . A 4 LEU HD11 . c30448_6cxq 1 45 . 1 1 4 4 LEU HD13 H 1 0.778 . . . . . . . A 4 LEU HD11 . c30448_6cxq 1 46 . 1 1 4 4 LEU HD21 H 1 0.842 . . . . . . . A 4 LEU HD21 . c30448_6cxq 1 47 . 1 1 4 4 LEU HD22 H 1 0.842 . . . . . . . A 4 LEU HD21 . c30448_6cxq 1 48 . 1 1 4 4 LEU HD23 H 1 0.842 . . . . . . . A 4 LEU HD21 . c30448_6cxq 1 49 . 1 1 4 4 LEU CA C 13 54.855 . . . . . . . A 4 LEU CA . c30448_6cxq 1 50 . 1 1 4 4 LEU CB C 13 42.916 . . . . . . . A 4 LEU CB . c30448_6cxq 1 51 . 1 1 4 4 LEU CG C 13 26.740 . . . . . . . A 4 LEU CG . c30448_6cxq 1 52 . 1 1 4 4 LEU CD1 C 13 23.615 . . . . . . . A 4 LEU CD1 . c30448_6cxq 1 53 . 1 1 4 4 LEU CD2 C 13 24.865 . . . . . . . A 4 LEU CD2 . c30448_6cxq 1 54 . 1 1 5 5 ARG H H 1 8.044 . . . . . . . A 5 ARG H . c30448_6cxq 1 55 . 1 1 5 5 ARG HA H 1 4.193 . . . . . . . A 5 ARG HA . c30448_6cxq 1 56 . 1 1 5 5 ARG HB2 H 1 1.745 . . . . . . . A 5 ARG HB2 . c30448_6cxq 1 57 . 1 1 5 5 ARG HB3 H 1 1.701 . . . . . . . A 5 ARG HB3 . c30448_6cxq 1 58 . 1 1 5 5 ARG HG2 H 1 1.572 . . . . . . . A 5 ARG HG2 . c30448_6cxq 1 59 . 1 1 5 5 ARG HG3 H 1 1.551 . . . . . . . A 5 ARG HG3 . c30448_6cxq 1 60 . 1 1 5 5 ARG HD2 H 1 3.161 . . . . . . . A 5 ARG HD2 . c30448_6cxq 1 61 . 1 1 5 5 ARG HD3 H 1 3.161 . . . . . . . A 5 ARG HD3 . c30448_6cxq 1 62 . 1 1 5 5 ARG HE H 1 7.179 . . . . . . . A 5 ARG HE . c30448_6cxq 1 63 . 1 1 5 5 ARG CA C 13 55.493 . . . . . . . A 5 ARG CA . c30448_6cxq 1 64 . 1 1 5 5 ARG CB C 13 30.989 . . . . . . . A 5 ARG CB . c30448_6cxq 1 65 . 1 1 5 5 ARG CG C 13 27.366 . . . . . . . A 5 ARG CG . c30448_6cxq 1 66 . 1 1 5 5 ARG CD C 13 43.221 . . . . . . . A 5 ARG CD . c30448_6cxq 1 67 . 1 1 6 6 HIS H H 1 8.546 . . . . . . . A 6 HIS H . c30448_6cxq 1 68 . 1 1 6 6 HIS HA H 1 4.622 . . . . . . . A 6 HIS HA . c30448_6cxq 1 69 . 1 1 6 6 HIS HB2 H 1 3.206 . . . . . . . A 6 HIS HB2 . c30448_6cxq 1 70 . 1 1 6 6 HIS HB3 H 1 3.121 . . . . . . . A 6 HIS HB3 . c30448_6cxq 1 71 . 1 1 6 6 HIS HD2 H 1 7.255 . . . . . . . A 6 HIS HD2 . c30448_6cxq 1 72 . 1 1 6 6 HIS HE1 H 1 8.531 . . . . . . . A 6 HIS HE1 . c30448_6cxq 1 73 . 1 1 6 6 HIS CA C 13 54.890 . . . . . . . A 6 HIS CA . c30448_6cxq 1 74 . 1 1 6 6 HIS CB C 13 29.241 . . . . . . . A 6 HIS CB . c30448_6cxq 1 75 . 1 1 6 6 HIS CD2 C 13 120.058 . . . . . . . A 6 HIS CD2 . c30448_6cxq 1 76 . 1 1 6 6 HIS CE1 C 13 136.473 . . . . . . . A 6 HIS CE1 . c30448_6cxq 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 c30448_6cxq _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 c30448_6cxq _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 . . . c30448_6cxq 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 . . . . c30448_6cxq 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 4.820 -1.691 3.718 . . . 1.0 . . . . . . . . . . . . A . 1 HIS C . . . . . . . . . c30448_6cxq 1 . 1 . 2 . 1 1 1 HIS CA C 6.332 -1.712 3.585 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CA . . . . . . . . . c30448_6cxq 1 . 1 . 3 . 1 1 1 HIS CB C 6.769 -2.632 2.443 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CB . . . . . . . . . c30448_6cxq 1 . 1 . 4 . 1 1 1 HIS CD2 C 8.789 -1.776 1.058 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CD2 . . . . . . . . . c30448_6cxq 1 . 1 . 5 . 1 1 1 HIS CE1 C 7.679 -0.703 -0.498 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CE1 . . . . . . . . . c30448_6cxq 1 . 1 . 6 . 1 1 1 HIS CG C 7.470 -1.915 1.331 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CG . . . . . . . . . c30448_6cxq 1 . 1 . 7 . 1 1 1 HIS H1 H 6.906 -3.210 4.872 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H1 . . . . . . . . . c30448_6cxq 1 . 1 . 8 . 1 1 1 HIS H2 H 6.467 -1.739 5.638 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H2 . . . . . . . . . c30448_6cxq 1 . 1 . 9 . 1 1 1 HIS H3 H 7.970 -1.868 4.821 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H3 . . . . . . . . . c30448_6cxq 1 . 1 . 10 . 1 1 1 HIS HA H 6.659 -0.702 3.380 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HA . . . . . . . . . c30448_6cxq 1 . 1 . 11 . 1 1 1 HIS HB2 H 7.446 -3.379 2.831 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HB2 . . . . . . . . . c30448_6cxq 1 . 1 . 12 . 1 1 1 HIS HB3 H 5.900 -3.123 2.028 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HB3 . . . . . . . . . c30448_6cxq 1 . 1 . 13 . 1 1 1 HIS HD1 H 5.829 -1.145 0.255 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HD1 . . . . . . . . . c30448_6cxq 1 . 1 . 14 . 1 1 1 HIS HD2 H 9.609 -2.185 1.632 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HD2 . . . . . . . . . c30448_6cxq 1 . 1 . 15 . 1 1 1 HIS HE1 H 7.444 -0.113 -1.371 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HE1 . . . . . . . . . c30448_6cxq 1 . 1 . 16 . 1 1 1 HIS HE2 H 9.726 -0.680 -0.468 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HE2 . . . . . . . . . c30448_6cxq 1 . 1 . 17 . 1 1 1 HIS N N 6.977 -2.174 4.843 . . . 1.0 . . . . . . . . . . . . A . 1 HIS N . . . . . . . . . c30448_6cxq 1 . 1 . 18 . 1 1 1 HIS ND1 N 6.802 -1.230 0.337 . . . 1.0 . . . . . . . . . . . . A . 1 HIS ND1 . . . . . . . . . c30448_6cxq 1 . 1 . 19 . 1 1 1 HIS NE2 N 8.891 -1.018 -0.082 . . . 1.0 . . . . . . . . . . . . A . 1 HIS NE2 . . . . . . . . . c30448_6cxq 1 . 1 . 20 . 1 1 1 HIS O O 4.288 -1.644 4.827 . . . 1.0 . . . . . . . . . . . . A . 1 HIS O . . . . . . . . . c30448_6cxq 1 . 1 . 21 . 1 1 2 ARG C C 2.051 -2.335 1.431 . . . 1.0 . . . . . . . . . . . . A . 2 ARG C . . . . . . . . . c30448_6cxq 1 . 1 . 22 . 1 1 2 ARG CA C 2.678 -1.613 2.608 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CA . . . . . . . . . c30448_6cxq 1 . 1 . 23 . 1 1 2 ARG CB C 2.231 -0.151 2.607 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CB . . . . . . . . . c30448_6cxq 1 . 1 . 24 . 1 1 2 ARG CD C 3.216 2.117 2.157 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CD . . . . . . . . . c30448_6cxq 1 . 1 . 25 . 1 1 2 ARG CG C 3.398 0.773 2.843 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CG . . . . . . . . . c30448_6cxq 1 . 1 . 26 . 1 1 2 ARG CZ C 1.901 4.181 2.450 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CZ . . . . . . . . . c30448_6cxq 1 . 1 . 27 . 1 1 2 ARG H H 4.599 -1.686 1.727 . . . 1.0 . . . . . . . . . . . . A . 2 ARG H . . . . . . . . . c30448_6cxq 1 . 1 . 28 . 1 1 2 ARG HA H 2.363 -2.053 3.516 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HA . . . . . . . . . c30448_6cxq 1 . 1 . 29 . 1 1 2 ARG HB2 H 1.776 0.092 1.643 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB2 . . . . . . . . . c30448_6cxq 1 . 1 . 30 . 1 1 2 ARG HB3 H 1.507 0.001 3.393 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB3 . . . . . . . . . c30448_6cxq 1 . 1 . 31 . 1 1 2 ARG HD2 H 4.164 2.634 2.149 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD2 . . . . . . . . . c30448_6cxq 1 . 1 . 32 . 1 1 2 ARG HD3 H 2.891 1.948 1.142 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD3 . . . . . . . . . c30448_6cxq 1 . 1 . 33 . 1 1 2 ARG HE H 1.785 2.574 3.628 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HE . . . . . . . . . c30448_6cxq 1 . 1 . 34 . 1 1 2 ARG HG2 H 3.534 0.921 3.903 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG2 . . . . . . . . . c30448_6cxq 1 . 1 . 35 . 1 1 2 ARG HG3 H 4.262 0.285 2.448 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG3 . . . . . . . . . c30448_6cxq 1 . 1 . 36 . 1 1 2 ARG HH11 H 3.169 4.211 0.874 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH11 . . . . . . . . . c30448_6cxq 1 . 1 . 37 . 1 1 2 ARG HH12 H 2.231 5.649 1.099 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH12 . . . . . . . . . c30448_6cxq 1 . 1 . 38 . 1 1 2 ARG HH21 H 0.550 4.464 3.926 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH21 . . . . . . . . . c30448_6cxq 1 . 1 . 39 . 1 1 2 ARG HH22 H 0.744 5.793 2.832 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH22 . . . . . . . . . c30448_6cxq 1 . 1 . 40 . 1 1 2 ARG N N 4.127 -1.681 2.586 . . . 1.0 . . . . . . . . . . . . A . 2 ARG N . . . . . . . . . c30448_6cxq 1 . 1 . 41 . 1 1 2 ARG NE N 2.228 2.951 2.839 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NE . . . . . . . . . c30448_6cxq 1 . 1 . 42 . 1 1 2 ARG NH1 N 2.482 4.725 1.387 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH1 . . . . . . . . . c30448_6cxq 1 . 1 . 43 . 1 1 2 ARG NH2 N 0.991 4.869 3.124 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH2 . . . . . . . . . c30448_6cxq 1 . 1 . 44 . 1 1 2 ARG O O 2.679 -2.504 0.386 . . . 1.0 . . . . . . . . . . . . A . 2 ARG O . . . . . . . . . c30448_6cxq 1 . 1 . 45 . 1 1 3 PHE C C -0.611 -2.254 -0.330 . . . 1.0 . . . . . . . . . . . . A . 3 PHE C . . . . . . . . . c30448_6cxq 1 . 1 . 46 . 1 1 3 PHE CA C 0.054 -3.342 0.504 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CA . . . . . . . . . c30448_6cxq 1 . 1 . 47 . 1 1 3 PHE CB C -0.987 -4.318 1.051 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CB . . . . . . . . . c30448_6cxq 1 . 1 . 48 . 1 1 3 PHE CD1 C -1.642 -6.727 1.001 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CD1 . . . . . . . . . c30448_6cxq 1 . 1 . 49 . 1 1 3 PHE CD2 C -0.355 -5.895 -0.824 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CD2 . . . . . . . . . c30448_6cxq 1 . 1 . 50 . 1 1 3 PHE CE1 C -1.664 -7.981 0.419 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CE1 . . . . . . . . . c30448_6cxq 1 . 1 . 51 . 1 1 3 PHE CE2 C -0.373 -7.145 -1.411 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CE2 . . . . . . . . . c30448_6cxq 1 . 1 . 52 . 1 1 3 PHE CG C -0.990 -5.673 0.392 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CG . . . . . . . . . c30448_6cxq 1 . 1 . 53 . 1 1 3 PHE CZ C -1.028 -8.190 -0.789 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CZ . . . . . . . . . c30448_6cxq 1 . 1 . 54 . 1 1 3 PHE H H 0.324 -2.501 2.424 . . . 1.0 . . . . . . . . . . . . A . 3 PHE H . . . . . . . . . c30448_6cxq 1 . 1 . 55 . 1 1 3 PHE HA H 0.757 -3.867 -0.108 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HA . . . . . . . . . c30448_6cxq 1 . 1 . 56 . 1 1 3 PHE HB2 H -0.803 -4.470 2.108 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HB2 . . . . . . . . . c30448_6cxq 1 . 1 . 57 . 1 1 3 PHE HB3 H -1.966 -3.889 0.918 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HB3 . . . . . . . . . c30448_6cxq 1 . 1 . 58 . 1 1 3 PHE HD1 H -2.141 -6.561 1.943 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HD1 . . . . . . . . . c30448_6cxq 1 . 1 . 59 . 1 1 3 PHE HD2 H 0.156 -5.080 -1.313 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HD2 . . . . . . . . . c30448_6cxq 1 . 1 . 60 . 1 1 3 PHE HE1 H -2.178 -8.795 0.908 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HE1 . . . . . . . . . c30448_6cxq 1 . 1 . 61 . 1 1 3 PHE HE2 H 0.126 -7.306 -2.356 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HE2 . . . . . . . . . c30448_6cxq 1 . 1 . 62 . 1 1 3 PHE HZ H -1.043 -9.168 -1.246 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HZ . . . . . . . . . c30448_6cxq 1 . 1 . 63 . 1 1 3 PHE N N 0.786 -2.704 1.583 . . . 1.0 . . . . . . . . . . . . A . 3 PHE N . . . . . . . . . c30448_6cxq 1 . 1 . 64 . 1 1 3 PHE O O -1.669 -2.453 -0.927 . . . 1.0 . . . . . . . . . . . . A . 3 PHE O . . . . . . . . . c30448_6cxq 1 . 1 . 65 . 1 1 4 LEU C C -1.892 0.379 -0.729 . . . 1.0 . . . . . . . . . . . . A . 4 LEU C . . . . . . . . . c30448_6cxq 1 . 1 . 66 . 1 1 4 LEU CA C -0.430 0.079 -1.052 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CA . . . . . . . . . c30448_6cxq 1 . 1 . 67 . 1 1 4 LEU CB C -0.246 -0.100 -2.560 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CB . . . . . . . . . c30448_6cxq 1 . 1 . 68 . 1 1 4 LEU CD1 C 2.018 -0.898 -3.286 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CD1 . . . . . . . . . c30448_6cxq 1 . 1 . 69 . 1 1 4 LEU CD2 C 0.973 1.076 -4.410 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CD2 . . . . . . . . . c30448_6cxq 1 . 1 . 70 . 1 1 4 LEU CG C 1.124 0.318 -3.099 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CG . . . . . . . . . c30448_6cxq 1 . 1 . 71 . 1 1 4 LEU H H 0.866 -1.019 0.172 . . . 1.0 . . . . . . . . . . . . A . 4 LEU H . . . . . . . . . c30448_6cxq 1 . 1 . 72 . 1 1 4 LEU HA H 0.179 0.910 -0.717 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HA . . . . . . . . . c30448_6cxq 1 . 1 . 73 . 1 1 4 LEU HB2 H -0.403 -1.143 -2.798 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HB2 . . . . . . . . . c30448_6cxq 1 . 1 . 74 . 1 1 4 LEU HB3 H -1.001 0.484 -3.065 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HB3 . . . . . . . . . c30448_6cxq 1 . 1 . 75 . 1 1 4 LEU HD11 H 1.408 -1.768 -3.480 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD11 . . . . . . . . . c30448_6cxq 1 . 1 . 76 . 1 1 4 LEU HD12 H 2.599 -1.059 -2.389 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD12 . . . . . . . . . c30448_6cxq 1 . 1 . 77 . 1 1 4 LEU HD13 H 2.683 -0.731 -4.120 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD13 . . . . . . . . . c30448_6cxq 1 . 1 . 78 . 1 1 4 LEU HD21 H 1.007 0.379 -5.235 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD21 . . . . . . . . . c30448_6cxq 1 . 1 . 79 . 1 1 4 LEU HD22 H 1.778 1.789 -4.508 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD22 . . . . . . . . . c30448_6cxq 1 . 1 . 80 . 1 1 4 LEU HD23 H 0.027 1.597 -4.418 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD23 . . . . . . . . . c30448_6cxq 1 . 1 . 81 . 1 1 4 LEU HG H 1.599 0.975 -2.385 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HG . . . . . . . . . c30448_6cxq 1 . 1 . 82 . 1 1 4 LEU N N 0.038 -1.092 -0.336 . . . 1.0 . . . . . . . . . . . . A . 4 LEU N . . . . . . . . . c30448_6cxq 1 . 1 . 83 . 1 1 4 LEU O O -2.512 -0.308 0.083 . . . 1.0 . . . . . . . . . . . . A . 4 LEU O . . . . . . . . . c30448_6cxq 1 . 1 . 84 . 1 1 5 ARG C C -4.626 1.716 -2.443 . . . 1.0 . . . . . . . . . . . . A . 5 ARG C . . . . . . . . . c30448_6cxq 1 . 1 . 85 . 1 1 5 ARG CA C -3.821 1.804 -1.150 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CA . . . . . . . . . c30448_6cxq 1 . 1 . 86 . 1 1 5 ARG CB C -3.883 3.226 -0.603 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CB . . . . . . . . . c30448_6cxq 1 . 1 . 87 . 1 1 5 ARG CD C -1.761 4.357 -1.115 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CD . . . . . . . . . c30448_6cxq 1 . 1 . 88 . 1 1 5 ARG CG C -3.201 4.229 -1.496 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CG . . . . . . . . . c30448_6cxq 1 . 1 . 89 . 1 1 5 ARG CZ C 0.242 5.428 -2.074 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CZ . . . . . . . . . c30448_6cxq 1 . 1 . 90 . 1 1 5 ARG H H -1.888 1.919 -2.004 . . . 1.0 . . . . . . . . . . . . A . 5 ARG H . . . . . . . . . c30448_6cxq 1 . 1 . 91 . 1 1 5 ARG HA H -4.241 1.133 -0.424 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HA . . . . . . . . . c30448_6cxq 1 . 1 . 92 . 1 1 5 ARG HB2 H -4.915 3.526 -0.493 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HB2 . . . . . . . . . c30448_6cxq 1 . 1 . 93 . 1 1 5 ARG HB3 H -3.393 3.249 0.367 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HB3 . . . . . . . . . c30448_6cxq 1 . 1 . 94 . 1 1 5 ARG HD2 H -1.707 5.052 -0.309 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HD2 . . . . . . . . . c30448_6cxq 1 . 1 . 95 . 1 1 5 ARG HD3 H -1.407 3.389 -0.786 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HD3 . . . . . . . . . c30448_6cxq 1 . 1 . 96 . 1 1 5 ARG HE H -1.275 4.677 -3.134 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HE . . . . . . . . . c30448_6cxq 1 . 1 . 97 . 1 1 5 ARG HG2 H -3.262 3.900 -2.514 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HG2 . . . . . . . . . c30448_6cxq 1 . 1 . 98 . 1 1 5 ARG HG3 H -3.683 5.189 -1.389 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HG3 . . . . . . . . . c30448_6cxq 1 . 1 . 99 . 1 1 5 ARG HH11 H 0.227 5.345 -0.053 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH11 . . . . . . . . . c30448_6cxq 1 . 1 . 100 . 1 1 5 ARG HH12 H 1.621 6.094 -0.755 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH12 . . . . . . . . . c30448_6cxq 1 . 1 . 101 . 1 1 5 ARG HH21 H 0.560 5.662 -4.056 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH21 . . . . . . . . . c30448_6cxq 1 . 1 . 102 . 1 1 5 ARG HH22 H 1.811 6.275 -3.026 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH22 . . . . . . . . . c30448_6cxq 1 . 1 . 103 . 1 1 5 ARG N N -2.434 1.410 -1.370 . . . 1.0 . . . . . . . . . . . . A . 5 ARG N . . . . . . . . . c30448_6cxq 1 . 1 . 104 . 1 1 5 ARG NE N -0.934 4.823 -2.226 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NE . . . . . . . . . c30448_6cxq 1 . 1 . 105 . 1 1 5 ARG NH1 N 0.737 5.639 -0.861 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NH1 . . . . . . . . . c30448_6cxq 1 . 1 . 106 . 1 1 5 ARG NH2 N 0.927 5.820 -3.139 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NH2 . . . . . . . . . c30448_6cxq 1 . 1 . 107 . 1 1 5 ARG O O -5.656 2.374 -2.588 . . . 1.0 . . . . . . . . . . . . A . 5 ARG O . . . . . . . . . c30448_6cxq 1 . 1 . 108 . 1 1 6 HIS C C -6.301 0.418 -4.477 . . . 1.0 . . . . . . . . . . . . A . 6 HIS C . . . . . . . . . c30448_6cxq 1 . 1 . 109 . 1 1 6 HIS CA C -4.821 0.742 -4.668 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CA . . . . . . . . . c30448_6cxq 1 . 1 . 110 . 1 1 6 HIS CB C -4.147 -0.363 -5.484 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CB . . . . . . . . . c30448_6cxq 1 . 1 . 111 . 1 1 6 HIS CD2 C -5.033 -2.779 -5.149 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CD2 . . . . . . . . . c30448_6cxq 1 . 1 . 112 . 1 1 6 HIS CE1 C -3.784 -3.343 -3.438 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CE1 . . . . . . . . . c30448_6cxq 1 . 1 . 113 . 1 1 6 HIS CG C -4.246 -1.717 -4.852 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CG . . . . . . . . . c30448_6cxq 1 . 1 . 114 . 1 1 6 HIS H H -3.320 0.411 -3.214 . . . 1.0 . . . . . . . . . . . . A . 6 HIS H . . . . . . . . . c30448_6cxq 1 . 1 . 115 . 1 1 6 HIS HA H -4.735 1.676 -5.205 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HA . . . . . . . . . c30448_6cxq 1 . 1 . 116 . 1 1 6 HIS HB2 H -4.615 -0.417 -6.459 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HB2 . . . . . . . . . c30448_6cxq 1 . 1 . 117 . 1 1 6 HIS HB3 H -3.096 -0.124 -5.600 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HB3 . . . . . . . . . c30448_6cxq 1 . 1 . 118 . 1 1 6 HIS HD1 H -2.803 -1.551 -3.325 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HD1 . . . . . . . . . c30448_6cxq 1 . 1 . 119 . 1 1 6 HIS HD2 H -5.766 -2.831 -5.942 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HD2 . . . . . . . . . c30448_6cxq 1 . 1 . 120 . 1 1 6 HIS HE1 H -3.341 -3.907 -2.630 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HE1 . . . . . . . . . c30448_6cxq 1 . 1 . 121 . 1 1 6 HIS HE2 H -5.073 -4.691 -4.283 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HE2 . . . . . . . . . c30448_6cxq 1 . 1 . 122 . 1 1 6 HIS N N -4.148 0.906 -3.384 . . . 1.0 . . . . . . . . . . . . A . 6 HIS N . . . . . . . . . c30448_6cxq 1 . 1 . 123 . 1 1 6 HIS ND1 N -3.476 -2.103 -3.775 . . . 1.0 . . . . . . . . . . . . A . 6 HIS ND1 . . . . . . . . . c30448_6cxq 1 . 1 . 124 . 1 1 6 HIS NE2 N -4.726 -3.775 -4.256 . . . 1.0 . . . . . . . . . . . . A . 6 HIS NE2 . . . . . . . . . c30448_6cxq 1 . 1 . 125 . 1 1 6 HIS O O -6.607 -0.504 -3.693 . . . 1.0 . . . . . . . . . . . . A . 6 HIS O . . . . . . . . . c30448_6cxq 1 . 2 . 126 . 1 1 1 HIS C C 4.873 -1.646 3.657 . . . 1.0 . . . . . . . . . . . . A . 1 HIS C . . . . . . . . . c30448_6cxq 1 . 2 . 127 . 1 1 1 HIS CA C 6.378 -1.773 3.518 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CA . . . . . . . . . c30448_6cxq 1 . 2 . 128 . 1 1 1 HIS CB C 6.740 -2.830 2.473 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CB . . . . . . . . . c30448_6cxq 1 . 2 . 129 . 1 1 1 HIS CD2 C 6.657 -2.613 -0.110 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CD2 . . . . . . . . . c30448_6cxq 1 . 2 . 130 . 1 1 1 HIS CE1 C 8.014 -0.905 -0.332 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CE1 . . . . . . . . . c30448_6cxq 1 . 2 . 131 . 1 1 1 HIS CG C 7.068 -2.256 1.130 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CG . . . . . . . . . c30448_6cxq 1 . 2 . 132 . 1 1 1 HIS H1 H 8.040 -2.096 4.688 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H1 . . . . . . . . . c30448_6cxq 1 . 2 . 133 . 1 1 1 HIS H2 H 6.704 -3.112 5.045 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H2 . . . . . . . . . c30448_6cxq 1 . 2 . 134 . 1 1 1 HIS H3 H 6.686 -1.466 5.529 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H3 . . . . . . . . . c30448_6cxq 1 . 2 . 135 . 1 1 1 HIS HA H 6.765 -0.812 3.208 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HA . . . . . . . . . c30448_6cxq 1 . 2 . 136 . 1 1 1 HIS HB2 H 7.601 -3.385 2.815 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HB2 . . . . . . . . . c30448_6cxq 1 . 2 . 137 . 1 1 1 HIS HB3 H 5.907 -3.507 2.352 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HB3 . . . . . . . . . c30448_6cxq 1 . 2 . 138 . 1 1 1 HIS HD1 H 8.381 -0.699 1.671 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HD1 . . . . . . . . . c30448_6cxq 1 . 2 . 139 . 1 1 1 HIS HD2 H 5.981 -3.420 -0.354 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HD2 . . . . . . . . . c30448_6cxq 1 . 2 . 140 . 1 1 1 HIS HE1 H 8.609 -0.115 -0.765 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HE1 . . . . . . . . . c30448_6cxq 1 . 2 . 141 . 1 1 1 HIS HE2 H 7.217 -1.830 -1.976 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HE2 . . . . . . . . . c30448_6cxq 1 . 2 . 142 . 1 1 1 HIS N N 7.009 -2.145 4.812 . . . 1.0 . . . . . . . . . . . . A . 1 HIS N . . . . . . . . . c30448_6cxq 1 . 2 . 143 . 1 1 1 HIS ND1 N 7.918 -1.184 0.956 . . . 1.0 . . . . . . . . . . . . A . 1 HIS ND1 . . . . . . . . . c30448_6cxq 1 . 2 . 144 . 1 1 1 HIS NE2 N 7.259 -1.757 -1.000 . . . 1.0 . . . . . . . . . . . . A . 1 HIS NE2 . . . . . . . . . c30448_6cxq 1 . 2 . 145 . 1 1 1 HIS O O 4.357 -1.451 4.758 . . . 1.0 . . . . . . . . . . . . A . 1 HIS O . . . . . . . . . c30448_6cxq 1 . 2 . 146 . 1 1 2 ARG C C 2.050 -2.327 1.432 . . . 1.0 . . . . . . . . . . . . A . 2 ARG C . . . . . . . . . c30448_6cxq 1 . 2 . 147 . 1 1 2 ARG CA C 2.724 -1.564 2.557 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CA . . . . . . . . . c30448_6cxq 1 . 2 . 148 . 1 1 2 ARG CB C 2.356 -0.082 2.459 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CB . . . . . . . . . c30448_6cxq 1 . 2 . 149 . 1 1 2 ARG CD C 3.449 2.045 1.690 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CD . . . . . . . . . c30448_6cxq 1 . 2 . 150 . 1 1 2 ARG CG C 3.582 0.789 2.537 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CG . . . . . . . . . c30448_6cxq 1 . 2 . 151 . 1 1 2 ARG CZ C 5.562 1.954 0.426 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CZ . . . . . . . . . c30448_6cxq 1 . 2 . 152 . 1 1 2 ARG H H 4.628 -1.844 1.678 . . . 1.0 . . . . . . . . . . . . A . 2 ARG H . . . . . . . . . c30448_6cxq 1 . 2 . 153 . 1 1 2 ARG HA H 2.393 -1.926 3.492 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HA . . . . . . . . . c30448_6cxq 1 . 2 . 154 . 1 1 2 ARG HB2 H 1.846 0.107 1.512 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB2 . . . . . . . . . c30448_6cxq 1 . 2 . 155 . 1 1 2 ARG HB3 H 1.699 0.174 3.277 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB3 . . . . . . . . . c30448_6cxq 1 . 2 . 156 . 1 1 2 ARG HD2 H 2.409 2.184 1.434 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD2 . . . . . . . . . c30448_6cxq 1 . 2 . 157 . 1 1 2 ARG HD3 H 3.794 2.890 2.267 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD3 . . . . . . . . . c30448_6cxq 1 . 2 . 158 . 1 1 2 ARG HE H 3.740 1.901 -0.386 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HE . . . . . . . . . c30448_6cxq 1 . 2 . 159 . 1 1 2 ARG HG2 H 3.769 1.061 3.565 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG2 . . . . . . . . . c30448_6cxq 1 . 2 . 160 . 1 1 2 ARG HG3 H 4.400 0.201 2.179 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG3 . . . . . . . . . c30448_6cxq 1 . 2 . 161 . 1 1 2 ARG HH11 H 5.791 2.095 2.430 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH11 . . . . . . . . . c30448_6cxq 1 . 2 . 162 . 1 1 2 ARG HH12 H 7.262 2.027 1.519 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH12 . . . . . . . . . c30448_6cxq 1 . 2 . 163 . 1 1 2 ARG HH21 H 5.672 1.811 -1.587 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH21 . . . . . . . . . c30448_6cxq 1 . 2 . 164 . 1 1 2 ARG HH22 H 7.195 1.866 -0.763 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH22 . . . . . . . . . c30448_6cxq 1 . 2 . 165 . 1 1 2 ARG N N 4.167 -1.717 2.533 . . . 1.0 . . . . . . . . . . . . A . 2 ARG N . . . . . . . . . c30448_6cxq 1 . 2 . 166 . 1 1 2 ARG NE N 4.232 1.959 0.459 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NE . . . . . . . . . c30448_6cxq 1 . 2 . 167 . 1 1 2 ARG NH1 N 6.262 2.032 1.551 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH1 . . . . . . . . . c30448_6cxq 1 . 2 . 168 . 1 1 2 ARG NH2 N 6.195 1.870 -0.737 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH2 . . . . . . . . . c30448_6cxq 1 . 2 . 169 . 1 1 2 ARG O O 2.642 -2.551 0.377 . . . 1.0 . . . . . . . . . . . . A . 2 ARG O . . . . . . . . . c30448_6cxq 1 . 2 . 170 . 1 1 3 PHE C C -0.676 -2.290 -0.240 . . . 1.0 . . . . . . . . . . . . A . 3 PHE C . . . . . . . . . c30448_6cxq 1 . 2 . 171 . 1 1 3 PHE CA C 0.013 -3.347 0.613 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CA . . . . . . . . . c30448_6cxq 1 . 2 . 172 . 1 1 3 PHE CB C -1.012 -4.294 1.234 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CB . . . . . . . . . c30448_6cxq 1 . 2 . 173 . 1 1 3 PHE CD1 C -1.706 -6.693 1.269 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CD1 . . . . . . . . . c30448_6cxq 1 . 2 . 174 . 1 1 3 PHE CD2 C -0.494 -5.920 -0.632 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CD2 . . . . . . . . . c30448_6cxq 1 . 2 . 175 . 1 1 3 PHE CE1 C -1.774 -7.958 0.716 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CE1 . . . . . . . . . c30448_6cxq 1 . 2 . 176 . 1 1 3 PHE CE2 C -0.558 -7.183 -1.190 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CE2 . . . . . . . . . c30448_6cxq 1 . 2 . 177 . 1 1 3 PHE CG C -1.068 -5.662 0.606 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CG . . . . . . . . . c30448_6cxq 1 . 2 . 178 . 1 1 3 PHE CZ C -1.199 -8.203 -0.515 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CZ . . . . . . . . . c30448_6cxq 1 . 2 . 179 . 1 1 3 PHE H H 0.354 -2.427 2.485 . . . 1.0 . . . . . . . . . . . . A . 3 PHE H . . . . . . . . . c30448_6cxq 1 . 2 . 180 . 1 1 3 PHE HA H 0.692 -3.900 -0.001 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HA . . . . . . . . . c30448_6cxq 1 . 2 . 181 . 1 1 3 PHE HB2 H -0.777 -4.426 2.283 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HB2 . . . . . . . . . c30448_6cxq 1 . 2 . 182 . 1 1 3 PHE HB3 H -1.990 -3.853 1.141 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HB3 . . . . . . . . . c30448_6cxq 1 . 2 . 183 . 1 1 3 PHE HD1 H -2.157 -6.498 2.229 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HD1 . . . . . . . . . c30448_6cxq 1 . 2 . 184 . 1 1 3 PHE HD2 H 0.006 -5.125 -1.163 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HD2 . . . . . . . . . c30448_6cxq 1 . 2 . 185 . 1 1 3 PHE HE1 H -2.276 -8.754 1.247 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HE1 . . . . . . . . . c30448_6cxq 1 . 2 . 186 . 1 1 3 PHE HE2 H -0.107 -7.372 -2.153 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HE2 . . . . . . . . . c30448_6cxq 1 . 2 . 187 . 1 1 3 PHE HZ H -1.250 -9.191 -0.949 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HZ . . . . . . . . . c30448_6cxq 1 . 2 . 188 . 1 1 3 PHE N N 0.787 -2.671 1.640 . . . 1.0 . . . . . . . . . . . . A . 3 PHE N . . . . . . . . . c30448_6cxq 1 . 2 . 189 . 1 1 3 PHE O O -1.748 -2.511 -0.803 . . . 1.0 . . . . . . . . . . . . A . 3 PHE O . . . . . . . . . c30448_6cxq 1 . 2 . 190 . 1 1 4 LEU C C -1.974 0.323 -0.701 . . . 1.0 . . . . . . . . . . . . A . 4 LEU C . . . . . . . . . c30448_6cxq 1 . 2 . 191 . 1 1 4 LEU CA C -0.519 0.017 -1.048 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CA . . . . . . . . . c30448_6cxq 1 . 2 . 192 . 1 1 4 LEU CB C -0.373 -0.216 -2.553 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CB . . . . . . . . . c30448_6cxq 1 . 2 . 193 . 1 1 4 LEU CD1 C 1.659 -1.612 -3.003 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CD1 . . . . . . . . . c30448_6cxq 1 . 2 . 194 . 1 1 4 LEU CD2 C 1.116 0.319 -4.497 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CD2 . . . . . . . . . c30448_6cxq 1 . 2 . 195 . 1 1 4 LEU CG C 1.065 -0.214 -3.073 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CG . . . . . . . . . c30448_6cxq 1 . 2 . 196 . 1 1 4 LEU H H 0.811 -1.037 0.179 . . . 1.0 . . . . . . . . . . . . A . 4 LEU H . . . . . . . . . c30448_6cxq 1 . 2 . 197 . 1 1 4 LEU HA H 0.095 0.861 -0.758 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HA . . . . . . . . . c30448_6cxq 1 . 2 . 198 . 1 1 4 LEU HB2 H -0.820 -1.170 -2.793 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HB2 . . . . . . . . . c30448_6cxq 1 . 2 . 199 . 1 1 4 LEU HB3 H -0.920 0.559 -3.071 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HB3 . . . . . . . . . c30448_6cxq 1 . 2 . 200 . 1 1 4 LEU HD11 H 0.867 -2.343 -3.066 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD11 . . . . . . . . . c30448_6cxq 1 . 2 . 201 . 1 1 4 LEU HD12 H 2.187 -1.733 -2.069 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD12 . . . . . . . . . c30448_6cxq 1 . 2 . 202 . 1 1 4 LEU HD13 H 2.345 -1.753 -3.826 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD13 . . . . . . . . . c30448_6cxq 1 . 2 . 203 . 1 1 4 LEU HD21 H 2.076 0.780 -4.675 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD21 . . . . . . . . . c30448_6cxq 1 . 2 . 204 . 1 1 4 LEU HD22 H 0.334 1.051 -4.635 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD22 . . . . . . . . . c30448_6cxq 1 . 2 . 205 . 1 1 4 LEU HD23 H 0.973 -0.495 -5.191 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD23 . . . . . . . . . c30448_6cxq 1 . 2 . 206 . 1 1 4 LEU HG H 1.665 0.434 -2.451 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HG . . . . . . . . . c30448_6cxq 1 . 2 . 207 . 1 1 4 LEU N N -0.030 -1.128 -0.303 . . . 1.0 . . . . . . . . . . . . A . 4 LEU N . . . . . . . . . c30448_6cxq 1 . 2 . 208 . 1 1 4 LEU O O -2.587 -0.365 0.115 . . . 1.0 . . . . . . . . . . . . A . 4 LEU O . . . . . . . . . c30448_6cxq 1 . 2 . 209 . 1 1 5 ARG C C -4.761 1.523 -2.335 . . . 1.0 . . . . . . . . . . . . A . 5 ARG C . . . . . . . . . c30448_6cxq 1 . 2 . 210 . 1 1 5 ARG CA C -3.903 1.755 -1.093 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CA . . . . . . . . . c30448_6cxq 1 . 2 . 211 . 1 1 5 ARG CB C -3.969 3.225 -0.688 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CB . . . . . . . . . c30448_6cxq 1 . 2 . 212 . 1 1 5 ARG CD C -1.825 4.316 -1.220 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CD . . . . . . . . . c30448_6cxq 1 . 2 . 213 . 1 1 5 ARG CG C -3.247 4.136 -1.649 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CG . . . . . . . . . c30448_6cxq 1 . 2 . 214 . 1 1 5 ARG CZ C 0.202 5.361 -2.156 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CZ . . . . . . . . . c30448_6cxq 1 . 2 . 215 . 1 1 5 ARG H H -1.980 1.866 -1.971 . . . 1.0 . . . . . . . . . . . . A . 5 ARG H . . . . . . . . . c30448_6cxq 1 . 2 . 216 . 1 1 5 ARG HA H -4.281 1.156 -0.286 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HA . . . . . . . . . c30448_6cxq 1 . 2 . 217 . 1 1 5 ARG HB2 H -5.002 3.539 -0.643 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HB2 . . . . . . . . . c30448_6cxq 1 . 2 . 218 . 1 1 5 ARG HB3 H -3.513 3.337 0.292 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HB3 . . . . . . . . . c30448_6cxq 1 . 2 . 219 . 1 1 5 ARG HD2 H -1.815 5.056 -0.452 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HD2 . . . . . . . . . c30448_6cxq 1 . 2 . 220 . 1 1 5 ARG HD3 H -1.463 3.377 -0.825 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HD3 . . . . . . . . . c30448_6cxq 1 . 2 . 221 . 1 1 5 ARG HE H -1.274 4.555 -3.234 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HE . . . . . . . . . c30448_6cxq 1 . 2 . 222 . 1 1 5 ARG HG2 H -3.260 3.703 -2.629 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HG2 . . . . . . . . . c30448_6cxq 1 . 2 . 223 . 1 1 5 ARG HG3 H -3.737 5.098 -1.665 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HG3 . . . . . . . . . c30448_6cxq 1 . 2 . 224 . 1 1 5 ARG HH11 H 0.119 5.361 -0.135 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH11 . . . . . . . . . c30448_6cxq 1 . 2 . 225 . 1 1 5 ARG HH12 H 1.532 6.092 -0.820 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH12 . . . . . . . . . c30448_6cxq 1 . 2 . 226 . 1 1 5 ARG HH21 H 0.584 5.516 -4.134 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH21 . . . . . . . . . c30448_6cxq 1 . 2 . 227 . 1 1 5 ARG HH22 H 1.796 6.180 -3.089 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH22 . . . . . . . . . c30448_6cxq 1 . 2 . 228 . 1 1 5 ARG N N -2.520 1.358 -1.330 . . . 1.0 . . . . . . . . . . . . A . 5 ARG N . . . . . . . . . c30448_6cxq 1 . 2 . 229 . 1 1 5 ARG NE N -0.965 4.741 -2.321 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NE . . . . . . . . . c30448_6cxq 1 . 2 . 230 . 1 1 5 ARG NH1 N 0.654 5.626 -0.937 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NH1 . . . . . . . . . c30448_6cxq 1 . 2 . 231 . 1 1 5 ARG NH2 N 0.920 5.714 -3.213 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NH2 . . . . . . . . . c30448_6cxq 1 . 2 . 232 . 1 1 5 ARG O O -5.990 1.536 -2.262 . . . 1.0 . . . . . . . . . . . . A . 5 ARG O . . . . . . . . . c30448_6cxq 1 . 2 . 233 . 1 1 6 HIS C C -5.934 0.080 -4.576 . . . 1.0 . . . . . . . . . . . . A . 6 HIS C . . . . . . . . . c30448_6cxq 1 . 2 . 234 . 1 1 6 HIS CA C -4.800 1.091 -4.739 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CA . . . . . . . . . c30448_6cxq 1 . 2 . 235 . 1 1 6 HIS CB C -3.813 0.602 -5.802 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CB . . . . . . . . . c30448_6cxq 1 . 2 . 236 . 1 1 6 HIS CD2 C -3.829 -1.989 -5.650 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CD2 . . . . . . . . . c30448_6cxq 1 . 2 . 237 . 1 1 6 HIS CE1 C -1.782 -2.280 -4.923 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CE1 . . . . . . . . . c30448_6cxq 1 . 2 . 238 . 1 1 6 HIS CG C -3.263 -0.764 -5.529 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CG . . . . . . . . . c30448_6cxq 1 . 2 . 239 . 1 1 6 HIS H H -3.125 1.325 -3.472 . . . 1.0 . . . . . . . . . . . . A . 6 HIS H . . . . . . . . . c30448_6cxq 1 . 2 . 240 . 1 1 6 HIS HA H -5.217 2.034 -5.058 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HA . . . . . . . . . c30448_6cxq 1 . 2 . 241 . 1 1 6 HIS HB2 H -4.313 0.572 -6.763 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HB2 . . . . . . . . . c30448_6cxq 1 . 2 . 242 . 1 1 6 HIS HB3 H -2.978 1.293 -5.851 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HB3 . . . . . . . . . c30448_6cxq 1 . 2 . 243 . 1 1 6 HIS HD1 H -1.315 -0.288 -4.882 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HD1 . . . . . . . . . c30448_6cxq 1 . 2 . 244 . 1 1 6 HIS HD2 H -4.835 -2.199 -5.985 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HD2 . . . . . . . . . c30448_6cxq 1 . 2 . 245 . 1 1 6 HIS HE1 H -0.869 -2.744 -4.579 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HE1 . . . . . . . . . c30448_6cxq 1 . 2 . 246 . 1 1 6 HIS HE2 H -2.983 -3.885 -5.340 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HE2 . . . . . . . . . c30448_6cxq 1 . 2 . 247 . 1 1 6 HIS N N -4.104 1.318 -3.477 . . . 1.0 . . . . . . . . . . . . A . 6 HIS N . . . . . . . . . c30448_6cxq 1 . 2 . 248 . 1 1 6 HIS ND1 N -1.980 -0.982 -5.070 . . . 1.0 . . . . . . . . . . . . A . 6 HIS ND1 . . . . . . . . . c30448_6cxq 1 . 2 . 249 . 1 1 6 HIS NE2 N -2.888 -2.912 -5.268 . . . 1.0 . . . . . . . . . . . . A . 6 HIS NE2 . . . . . . . . . c30448_6cxq 1 . 2 . 250 . 1 1 6 HIS O O -5.916 -0.672 -3.580 . . . 1.0 . . . . . . . . . . . . A . 6 HIS O . . . . . . . . . c30448_6cxq 1 . 3 . 251 . 1 1 1 HIS C C 4.871 -1.621 3.649 . . . 1.0 . . . . . . . . . . . . A . 1 HIS C . . . . . . . . . c30448_6cxq 1 . 3 . 252 . 1 1 1 HIS CA C 6.378 -1.686 3.481 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CA . . . . . . . . . c30448_6cxq 1 . 3 . 253 . 1 1 1 HIS CB C 6.761 -2.669 2.374 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CB . . . . . . . . . c30448_6cxq 1 . 3 . 254 . 1 1 1 HIS CD2 C 6.754 -2.435 -0.209 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CD2 . . . . . . . . . c30448_6cxq 1 . 3 . 255 . 1 1 1 HIS CE1 C 7.679 -0.452 -0.353 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CE1 . . . . . . . . . c30448_6cxq 1 . 3 . 256 . 1 1 1 HIS CG C 7.010 -2.013 1.052 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CG . . . . . . . . . c30448_6cxq 1 . 3 . 257 . 1 1 1 HIS H1 H 6.565 -1.622 5.529 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H1 . . . . . . . . . c30448_6cxq 1 . 3 . 258 . 1 1 1 HIS H2 H 8.043 -1.826 4.681 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H2 . . . . . . . . . c30448_6cxq 1 . 3 . 259 . 1 1 1 HIS H3 H 6.945 -3.137 4.824 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H3 . . . . . . . . . c30448_6cxq 1 . 3 . 260 . 1 1 1 HIS HA H 6.724 -0.696 3.220 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HA . . . . . . . . . c30448_6cxq 1 . 3 . 261 . 1 1 1 HIS HB2 H 7.662 -3.190 2.660 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HB2 . . . . . . . . . c30448_6cxq 1 . 3 . 262 . 1 1 1 HIS HB3 H 5.962 -3.385 2.246 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HB3 . . . . . . . . . c30448_6cxq 1 . 3 . 263 . 1 1 1 HIS HD1 H 7.890 -0.199 1.667 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HD1 . . . . . . . . . c30448_6cxq 1 . 3 . 264 . 1 1 1 HIS HD2 H 6.300 -3.374 -0.491 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HD2 . . . . . . . . . c30448_6cxq 1 . 3 . 265 . 1 1 1 HIS HE1 H 8.091 0.463 -0.751 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HE1 . . . . . . . . . c30448_6cxq 1 . 3 . 266 . 1 1 1 HIS HE2 H 7.048 -1.438 -2.034 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HE2 . . . . . . . . . c30448_6cxq 1 . 3 . 267 . 1 1 1 HIS N N 7.043 -2.106 4.742 . . . 1.0 . . . . . . . . . . . . A . 1 HIS N . . . . . . . . . c30448_6cxq 1 . 3 . 268 . 1 1 1 HIS ND1 N 7.590 -0.768 0.927 . . . 1.0 . . . . . . . . . . . . A . 1 HIS ND1 . . . . . . . . . c30448_6cxq 1 . 3 . 269 . 1 1 1 HIS NE2 N 7.180 -1.447 -1.063 . . . 1.0 . . . . . . . . . . . . A . 1 HIS NE2 . . . . . . . . . c30448_6cxq 1 . 3 . 270 . 1 1 1 HIS O O 4.369 -1.488 4.765 . . . 1.0 . . . . . . . . . . . . A . 1 HIS O . . . . . . . . . c30448_6cxq 1 . 3 . 271 . 1 1 2 ARG C C 2.034 -2.344 1.468 . . . 1.0 . . . . . . . . . . . . A . 2 ARG C . . . . . . . . . c30448_6cxq 1 . 3 . 272 . 1 1 2 ARG CA C 2.703 -1.571 2.588 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CA . . . . . . . . . c30448_6cxq 1 . 3 . 273 . 1 1 2 ARG CB C 2.284 -0.102 2.517 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CB . . . . . . . . . c30448_6cxq 1 . 3 . 274 . 1 1 2 ARG CD C 3.301 2.109 1.883 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CD . . . . . . . . . c30448_6cxq 1 . 3 . 275 . 1 1 2 ARG CG C 3.476 0.811 2.653 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CG . . . . . . . . . c30448_6cxq 1 . 3 . 276 . 1 1 2 ARG CZ C 4.522 3.337 0.130 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CZ . . . . . . . . . c30448_6cxq 1 . 3 . 277 . 1 1 2 ARG H H 4.598 -1.747 1.667 . . . 1.0 . . . . . . . . . . . . A . 2 ARG H . . . . . . . . . c30448_6cxq 1 . 3 . 278 . 1 1 2 ARG HA H 2.402 -1.955 3.526 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HA . . . . . . . . . c30448_6cxq 1 . 3 . 279 . 1 1 2 ARG HB2 H 1.795 0.094 1.559 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB2 . . . . . . . . . c30448_6cxq 1 . 3 . 280 . 1 1 2 ARG HB3 H 1.595 0.111 3.321 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB3 . . . . . . . . . c30448_6cxq 1 . 3 . 281 . 1 1 2 ARG HD2 H 2.285 2.166 1.524 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD2 . . . . . . . . . c30448_6cxq 1 . 3 . 282 . 1 1 2 ARG HD3 H 3.493 2.937 2.551 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD3 . . . . . . . . . c30448_6cxq 1 . 3 . 283 . 1 1 2 ARG HE H 4.614 1.365 0.421 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HE . . . . . . . . . c30448_6cxq 1 . 3 . 284 . 1 1 2 ARG HG2 H 3.648 1.027 3.696 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG2 . . . . . . . . . c30448_6cxq 1 . 3 . 285 . 1 1 2 ARG HG3 H 4.318 0.277 2.268 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG3 . . . . . . . . . c30448_6cxq 1 . 3 . 286 . 1 1 2 ARG HH11 H 3.362 4.498 1.313 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH11 . . . . . . . . . c30448_6cxq 1 . 3 . 287 . 1 1 2 ARG HH12 H 4.233 5.337 0.074 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH12 . . . . . . . . . c30448_6cxq 1 . 3 . 288 . 1 1 2 ARG HH21 H 5.760 2.467 -1.209 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH21 . . . . . . . . . c30448_6cxq 1 . 3 . 289 . 1 1 2 ARG HH22 H 5.593 4.184 -1.359 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH22 . . . . . . . . . c30448_6cxq 1 . 3 . 290 . 1 1 2 ARG N N 4.149 -1.672 2.535 . . . 1.0 . . . . . . . . . . . . A . 2 ARG N . . . . . . . . . c30448_6cxq 1 . 3 . 291 . 1 1 2 ARG NE N 4.212 2.198 0.745 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NE . . . . . . . . . c30448_6cxq 1 . 3 . 292 . 1 1 2 ARG NH1 N 3.995 4.485 0.539 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH1 . . . . . . . . . c30448_6cxq 1 . 3 . 293 . 1 1 2 ARG NH2 N 5.360 3.329 -0.897 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH2 . . . . . . . . . c30448_6cxq 1 . 3 . 294 . 1 1 2 ARG O O 2.623 -2.560 0.409 . . . 1.0 . . . . . . . . . . . . A . 2 ARG O . . . . . . . . . c30448_6cxq 1 . 3 . 295 . 1 1 3 PHE C C -0.675 -2.347 -0.210 . . . 1.0 . . . . . . . . . . . . A . 3 PHE C . . . . . . . . . c30448_6cxq 1 . 3 . 296 . 1 1 3 PHE CA C 0.009 -3.393 0.659 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CA . . . . . . . . . c30448_6cxq 1 . 3 . 297 . 1 1 3 PHE CB C -1.020 -4.332 1.287 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CB . . . . . . . . . c30448_6cxq 1 . 3 . 298 . 1 1 3 PHE CD1 C -1.673 -6.738 1.401 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CD1 . . . . . . . . . c30448_6cxq 1 . 3 . 299 . 1 1 3 PHE CD2 C -0.440 -6.019 -0.507 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CD2 . . . . . . . . . c30448_6cxq 1 . 3 . 300 . 1 1 3 PHE CE1 C -1.711 -8.024 0.898 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CE1 . . . . . . . . . c30448_6cxq 1 . 3 . 301 . 1 1 3 PHE CE2 C -0.473 -7.304 -1.016 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CE2 . . . . . . . . . c30448_6cxq 1 . 3 . 302 . 1 1 3 PHE CG C -1.040 -5.723 0.711 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CG . . . . . . . . . c30448_6cxq 1 . 3 . 303 . 1 1 3 PHE CZ C -1.109 -8.308 -0.313 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CZ . . . . . . . . . c30448_6cxq 1 . 3 . 304 . 1 1 3 PHE H H 0.344 -2.467 2.529 . . . 1.0 . . . . . . . . . . . . A . 3 PHE H . . . . . . . . . c30448_6cxq 1 . 3 . 305 . 1 1 3 PHE HA H 0.691 -3.954 0.055 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HA . . . . . . . . . c30448_6cxq 1 . 3 . 306 . 1 1 3 PHE HB2 H -0.813 -4.421 2.346 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HB2 . . . . . . . . . c30448_6cxq 1 . 3 . 307 . 1 1 3 PHE HB3 H -2.002 -3.909 1.150 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HB3 . . . . . . . . . c30448_6cxq 1 . 3 . 308 . 1 1 3 PHE HD1 H -2.144 -6.513 2.345 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HD1 . . . . . . . . . c30448_6cxq 1 . 3 . 309 . 1 1 3 PHE HD2 H 0.056 -5.236 -1.060 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HD2 . . . . . . . . . c30448_6cxq 1 . 3 . 310 . 1 1 3 PHE HE1 H -2.209 -8.807 1.450 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HE1 . . . . . . . . . c30448_6cxq 1 . 3 . 311 . 1 1 3 PHE HE2 H -0.002 -7.522 -1.963 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HE2 . . . . . . . . . c30448_6cxq 1 . 3 . 312 . 1 1 3 PHE HZ H -1.137 -9.312 -0.708 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HZ . . . . . . . . . c30448_6cxq 1 . 3 . 313 . 1 1 3 PHE N N 0.777 -2.706 1.683 . . . 1.0 . . . . . . . . . . . . A . 3 PHE N . . . . . . . . . c30448_6cxq 1 . 3 . 314 . 1 1 3 PHE O O -1.742 -2.577 -0.779 . . . 1.0 . . . . . . . . . . . . A . 3 PHE O . . . . . . . . . c30448_6cxq 1 . 3 . 315 . 1 1 4 LEU C C -1.973 0.262 -0.701 . . . 1.0 . . . . . . . . . . . . A . 4 LEU C . . . . . . . . . c30448_6cxq 1 . 3 . 316 . 1 1 4 LEU CA C -0.519 -0.050 -1.043 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CA . . . . . . . . . c30448_6cxq 1 . 3 . 317 . 1 1 4 LEU CB C -0.372 -0.305 -2.544 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CB . . . . . . . . . c30448_6cxq 1 . 3 . 318 . 1 1 4 LEU CD1 C 1.645 -1.724 -2.995 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CD1 . . . . . . . . . c30448_6cxq 1 . 3 . 319 . 1 1 4 LEU CD2 C 1.126 0.216 -4.485 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CD2 . . . . . . . . . c30448_6cxq 1 . 3 . 320 . 1 1 4 LEU CG C 1.067 -0.319 -3.062 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CG . . . . . . . . . c30448_6cxq 1 . 3 . 321 . 1 1 4 LEU H H 0.806 -1.086 0.205 . . . 1.0 . . . . . . . . . . . . A . 4 LEU H . . . . . . . . . c30448_6cxq 1 . 3 . 322 . 1 1 4 LEU HA H 0.097 0.797 -0.765 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HA . . . . . . . . . c30448_6cxq 1 . 3 . 323 . 1 1 4 LEU HB2 H -0.824 -1.260 -2.771 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HB2 . . . . . . . . . c30448_6cxq 1 . 3 . 324 . 1 1 4 LEU HB3 H -0.914 0.465 -3.073 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HB3 . . . . . . . . . c30448_6cxq 1 . 3 . 325 . 1 1 4 LEU HD11 H 2.171 -1.853 -2.060 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD11 . . . . . . . . . c30448_6cxq 1 . 3 . 326 . 1 1 4 LEU HD12 H 2.330 -1.872 -3.817 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD12 . . . . . . . . . c30448_6cxq 1 . 3 . 327 . 1 1 4 LEU HD13 H 0.844 -2.446 -3.060 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD13 . . . . . . . . . c30448_6cxq 1 . 3 . 328 . 1 1 4 LEU HD21 H 0.176 0.050 -4.972 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD21 . . . . . . . . . c30448_6cxq 1 . 3 . 329 . 1 1 4 LEU HD22 H 1.904 -0.297 -5.031 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD22 . . . . . . . . . c30448_6cxq 1 . 3 . 330 . 1 1 4 LEU HD23 H 1.339 1.275 -4.464 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD23 . . . . . . . . . c30448_6cxq 1 . 3 . 331 . 1 1 4 LEU HG H 1.674 0.322 -2.438 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HG . . . . . . . . . c30448_6cxq 1 . 3 . 332 . 1 1 4 LEU N N -0.032 -1.185 -0.282 . . . 1.0 . . . . . . . . . . . . A . 4 LEU N . . . . . . . . . c30448_6cxq 1 . 3 . 333 . 1 1 4 LEU O O -2.591 -0.422 0.115 . . . 1.0 . . . . . . . . . . . . A . 4 LEU O . . . . . . . . . c30448_6cxq 1 . 3 . 334 . 1 1 5 ARG C C -4.742 1.548 -2.351 . . . 1.0 . . . . . . . . . . . . A . 5 ARG C . . . . . . . . . c30448_6cxq 1 . 3 . 335 . 1 1 5 ARG CA C -3.892 1.709 -1.092 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CA . . . . . . . . . c30448_6cxq 1 . 3 . 336 . 1 1 5 ARG CB C -3.940 3.159 -0.622 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CB . . . . . . . . . c30448_6cxq 1 . 3 . 337 . 1 1 5 ARG CD C -1.773 4.233 -1.095 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CD . . . . . . . . . c30448_6cxq 1 . 3 . 338 . 1 1 5 ARG CG C -3.197 4.101 -1.535 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CG . . . . . . . . . c30448_6cxq 1 . 3 . 339 . 1 1 5 ARG CZ C 0.277 5.287 -1.968 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CZ . . . . . . . . . c30448_6cxq 1 . 3 . 340 . 1 1 5 ARG H H -1.967 1.808 -1.967 . . . 1.0 . . . . . . . . . . . . A . 5 ARG H . . . . . . . . . c30448_6cxq 1 . 3 . 341 . 1 1 5 ARG HA H -4.289 1.080 -0.316 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HA . . . . . . . . . c30448_6cxq 1 . 3 . 342 . 1 1 5 ARG HB2 H -4.969 3.486 -0.571 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HB2 . . . . . . . . . c30448_6cxq 1 . 3 . 343 . 1 1 5 ARG HB3 H -3.490 3.221 0.366 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HB3 . . . . . . . . . c30448_6cxq 1 . 3 . 344 . 1 1 5 ARG HD2 H -1.753 4.926 -0.285 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HD2 . . . . . . . . . c30448_6cxq 1 . 3 . 345 . 1 1 5 ARG HD3 H -1.427 3.266 -0.755 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HD3 . . . . . . . . . c30448_6cxq 1 . 3 . 346 . 1 1 5 ARG HE H -1.219 4.586 -3.090 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HE . . . . . . . . . c30448_6cxq 1 . 3 . 347 . 1 1 5 ARG HG2 H -3.215 3.715 -2.534 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HG2 . . . . . . . . . c30448_6cxq 1 . 3 . 348 . 1 1 5 ARG HG3 H -3.668 5.072 -1.506 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HG3 . . . . . . . . . c30448_6cxq 1 . 3 . 349 . 1 1 5 ARG HH11 H 0.193 5.165 0.049 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH11 . . . . . . . . . c30448_6cxq 1 . 3 . 350 . 1 1 5 ARG HH12 H 1.623 5.902 -0.591 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH12 . . . . . . . . . c30448_6cxq 1 . 3 . 351 . 1 1 5 ARG HH21 H 0.662 5.556 -3.934 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH21 . . . . . . . . . c30448_6cxq 1 . 3 . 352 . 1 1 5 ARG HH22 H 1.890 6.124 -2.852 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH22 . . . . . . . . . c30448_6cxq 1 . 3 . 353 . 1 1 5 ARG N N -2.512 1.302 -1.329 . . . 1.0 . . . . . . . . . . . . A . 5 ARG N . . . . . . . . . c30448_6cxq 1 . 3 . 354 . 1 1 5 ARG NE N -0.905 4.707 -2.169 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NE . . . . . . . . . c30448_6cxq 1 . 3 . 355 . 1 1 5 ARG NH1 N 0.735 5.466 -0.735 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NH1 . . . . . . . . . c30448_6cxq 1 . 3 . 356 . 1 1 5 ARG NH2 N 1.002 5.688 -3.003 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NH2 . . . . . . . . . c30448_6cxq 1 . 3 . 357 . 1 1 5 ARG O O -5.969 1.630 -2.294 . . . 1.0 . . . . . . . . . . . . A . 5 ARG O . . . . . . . . . c30448_6cxq 1 . 3 . 358 . 1 1 6 HIS C C -5.976 0.226 -4.627 . . . 1.0 . . . . . . . . . . . . A . 6 HIS C . . . . . . . . . c30448_6cxq 1 . 3 . 359 . 1 1 6 HIS CA C -4.778 1.164 -4.763 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CA . . . . . . . . . c30448_6cxq 1 . 3 . 360 . 1 1 6 HIS CB C -3.813 0.629 -5.825 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CB . . . . . . . . . c30448_6cxq 1 . 3 . 361 . 1 1 6 HIS CD2 C -3.280 -1.842 -6.417 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CD2 . . . . . . . . . c30448_6cxq 1 . 3 . 362 . 1 1 6 HIS CE1 C -2.623 -2.512 -4.436 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CE1 . . . . . . . . . c30448_6cxq 1 . 3 . 363 . 1 1 6 HIS CG C -3.369 -0.781 -5.579 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CG . . . . . . . . . c30448_6cxq 1 . 3 . 364 . 1 1 6 HIS H H -3.106 1.278 -3.473 . . . 1.0 . . . . . . . . . . . . A . 6 HIS H . . . . . . . . . c30448_6cxq 1 . 3 . 365 . 1 1 6 HIS HA H -5.130 2.137 -5.071 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HA . . . . . . . . . c30448_6cxq 1 . 3 . 366 . 1 1 6 HIS HB2 H -4.301 0.658 -6.792 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HB2 . . . . . . . . . c30448_6cxq 1 . 3 . 367 . 1 1 6 HIS HB3 H -2.930 1.257 -5.847 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HB3 . . . . . . . . . c30448_6cxq 1 . 3 . 368 . 1 1 6 HIS HD1 H -2.902 -0.701 -3.525 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HD1 . . . . . . . . . c30448_6cxq 1 . 3 . 369 . 1 1 6 HIS HD2 H -3.529 -1.850 -7.469 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HD2 . . . . . . . . . c30448_6cxq 1 . 3 . 370 . 1 1 6 HIS HE1 H -2.261 -3.130 -3.627 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HE1 . . . . . . . . . c30448_6cxq 1 . 3 . 371 . 1 1 6 HIS HE2 H -2.728 -3.825 -6.003 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HE2 . . . . . . . . . c30448_6cxq 1 . 3 . 372 . 1 1 6 HIS N N -4.084 1.327 -3.489 . . . 1.0 . . . . . . . . . . . . A . 6 HIS N . . . . . . . . . c30448_6cxq 1 . 3 . 373 . 1 1 6 HIS ND1 N -2.951 -1.235 -4.345 . . . 1.0 . . . . . . . . . . . . A . 6 HIS ND1 . . . . . . . . . c30448_6cxq 1 . 3 . 374 . 1 1 6 HIS NE2 N -2.814 -2.903 -5.681 . . . 1.0 . . . . . . . . . . . . A . 6 HIS NE2 . . . . . . . . . c30448_6cxq 1 . 3 . 375 . 1 1 6 HIS O O -5.914 -0.693 -3.784 . . . 1.0 . . . . . . . . . . . . A . 6 HIS O . . . . . . . . . c30448_6cxq 1 . 4 . 376 . 1 1 1 HIS C C 4.848 -1.662 3.689 . . . 1.0 . . . . . . . . . . . . A . 1 HIS C . . . . . . . . . c30448_6cxq 1 . 4 . 377 . 1 1 1 HIS CA C 6.356 -1.789 3.574 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CA . . . . . . . . . c30448_6cxq 1 . 4 . 378 . 1 1 1 HIS CB C 6.737 -2.800 2.490 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CB . . . . . . . . . c30448_6cxq 1 . 4 . 379 . 1 1 1 HIS CD2 C 6.923 -2.434 -0.072 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CD2 . . . . . . . . . c30448_6cxq 1 . 4 . 380 . 1 1 1 HIS CE1 C 8.353 -0.772 -0.055 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CE1 . . . . . . . . . c30448_6cxq 1 . 4 . 381 . 1 1 1 HIS CG C 7.219 -2.165 1.222 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CG . . . . . . . . . c30448_6cxq 1 . 4 . 382 . 1 1 1 HIS H1 H 7.972 -1.987 4.833 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H1 . . . . . . . . . c30448_6cxq 1 . 4 . 383 . 1 1 1 HIS H2 H 6.815 -3.250 4.949 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H2 . . . . . . . . . c30448_6cxq 1 . 4 . 384 . 1 1 1 HIS H3 H 6.478 -1.709 5.627 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H3 . . . . . . . . . c30448_6cxq 1 . 4 . 385 . 1 1 1 HIS HA H 6.753 -0.817 3.316 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HA . . . . . . . . . c30448_6cxq 1 . 4 . 386 . 1 1 1 HIS HB2 H 7.526 -3.437 2.862 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HB2 . . . . . . . . . c30448_6cxq 1 . 4 . 387 . 1 1 1 HIS HB3 H 5.875 -3.406 2.252 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HB3 . . . . . . . . . c30448_6cxq 1 . 4 . 388 . 1 1 1 HIS HD1 H 8.522 -0.694 1.983 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HD1 . . . . . . . . . c30448_6cxq 1 . 4 . 389 . 1 1 1 HIS HD2 H 6.248 -3.199 -0.429 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HD2 . . . . . . . . . c30448_6cxq 1 . 4 . 390 . 1 1 1 HIS HE1 H 9.016 0.017 -0.378 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HE1 . . . . . . . . . c30448_6cxq 1 . 4 . 391 . 1 1 1 HIS HE2 H 7.560 -1.453 -1.815 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HE2 . . . . . . . . . c30448_6cxq 1 . 4 . 392 . 1 1 1 HIS N N 6.960 -2.223 4.862 . . . 1.0 . . . . . . . . . . . . A . 1 HIS N . . . . . . . . . c30448_6cxq 1 . 4 . 393 . 1 1 1 HIS ND1 N 8.118 -1.120 1.198 . . . 1.0 . . . . . . . . . . . . A . 1 HIS ND1 . . . . . . . . . c30448_6cxq 1 . 4 . 394 . 1 1 1 HIS NE2 N 7.641 -1.555 -0.844 . . . 1.0 . . . . . . . . . . . . A . 1 HIS NE2 . . . . . . . . . c30448_6cxq 1 . 4 . 395 . 1 1 1 HIS O O 4.314 -1.488 4.785 . . . 1.0 . . . . . . . . . . . . A . 1 HIS O . . . . . . . . . c30448_6cxq 1 . 4 . 396 . 1 1 2 ARG C C 2.061 -2.296 1.410 . . . 1.0 . . . . . . . . . . . . A . 2 ARG C . . . . . . . . . c30448_6cxq 1 . 4 . 397 . 1 1 2 ARG CA C 2.719 -1.549 2.555 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CA . . . . . . . . . c30448_6cxq 1 . 4 . 398 . 1 1 2 ARG CB C 2.356 -0.065 2.471 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CB . . . . . . . . . c30448_6cxq 1 . 4 . 399 . 1 1 2 ARG CD C 3.475 2.070 1.755 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CD . . . . . . . . . c30448_6cxq 1 . 4 . 400 . 1 1 2 ARG CG C 3.584 0.801 2.585 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CG . . . . . . . . . c30448_6cxq 1 . 4 . 401 . 1 1 2 ARG CZ C 4.195 2.825 -0.478 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CZ . . . . . . . . . c30448_6cxq 1 . 4 . 402 . 1 1 2 ARG H H 4.635 -1.817 1.703 . . . 1.0 . . . . . . . . . . . . A . 2 ARG H . . . . . . . . . c30448_6cxq 1 . 4 . 403 . 1 1 2 ARG HA H 2.370 -1.922 3.480 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HA . . . . . . . . . c30448_6cxq 1 . 4 . 404 . 1 1 2 ARG HB2 H 1.865 0.140 1.516 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB2 . . . . . . . . . c30448_6cxq 1 . 4 . 405 . 1 1 2 ARG HB3 H 1.684 0.183 3.279 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB3 . . . . . . . . . c30448_6cxq 1 . 4 . 406 . 1 1 2 ARG HD2 H 2.452 2.185 1.428 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD2 . . . . . . . . . c30448_6cxq 1 . 4 . 407 . 1 1 2 ARG HD3 H 3.751 2.912 2.372 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD3 . . . . . . . . . c30448_6cxq 1 . 4 . 408 . 1 1 2 ARG HE H 5.082 1.387 0.585 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HE . . . . . . . . . c30448_6cxq 1 . 4 . 409 . 1 1 2 ARG HG2 H 3.752 1.056 3.621 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG2 . . . . . . . . . c30448_6cxq 1 . 4 . 410 . 1 1 2 ARG HG3 H 4.407 0.215 2.235 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG3 . . . . . . . . . c30448_6cxq 1 . 4 . 411 . 1 1 2 ARG HH11 H 2.574 3.792 0.250 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH11 . . . . . . . . . c30448_6cxq 1 . 4 . 412 . 1 1 2 ARG HH12 H 3.102 4.304 -1.318 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH12 . . . . . . . . . c30448_6cxq 1 . 4 . 413 . 1 1 2 ARG HH21 H 5.777 2.061 -1.477 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH21 . . . . . . . . . c30448_6cxq 1 . 4 . 414 . 1 1 2 ARG HH22 H 4.919 3.322 -2.298 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH22 . . . . . . . . . c30448_6cxq 1 . 4 . 415 . 1 1 2 ARG N N 4.161 -1.707 2.553 . . . 1.0 . . . . . . . . . . . . A . 2 ARG N . . . . . . . . . c30448_6cxq 1 . 4 . 416 . 1 1 2 ARG NE N 4.346 2.034 0.583 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NE . . . . . . . . . c30448_6cxq 1 . 4 . 417 . 1 1 2 ARG NH1 N 3.209 3.713 -0.518 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH1 . . . . . . . . . c30448_6cxq 1 . 4 . 418 . 1 1 2 ARG NH2 N 5.032 2.728 -1.501 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH2 . . . . . . . . . c30448_6cxq 1 . 4 . 419 . 1 1 2 ARG O O 2.663 -2.488 0.353 . . . 1.0 . . . . . . . . . . . . A . 2 ARG O . . . . . . . . . c30448_6cxq 1 . 4 . 420 . 1 1 3 PHE C C -0.641 -2.262 -0.289 . . . 1.0 . . . . . . . . . . . . A . 3 PHE C . . . . . . . . . c30448_6cxq 1 . 4 . 421 . 1 1 3 PHE CA C 0.047 -3.328 0.554 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CA . . . . . . . . . c30448_6cxq 1 . 4 . 422 . 1 1 3 PHE CB C -0.978 -4.296 1.146 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CB . . . . . . . . . c30448_6cxq 1 . 4 . 423 . 1 1 3 PHE CD1 C -1.619 -6.709 1.167 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CD1 . . . . . . . . . c30448_6cxq 1 . 4 . 424 . 1 1 3 PHE CD2 C -0.374 -5.915 -0.703 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CD2 . . . . . . . . . c30448_6cxq 1 . 4 . 425 . 1 1 3 PHE CE1 C -1.645 -7.977 0.616 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CE1 . . . . . . . . . c30448_6cxq 1 . 4 . 426 . 1 1 3 PHE CE2 C -0.396 -7.180 -1.259 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CE2 . . . . . . . . . c30448_6cxq 1 . 4 . 427 . 1 1 3 PHE CG C -0.986 -5.666 0.520 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CG . . . . . . . . . c30448_6cxq 1 . 4 . 428 . 1 1 3 PHE CZ C -1.032 -8.212 -0.599 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CZ . . . . . . . . . c30448_6cxq 1 . 4 . 429 . 1 1 3 PHE H H 0.360 -2.446 2.449 . . . 1.0 . . . . . . . . . . . . A . 3 PHE H . . . . . . . . . c30448_6cxq 1 . 4 . 430 . 1 1 3 PHE HA H 0.737 -3.865 -0.062 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HA . . . . . . . . . c30448_6cxq 1 . 4 . 431 . 1 1 3 PHE HB2 H -0.773 -4.421 2.202 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HB2 . . . . . . . . . c30448_6cxq 1 . 4 . 432 . 1 1 3 PHE HB3 H -1.962 -3.875 1.022 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HB3 . . . . . . . . . c30448_6cxq 1 . 4 . 433 . 1 1 3 PHE HD1 H -2.100 -6.522 2.115 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HD1 . . . . . . . . . c30448_6cxq 1 . 4 . 434 . 1 1 3 PHE HD2 H 0.122 -5.109 -1.222 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HD2 . . . . . . . . . c30448_6cxq 1 . 4 . 435 . 1 1 3 PHE HE1 H -2.144 -8.782 1.135 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HE1 . . . . . . . . . c30448_6cxq 1 . 4 . 436 . 1 1 3 PHE HE2 H 0.084 -7.360 -2.209 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HE2 . . . . . . . . . c30448_6cxq 1 . 4 . 437 . 1 1 3 PHE HZ H -1.051 -9.202 -1.031 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HZ . . . . . . . . . c30448_6cxq 1 . 4 . 438 . 1 1 3 PHE N N 0.802 -2.665 1.602 . . . 1.0 . . . . . . . . . . . . A . 3 PHE N . . . . . . . . . c30448_6cxq 1 . 4 . 439 . 1 1 3 PHE O O -1.712 -2.476 -0.855 . . . 1.0 . . . . . . . . . . . . A . 3 PHE O . . . . . . . . . c30448_6cxq 1 . 4 . 440 . 1 1 4 LEU C C -1.937 0.359 -0.720 . . . 1.0 . . . . . . . . . . . . A . 4 LEU C . . . . . . . . . c30448_6cxq 1 . 4 . 441 . 1 1 4 LEU CA C -0.483 0.053 -1.073 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CA . . . . . . . . . c30448_6cxq 1 . 4 . 442 . 1 1 4 LEU CB C -0.336 -0.164 -2.580 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CB . . . . . . . . . c30448_6cxq 1 . 4 . 443 . 1 1 4 LEU CD1 C 1.685 -1.591 -2.987 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CD1 . . . . . . . . . c30448_6cxq 1 . 4 . 444 . 1 1 4 LEU CD2 C 1.167 0.310 -4.528 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CD2 . . . . . . . . . c30448_6cxq 1 . 4 . 445 . 1 1 4 LEU CG C 1.105 -0.189 -3.092 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CG . . . . . . . . . c30448_6cxq 1 . 4 . 446 . 1 1 4 LEU H H 0.846 -1.013 0.145 . . . 1.0 . . . . . . . . . . . . A . 4 LEU H . . . . . . . . . c30448_6cxq 1 . 4 . 447 . 1 1 4 LEU HA H 0.133 0.893 -0.773 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HA . . . . . . . . . c30448_6cxq 1 . 4 . 448 . 1 1 4 LEU HB2 H -0.803 -1.105 -2.833 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HB2 . . . . . . . . . c30448_6cxq 1 . 4 . 449 . 1 1 4 LEU HB3 H -0.862 0.629 -3.090 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HB3 . . . . . . . . . c30448_6cxq 1 . 4 . 450 . 1 1 4 LEU HD11 H 2.716 -1.579 -3.308 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD11 . . . . . . . . . c30448_6cxq 1 . 4 . 451 . 1 1 4 LEU HD12 H 1.119 -2.262 -3.615 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD12 . . . . . . . . . c30448_6cxq 1 . 4 . 452 . 1 1 4 LEU HD13 H 1.631 -1.926 -1.961 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD13 . . . . . . . . . c30448_6cxq 1 . 4 . 453 . 1 1 4 LEU HD21 H 0.590 1.219 -4.619 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD21 . . . . . . . . . c30448_6cxq 1 . 4 . 454 . 1 1 4 LEU HD22 H 0.760 -0.442 -5.188 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD22 . . . . . . . . . c30448_6cxq 1 . 4 . 455 . 1 1 4 LEU HD23 H 2.194 0.508 -4.797 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD23 . . . . . . . . . c30448_6cxq 1 . 4 . 456 . 1 1 4 LEU HG H 1.708 0.469 -2.483 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HG . . . . . . . . . c30448_6cxq 1 . 4 . 457 . 1 1 4 LEU N N 0.006 -1.099 -0.339 . . . 1.0 . . . . . . . . . . . . A . 4 LEU N . . . . . . . . . c30448_6cxq 1 . 4 . 458 . 1 1 4 LEU O O -2.541 -0.321 0.109 . . . 1.0 . . . . . . . . . . . . A . 4 LEU O . . . . . . . . . c30448_6cxq 1 . 4 . 459 . 1 1 5 ARG C C -4.747 1.556 -2.338 . . . 1.0 . . . . . . . . . . . . A . 5 ARG C . . . . . . . . . c30448_6cxq 1 . 4 . 460 . 1 1 5 ARG CA C -3.872 1.786 -1.107 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CA . . . . . . . . . c30448_6cxq 1 . 4 . 461 . 1 1 5 ARG CB C -3.932 3.256 -0.702 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CB . . . . . . . . . c30448_6cxq 1 . 4 . 462 . 1 1 5 ARG CD C -1.800 4.348 -1.280 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CD . . . . . . . . . c30448_6cxq 1 . 4 . 463 . 1 1 5 ARG CG C -3.231 4.167 -1.679 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CG . . . . . . . . . c30448_6cxq 1 . 4 . 464 . 1 1 5 ARG CZ C 0.207 5.391 -2.262 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CZ . . . . . . . . . c30448_6cxq 1 . 4 . 465 . 1 1 5 ARG H H -1.957 1.892 -2.004 . . . 1.0 . . . . . . . . . . . . A . 5 ARG H . . . . . . . . . c30448_6cxq 1 . 4 . 466 . 1 1 5 ARG HA H -4.243 1.189 -0.294 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HA . . . . . . . . . c30448_6cxq 1 . 4 . 467 . 1 1 5 ARG HB2 H -4.963 3.569 -0.636 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HB2 . . . . . . . . . c30448_6cxq 1 . 4 . 468 . 1 1 5 ARG HB3 H -3.455 3.370 0.269 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HB3 . . . . . . . . . c30448_6cxq 1 . 4 . 469 . 1 1 5 ARG HD2 H -1.774 5.090 -0.514 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HD2 . . . . . . . . . c30448_6cxq 1 . 4 . 470 . 1 1 5 ARG HD3 H -1.431 3.409 -0.890 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HD3 . . . . . . . . . c30448_6cxq 1 . 4 . 471 . 1 1 5 ARG HE H -1.291 4.580 -3.305 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HE . . . . . . . . . c30448_6cxq 1 . 4 . 472 . 1 1 5 ARG HG2 H -3.264 3.733 -2.657 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HG2 . . . . . . . . . c30448_6cxq 1 . 4 . 473 . 1 1 5 ARG HG3 H -3.721 5.128 -1.685 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HG3 . . . . . . . . . c30448_6cxq 1 . 4 . 474 . 1 1 5 ARG HH11 H 0.165 5.400 -0.239 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH11 . . . . . . . . . c30448_6cxq 1 . 4 . 475 . 1 1 5 ARG HH12 H 1.563 6.128 -0.956 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH12 . . . . . . . . . c30448_6cxq 1 . 4 . 476 . 1 1 5 ARG HH21 H 0.548 5.539 -4.248 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH21 . . . . . . . . . c30448_6cxq 1 . 4 . 477 . 1 1 5 ARG HH22 H 1.780 6.207 -3.231 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH22 . . . . . . . . . c30448_6cxq 1 . 4 . 478 . 1 1 5 ARG N N -2.490 1.388 -1.355 . . . 1.0 . . . . . . . . . . . . A . 5 ARG N . . . . . . . . . c30448_6cxq 1 . 4 . 479 . 1 1 5 ARG NE N -0.963 4.770 -2.400 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NE . . . . . . . . . c30448_6cxq 1 . 4 . 480 . 1 1 5 ARG NH1 N 0.683 5.661 -1.053 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NH1 . . . . . . . . . c30448_6cxq 1 . 4 . 481 . 1 1 5 ARG NH2 N 0.902 5.741 -3.335 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NH2 . . . . . . . . . c30448_6cxq 1 . 4 . 482 . 1 1 5 ARG O O -5.970 1.685 -2.271 . . . 1.0 . . . . . . . . . . . . A . 5 ARG O . . . . . . . . . c30448_6cxq 1 . 4 . 483 . 1 1 6 HIS C C -6.054 0.087 -4.486 . . . 1.0 . . . . . . . . . . . . A . 6 HIS C . . . . . . . . . c30448_6cxq 1 . 4 . 484 . 1 1 6 HIS CA C -4.838 0.984 -4.710 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CA . . . . . . . . . c30448_6cxq 1 . 4 . 485 . 1 1 6 HIS CB C -3.907 0.349 -5.746 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CB . . . . . . . . . c30448_6cxq 1 . 4 . 486 . 1 1 6 HIS CD2 C -2.931 -1.472 -4.178 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CD2 . . . . . . . . . c30448_6cxq 1 . 4 . 487 . 1 1 6 HIS CE1 C -2.917 -3.143 -5.597 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CE1 . . . . . . . . . c30448_6cxq 1 . 4 . 488 . 1 1 6 HIS CG C -3.418 -1.011 -5.354 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CG . . . . . . . . . c30448_6cxq 1 . 4 . 489 . 1 1 6 HIS H H -3.140 1.141 -3.458 . . . 1.0 . . . . . . . . . . . . A . 6 HIS H . . . . . . . . . c30448_6cxq 1 . 4 . 490 . 1 1 6 HIS HA H -5.174 1.940 -5.083 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HA . . . . . . . . . c30448_6cxq 1 . 4 . 491 . 1 1 6 HIS HB2 H -4.437 0.254 -6.686 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HB2 . . . . . . . . . c30448_6cxq 1 . 4 . 492 . 1 1 6 HIS HB3 H -3.042 0.989 -5.882 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HB3 . . . . . . . . . c30448_6cxq 1 . 4 . 493 . 1 1 6 HIS HD1 H -3.688 -2.067 -7.158 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HD1 . . . . . . . . . c30448_6cxq 1 . 4 . 494 . 1 1 6 HIS HD2 H -2.805 -0.902 -3.268 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HD2 . . . . . . . . . c30448_6cxq 1 . 4 . 495 . 1 1 6 HIS HE1 H -2.784 -4.124 -6.028 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HE1 . . . . . . . . . c30448_6cxq 1 . 4 . 496 . 1 1 6 HIS HE2 H -2.341 -3.417 -3.651 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HE2 . . . . . . . . . c30448_6cxq 1 . 4 . 497 . 1 1 6 HIS N N -4.116 1.223 -3.463 . . . 1.0 . . . . . . . . . . . . A . 6 HIS N . . . . . . . . . c30448_6cxq 1 . 4 . 498 . 1 1 6 HIS ND1 N -3.396 -2.082 -6.222 . . . 1.0 . . . . . . . . . . . . A . 6 HIS ND1 . . . . . . . . . c30448_6cxq 1 . 4 . 499 . 1 1 6 HIS NE2 N -2.627 -2.799 -4.356 . . . 1.0 . . . . . . . . . . . . A . 6 HIS NE2 . . . . . . . . . c30448_6cxq 1 . 4 . 500 . 1 1 6 HIS O O -5.864 -1.068 -4.052 . . . 1.0 . . . . . . . . . . . . A . 6 HIS O . . . . . . . . . c30448_6cxq 1 . 5 . 501 . 1 1 1 HIS C C 4.822 -1.710 3.694 . . . 1.0 . . . . . . . . . . . . A . 1 HIS C . . . . . . . . . c30448_6cxq 1 . 5 . 502 . 1 1 1 HIS CA C 6.333 -1.789 3.572 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CA . . . . . . . . . c30448_6cxq 1 . 5 . 503 . 1 1 1 HIS CB C 6.742 -2.749 2.452 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CB . . . . . . . . . c30448_6cxq 1 . 5 . 504 . 1 1 1 HIS CD2 C 8.641 -2.298 0.744 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CD2 . . . . . . . . . c30448_6cxq 1 . 5 . 505 . 1 1 1 HIS CE1 C 7.707 -0.639 -0.343 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CE1 . . . . . . . . . c30448_6cxq 1 . 5 . 506 . 1 1 1 HIS CG C 7.430 -2.073 1.307 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CG . . . . . . . . . c30448_6cxq 1 . 5 . 507 . 1 1 1 HIS H1 H 6.452 -1.783 5.626 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H1 . . . . . . . . . c30448_6cxq 1 . 5 . 508 . 1 1 1 HIS H2 H 7.956 -1.976 4.822 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H2 . . . . . . . . . c30448_6cxq 1 . 5 . 509 . 1 1 1 HIS H3 H 6.845 -3.281 4.892 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H3 . . . . . . . . . c30448_6cxq 1 . 5 . 510 . 1 1 1 HIS HA H 6.700 -0.797 3.348 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HA . . . . . . . . . c30448_6cxq 1 . 5 . 511 . 1 1 1 HIS HB2 H 7.417 -3.490 2.853 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HB2 . . . . . . . . . c30448_6cxq 1 . 5 . 512 . 1 1 1 HIS HB3 H 5.861 -3.243 2.068 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HB3 . . . . . . . . . c30448_6cxq 1 . 5 . 513 . 1 1 1 HIS HD1 H 5.991 -0.630 0.771 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HD1 . . . . . . . . . c30448_6cxq 1 . 5 . 514 . 1 1 1 HIS HD2 H 9.359 -3.048 1.045 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HD2 . . . . . . . . . c30448_6cxq 1 . 5 . 515 . 1 1 1 HIS HE1 H 7.535 0.160 -1.049 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HE1 . . . . . . . . . c30448_6cxq 1 . 5 . 516 . 1 1 1 HIS HE2 H 9.603 -1.258 -0.805 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HE2 . . . . . . . . . c30448_6cxq 1 . 5 . 517 . 1 1 1 HIS N N 6.952 -2.249 4.843 . . . 1.0 . . . . . . . . . . . . A . 1 HIS N . . . . . . . . . c30448_6cxq 1 . 5 . 518 . 1 1 1 HIS ND1 N 6.870 -1.028 0.603 . . . 1.0 . . . . . . . . . . . . A . 1 HIS ND1 . . . . . . . . . c30448_6cxq 1 . 5 . 519 . 1 1 1 HIS NE2 N 8.788 -1.393 -0.278 . . . 1.0 . . . . . . . . . . . . A . 1 HIS NE2 . . . . . . . . . c30448_6cxq 1 . 5 . 520 . 1 1 1 HIS O O 4.286 -1.612 4.798 . . . 1.0 . . . . . . . . . . . . A . 1 HIS O . . . . . . . . . c30448_6cxq 1 . 5 . 521 . 1 1 2 ARG C C 2.045 -2.303 1.395 . . . 1.0 . . . . . . . . . . . . A . 2 ARG C . . . . . . . . . c30448_6cxq 1 . 5 . 522 . 1 1 2 ARG CA C 2.688 -1.591 2.570 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CA . . . . . . . . . c30448_6cxq 1 . 5 . 523 . 1 1 2 ARG CB C 2.288 -0.115 2.552 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CB . . . . . . . . . c30448_6cxq 1 . 5 . 524 . 1 1 2 ARG CD C 3.349 2.095 1.995 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CD . . . . . . . . . c30448_6cxq 1 . 5 . 525 . 1 1 2 ARG CG C 3.490 0.775 2.735 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CG . . . . . . . . . c30448_6cxq 1 . 5 . 526 . 1 1 2 ARG CZ C 4.079 3.033 -0.164 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CZ . . . . . . . . . c30448_6cxq 1 . 5 . 527 . 1 1 2 ARG H H 4.610 -1.758 1.702 . . . 1.0 . . . . . . . . . . . . A . 2 ARG H . . . . . . . . . c30448_6cxq 1 . 5 . 528 . 1 1 2 ARG HA H 2.353 -2.013 3.478 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HA . . . . . . . . . c30448_6cxq 1 . 5 . 529 . 1 1 2 ARG HB2 H 1.811 0.125 1.599 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB2 . . . . . . . . . c30448_6cxq 1 . 5 . 530 . 1 1 2 ARG HB3 H 1.594 0.074 3.357 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB3 . . . . . . . . . c30448_6cxq 1 . 5 . 531 . 1 1 2 ARG HD2 H 2.328 2.197 1.657 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD2 . . . . . . . . . c30448_6cxq 1 . 5 . 532 . 1 1 2 ARG HD3 H 3.584 2.901 2.674 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD3 . . . . . . . . . c30448_6cxq 1 . 5 . 533 . 1 1 2 ARG HE H 4.998 1.553 0.810 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HE . . . . . . . . . c30448_6cxq 1 . 5 . 534 . 1 1 2 ARG HG2 H 3.645 0.963 3.787 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG2 . . . . . . . . . c30448_6cxq 1 . 5 . 535 . 1 1 2 ARG HG3 H 4.331 0.239 2.352 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG3 . . . . . . . . . c30448_6cxq 1 . 5 . 536 . 1 1 2 ARG HH11 H 2.415 3.891 0.602 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH11 . . . . . . . . . c30448_6cxq 1 . 5 . 537 . 1 1 2 ARG HH12 H 2.950 4.532 -0.915 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH12 . . . . . . . . . c30448_6cxq 1 . 5 . 538 . 1 1 2 ARG HH21 H 5.703 2.396 -1.185 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH21 . . . . . . . . . c30448_6cxq 1 . 5 . 539 . 1 1 2 ARG HH22 H 4.816 3.684 -1.930 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH22 . . . . . . . . . c30448_6cxq 1 . 5 . 540 . 1 1 2 ARG N N 4.135 -1.710 2.557 . . . 1.0 . . . . . . . . . . . . A . 2 ARG N . . . . . . . . . c30448_6cxq 1 . 5 . 541 . 1 1 2 ARG NE N 4.240 2.174 0.840 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NE . . . . . . . . . c30448_6cxq 1 . 5 . 542 . 1 1 2 ARG NH1 N 3.065 3.889 -0.158 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH1 . . . . . . . . . c30448_6cxq 1 . 5 . 543 . 1 1 2 ARG NH2 N 4.936 3.038 -1.176 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH2 . . . . . . . . . c30448_6cxq 1 . 5 . 544 . 1 1 2 ARG O O 2.662 -2.471 0.342 . . . 1.0 . . . . . . . . . . . . A . 2 ARG O . . . . . . . . . c30448_6cxq 1 . 5 . 545 . 1 1 3 PHE C C -0.637 -2.203 -0.339 . . . 1.0 . . . . . . . . . . . . A . 3 PHE C . . . . . . . . . c30448_6cxq 1 . 5 . 546 . 1 1 3 PHE CA C 0.035 -3.296 0.482 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CA . . . . . . . . . c30448_6cxq 1 . 5 . 547 . 1 1 3 PHE CB C -1.003 -4.273 1.033 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CB . . . . . . . . . c30448_6cxq 1 . 5 . 548 . 1 1 3 PHE CD1 C -1.681 -6.676 0.954 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CD1 . . . . . . . . . c30448_6cxq 1 . 5 . 549 . 1 1 3 PHE CD2 C -0.414 -5.824 -0.876 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CD2 . . . . . . . . . c30448_6cxq 1 . 5 . 550 . 1 1 3 PHE CE1 C -1.723 -7.919 0.352 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CE1 . . . . . . . . . c30448_6cxq 1 . 5 . 551 . 1 1 3 PHE CE2 C -0.452 -7.065 -1.484 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CE2 . . . . . . . . . c30448_6cxq 1 . 5 . 552 . 1 1 3 PHE CG C -1.029 -5.617 0.352 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CG . . . . . . . . . c30448_6cxq 1 . 5 . 553 . 1 1 3 PHE CZ C -1.107 -8.114 -0.868 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CZ . . . . . . . . . c30448_6cxq 1 . 5 . 554 . 1 1 3 PHE H H 0.327 -2.467 2.404 . . . 1.0 . . . . . . . . . . . . A . 3 PHE H . . . . . . . . . c30448_6cxq 1 . 5 . 555 . 1 1 3 PHE HA H 0.730 -3.819 -0.140 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HA . . . . . . . . . c30448_6cxq 1 . 5 . 556 . 1 1 3 PHE HB2 H -0.802 -4.443 2.084 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HB2 . . . . . . . . . c30448_6cxq 1 . 5 . 557 . 1 1 3 PHE HB3 H -1.981 -3.835 0.925 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HB3 . . . . . . . . . c30448_6cxq 1 . 5 . 558 . 1 1 3 PHE HD1 H -2.164 -6.520 1.906 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HD1 . . . . . . . . . c30448_6cxq 1 . 5 . 559 . 1 1 3 PHE HD2 H 0.097 -5.006 -1.360 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HD2 . . . . . . . . . c30448_6cxq 1 . 5 . 560 . 1 1 3 PHE HE1 H -2.236 -8.737 0.836 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HE1 . . . . . . . . . c30448_6cxq 1 . 5 . 561 . 1 1 3 PHE HE2 H 0.031 -7.214 -2.438 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HE2 . . . . . . . . . c30448_6cxq 1 . 5 . 562 . 1 1 3 PHE HZ H -1.138 -9.085 -1.341 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HZ . . . . . . . . . c30448_6cxq 1 . 5 . 563 . 1 1 3 PHE N N 0.780 -2.667 1.558 . . . 1.0 . . . . . . . . . . . . A . 3 PHE N . . . . . . . . . c30448_6cxq 1 . 5 . 564 . 1 1 3 PHE O O -1.698 -2.397 -0.931 . . . 1.0 . . . . . . . . . . . . A . 3 PHE O . . . . . . . . . c30448_6cxq 1 . 5 . 565 . 1 1 4 LEU C C -1.923 0.431 -0.710 . . . 1.0 . . . . . . . . . . . . A . 4 LEU C . . . . . . . . . c30448_6cxq 1 . 5 . 566 . 1 1 4 LEU CA C -0.463 0.135 -1.046 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CA . . . . . . . . . c30448_6cxq 1 . 5 . 567 . 1 1 4 LEU CB C -0.292 -0.037 -2.556 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CB . . . . . . . . . c30448_6cxq 1 . 5 . 568 . 1 1 4 LEU CD1 C 2.013 -0.768 -3.221 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CD1 . . . . . . . . . c30448_6cxq 1 . 5 . 569 . 1 1 4 LEU CD2 C 0.888 1.087 -4.463 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CD2 . . . . . . . . . c30448_6cxq 1 . 5 . 570 . 1 1 4 LEU CG C 1.062 0.413 -3.110 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CG . . . . . . . . . c30448_6cxq 1 . 5 . 571 . 1 1 4 LEU H H 0.843 -0.970 0.161 . . . 1.0 . . . . . . . . . . . . A . 4 LEU H . . . . . . . . . c30448_6cxq 1 . 5 . 572 . 1 1 4 LEU HA H 0.148 0.965 -0.711 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HA . . . . . . . . . c30448_6cxq 1 . 5 . 573 . 1 1 4 LEU HB2 H -0.427 -1.082 -2.795 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HB2 . . . . . . . . . c30448_6cxq 1 . 5 . 574 . 1 1 4 LEU HB3 H -1.065 0.531 -3.052 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HB3 . . . . . . . . . c30448_6cxq 1 . 5 . 575 . 1 1 4 LEU HD11 H 1.699 -1.548 -2.542 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD11 . . . . . . . . . c30448_6cxq 1 . 5 . 576 . 1 1 4 LEU HD12 H 3.013 -0.451 -2.965 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD12 . . . . . . . . . c30448_6cxq 1 . 5 . 577 . 1 1 4 LEU HD13 H 2.002 -1.145 -4.232 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD13 . . . . . . . . . c30448_6cxq 1 . 5 . 578 . 1 1 4 LEU HD21 H 0.938 0.344 -5.245 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD21 . . . . . . . . . c30448_6cxq 1 . 5 . 579 . 1 1 4 LEU HD22 H 1.673 1.814 -4.607 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD22 . . . . . . . . . c30448_6cxq 1 . 5 . 580 . 1 1 4 LEU HD23 H -0.072 1.582 -4.497 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD23 . . . . . . . . . c30448_6cxq 1 . 5 . 581 . 1 1 4 LEU HG H 1.500 1.131 -2.432 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HG . . . . . . . . . c30448_6cxq 1 . 5 . 582 . 1 1 4 LEU N N 0.011 -1.040 -0.341 . . . 1.0 . . . . . . . . . . . . A . 4 LEU N . . . . . . . . . c30448_6cxq 1 . 5 . 583 . 1 1 4 LEU O O -2.534 -0.257 0.107 . . . 1.0 . . . . . . . . . . . . A . 4 LEU O . . . . . . . . . c30448_6cxq 1 . 5 . 584 . 1 1 5 ARG C C -4.726 1.564 -2.342 . . . 1.0 . . . . . . . . . . . . A . 5 ARG C . . . . . . . . . c30448_6cxq 1 . 5 . 585 . 1 1 5 ARG CA C -3.861 1.849 -1.116 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CA . . . . . . . . . c30448_6cxq 1 . 5 . 586 . 1 1 5 ARG CB C -3.940 3.332 -0.766 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CB . . . . . . . . . c30448_6cxq 1 . 5 . 587 . 1 1 5 ARG CD C -1.816 4.428 -1.359 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CD . . . . . . . . . c30448_6cxq 1 . 5 . 588 . 1 1 5 ARG CG C -3.239 4.213 -1.768 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CG . . . . . . . . . c30448_6cxq 1 . 5 . 589 . 1 1 5 ARG CZ C 0.204 5.418 -2.365 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CZ . . . . . . . . . c30448_6cxq 1 . 5 . 590 . 1 1 5 ARG H H -1.935 1.969 -1.986 . . . 1.0 . . . . . . . . . . . . A . 5 ARG H . . . . . . . . . c30448_6cxq 1 . 5 . 591 . 1 1 5 ARG HA H -4.227 1.277 -0.284 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HA . . . . . . . . . c30448_6cxq 1 . 5 . 592 . 1 1 5 ARG HB2 H -4.976 3.636 -0.722 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HB2 . . . . . . . . . c30448_6cxq 1 . 5 . 593 . 1 1 5 ARG HB3 H -3.475 3.486 0.205 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HB3 . . . . . . . . . c30448_6cxq 1 . 5 . 594 . 1 1 5 ARG HD2 H -1.807 5.212 -0.635 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HD2 . . . . . . . . . c30448_6cxq 1 . 5 . 595 . 1 1 5 ARG HD3 H -1.446 3.515 -0.911 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HD3 . . . . . . . . . c30448_6cxq 1 . 5 . 596 . 1 1 5 ARG HE H -1.281 4.557 -3.387 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HE . . . . . . . . . c30448_6cxq 1 . 5 . 597 . 1 1 5 ARG HG2 H -3.253 3.740 -2.730 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HG2 . . . . . . . . . c30448_6cxq 1 . 5 . 598 . 1 1 5 ARG HG3 H -3.741 5.167 -1.818 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HG3 . . . . . . . . . c30448_6cxq 1 . 5 . 599 . 1 1 5 ARG HH11 H 0.132 5.534 -0.347 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH11 . . . . . . . . . c30448_6cxq 1 . 5 . 600 . 1 1 5 ARG HH12 H 1.542 6.222 -1.080 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH12 . . . . . . . . . c30448_6cxq 1 . 5 . 601 . 1 1 5 ARG HH21 H 0.575 5.462 -4.352 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH21 . . . . . . . . . c30448_6cxq 1 . 5 . 602 . 1 1 5 ARG HH22 H 1.793 6.181 -3.353 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH22 . . . . . . . . . c30448_6cxq 1 . 5 . 603 . 1 1 5 ARG N N -2.474 1.460 -1.346 . . . 1.0 . . . . . . . . . . . . A . 5 ARG N . . . . . . . . . c30448_6cxq 1 . 5 . 604 . 1 1 5 ARG NE N -0.964 4.792 -2.488 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NE . . . . . . . . . c30448_6cxq 1 . 5 . 605 . 1 1 5 ARG NH1 N 0.663 5.752 -1.165 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NH1 . . . . . . . . . c30448_6cxq 1 . 5 . 606 . 1 1 5 ARG NH2 N 0.916 5.711 -3.445 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NH2 . . . . . . . . . c30448_6cxq 1 . 5 . 607 . 1 1 5 ARG O O -5.945 1.735 -2.304 . . . 1.0 . . . . . . . . . . . . A . 5 ARG O . . . . . . . . . c30448_6cxq 1 . 5 . 608 . 1 1 6 HIS C C -6.049 0.001 -4.408 . . . 1.0 . . . . . . . . . . . . A . 6 HIS C . . . . . . . . . c30448_6cxq 1 . 5 . 609 . 1 1 6 HIS CA C -4.799 0.837 -4.672 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CA . . . . . . . . . c30448_6cxq 1 . 5 . 610 . 1 1 6 HIS CB C -3.876 0.099 -5.642 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CB . . . . . . . . . c30448_6cxq 1 . 5 . 611 . 1 1 6 HIS CD2 C -1.968 -1.482 -4.874 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CD2 . . . . . . . . . c30448_6cxq 1 . 5 . 612 . 1 1 6 HIS CE1 C -3.201 -3.139 -4.140 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CE1 . . . . . . . . . c30448_6cxq 1 . 5 . 613 . 1 1 6 HIS CG C -3.265 -1.138 -5.060 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CG . . . . . . . . . c30448_6cxq 1 . 5 . 614 . 1 1 6 HIS H H -3.117 1.026 -3.405 . . . 1.0 . . . . . . . . . . . . A . 6 HIS H . . . . . . . . . c30448_6cxq 1 . 5 . 615 . 1 1 6 HIS HA H -5.094 1.776 -5.116 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HA . . . . . . . . . c30448_6cxq 1 . 5 . 616 . 1 1 6 HIS HB2 H -4.444 -0.193 -6.518 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HB2 . . . . . . . . . c30448_6cxq 1 . 5 . 617 . 1 1 6 HIS HB3 H -3.071 0.762 -5.938 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HB3 . . . . . . . . . c30448_6cxq 1 . 5 . 618 . 1 1 6 HIS HD1 H -4.990 -2.252 -4.587 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HD1 . . . . . . . . . c30448_6cxq 1 . 5 . 619 . 1 1 6 HIS HD2 H -1.104 -0.885 -5.129 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HD2 . . . . . . . . . c30448_6cxq 1 . 5 . 620 . 1 1 6 HIS HE1 H -3.505 -4.084 -3.713 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HE1 . . . . . . . . . c30448_6cxq 1 . 5 . 621 . 1 1 6 HIS HE2 H -1.158 -3.275 -4.144 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HE2 . . . . . . . . . c30448_6cxq 1 . 5 . 622 . 1 1 6 HIS N N -4.089 1.137 -3.432 . . . 1.0 . . . . . . . . . . . . A . 6 HIS N . . . . . . . . . c30448_6cxq 1 . 5 . 623 . 1 1 6 HIS ND1 N -4.011 -2.198 -4.591 . . . 1.0 . . . . . . . . . . . . A . 6 HIS ND1 . . . . . . . . . c30448_6cxq 1 . 5 . 624 . 1 1 6 HIS NE2 N -1.956 -2.729 -4.301 . . . 1.0 . . . . . . . . . . . . A . 6 HIS NE2 . . . . . . . . . c30448_6cxq 1 . 5 . 625 . 1 1 6 HIS O O -6.915 -0.069 -5.306 . . . 1.0 . . . . . . . . . . . . A . 6 HIS O . . . . . . . . . c30448_6cxq 1 . 6 . 626 . 1 1 1 HIS C C 4.789 -1.665 3.703 . . . 1.0 . . . . . . . . . . . . A . 1 HIS C . . . . . . . . . c30448_6cxq 1 . 6 . 627 . 1 1 1 HIS CA C 6.300 -1.762 3.606 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CA . . . . . . . . . c30448_6cxq 1 . 6 . 628 . 1 1 1 HIS CB C 6.717 -2.745 2.509 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CB . . . . . . . . . c30448_6cxq 1 . 6 . 629 . 1 1 1 HIS CD2 C 7.390 -2.421 0.025 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CD2 . . . . . . . . . c30448_6cxq 1 . 6 . 630 . 1 1 1 HIS CE1 C 8.591 -0.601 0.255 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CE1 . . . . . . . . . c30448_6cxq 1 . 6 . 631 . 1 1 1 HIS CG C 7.378 -2.088 1.338 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CG . . . . . . . . . c30448_6cxq 1 . 6 . 632 . 1 1 1 HIS H1 H 7.900 -1.943 4.886 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H1 . . . . . . . . . c30448_6cxq 1 . 6 . 633 . 1 1 1 HIS H2 H 6.775 -3.237 4.959 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H2 . . . . . . . . . c30448_6cxq 1 . 6 . 634 . 1 1 1 HIS H3 H 6.388 -1.719 5.661 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H3 . . . . . . . . . c30448_6cxq 1 . 6 . 635 . 1 1 1 HIS HA H 6.680 -0.777 3.371 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HA . . . . . . . . . c30448_6cxq 1 . 6 . 636 . 1 1 1 HIS HB2 H 7.411 -3.461 2.923 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HB2 . . . . . . . . . c30448_6cxq 1 . 6 . 637 . 1 1 1 HIS HB3 H 5.842 -3.267 2.149 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HB3 . . . . . . . . . c30448_6cxq 1 . 6 . 638 . 1 1 1 HIS HD1 H 8.323 -0.456 2.278 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HD1 . . . . . . . . . c30448_6cxq 1 . 6 . 639 . 1 1 1 HIS HD2 H 6.894 -3.268 -0.427 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HD2 . . . . . . . . . c30448_6cxq 1 . 6 . 640 . 1 1 1 HIS HE1 H 9.215 0.254 0.036 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HE1 . . . . . . . . . c30448_6cxq 1 . 6 . 641 . 1 1 1 HIS HE2 H 8.411 -1.513 -1.570 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HE2 . . . . . . . . . c30448_6cxq 1 . 6 . 642 . 1 1 1 HIS N N 6.895 -2.205 4.894 . . . 1.0 . . . . . . . . . . . . A . 1 HIS N . . . . . . . . . c30448_6cxq 1 . 6 . 643 . 1 1 1 HIS ND1 N 8.140 -0.944 1.448 . . . 1.0 . . . . . . . . . . . . A . 1 HIS ND1 . . . . . . . . . c30448_6cxq 1 . 6 . 644 . 1 1 1 HIS NE2 N 8.151 -1.480 -0.626 . . . 1.0 . . . . . . . . . . . . A . 1 HIS NE2 . . . . . . . . . c30448_6cxq 1 . 6 . 645 . 1 1 1 HIS O O 4.237 -1.527 4.795 . . . 1.0 . . . . . . . . . . . . A . 1 HIS O . . . . . . . . . c30448_6cxq 1 . 6 . 646 . 1 1 2 ARG C C 2.041 -2.306 1.384 . . . 1.0 . . . . . . . . . . . . A . 2 ARG C . . . . . . . . . c30448_6cxq 1 . 6 . 647 . 1 1 2 ARG CA C 2.674 -1.562 2.544 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CA . . . . . . . . . c30448_6cxq 1 . 6 . 648 . 1 1 2 ARG CB C 2.290 -0.083 2.472 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CB . . . . . . . . . c30448_6cxq 1 . 6 . 649 . 1 1 2 ARG CD C 3.387 2.095 1.862 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CD . . . . . . . . . c30448_6cxq 1 . 6 . 650 . 1 1 2 ARG CG C 3.497 0.801 2.651 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CG . . . . . . . . . c30448_6cxq 1 . 6 . 651 . 1 1 2 ARG CZ C 4.347 3.094 -0.176 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CZ . . . . . . . . . c30448_6cxq 1 . 6 . 652 . 1 1 2 ARG H H 4.606 -1.774 1.710 . . . 1.0 . . . . . . . . . . . . A . 2 ARG H . . . . . . . . . c30448_6cxq 1 . 6 . 653 . 1 1 2 ARG HA H 2.321 -1.950 3.461 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HA . . . . . . . . . c30448_6cxq 1 . 6 . 654 . 1 1 2 ARG HB2 H 1.835 0.131 1.501 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB2 . . . . . . . . . c30448_6cxq 1 . 6 . 655 . 1 1 2 ARG HB3 H 1.581 0.139 3.256 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB3 . . . . . . . . . c30448_6cxq 1 . 6 . 656 . 1 1 2 ARG HD2 H 2.385 2.178 1.467 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD2 . . . . . . . . . c30448_6cxq 1 . 6 . 657 . 1 1 2 ARG HD3 H 3.581 2.925 2.526 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD3 . . . . . . . . . c30448_6cxq 1 . 6 . 658 . 1 1 2 ARG HE H 5.003 1.425 0.698 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HE . . . . . . . . . c30448_6cxq 1 . 6 . 659 . 1 1 2 ARG HG2 H 3.631 1.024 3.698 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG2 . . . . . . . . . c30448_6cxq 1 . 6 . 660 . 1 1 2 ARG HG3 H 4.341 0.243 2.306 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG3 . . . . . . . . . c30448_6cxq 1 . 6 . 661 . 1 1 2 ARG HH11 H 2.786 4.118 0.603 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH11 . . . . . . . . . c30448_6cxq 1 . 6 . 662 . 1 1 2 ARG HH12 H 3.476 4.797 -0.832 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH12 . . . . . . . . . c30448_6cxq 1 . 6 . 663 . 1 1 2 ARG HH21 H 5.911 2.316 -1.191 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH21 . . . . . . . . . c30448_6cxq 1 . 6 . 664 . 1 1 2 ARG HH22 H 5.250 3.773 -1.852 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH22 . . . . . . . . . c30448_6cxq 1 . 6 . 665 . 1 1 2 ARG N N 4.119 -1.695 2.557 . . . 1.0 . . . . . . . . . . . . A . 2 ARG N . . . . . . . . . c30448_6cxq 1 . 6 . 666 . 1 1 2 ARG NE N 4.337 2.142 0.753 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NE . . . . . . . . . c30448_6cxq 1 . 6 . 667 . 1 1 2 ARG NH1 N 3.464 4.084 -0.131 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH1 . . . . . . . . . c30448_6cxq 1 . 6 . 668 . 1 1 2 ARG NH2 N 5.243 3.058 -1.153 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH2 . . . . . . . . . c30448_6cxq 1 . 6 . 669 . 1 1 2 ARG O O 2.661 -2.488 0.336 . . . 1.0 . . . . . . . . . . . . A . 2 ARG O . . . . . . . . . c30448_6cxq 1 . 6 . 670 . 1 1 3 PHE C C -0.623 -2.264 -0.363 . . . 1.0 . . . . . . . . . . . . A . 3 PHE C . . . . . . . . . c30448_6cxq 1 . 6 . 671 . 1 1 3 PHE CA C 0.044 -3.337 0.488 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CA . . . . . . . . . c30448_6cxq 1 . 6 . 672 . 1 1 3 PHE CB C -0.997 -4.301 1.058 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CB . . . . . . . . . c30448_6cxq 1 . 6 . 673 . 1 1 3 PHE CD1 C -1.612 -6.720 1.114 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CD1 . . . . . . . . . c30448_6cxq 1 . 6 . 674 . 1 1 3 PHE CD2 C -0.314 -5.955 -0.731 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CD2 . . . . . . . . . c30448_6cxq 1 . 6 . 675 . 1 1 3 PHE CE1 C -1.606 -8.000 0.594 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CE1 . . . . . . . . . c30448_6cxq 1 . 6 . 676 . 1 1 3 PHE CE2 C -0.303 -7.232 -1.258 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CE2 . . . . . . . . . c30448_6cxq 1 . 6 . 677 . 1 1 3 PHE CG C -0.969 -5.685 0.464 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CG . . . . . . . . . c30448_6cxq 1 . 6 . 678 . 1 1 3 PHE CZ C -0.950 -8.257 -0.594 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CZ . . . . . . . . . c30448_6cxq 1 . 6 . 679 . 1 1 3 PHE H H 0.323 -2.465 2.393 . . . 1.0 . . . . . . . . . . . . A . 3 PHE H . . . . . . . . . c30448_6cxq 1 . 6 . 680 . 1 1 3 PHE HA H 0.745 -3.875 -0.116 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HA . . . . . . . . . c30448_6cxq 1 . 6 . 681 . 1 1 3 PHE HB2 H -0.835 -4.401 2.125 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HB2 . . . . . . . . . c30448_6cxq 1 . 6 . 682 . 1 1 3 PHE HB3 H -1.980 -3.892 0.885 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HB3 . . . . . . . . . c30448_6cxq 1 . 6 . 683 . 1 1 3 PHE HD1 H -2.127 -6.516 2.041 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HD1 . . . . . . . . . c30448_6cxq 1 . 6 . 684 . 1 1 3 PHE HD2 H 0.191 -5.156 -1.252 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HD2 . . . . . . . . . c30448_6cxq 1 . 6 . 685 . 1 1 3 PHE HE1 H -2.113 -8.799 1.115 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HE1 . . . . . . . . . c30448_6cxq 1 . 6 . 686 . 1 1 3 PHE HE2 H 0.211 -7.430 -2.186 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HE2 . . . . . . . . . c30448_6cxq 1 . 6 . 687 . 1 1 3 PHE HZ H -0.943 -9.256 -1.004 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HZ . . . . . . . . . c30448_6cxq 1 . 6 . 688 . 1 1 3 PHE N N 0.780 -2.679 1.552 . . . 1.0 . . . . . . . . . . . . A . 3 PHE N . . . . . . . . . c30448_6cxq 1 . 6 . 689 . 1 1 3 PHE O O -1.689 -2.469 -0.944 . . . 1.0 . . . . . . . . . . . . A . 3 PHE O . . . . . . . . . c30448_6cxq 1 . 6 . 690 . 1 1 4 LEU C C -1.869 0.403 -0.749 . . . 1.0 . . . . . . . . . . . . A . 4 LEU C . . . . . . . . . c30448_6cxq 1 . 6 . 691 . 1 1 4 LEU CA C -0.437 0.049 -1.141 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CA . . . . . . . . . c30448_6cxq 1 . 6 . 692 . 1 1 4 LEU CB C -0.346 -0.197 -2.648 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CB . . . . . . . . . c30448_6cxq 1 . 6 . 693 . 1 1 4 LEU CD1 C 1.808 -1.287 -3.327 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CD1 . . . . . . . . . c30448_6cxq 1 . 6 . 694 . 1 1 4 LEU CD2 C 0.920 0.646 -4.642 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CD2 . . . . . . . . . c30448_6cxq 1 . 6 . 695 . 1 1 4 LEU CG C 1.040 0.024 -3.258 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CG . . . . . . . . . c30448_6cxq 1 . 6 . 696 . 1 1 4 LEU H H 0.868 -1.027 0.093 . . . 1.0 . . . . . . . . . . . . A . 4 LEU H . . . . . . . . . c30448_6cxq 1 . 6 . 697 . 1 1 4 LEU HA H 0.213 0.874 -0.873 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HA . . . . . . . . . c30448_6cxq 1 . 6 . 698 . 1 1 4 LEU HB2 H -0.644 -1.217 -2.843 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HB2 . . . . . . . . . c30448_6cxq 1 . 6 . 699 . 1 1 4 LEU HB3 H -1.042 0.464 -3.143 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HB3 . . . . . . . . . c30448_6cxq 1 . 6 . 700 . 1 1 4 LEU HD11 H 1.111 -2.110 -3.388 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD11 . . . . . . . . . c30448_6cxq 1 . 6 . 701 . 1 1 4 LEU HD12 H 2.415 -1.395 -2.441 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD12 . . . . . . . . . c30448_6cxq 1 . 6 . 702 . 1 1 4 LEU HD13 H 2.442 -1.287 -4.201 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD13 . . . . . . . . . c30448_6cxq 1 . 6 . 703 . 1 1 4 LEU HD21 H 1.777 1.275 -4.829 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD21 . . . . . . . . . c30448_6cxq 1 . 6 . 704 . 1 1 4 LEU HD22 H 0.019 1.239 -4.692 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD22 . . . . . . . . . c30448_6cxq 1 . 6 . 705 . 1 1 4 LEU HD23 H 0.878 -0.136 -5.385 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD23 . . . . . . . . . c30448_6cxq 1 . 6 . 706 . 1 1 4 LEU HG H 1.598 0.705 -2.632 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HG . . . . . . . . . c30448_6cxq 1 . 6 . 707 . 1 1 4 LEU N N 0.034 -1.107 -0.403 . . . 1.0 . . . . . . . . . . . . A . 4 LEU N . . . . . . . . . c30448_6cxq 1 . 6 . 708 . 1 1 4 LEU O O -2.464 -0.241 0.115 . . . 1.0 . . . . . . . . . . . . A . 4 LEU O . . . . . . . . . c30448_6cxq 1 . 6 . 709 . 1 1 5 ARG C C -4.712 1.549 -2.273 . . . 1.0 . . . . . . . . . . . . A . 5 ARG C . . . . . . . . . c30448_6cxq 1 . 6 . 710 . 1 1 5 ARG CA C -3.779 1.870 -1.109 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CA . . . . . . . . . c30448_6cxq 1 . 6 . 711 . 1 1 5 ARG CB C -3.802 3.371 -0.829 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CB . . . . . . . . . c30448_6cxq 1 . 6 . 712 . 1 1 5 ARG CD C -1.674 4.374 -1.561 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CD . . . . . . . . . c30448_6cxq 1 . 6 . 713 . 1 1 5 ARG CG C -3.119 4.181 -1.901 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CG . . . . . . . . . c30448_6cxq 1 . 6 . 714 . 1 1 5 ARG CZ C 0.335 5.236 -2.698 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CZ . . . . . . . . . c30448_6cxq 1 . 6 . 715 . 1 1 5 ARG H H -1.893 1.904 -2.070 . . . 1.0 . . . . . . . . . . . . A . 5 ARG H . . . . . . . . . c30448_6cxq 1 . 6 . 716 . 1 1 5 ARG HA H -4.116 1.349 -0.231 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HA . . . . . . . . . c30448_6cxq 1 . 6 . 717 . 1 1 5 ARG HB2 H -4.825 3.707 -0.758 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HB2 . . . . . . . . . c30448_6cxq 1 . 6 . 718 . 1 1 5 ARG HB3 H -3.292 3.558 0.113 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HB3 . . . . . . . . . c30448_6cxq 1 . 6 . 719 . 1 1 5 ARG HD2 H -1.614 5.194 -0.881 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HD2 . . . . . . . . . c30448_6cxq 1 . 6 . 720 . 1 1 5 ARG HD3 H -1.311 3.476 -1.081 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HD3 . . . . . . . . . c30448_6cxq 1 . 6 . 721 . 1 1 5 ARG HE H -1.228 4.393 -3.614 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HE . . . . . . . . . c30448_6cxq 1 . 6 . 722 . 1 1 5 ARG HG2 H -3.187 3.663 -2.837 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HG2 . . . . . . . . . c30448_6cxq 1 . 6 . 723 . 1 1 5 ARG HG3 H -3.597 5.146 -1.978 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HG3 . . . . . . . . . c30448_6cxq 1 . 6 . 724 . 1 1 5 ARG HH11 H 0.361 5.439 -0.686 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH11 . . . . . . . . . c30448_6cxq 1 . 6 . 725 . 1 1 5 ARG HH12 H 1.761 6.037 -1.510 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH12 . . . . . . . . . c30448_6cxq 1 . 6 . 726 . 1 1 5 ARG HH21 H 0.615 5.179 -4.699 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH21 . . . . . . . . . c30448_6cxq 1 . 6 . 727 . 1 1 5 ARG HH22 H 1.906 5.890 -3.788 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH22 . . . . . . . . . c30448_6cxq 1 . 6 . 728 . 1 1 5 ARG N N -2.417 1.431 -1.390 . . . 1.0 . . . . . . . . . . . . A . 5 ARG N . . . . . . . . . c30448_6cxq 1 . 6 . 729 . 1 1 5 ARG NE N -0.862 4.654 -2.742 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NE . . . . . . . . . c30448_6cxq 1 . 6 . 730 . 1 1 5 ARG NH1 N 0.862 5.600 -1.536 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NH1 . . . . . . . . . c30448_6cxq 1 . 6 . 731 . 1 1 5 ARG NH2 N 1.007 5.453 -3.820 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NH2 . . . . . . . . . c30448_6cxq 1 . 6 . 732 . 1 1 5 ARG O O -5.934 1.575 -2.125 . . . 1.0 . . . . . . . . . . . . A . 5 ARG O . . . . . . . . . c30448_6cxq 1 . 6 . 733 . 1 1 6 HIS C C -6.025 -0.053 -4.318 . . . 1.0 . . . . . . . . . . . . A . 6 HIS C . . . . . . . . . c30448_6cxq 1 . 6 . 734 . 1 1 6 HIS CA C -4.902 0.935 -4.629 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CA . . . . . . . . . c30448_6cxq 1 . 6 . 735 . 1 1 6 HIS CB C -3.986 0.360 -5.712 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CB . . . . . . . . . c30448_6cxq 1 . 6 . 736 . 1 1 6 HIS CD2 C -2.731 -1.876 -6.109 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CD2 . . . . . . . . . c30448_6cxq 1 . 6 . 737 . 1 1 6 HIS CE1 C -2.845 -2.674 -4.071 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CE1 . . . . . . . . . c30448_6cxq 1 . 6 . 738 . 1 1 6 HIS CG C -3.394 -0.968 -5.354 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CG . . . . . . . . . c30448_6cxq 1 . 6 . 739 . 1 1 6 HIS H H -3.150 1.255 -3.490 . . . 1.0 . . . . . . . . . . . . A . 6 HIS H . . . . . . . . . c30448_6cxq 1 . 6 . 740 . 1 1 6 HIS HA H -5.337 1.853 -4.992 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HA . . . . . . . . . c30448_6cxq 1 . 6 . 741 . 1 1 6 HIS HB2 H -4.554 0.234 -6.626 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HB2 . . . . . . . . . c30448_6cxq 1 . 6 . 742 . 1 1 6 HIS HB3 H -3.170 1.052 -5.886 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HB3 . . . . . . . . . c30448_6cxq 1 . 6 . 743 . 1 1 6 HIS HD1 H -3.868 -1.077 -3.303 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HD1 . . . . . . . . . c30448_6cxq 1 . 6 . 744 . 1 1 6 HIS HD2 H -2.505 -1.790 -7.163 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HD2 . . . . . . . . . c30448_6cxq 1 . 6 . 745 . 1 1 6 HIS HE1 H -2.734 -3.319 -3.212 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HE1 . . . . . . . . . c30448_6cxq 1 . 6 . 746 . 1 1 6 HIS HE2 H -1.833 -3.684 -5.536 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HE2 . . . . . . . . . c30448_6cxq 1 . 6 . 747 . 1 1 6 HIS N N -4.128 1.254 -3.434 . . . 1.0 . . . . . . . . . . . . A . 6 HIS N . . . . . . . . . c30448_6cxq 1 . 6 . 748 . 1 1 6 HIS ND1 N -3.449 -1.499 -4.082 . . . 1.0 . . . . . . . . . . . . A . 6 HIS ND1 . . . . . . . . . c30448_6cxq 1 . 6 . 749 . 1 1 6 HIS NE2 N -2.402 -2.926 -5.288 . . . 1.0 . . . . . . . . . . . . A . 6 HIS NE2 . . . . . . . . . c30448_6cxq 1 . 6 . 750 . 1 1 6 HIS O O -6.986 -0.125 -5.113 . . . 1.0 . . . . . . . . . . . . A . 6 HIS O . . . . . . . . . c30448_6cxq 1 . 7 . 751 . 1 1 1 HIS C C 4.834 -1.725 3.676 . . . 1.0 . . . . . . . . . . . . A . 1 HIS C . . . . . . . . . c30448_6cxq 1 . 7 . 752 . 1 1 1 HIS CA C 6.343 -1.749 3.519 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CA . . . . . . . . . c30448_6cxq 1 . 7 . 753 . 1 1 1 HIS CB C 6.756 -2.639 2.343 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CB . . . . . . . . . c30448_6cxq 1 . 7 . 754 . 1 1 1 HIS CD2 C 8.432 -2.245 0.403 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CD2 . . . . . . . . . c30448_6cxq 1 . 7 . 755 . 1 1 1 HIS CE1 C 7.817 -0.213 -0.144 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CE1 . . . . . . . . . c30448_6cxq 1 . 7 . 756 . 1 1 1 HIS CG C 7.420 -1.890 1.230 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CG . . . . . . . . . c30448_6cxq 1 . 7 . 757 . 1 1 1 HIS H1 H 6.512 -1.837 5.568 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H1 . . . . . . . . . c30448_6cxq 1 . 7 . 758 . 1 1 1 HIS H2 H 8.001 -1.950 4.721 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H2 . . . . . . . . . c30448_6cxq 1 . 7 . 759 . 1 1 1 HIS H3 H 6.925 -3.288 4.755 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H3 . . . . . . . . . c30448_6cxq 1 . 7 . 760 . 1 1 1 HIS HA H 6.673 -0.736 3.338 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HA . . . . . . . . . c30448_6cxq 1 . 7 . 761 . 1 1 1 HIS HB2 H 7.448 -3.390 2.695 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HB2 . . . . . . . . . c30448_6cxq 1 . 7 . 762 . 1 1 1 HIS HB3 H 5.880 -3.126 1.941 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HB3 . . . . . . . . . c30448_6cxq 1 . 7 . 763 . 1 1 1 HIS HD1 H 6.349 -0.076 1.275 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HD1 . . . . . . . . . c30448_6cxq 1 . 7 . 764 . 1 1 1 HIS HD2 H 8.962 -3.187 0.406 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HD2 . . . . . . . . . c30448_6cxq 1 . 7 . 765 . 1 1 1 HIS HE1 H 7.759 0.746 -0.638 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HE1 . . . . . . . . . c30448_6cxq 1 . 7 . 766 . 1 1 1 HIS HE2 H 9.393 -1.119 -1.086 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HE2 . . . . . . . . . c30448_6cxq 1 . 7 . 767 . 1 1 1 HIS N N 7.005 -2.251 4.752 . . . 1.0 . . . . . . . . . . . . A . 1 HIS N . . . . . . . . . c30448_6cxq 1 . 7 . 768 . 1 1 1 HIS ND1 N 7.058 -0.611 0.862 . . . 1.0 . . . . . . . . . . . . A . 1 HIS ND1 . . . . . . . . . c30448_6cxq 1 . 7 . 769 . 1 1 1 HIS NE2 N 8.659 -1.185 -0.441 . . . 1.0 . . . . . . . . . . . . A . 1 HIS NE2 . . . . . . . . . c30448_6cxq 1 . 7 . 770 . 1 1 1 HIS O O 4.320 -1.707 4.794 . . . 1.0 . . . . . . . . . . . . A . 1 HIS O . . . . . . . . . c30448_6cxq 1 . 7 . 771 . 1 1 2 ARG C C 2.028 -2.305 1.421 . . . 1.0 . . . . . . . . . . . . A . 2 ARG C . . . . . . . . . c30448_6cxq 1 . 7 . 772 . 1 1 2 ARG CA C 2.675 -1.609 2.603 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CA . . . . . . . . . c30448_6cxq 1 . 7 . 773 . 1 1 2 ARG CB C 2.232 -0.147 2.642 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CB . . . . . . . . . c30448_6cxq 1 . 7 . 774 . 1 1 2 ARG CD C 3.204 2.143 2.288 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CD . . . . . . . . . c30448_6cxq 1 . 7 . 775 . 1 1 2 ARG CG C 3.401 0.767 2.902 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CG . . . . . . . . . c30448_6cxq 1 . 7 . 776 . 1 1 2 ARG CZ C 2.289 4.315 3.009 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CZ . . . . . . . . . c30448_6cxq 1 . 7 . 777 . 1 1 2 ARG H H 4.582 -1.666 1.689 . . . 1.0 . . . . . . . . . . . . A . 2 ARG H . . . . . . . . . c30448_6cxq 1 . 7 . 778 . 1 1 2 ARG HA H 2.374 -2.070 3.505 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HA . . . . . . . . . c30448_6cxq 1 . 7 . 779 . 1 1 2 ARG HB2 H 1.775 0.123 1.687 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB2 . . . . . . . . . c30448_6cxq 1 . 7 . 780 . 1 1 2 ARG HB3 H 1.510 -0.016 3.435 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB3 . . . . . . . . . c30448_6cxq 1 . 7 . 781 . 1 1 2 ARG HD2 H 4.167 2.620 2.188 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD2 . . . . . . . . . c30448_6cxq 1 . 7 . 782 . 1 1 2 ARG HD3 H 2.758 2.027 1.311 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD3 . . . . . . . . . c30448_6cxq 1 . 7 . 783 . 1 1 2 ARG HE H 1.766 2.544 3.767 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HE . . . . . . . . . c30448_6cxq 1 . 7 . 784 . 1 1 2 ARG HG2 H 3.557 0.861 3.965 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG2 . . . . . . . . . c30448_6cxq 1 . 7 . 785 . 1 1 2 ARG HG3 H 4.259 0.300 2.467 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG3 . . . . . . . . . c30448_6cxq 1 . 7 . 786 . 1 1 2 ARG HH11 H 3.666 4.435 1.532 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH11 . . . . . . . . . c30448_6cxq 1 . 7 . 787 . 1 1 2 ARG HH12 H 3.007 5.948 2.058 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH12 . . . . . . . . . c30448_6cxq 1 . 7 . 788 . 1 1 2 ARG HH21 H 0.898 4.533 4.460 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH21 . . . . . . . . . c30448_6cxq 1 . 7 . 789 . 1 1 2 ARG HH22 H 1.437 6.004 3.720 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH22 . . . . . . . . . c30448_6cxq 1 . 7 . 790 . 1 1 2 ARG N N 4.124 -1.682 2.555 . . . 1.0 . . . . . . . . . . . . A . 2 ARG N . . . . . . . . . c30448_6cxq 1 . 7 . 791 . 1 1 2 ARG NE N 2.339 2.988 3.108 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NE . . . . . . . . . c30448_6cxq 1 . 7 . 792 . 1 1 2 ARG NH1 N 3.050 4.951 2.128 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH1 . . . . . . . . . c30448_6cxq 1 . 7 . 793 . 1 1 2 ARG NH2 N 1.474 5.007 3.794 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH2 . . . . . . . . . c30448_6cxq 1 . 7 . 794 . 1 1 2 ARG O O 2.636 -2.444 0.359 . . . 1.0 . . . . . . . . . . . . A . 2 ARG O . . . . . . . . . c30448_6cxq 1 . 7 . 795 . 1 1 3 PHE C C -0.648 -2.202 -0.303 . . . 1.0 . . . . . . . . . . . . A . 3 PHE C . . . . . . . . . c30448_6cxq 1 . 7 . 796 . 1 1 3 PHE CA C 0.020 -3.304 0.508 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CA . . . . . . . . . c30448_6cxq 1 . 7 . 797 . 1 1 3 PHE CB C -1.021 -4.281 1.055 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CB . . . . . . . . . c30448_6cxq 1 . 7 . 798 . 1 1 3 PHE CD1 C -1.686 -6.687 0.987 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CD1 . . . . . . . . . c30448_6cxq 1 . 7 . 799 . 1 1 3 PHE CD2 C -0.422 -5.839 -0.846 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CD2 . . . . . . . . . c30448_6cxq 1 . 7 . 800 . 1 1 3 PHE CE1 C -1.722 -7.933 0.392 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CE1 . . . . . . . . . c30448_6cxq 1 . 7 . 801 . 1 1 3 PHE CE2 C -0.453 -7.083 -1.447 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CE2 . . . . . . . . . c30448_6cxq 1 . 7 . 802 . 1 1 3 PHE CG C -1.039 -5.628 0.380 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CG . . . . . . . . . c30448_6cxq 1 . 7 . 803 . 1 1 3 PHE CZ C -1.104 -8.132 -0.827 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CZ . . . . . . . . . c30448_6cxq 1 . 7 . 804 . 1 1 3 PHE H H 0.323 -2.510 2.444 . . . 1.0 . . . . . . . . . . . . A . 3 PHE H . . . . . . . . . c30448_6cxq 1 . 7 . 805 . 1 1 3 PHE HA H 0.713 -3.825 -0.118 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HA . . . . . . . . . c30448_6cxq 1 . 7 . 806 . 1 1 3 PHE HB2 H -0.827 -4.447 2.108 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HB2 . . . . . . . . . c30448_6cxq 1 . 7 . 807 . 1 1 3 PHE HB3 H -1.999 -3.845 0.937 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HB3 . . . . . . . . . c30448_6cxq 1 . 7 . 808 . 1 1 3 PHE HD1 H -2.171 -6.528 1.938 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HD1 . . . . . . . . . c30448_6cxq 1 . 7 . 809 . 1 1 3 PHE HD2 H 0.086 -5.021 -1.334 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HD2 . . . . . . . . . c30448_6cxq 1 . 7 . 810 . 1 1 3 PHE HE1 H -2.232 -8.751 0.879 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HE1 . . . . . . . . . c30448_6cxq 1 . 7 . 811 . 1 1 3 PHE HE2 H 0.031 -7.235 -2.401 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HE2 . . . . . . . . . c30448_6cxq 1 . 7 . 812 . 1 1 3 PHE HZ H -1.130 -9.105 -1.295 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HZ . . . . . . . . . c30448_6cxq 1 . 7 . 813 . 1 1 3 PHE N N 0.769 -2.687 1.589 . . . 1.0 . . . . . . . . . . . . A . 3 PHE N . . . . . . . . . c30448_6cxq 1 . 7 . 814 . 1 1 3 PHE O O -1.707 -2.392 -0.902 . . . 1.0 . . . . . . . . . . . . A . 3 PHE O . . . . . . . . . c30448_6cxq 1 . 7 . 815 . 1 1 4 LEU C C -1.946 0.414 -0.683 . . . 1.0 . . . . . . . . . . . . A . 4 LEU C . . . . . . . . . c30448_6cxq 1 . 7 . 816 . 1 1 4 LEU CA C -0.473 0.144 -0.984 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CA . . . . . . . . . c30448_6cxq 1 . 7 . 817 . 1 1 4 LEU CB C -0.256 0.005 -2.493 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CB . . . . . . . . . c30448_6cxq 1 . 7 . 818 . 1 1 4 LEU CD1 C 1.792 -1.398 -2.839 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CD1 . . . . . . . . . c30448_6cxq 1 . 7 . 819 . 1 1 4 LEU CD2 C 1.332 0.535 -4.358 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CD2 . . . . . . . . . c30448_6cxq 1 . 7 . 820 . 1 1 4 LEU CG C 1.207 0.002 -2.938 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CG . . . . . . . . . c30448_6cxq 1 . 7 . 821 . 1 1 4 LEU H H 0.828 -0.975 0.215 . . . 1.0 . . . . . . . . . . . . A . 4 LEU H . . . . . . . . . c30448_6cxq 1 . 7 . 822 . 1 1 4 LEU HA H 0.117 0.975 -0.617 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HA . . . . . . . . . c30448_6cxq 1 . 7 . 823 . 1 1 4 LEU HB2 H -0.711 -0.920 -2.816 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HB2 . . . . . . . . . c30448_6cxq 1 . 7 . 824 . 1 1 4 LEU HB3 H -0.757 0.824 -2.986 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HB3 . . . . . . . . . c30448_6cxq 1 . 7 . 825 . 1 1 4 LEU HD11 H 1.246 -1.966 -2.100 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD11 . . . . . . . . . c30448_6cxq 1 . 7 . 826 . 1 1 4 LEU HD12 H 2.831 -1.335 -2.549 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD12 . . . . . . . . . c30448_6cxq 1 . 7 . 827 . 1 1 4 LEU HD13 H 1.716 -1.889 -3.798 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD13 . . . . . . . . . c30448_6cxq 1 . 7 . 828 . 1 1 4 LEU HD21 H 0.917 1.531 -4.406 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD21 . . . . . . . . . c30448_6cxq 1 . 7 . 829 . 1 1 4 LEU HD22 H 0.795 -0.113 -5.034 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD22 . . . . . . . . . c30448_6cxq 1 . 7 . 830 . 1 1 4 LEU HD23 H 2.374 0.565 -4.640 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD23 . . . . . . . . . c30448_6cxq 1 . 7 . 831 . 1 1 4 LEU HG H 1.776 0.648 -2.286 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HG . . . . . . . . . c30448_6cxq 1 . 7 . 832 . 1 1 4 LEU N N -0.001 -1.039 -0.290 . . . 1.0 . . . . . . . . . . . . A . 4 LEU N . . . . . . . . . c30448_6cxq 1 . 7 . 833 . 1 1 4 LEU O O -2.569 -0.297 0.106 . . . 1.0 . . . . . . . . . . . . A . 4 LEU O . . . . . . . . . c30448_6cxq 1 . 7 . 834 . 1 1 5 ARG C C -4.719 1.575 -2.377 . . . 1.0 . . . . . . . . . . . . A . 5 ARG C . . . . . . . . . c30448_6cxq 1 . 7 . 835 . 1 1 5 ARG CA C -3.896 1.808 -1.111 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CA . . . . . . . . . c30448_6cxq 1 . 7 . 836 . 1 1 5 ARG CB C -4.006 3.270 -0.690 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CB . . . . . . . . . c30448_6cxq 1 . 7 . 837 . 1 1 5 ARG CD C -1.888 4.423 -1.188 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CD . . . . . . . . . c30448_6cxq 1 . 7 . 838 . 1 1 5 ARG CG C -3.300 4.210 -1.634 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CG . . . . . . . . . c30448_6cxq 1 . 7 . 839 . 1 1 5 ARG CZ C 0.132 5.492 -2.110 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CZ . . . . . . . . . c30448_6cxq 1 . 7 . 840 . 1 1 5 ARG H H -1.951 1.976 -1.931 . . . 1.0 . . . . . . . . . . . . A . 5 ARG H . . . . . . . . . c30448_6cxq 1 . 7 . 841 . 1 1 5 ARG HA H -4.282 1.191 -0.321 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HA . . . . . . . . . c30448_6cxq 1 . 7 . 842 . 1 1 5 ARG HB2 H -5.047 3.556 -0.652 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HB2 . . . . . . . . . c30448_6cxq 1 . 7 . 843 . 1 1 5 ARG HB3 H -3.562 3.383 0.296 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HB3 . . . . . . . . . c30448_6cxq 1 . 7 . 844 . 1 1 5 ARG HD2 H -1.903 5.172 -0.428 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HD2 . . . . . . . . . c30448_6cxq 1 . 7 . 845 . 1 1 5 ARG HD3 H -1.515 3.495 -0.776 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HD3 . . . . . . . . . c30448_6cxq 1 . 7 . 846 . 1 1 5 ARG HE H -1.316 4.649 -3.197 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HE . . . . . . . . . c30448_6cxq 1 . 7 . 847 . 1 1 5 ARG HG2 H -3.292 3.787 -2.618 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HG2 . . . . . . . . . c30448_6cxq 1 . 7 . 848 . 1 1 5 ARG HG3 H -3.815 5.159 -1.644 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HG3 . . . . . . . . . c30448_6cxq 1 . 7 . 849 . 1 1 5 ARG HH11 H 0.023 5.514 -0.090 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH11 . . . . . . . . . c30448_6cxq 1 . 7 . 850 . 1 1 5 ARG HH12 H 1.432 6.260 -0.765 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH12 . . . . . . . . . c30448_6cxq 1 . 7 . 851 . 1 1 5 ARG HH21 H 0.538 5.631 -4.085 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH21 . . . . . . . . . c30448_6cxq 1 . 7 . 852 . 1 1 5 ARG HH22 H 1.724 6.327 -3.032 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH22 . . . . . . . . . c30448_6cxq 1 . 7 . 853 . 1 1 5 ARG N N -2.497 1.446 -1.314 . . . 1.0 . . . . . . . . . . . . A . 5 ARG N . . . . . . . . . c30448_6cxq 1 . 7 . 854 . 1 1 5 ARG NE N -1.021 4.851 -2.283 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NE . . . . . . . . . c30448_6cxq 1 . 7 . 855 . 1 1 5 ARG NH1 N 0.564 5.779 -0.888 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NH1 . . . . . . . . . c30448_6cxq 1 . 7 . 856 . 1 1 5 ARG NH2 N 0.858 5.846 -3.162 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NH2 . . . . . . . . . c30448_6cxq 1 . 7 . 857 . 1 1 5 ARG O O -5.925 1.824 -2.396 . . . 1.0 . . . . . . . . . . . . A . 5 ARG O . . . . . . . . . c30448_6cxq 1 . 7 . 858 . 1 1 6 HIS C C -6.037 0.074 -4.499 . . . 1.0 . . . . . . . . . . . . A . 6 HIS C . . . . . . . . . c30448_6cxq 1 . 7 . 859 . 1 1 6 HIS CA C -4.736 0.846 -4.707 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CA . . . . . . . . . c30448_6cxq 1 . 7 . 860 . 1 1 6 HIS CB C -3.813 0.067 -5.646 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CB . . . . . . . . . c30448_6cxq 1 . 7 . 861 . 1 1 6 HIS CD2 C -2.944 -1.703 -3.960 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CD2 . . . . . . . . . c30448_6cxq 1 . 7 . 862 . 1 1 6 HIS CE1 C -3.256 -3.493 -5.187 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CE1 . . . . . . . . . c30448_6cxq 1 . 7 . 863 . 1 1 6 HIS CG C -3.466 -1.300 -5.143 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CG . . . . . . . . . c30448_6cxq 1 . 7 . 864 . 1 1 6 HIS H H -3.102 0.928 -3.366 . . . 1.0 . . . . . . . . . . . . A . 6 HIS H . . . . . . . . . c30448_6cxq 1 . 7 . 865 . 1 1 6 HIS HA H -4.965 1.802 -5.155 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HA . . . . . . . . . c30448_6cxq 1 . 7 . 866 . 1 1 6 HIS HB2 H -4.301 -0.047 -6.606 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HB2 . . . . . . . . . c30448_6cxq 1 . 7 . 867 . 1 1 6 HIS HB3 H -2.890 0.621 -5.773 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HB3 . . . . . . . . . c30448_6cxq 1 . 7 . 868 . 1 1 6 HIS HD1 H -4.014 -2.485 -6.797 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HD1 . . . . . . . . . c30448_6cxq 1 . 7 . 869 . 1 1 6 HIS HD2 H -2.673 -1.067 -3.129 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HD2 . . . . . . . . . c30448_6cxq 1 . 7 . 870 . 1 1 6 HIS HE1 H -3.283 -4.521 -5.517 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HE1 . . . . . . . . . c30448_6cxq 1 . 7 . 871 . 1 1 6 HIS HE2 H -2.388 -3.629 -3.337 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HE2 . . . . . . . . . c30448_6cxq 1 . 7 . 872 . 1 1 6 HIS N N -4.063 1.103 -3.437 . . . 1.0 . . . . . . . . . . . . A . 6 HIS N . . . . . . . . . c30448_6cxq 1 . 7 . 873 . 1 1 6 HIS ND1 N -3.649 -2.446 -5.889 . . . 1.0 . . . . . . . . . . . . A . 6 HIS ND1 . . . . . . . . . c30448_6cxq 1 . 7 . 874 . 1 1 6 HIS NE2 N -2.823 -3.070 -4.014 . . . 1.0 . . . . . . . . . . . . A . 6 HIS NE2 . . . . . . . . . c30448_6cxq 1 . 7 . 875 . 1 1 6 HIS O O -6.202 -0.524 -3.414 . . . 1.0 . . . . . . . . . . . . A . 6 HIS O . . . . . . . . . c30448_6cxq 1 . 8 . 876 . 1 1 1 HIS C C 4.818 -1.730 3.713 . . . 1.0 . . . . . . . . . . . . A . 1 HIS C . . . . . . . . . c30448_6cxq 1 . 8 . 877 . 1 1 1 HIS CA C 6.329 -1.801 3.594 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CA . . . . . . . . . c30448_6cxq 1 . 8 . 878 . 1 1 1 HIS CB C 6.743 -2.715 2.438 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CB . . . . . . . . . c30448_6cxq 1 . 8 . 879 . 1 1 1 HIS CD2 C 6.556 -1.739 0.041 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CD2 . . . . . . . . . c30448_6cxq 1 . 8 . 880 . 1 1 1 HIS CE1 C 8.529 -0.789 -0.072 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CE1 . . . . . . . . . c30448_6cxq 1 . 8 . 881 . 1 1 1 HIS CG C 7.188 -1.971 1.217 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CG . . . . . . . . . c30448_6cxq 1 . 8 . 882 . 1 1 1 HIS H1 H 6.846 -1.571 5.572 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H1 . . . . . . . . . c30448_6cxq 1 . 8 . 883 . 1 1 1 HIS H2 H 7.946 -2.512 4.649 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H2 . . . . . . . . . c30448_6cxq 1 . 8 . 884 . 1 1 1 HIS H3 H 6.435 -3.173 5.123 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H3 . . . . . . . . . c30448_6cxq 1 . 8 . 885 . 1 1 1 HIS HA H 6.694 -0.800 3.411 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HA . . . . . . . . . c30448_6cxq 1 . 8 . 886 . 1 1 1 HIS HB2 H 7.561 -3.342 2.759 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HB2 . . . . . . . . . c30448_6cxq 1 . 8 . 887 . 1 1 1 HIS HB3 H 5.905 -3.338 2.162 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HB3 . . . . . . . . . c30448_6cxq 1 . 8 . 888 . 1 1 1 HIS HD1 H 9.115 -1.353 1.806 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HD1 . . . . . . . . . c30448_6cxq 1 . 8 . 889 . 1 1 1 HIS HD2 H 5.564 -2.071 -0.230 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HD2 . . . . . . . . . c30448_6cxq 1 . 8 . 890 . 1 1 1 HIS HE1 H 9.386 -0.240 -0.433 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HE1 . . . . . . . . . c30448_6cxq 1 . 8 . 891 . 1 1 1 HIS HE2 H 7.192 -0.614 -1.614 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HE2 . . . . . . . . . c30448_6cxq 1 . 8 . 892 . 1 1 1 HIS N N 6.944 -2.310 4.848 . . . 1.0 . . . . . . . . . . . . A . 1 HIS N . . . . . . . . . c30448_6cxq 1 . 8 . 893 . 1 1 1 HIS ND1 N 8.422 -1.363 1.113 . . . 1.0 . . . . . . . . . . . . A . 1 HIS ND1 . . . . . . . . . c30448_6cxq 1 . 8 . 894 . 1 1 1 HIS NE2 N 7.412 -1.003 -0.741 . . . 1.0 . . . . . . . . . . . . A . 1 HIS NE2 . . . . . . . . . c30448_6cxq 1 . 8 . 895 . 1 1 1 HIS O O 4.277 -1.660 4.817 . . . 1.0 . . . . . . . . . . . . A . 1 HIS O . . . . . . . . . c30448_6cxq 1 . 8 . 896 . 1 1 2 ARG C C 2.053 -2.278 1.389 . . . 1.0 . . . . . . . . . . . . A . 2 ARG C . . . . . . . . . c30448_6cxq 1 . 8 . 897 . 1 1 2 ARG CA C 2.688 -1.590 2.583 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CA . . . . . . . . . c30448_6cxq 1 . 8 . 898 . 1 1 2 ARG CB C 2.284 -0.115 2.597 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CB . . . . . . . . . c30448_6cxq 1 . 8 . 899 . 1 1 2 ARG CD C 3.341 2.110 2.101 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CD . . . . . . . . . c30448_6cxq 1 . 8 . 900 . 1 1 2 ARG CG C 3.481 0.774 2.812 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CG . . . . . . . . . c30448_6cxq 1 . 8 . 901 . 1 1 2 ARG CZ C 2.748 3.718 3.871 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CZ . . . . . . . . . c30448_6cxq 1 . 8 . 902 . 1 1 2 ARG H H 4.613 -1.730 1.719 . . . 1.0 . . . . . . . . . . . . A . 2 ARG H . . . . . . . . . c30448_6cxq 1 . 8 . 903 . 1 1 2 ARG HA H 2.351 -2.034 3.480 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HA . . . . . . . . . c30448_6cxq 1 . 8 . 904 . 1 1 2 ARG HB2 H 1.814 0.146 1.646 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB2 . . . . . . . . . c30448_6cxq 1 . 8 . 905 . 1 1 2 ARG HB3 H 1.582 0.053 3.401 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB3 . . . . . . . . . c30448_6cxq 1 . 8 . 906 . 1 1 2 ARG HD2 H 4.312 2.578 2.048 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD2 . . . . . . . . . c30448_6cxq 1 . 8 . 907 . 1 1 2 ARG HD3 H 2.972 1.934 1.101 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD3 . . . . . . . . . c30448_6cxq 1 . 8 . 908 . 1 1 2 ARG HE H 1.510 3.085 2.439 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HE . . . . . . . . . c30448_6cxq 1 . 8 . 909 . 1 1 2 ARG HG2 H 3.626 0.938 3.869 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG2 . . . . . . . . . c30448_6cxq 1 . 8 . 910 . 1 1 2 ARG HG3 H 4.327 0.249 2.424 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG3 . . . . . . . . . c30448_6cxq 1 . 8 . 911 . 1 1 2 ARG HH11 H 4.651 3.039 3.960 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH11 . . . . . . . . . c30448_6cxq 1 . 8 . 912 . 1 1 2 ARG HH12 H 4.210 4.174 5.191 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH12 . . . . . . . . . c30448_6cxq 1 . 8 . 913 . 1 1 2 ARG HH21 H 0.928 4.579 4.057 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH21 . . . . . . . . . c30448_6cxq 1 . 8 . 914 . 1 1 2 ARG HH22 H 2.096 5.048 5.247 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH22 . . . . . . . . . c30448_6cxq 1 . 8 . 915 . 1 1 2 ARG N N 4.135 -1.704 2.574 . . . 1.0 . . . . . . . . . . . . A . 2 ARG N . . . . . . . . . c30448_6cxq 1 . 8 . 916 . 1 1 2 ARG NE N 2.420 3.007 2.795 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NE . . . . . . . . . c30448_6cxq 1 . 8 . 917 . 1 1 2 ARG NH1 N 3.970 3.637 4.383 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH1 . . . . . . . . . c30448_6cxq 1 . 8 . 918 . 1 1 2 ARG NH2 N 1.851 4.513 4.438 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH2 . . . . . . . . . c30448_6cxq 1 . 8 . 919 . 1 1 2 ARG O O 2.670 -2.408 0.332 . . . 1.0 . . . . . . . . . . . . A . 2 ARG O . . . . . . . . . c30448_6cxq 1 . 8 . 920 . 1 1 3 PHE C C -0.614 -2.166 -0.353 . . . 1.0 . . . . . . . . . . . . A . 3 PHE C . . . . . . . . . c30448_6cxq 1 . 8 . 921 . 1 1 3 PHE CA C 0.055 -3.273 0.450 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CA . . . . . . . . . c30448_6cxq 1 . 8 . 922 . 1 1 3 PHE CB C -0.982 -4.262 0.975 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CB . . . . . . . . . c30448_6cxq 1 . 8 . 923 . 1 1 3 PHE CD1 C -1.759 -6.623 0.718 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CD1 . . . . . . . . . c30448_6cxq 1 . 8 . 924 . 1 1 3 PHE CD2 C -0.530 -5.660 -1.082 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CD2 . . . . . . . . . c30448_6cxq 1 . 8 . 925 . 1 1 3 PHE CE1 C -1.874 -7.806 0.012 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CE1 . . . . . . . . . c30448_6cxq 1 . 8 . 926 . 1 1 3 PHE CE2 C -0.640 -6.840 -1.793 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CE2 . . . . . . . . . c30448_6cxq 1 . 8 . 927 . 1 1 3 PHE CG C -1.089 -5.539 0.184 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CG . . . . . . . . . c30448_6cxq 1 . 8 . 928 . 1 1 3 PHE CZ C -1.313 -7.914 -1.245 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CZ . . . . . . . . . c30448_6cxq 1 . 8 . 929 . 1 1 3 PHE H H 0.338 -2.494 2.394 . . . 1.0 . . . . . . . . . . . . A . 3 PHE H . . . . . . . . . c30448_6cxq 1 . 8 . 930 . 1 1 3 PHE HA H 0.754 -3.783 -0.178 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HA . . . . . . . . . c30448_6cxq 1 . 8 . 931 . 1 1 3 PHE HB2 H -0.730 -4.528 1.994 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HB2 . . . . . . . . . c30448_6cxq 1 . 8 . 932 . 1 1 3 PHE HB3 H -1.948 -3.787 0.959 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HB3 . . . . . . . . . c30448_6cxq 1 . 8 . 933 . 1 1 3 PHE HD1 H -2.199 -6.536 1.699 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HD1 . . . . . . . . . c30448_6cxq 1 . 8 . 934 . 1 1 3 PHE HD2 H -0.005 -4.821 -1.513 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HD2 . . . . . . . . . c30448_6cxq 1 . 8 . 935 . 1 1 3 PHE HE1 H -2.400 -8.644 0.443 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HE1 . . . . . . . . . c30448_6cxq 1 . 8 . 936 . 1 1 3 PHE HE2 H -0.200 -6.922 -2.776 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HE2 . . . . . . . . . c30448_6cxq 1 . 8 . 937 . 1 1 3 PHE HZ H -1.400 -8.838 -1.799 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HZ . . . . . . . . . c30448_6cxq 1 . 8 . 938 . 1 1 3 PHE N N 0.793 -2.663 1.543 . . . 1.0 . . . . . . . . . . . . A . 3 PHE N . . . . . . . . . c30448_6cxq 1 . 8 . 939 . 1 1 3 PHE O O -1.676 -2.351 -0.948 . . . 1.0 . . . . . . . . . . . . A . 3 PHE O . . . . . . . . . c30448_6cxq 1 . 8 . 940 . 1 1 4 LEU C C -1.911 0.453 -0.706 . . . 1.0 . . . . . . . . . . . . A . 4 LEU C . . . . . . . . . c30448_6cxq 1 . 8 . 941 . 1 1 4 LEU CA C -0.441 0.184 -1.021 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CA . . . . . . . . . c30448_6cxq 1 . 8 . 942 . 1 1 4 LEU CB C -0.237 0.052 -2.531 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CB . . . . . . . . . c30448_6cxq 1 . 8 . 943 . 1 1 4 LEU CD1 C 1.682 -1.553 -2.686 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CD1 . . . . . . . . . c30448_6cxq 1 . 8 . 944 . 1 1 4 LEU CD2 C 1.366 0.188 -4.453 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CD2 . . . . . . . . . c30448_6cxq 1 . 8 . 945 . 1 1 4 LEU CG C 1.215 -0.135 -2.974 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CG . . . . . . . . . c30448_6cxq 1 . 8 . 946 . 1 1 4 LEU H H 0.865 -0.941 0.168 . . . 1.0 . . . . . . . . . . . . A . 4 LEU H . . . . . . . . . c30448_6cxq 1 . 8 . 947 . 1 1 4 LEU HA H 0.153 1.012 -0.653 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HA . . . . . . . . . c30448_6cxq 1 . 8 . 948 . 1 1 4 LEU HB2 H -0.809 -0.796 -2.878 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HB2 . . . . . . . . . c30448_6cxq 1 . 8 . 949 . 1 1 4 LEU HB3 H -0.621 0.943 -3.005 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HB3 . . . . . . . . . c30448_6cxq 1 . 8 . 950 . 1 1 4 LEU HD11 H 1.878 -1.660 -1.629 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD11 . . . . . . . . . c30448_6cxq 1 . 8 . 951 . 1 1 4 LEU HD12 H 2.587 -1.754 -3.242 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD12 . . . . . . . . . c30448_6cxq 1 . 8 . 952 . 1 1 4 LEU HD13 H 0.915 -2.252 -2.983 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD13 . . . . . . . . . c30448_6cxq 1 . 8 . 953 . 1 1 4 LEU HD21 H 1.453 1.257 -4.581 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD21 . . . . . . . . . c30448_6cxq 1 . 8 . 954 . 1 1 4 LEU HD22 H 0.500 -0.169 -4.989 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD22 . . . . . . . . . c30448_6cxq 1 . 8 . 955 . 1 1 4 LEU HD23 H 2.252 -0.294 -4.838 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD23 . . . . . . . . . c30448_6cxq 1 . 8 . 956 . 1 1 4 LEU HG H 1.845 0.543 -2.416 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HG . . . . . . . . . c30448_6cxq 1 . 8 . 957 . 1 1 4 LEU N N 0.034 -1.003 -0.335 . . . 1.0 . . . . . . . . . . . . A . 4 LEU N . . . . . . . . . c30448_6cxq 1 . 8 . 958 . 1 1 4 LEU O O -2.523 -0.250 0.098 . . . 1.0 . . . . . . . . . . . . A . 4 LEU O . . . . . . . . . c30448_6cxq 1 . 8 . 959 . 1 1 5 ARG C C -4.690 1.642 -2.405 . . . 1.0 . . . . . . . . . . . . A . 5 ARG C . . . . . . . . . c30448_6cxq 1 . 8 . 960 . 1 1 5 ARG CA C -3.869 1.837 -1.133 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CA . . . . . . . . . c30448_6cxq 1 . 8 . 961 . 1 1 5 ARG CB C -3.972 3.287 -0.672 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CB . . . . . . . . . c30448_6cxq 1 . 8 . 962 . 1 1 5 ARG CD C -1.872 4.448 -1.211 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CD . . . . . . . . . c30448_6cxq 1 . 8 . 963 . 1 1 5 ARG CG C -3.298 4.252 -1.614 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CG . . . . . . . . . c30448_6cxq 1 . 8 . 964 . 1 1 5 ARG CZ C 0.124 5.512 -2.193 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CZ . . . . . . . . . c30448_6cxq 1 . 8 . 965 . 1 1 5 ARG H H -1.933 1.999 -1.975 . . . 1.0 . . . . . . . . . . . . A . 5 ARG H . . . . . . . . . c30448_6cxq 1 . 8 . 966 . 1 1 5 ARG HA H -4.257 1.200 -0.360 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HA . . . . . . . . . c30448_6cxq 1 . 8 . 967 . 1 1 5 ARG HB2 H -5.012 3.568 -0.596 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HB2 . . . . . . . . . c30448_6cxq 1 . 8 . 968 . 1 1 5 ARG HB3 H -3.499 3.379 0.302 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HB3 . . . . . . . . . c30448_6cxq 1 . 8 . 969 . 1 1 5 ARG HD2 H -1.856 5.194 -0.449 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HD2 . . . . . . . . . c30448_6cxq 1 . 8 . 970 . 1 1 5 ARG HD3 H -1.495 3.515 -0.815 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HD3 . . . . . . . . . c30448_6cxq 1 . 8 . 971 . 1 1 5 ARG HE H -1.355 4.666 -3.236 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HE . . . . . . . . . c30448_6cxq 1 . 8 . 972 . 1 1 5 ARG HG2 H -3.326 3.857 -2.609 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HG2 . . . . . . . . . c30448_6cxq 1 . 8 . 973 . 1 1 5 ARG HG3 H -3.811 5.201 -1.579 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HG3 . . . . . . . . . c30448_6cxq 1 . 8 . 974 . 1 1 5 ARG HH11 H 0.071 5.542 -0.171 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH11 . . . . . . . . . c30448_6cxq 1 . 8 . 975 . 1 1 5 ARG HH12 H 1.461 6.285 -0.888 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH12 . . . . . . . . . c30448_6cxq 1 . 8 . 976 . 1 1 5 ARG HH21 H 0.474 5.643 -4.179 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH21 . . . . . . . . . c30448_6cxq 1 . 8 . 977 . 1 1 5 ARG HH22 H 1.690 6.342 -3.163 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH22 . . . . . . . . . c30448_6cxq 1 . 8 . 978 . 1 1 5 ARG N N -2.471 1.475 -1.345 . . . 1.0 . . . . . . . . . . . . A . 5 ARG N . . . . . . . . . c30448_6cxq 1 . 8 . 979 . 1 1 5 ARG NE N -1.035 4.871 -2.331 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NE . . . . . . . . . c30448_6cxq 1 . 8 . 980 . 1 1 5 ARG NH1 N 0.590 5.803 -0.985 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NH1 . . . . . . . . . c30448_6cxq 1 . 8 . 981 . 1 1 5 ARG NH2 N 0.820 5.861 -3.266 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NH2 . . . . . . . . . c30448_6cxq 1 . 8 . 982 . 1 1 5 ARG O O -5.825 2.109 -2.498 . . . 1.0 . . . . . . . . . . . . A . 5 ARG O . . . . . . . . . c30448_6cxq 1 . 8 . 983 . 1 1 6 HIS C C -6.174 0.115 -4.432 . . . 1.0 . . . . . . . . . . . . A . 6 HIS C . . . . . . . . . c30448_6cxq 1 . 8 . 984 . 1 1 6 HIS CA C -4.788 0.712 -4.656 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CA . . . . . . . . . c30448_6cxq 1 . 8 . 985 . 1 1 6 HIS CB C -3.954 -0.224 -5.532 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CB . . . . . . . . . c30448_6cxq 1 . 8 . 986 . 1 1 6 HIS CD2 C -3.590 -1.918 -3.600 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CD2 . . . . . . . . . c30448_6cxq 1 . 8 . 987 . 1 1 6 HIS CE1 C -3.308 -3.726 -4.808 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CE1 . . . . . . . . . c30448_6cxq 1 . 8 . 988 . 1 1 6 HIS CG C -3.696 -1.558 -4.901 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CG . . . . . . . . . c30448_6cxq 1 . 8 . 989 . 1 1 6 HIS H H -3.201 0.613 -3.262 . . . 1.0 . . . . . . . . . . . . A . 6 HIS H . . . . . . . . . c30448_6cxq 1 . 8 . 990 . 1 1 6 HIS HA H -4.894 1.661 -5.161 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HA . . . . . . . . . c30448_6cxq 1 . 8 . 991 . 1 1 6 HIS HB2 H -4.476 -0.394 -6.465 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HB2 . . . . . . . . . c30448_6cxq 1 . 8 . 992 . 1 1 6 HIS HB3 H -2.995 0.241 -5.733 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HB3 . . . . . . . . . c30448_6cxq 1 . 8 . 993 . 1 1 6 HIS HD1 H -3.534 -2.782 -6.609 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HD1 . . . . . . . . . c30448_6cxq 1 . 8 . 994 . 1 1 6 HIS HD2 H -3.678 -1.262 -2.745 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HD2 . . . . . . . . . c30448_6cxq 1 . 8 . 995 . 1 1 6 HIS HE1 H -3.135 -4.751 -5.098 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HE1 . . . . . . . . . c30448_6cxq 1 . 8 . 996 . 1 1 6 HIS HE2 H -3.145 -3.793 -2.767 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HE2 . . . . . . . . . c30448_6cxq 1 . 8 . 997 . 1 1 6 HIS N N -4.108 0.957 -3.389 . . . 1.0 . . . . . . . . . . . . A . 6 HIS N . . . . . . . . . c30448_6cxq 1 . 8 . 998 . 1 1 6 HIS ND1 N -3.514 -2.714 -5.632 . . . 1.0 . . . . . . . . . . . . A . 6 HIS ND1 . . . . . . . . . c30448_6cxq 1 . 8 . 999 . 1 1 6 HIS NE2 N -3.349 -3.269 -3.570 . . . 1.0 . . . . . . . . . . . . A . 6 HIS NE2 . . . . . . . . . c30448_6cxq 1 . 8 . 1000 . 1 1 6 HIS O O -6.251 -1.050 -3.986 . . . 1.0 . . . . . . . . . . . . A . 6 HIS O . . . . . . . . . c30448_6cxq 1 . 9 . 1001 . 1 1 1 HIS C C 4.945 -1.557 3.634 . . . 1.0 . . . . . . . . . . . . A . 1 HIS C . . . . . . . . . c30448_6cxq 1 . 9 . 1002 . 1 1 1 HIS CA C 6.449 -1.616 3.435 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CA . . . . . . . . . c30448_6cxq 1 . 9 . 1003 . 1 1 1 HIS CB C 6.816 -2.622 2.341 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CB . . . . . . . . . c30448_6cxq 1 . 9 . 1004 . 1 1 1 HIS CD2 C 8.945 -4.075 2.041 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CD2 . . . . . . . . . c30448_6cxq 1 . 9 . 1005 . 1 1 1 HIS CE1 C 10.447 -2.502 2.313 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CE1 . . . . . . . . . c30448_6cxq 1 . 9 . 1006 . 1 1 1 HIS CG C 8.283 -2.915 2.266 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CG . . . . . . . . . c30448_6cxq 1 . 9 . 1007 . 1 1 1 HIS H1 H 8.145 -1.743 4.594 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H1 . . . . . . . . . c30448_6cxq 1 . 9 . 1008 . 1 1 1 HIS H2 H 7.030 -3.031 4.811 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H2 . . . . . . . . . c30448_6cxq 1 . 9 . 1009 . 1 1 1 HIS H3 H 6.697 -1.483 5.473 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H3 . . . . . . . . . c30448_6cxq 1 . 9 . 1010 . 1 1 1 HIS HA H 6.783 -0.629 3.145 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HA . . . . . . . . . c30448_6cxq 1 . 9 . 1011 . 1 1 1 HIS HB2 H 6.301 -3.552 2.528 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HB2 . . . . . . . . . c30448_6cxq 1 . 9 . 1012 . 1 1 1 HIS HB3 H 6.506 -2.231 1.383 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HB3 . . . . . . . . . c30448_6cxq 1 . 9 . 1013 . 1 1 1 HIS HD1 H 9.090 -0.999 2.611 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HD1 . . . . . . . . . c30448_6cxq 1 . 9 . 1014 . 1 1 1 HIS HD2 H 8.499 -5.044 1.867 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HD2 . . . . . . . . . c30448_6cxq 1 . 9 . 1015 . 1 1 1 HIS HE1 H 11.393 -1.987 2.397 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HE1 . . . . . . . . . c30448_6cxq 1 . 9 . 1016 . 1 1 1 HIS HE2 H 11.011 -4.451 2.037 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HE2 . . . . . . . . . c30448_6cxq 1 . 9 . 1017 . 1 1 1 HIS N N 7.143 -2.003 4.692 . . . 1.0 . . . . . . . . . . . . A . 1 HIS N . . . . . . . . . c30448_6cxq 1 . 9 . 1018 . 1 1 1 HIS ND1 N 9.253 -1.949 2.432 . . . 1.0 . . . . . . . . . . . . A . 1 HIS ND1 . . . . . . . . . c30448_6cxq 1 . 9 . 1019 . 1 1 1 HIS NE2 N 10.288 -3.790 2.076 . . . 1.0 . . . . . . . . . . . . A . 1 HIS NE2 . . . . . . . . . c30448_6cxq 1 . 9 . 1020 . 1 1 1 HIS O O 4.468 -1.395 4.757 . . . 1.0 . . . . . . . . . . . . A . 1 HIS O . . . . . . . . . c30448_6cxq 1 . 9 . 1021 . 1 1 2 ARG C C 2.061 -2.369 1.553 . . . 1.0 . . . . . . . . . . . . A . 2 ARG C . . . . . . . . . c30448_6cxq 1 . 9 . 1022 . 1 1 2 ARG CA C 2.753 -1.549 2.625 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CA . . . . . . . . . c30448_6cxq 1 . 9 . 1023 . 1 1 2 ARG CB C 2.322 -0.087 2.508 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CB . . . . . . . . . c30448_6cxq 1 . 9 . 1024 . 1 1 2 ARG CD C 3.309 2.111 1.786 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CD . . . . . . . . . c30448_6cxq 1 . 9 . 1025 . 1 1 2 ARG CG C 3.510 0.837 2.590 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CG . . . . . . . . . c30448_6cxq 1 . 9 . 1026 . 1 1 2 ARG CZ C 4.513 3.312 0.003 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CZ . . . . . . . . . c30448_6cxq 1 . 9 . 1027 . 1 1 2 ARG H H 4.626 -1.739 1.664 . . . 1.0 . . . . . . . . . . . . A . 2 ARG H . . . . . . . . . c30448_6cxq 1 . 9 . 1028 . 1 1 2 ARG HA H 2.478 -1.898 3.584 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HA . . . . . . . . . c30448_6cxq 1 . 9 . 1029 . 1 1 2 ARG HB2 H 1.816 0.071 1.553 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB2 . . . . . . . . . c30448_6cxq 1 . 9 . 1030 . 1 1 2 ARG HB3 H 1.646 0.150 3.316 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB3 . . . . . . . . . c30448_6cxq 1 . 9 . 1031 . 1 1 2 ARG HD2 H 2.289 2.141 1.433 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD2 . . . . . . . . . c30448_6cxq 1 . 9 . 1032 . 1 1 2 ARG HD3 H 3.491 2.959 2.429 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD3 . . . . . . . . . c30448_6cxq 1 . 9 . 1033 . 1 1 2 ARG HE H 4.612 1.345 0.326 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HE . . . . . . . . . c30448_6cxq 1 . 9 . 1034 . 1 1 2 ARG HG2 H 3.704 1.086 3.622 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG2 . . . . . . . . . c30448_6cxq 1 . 9 . 1035 . 1 1 2 ARG HG3 H 4.347 0.297 2.202 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG3 . . . . . . . . . c30448_6cxq 1 . 9 . 1036 . 1 1 2 ARG HH11 H 3.360 4.491 1.175 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH11 . . . . . . . . . c30448_6cxq 1 . 9 . 1037 . 1 1 2 ARG HH12 H 4.220 5.311 -0.085 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH12 . . . . . . . . . c30448_6cxq 1 . 9 . 1038 . 1 1 2 ARG HH21 H 5.743 2.422 -1.331 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH21 . . . . . . . . . c30448_6cxq 1 . 9 . 1039 . 1 1 2 ARG HH22 H 5.572 4.137 -1.508 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH22 . . . . . . . . . c30448_6cxq 1 . 9 . 1040 . 1 1 2 ARG N N 4.198 -1.644 2.540 . . . 1.0 . . . . . . . . . . . . A . 2 ARG N . . . . . . . . . c30448_6cxq 1 . 9 . 1041 . 1 1 2 ARG NE N 4.211 2.183 0.639 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NE . . . . . . . . . c30448_6cxq 1 . 9 . 1042 . 1 1 2 ARG NH1 N 3.988 4.466 0.397 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH1 . . . . . . . . . c30448_6cxq 1 . 9 . 1043 . 1 1 2 ARG NH2 N 5.344 3.289 -1.030 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH2 . . . . . . . . . c30448_6cxq 1 . 9 . 1044 . 1 1 2 ARG O O 2.628 -2.628 0.491 . . . 1.0 . . . . . . . . . . . . A . 2 ARG O . . . . . . . . . c30448_6cxq 1 . 9 . 1045 . 1 1 3 PHE C C -0.685 -2.449 -0.064 . . . 1.0 . . . . . . . . . . . . A . 3 PHE C . . . . . . . . . c30448_6cxq 1 . 9 . 1046 . 1 1 3 PHE CA C 0.021 -3.457 0.833 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CA . . . . . . . . . c30448_6cxq 1 . 9 . 1047 . 1 1 3 PHE CB C -0.992 -4.371 1.523 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CB . . . . . . . . . c30448_6cxq 1 . 9 . 1048 . 1 1 3 PHE CD1 C -1.609 -6.776 1.784 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CD1 . . . . . . . . . c30448_6cxq 1 . 9 . 1049 . 1 1 3 PHE CD2 C -0.407 -6.152 -0.177 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CD2 . . . . . . . . . c30448_6cxq 1 . 9 . 1050 . 1 1 3 PHE CE1 C -1.633 -8.090 1.356 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CE1 . . . . . . . . . c30448_6cxq 1 . 9 . 1051 . 1 1 3 PHE CE2 C -0.428 -7.464 -0.611 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CE2 . . . . . . . . . c30448_6cxq 1 . 9 . 1052 . 1 1 3 PHE CG C -0.998 -5.794 1.028 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CG . . . . . . . . . c30448_6cxq 1 . 9 . 1053 . 1 1 3 PHE CZ C -1.041 -8.435 0.157 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CZ . . . . . . . . . c30448_6cxq 1 . 9 . 1054 . 1 1 3 PHE H H 0.396 -2.453 2.656 . . . 1.0 . . . . . . . . . . . . A . 3 PHE H . . . . . . . . . c30448_6cxq 1 . 9 . 1055 . 1 1 3 PHE HA H 0.691 -4.040 0.238 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HA . . . . . . . . . c30448_6cxq 1 . 9 . 1056 . 1 1 3 PHE HB2 H -0.775 -4.396 2.584 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HB2 . . . . . . . . . c30448_6cxq 1 . 9 . 1057 . 1 1 3 PHE HB3 H -1.980 -3.970 1.371 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HB3 . . . . . . . . . c30448_6cxq 1 . 9 . 1058 . 1 1 3 PHE HD1 H -2.073 -6.503 2.719 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HD1 . . . . . . . . . c30448_6cxq 1 . 9 . 1059 . 1 1 3 PHE HD2 H 0.071 -5.396 -0.780 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HD2 . . . . . . . . . c30448_6cxq 1 . 9 . 1060 . 1 1 3 PHE HE1 H -2.114 -8.846 1.959 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HE1 . . . . . . . . . c30448_6cxq 1 . 9 . 1061 . 1 1 3 PHE HE2 H 0.036 -7.731 -1.549 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HE2 . . . . . . . . . c30448_6cxq 1 . 9 . 1062 . 1 1 3 PHE HZ H -1.059 -9.461 -0.180 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HZ . . . . . . . . . c30448_6cxq 1 . 9 . 1063 . 1 1 3 PHE N N 0.810 -2.726 1.810 . . . 1.0 . . . . . . . . . . . . A . 3 PHE N . . . . . . . . . c30448_6cxq 1 . 9 . 1064 . 1 1 3 PHE O O -1.765 -2.703 -0.597 . . . 1.0 . . . . . . . . . . . . A . 3 PHE O . . . . . . . . . c30448_6cxq 1 . 9 . 1065 . 1 1 4 LEU C C -2.008 0.116 -0.663 . . . 1.0 . . . . . . . . . . . . A . 4 LEU C . . . . . . . . . c30448_6cxq 1 . 9 . 1066 . 1 1 4 LEU CA C -0.550 -0.188 -0.998 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CA . . . . . . . . . c30448_6cxq 1 . 9 . 1067 . 1 1 4 LEU CB C -0.400 -0.490 -2.490 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CB . . . . . . . . . c30448_6cxq 1 . 9 . 1068 . 1 1 4 LEU CD1 C 1.497 -2.086 -2.861 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CD1 . . . . . . . . . c30448_6cxq 1 . 9 . 1069 . 1 1 4 LEU CD2 C 1.170 -0.154 -4.415 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CD2 . . . . . . . . . c30448_6cxq 1 . 9 . 1070 . 1 1 4 LEU CG C 1.041 -0.640 -2.979 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CG . . . . . . . . . c30448_6cxq 1 . 9 . 1071 . 1 1 4 LEU H H 0.804 -1.171 0.262 . . . 1.0 . . . . . . . . . . . . A . 4 LEU H . . . . . . . . . c30448_6cxq 1 . 9 . 1072 . 1 1 4 LEU HA H 0.054 0.677 -0.749 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HA . . . . . . . . . c30448_6cxq 1 . 9 . 1073 . 1 1 4 LEU HB2 H -0.929 -1.408 -2.704 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HB2 . . . . . . . . . c30448_6cxq 1 . 9 . 1074 . 1 1 4 LEU HB3 H -0.864 0.310 -3.047 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HB3 . . . . . . . . . c30448_6cxq 1 . 9 . 1075 . 1 1 4 LEU HD11 H 0.669 -2.744 -3.078 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD11 . . . . . . . . . c30448_6cxq 1 . 9 . 1076 . 1 1 4 LEU HD12 H 1.850 -2.271 -1.857 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD12 . . . . . . . . . c30448_6cxq 1 . 9 . 1077 . 1 1 4 LEU HD13 H 2.297 -2.270 -3.563 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD13 . . . . . . . . . c30448_6cxq 1 . 9 . 1078 . 1 1 4 LEU HD21 H 1.918 -0.740 -4.928 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD21 . . . . . . . . . c30448_6cxq 1 . 9 . 1079 . 1 1 4 LEU HD22 H 1.461 0.886 -4.418 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD22 . . . . . . . . . c30448_6cxq 1 . 9 . 1080 . 1 1 4 LEU HD23 H 0.220 -0.263 -4.918 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD23 . . . . . . . . . c30448_6cxq 1 . 9 . 1081 . 1 1 4 LEU HG H 1.688 -0.035 -2.361 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HG . . . . . . . . . c30448_6cxq 1 . 9 . 1082 . 1 1 4 LEU N N -0.044 -1.290 -0.201 . . . 1.0 . . . . . . . . . . . . A . 4 LEU N . . . . . . . . . c30448_6cxq 1 . 9 . 1083 . 1 1 4 LEU O O -2.598 -0.511 0.217 . . . 1.0 . . . . . . . . . . . . A . 4 LEU O . . . . . . . . . c30448_6cxq 1 . 9 . 1084 . 1 1 5 ARG C C -4.703 1.691 -2.465 . . . 1.0 . . . . . . . . . . . . A . 5 ARG C . . . . . . . . . c30448_6cxq 1 . 9 . 1085 . 1 1 5 ARG CA C -3.971 1.473 -1.144 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CA . . . . . . . . . c30448_6cxq 1 . 9 . 1086 . 1 1 5 ARG CB C -4.033 2.747 -0.306 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CB . . . . . . . . . c30448_6cxq 1 . 9 . 1087 . 1 1 5 ARG CD C -1.857 3.883 -0.464 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CD . . . . . . . . . c30448_6cxq 1 . 9 . 1088 . 1 1 5 ARG CG C -3.280 3.895 -0.926 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CG . . . . . . . . . c30448_6cxq 1 . 9 . 1089 . 1 1 5 ARG CZ C 0.204 5.112 -1.025 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CZ . . . . . . . . . c30448_6cxq 1 . 9 . 1090 . 1 1 5 ARG H H -2.062 1.551 -2.055 . . . 1.0 . . . . . . . . . . . . A . 5 ARG H . . . . . . . . . c30448_6cxq 1 . 9 . 1091 . 1 1 5 ARG HA H -4.448 0.678 -0.602 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HA . . . . . . . . . c30448_6cxq 1 . 9 . 1092 . 1 1 5 ARG HB2 H -5.063 3.049 -0.187 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HB2 . . . . . . . . . c30448_6cxq 1 . 9 . 1093 . 1 1 5 ARG HB3 H -3.599 2.544 0.670 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HB3 . . . . . . . . . c30448_6cxq 1 . 9 . 1094 . 1 1 5 ARG HD2 H -1.831 4.343 0.497 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HD2 . . . . . . . . . c30448_6cxq 1 . 9 . 1095 . 1 1 5 ARG HD3 H -1.533 2.854 -0.384 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HD3 . . . . . . . . . c30448_6cxq 1 . 9 . 1096 . 1 1 5 ARG HE H -1.272 4.705 -2.307 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HE . . . . . . . . . c30448_6cxq 1 . 9 . 1097 . 1 1 5 ARG HG2 H -3.298 3.800 -1.993 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HG2 . . . . . . . . . c30448_6cxq 1 . 9 . 1098 . 1 1 5 ARG HG3 H -3.740 4.826 -0.629 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HG3 . . . . . . . . . c30448_6cxq 1 . 9 . 1099 . 1 1 5 ARG HH11 H 0.093 4.503 0.901 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH11 . . . . . . . . . c30448_6cxq 1 . 9 . 1100 . 1 1 5 ARG HH12 H 1.530 5.373 0.480 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH12 . . . . . . . . . c30448_6cxq 1 . 9 . 1101 . 1 1 5 ARG HH21 H 0.619 5.848 -2.861 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH21 . . . . . . . . . c30448_6cxq 1 . 9 . 1102 . 1 1 5 ARG HH22 H 1.828 6.137 -1.655 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH22 . . . . . . . . . c30448_6cxq 1 . 9 . 1103 . 1 1 5 ARG N N -2.583 1.085 -1.369 . . . 1.0 . . . . . . . . . . . . A . 5 ARG N . . . . . . . . . c30448_6cxq 1 . 9 . 1104 . 1 1 5 ARG NE N -0.972 4.600 -1.379 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NE . . . . . . . . . c30448_6cxq 1 . 9 . 1105 . 1 1 5 ARG NH1 N 0.645 4.986 0.221 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NH1 . . . . . . . . . c30448_6cxq 1 . 9 . 1106 . 1 1 5 ARG NH2 N 0.945 5.751 -1.920 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NH2 . . . . . . . . . c30448_6cxq 1 . 9 . 1107 . 1 1 5 ARG O O -5.759 2.323 -2.502 . . . 1.0 . . . . . . . . . . . . A . 5 ARG O . . . . . . . . . c30448_6cxq 1 . 9 . 1108 . 1 1 6 HIS C C -6.185 0.845 -4.875 . . . 1.0 . . . . . . . . . . . . A . 6 HIS C . . . . . . . . . c30448_6cxq 1 . 9 . 1109 . 1 1 6 HIS CA C -4.734 1.321 -4.873 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CA . . . . . . . . . c30448_6cxq 1 . 9 . 1110 . 1 1 6 HIS CB C -3.927 0.540 -5.912 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CB . . . . . . . . . c30448_6cxq 1 . 9 . 1111 . 1 1 6 HIS CD2 C -3.507 -1.674 -4.625 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CD2 . . . . . . . . . c30448_6cxq 1 . 9 . 1112 . 1 1 6 HIS CE1 C -4.281 -3.070 -6.128 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CE1 . . . . . . . . . c30448_6cxq 1 . 9 . 1113 . 1 1 6 HIS CG C -3.929 -0.940 -5.682 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CG . . . . . . . . . c30448_6cxq 1 . 9 . 1114 . 1 1 6 HIS H H -3.291 0.683 -3.464 . . . 1.0 . . . . . . . . . . . . A . 6 HIS H . . . . . . . . . c30448_6cxq 1 . 9 . 1115 . 1 1 6 HIS HA H -4.711 2.370 -5.128 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HA . . . . . . . . . c30448_6cxq 1 . 9 . 1116 . 1 1 6 HIS HB2 H -4.345 0.723 -6.894 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HB2 . . . . . . . . . c30448_6cxq 1 . 9 . 1117 . 1 1 6 HIS HB3 H -2.898 0.880 -5.888 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HB3 . . . . . . . . . c30448_6cxq 1 . 9 . 1118 . 1 1 6 HIS HD1 H -4.786 -1.622 -7.483 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HD1 . . . . . . . . . c30448_6cxq 1 . 9 . 1119 . 1 1 6 HIS HD2 H -3.070 -1.292 -3.713 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HD2 . . . . . . . . . c30448_6cxq 1 . 9 . 1120 . 1 1 6 HIS HE1 H -4.572 -3.979 -6.633 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HE1 . . . . . . . . . c30448_6cxq 1 . 9 . 1121 . 1 1 6 HIS HE2 H -3.608 -3.749 -4.317 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HE2 . . . . . . . . . c30448_6cxq 1 . 9 . 1122 . 1 1 6 HIS N N -4.135 1.172 -3.551 . . . 1.0 . . . . . . . . . . . . A . 6 HIS N . . . . . . . . . c30448_6cxq 1 . 9 . 1123 . 1 1 6 HIS ND1 N -4.408 -1.845 -6.607 . . . 1.0 . . . . . . . . . . . . A . 6 HIS ND1 . . . . . . . . . c30448_6cxq 1 . 9 . 1124 . 1 1 6 HIS NE2 N -3.737 -2.993 -4.928 . . . 1.0 . . . . . . . . . . . . A . 6 HIS NE2 . . . . . . . . . c30448_6cxq 1 . 9 . 1125 . 1 1 6 HIS O O -6.412 -0.358 -4.628 . . . 1.0 . . . . . . . . . . . . A . 6 HIS O . . . . . . . . . c30448_6cxq 1 . 10 . 1126 . 1 1 1 HIS C C 4.877 -1.655 3.676 . . . 1.0 . . . . . . . . . . . . A . 1 HIS C . . . . . . . . . c30448_6cxq 1 . 10 . 1127 . 1 1 1 HIS CA C 6.383 -1.784 3.547 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CA . . . . . . . . . c30448_6cxq 1 . 10 . 1128 . 1 1 1 HIS CB C 6.753 -2.829 2.491 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CB . . . . . . . . . c30448_6cxq 1 . 10 . 1129 . 1 1 1 HIS CD2 C 8.803 -4.418 2.555 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CD2 . . . . . . . . . c30448_6cxq 1 . 10 . 1130 . 1 1 1 HIS CE1 C 10.385 -2.902 2.482 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CE1 . . . . . . . . . c30448_6cxq 1 . 10 . 1131 . 1 1 1 HIS CG C 8.202 -3.205 2.503 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CG . . . . . . . . . c30448_6cxq 1 . 10 . 1132 . 1 1 1 HIS H1 H 6.719 -3.152 5.047 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H1 . . . . . . . . . c30448_6cxq 1 . 10 . 1133 . 1 1 1 HIS H2 H 6.647 -1.519 5.570 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H2 . . . . . . . . . c30448_6cxq 1 . 10 . 1134 . 1 1 1 HIS H3 H 8.033 -2.095 4.737 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H3 . . . . . . . . . c30448_6cxq 1 . 10 . 1135 . 1 1 1 HIS HA H 6.775 -0.820 3.253 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HA . . . . . . . . . c30448_6cxq 1 . 10 . 1136 . 1 1 1 HIS HB2 H 6.176 -3.725 2.664 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HB2 . . . . . . . . . c30448_6cxq 1 . 10 . 1137 . 1 1 1 HIS HB3 H 6.518 -2.440 1.512 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HB3 . . . . . . . . . c30448_6cxq 1 . 10 . 1138 . 1 1 1 HIS HD1 H 9.108 -1.304 2.416 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HD1 . . . . . . . . . c30448_6cxq 1 . 10 . 1139 . 1 1 1 HIS HD2 H 8.307 -5.377 2.599 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HD2 . . . . . . . . . c30448_6cxq 1 . 10 . 1140 . 1 1 1 HIS HE1 H 11.356 -2.430 2.458 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HE1 . . . . . . . . . c30448_6cxq 1 . 10 . 1141 . 1 1 1 HIS HE2 H 10.846 -4.889 2.666 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HE2 . . . . . . . . . c30448_6cxq 1 . 10 . 1142 . 1 1 1 HIS N N 7.001 -2.173 4.842 . . . 1.0 . . . . . . . . . . . . A . 1 HIS N . . . . . . . . . c30448_6cxq 1 . 10 . 1143 . 1 1 1 HIS ND1 N 9.221 -2.277 2.459 . . . 1.0 . . . . . . . . . . . . A . 1 HIS ND1 . . . . . . . . . c30448_6cxq 1 . 10 . 1144 . 1 1 1 HIS NE2 N 10.159 -4.201 2.541 . . . 1.0 . . . . . . . . . . . . A . 1 HIS NE2 . . . . . . . . . c30448_6cxq 1 . 10 . 1145 . 1 1 1 HIS O O 4.355 -1.462 4.775 . . . 1.0 . . . . . . . . . . . . A . 1 HIS O . . . . . . . . . c30448_6cxq 1 . 10 . 1146 . 1 1 2 ARG C C 2.064 -2.312 1.430 . . . 1.0 . . . . . . . . . . . . A . 2 ARG C . . . . . . . . . c30448_6cxq 1 . 10 . 1147 . 1 1 2 ARG CA C 2.735 -1.562 2.565 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CA . . . . . . . . . c30448_6cxq 1 . 10 . 1148 . 1 1 2 ARG CB C 2.374 -0.077 2.479 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CB . . . . . . . . . c30448_6cxq 1 . 10 . 1149 . 1 1 2 ARG CD C 3.483 2.025 1.665 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CD . . . . . . . . . c30448_6cxq 1 . 10 . 1150 . 1 1 2 ARG CG C 3.606 0.787 2.539 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CG . . . . . . . . . c30448_6cxq 1 . 10 . 1151 . 1 1 2 ARG CZ C 4.550 2.895 -0.380 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CZ . . . . . . . . . c30448_6cxq 1 . 10 . 1152 . 1 1 2 ARG H H 4.642 -1.844 1.695 . . . 1.0 . . . . . . . . . . . . A . 2 ARG H . . . . . . . . . c30448_6cxq 1 . 10 . 1153 . 1 1 2 ARG HA H 2.396 -1.930 3.495 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HA . . . . . . . . . c30448_6cxq 1 . 10 . 1154 . 1 1 2 ARG HB2 H 1.849 0.119 1.542 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB2 . . . . . . . . . c30448_6cxq 1 . 10 . 1155 . 1 1 2 ARG HB3 H 1.733 0.181 3.309 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB3 . . . . . . . . . c30448_6cxq 1 . 10 . 1156 . 1 1 2 ARG HD2 H 2.438 2.202 1.459 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD2 . . . . . . . . . c30448_6cxq 1 . 10 . 1157 . 1 1 2 ARG HD3 H 3.892 2.869 2.199 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD3 . . . . . . . . . c30448_6cxq 1 . 10 . 1158 . 1 1 2 ARG HE H 4.422 0.964 0.112 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HE . . . . . . . . . c30448_6cxq 1 . 10 . 1159 . 1 1 2 ARG HG2 H 3.794 1.080 3.560 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG2 . . . . . . . . . c30448_6cxq 1 . 10 . 1160 . 1 1 2 ARG HG3 H 4.420 0.186 2.194 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG3 . . . . . . . . . c30448_6cxq 1 . 10 . 1161 . 1 1 2 ARG HH11 H 3.773 4.318 0.830 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH11 . . . . . . . . . c30448_6cxq 1 . 10 . 1162 . 1 1 2 ARG HH12 H 4.529 4.903 -0.614 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH12 . . . . . . . . . c30448_6cxq 1 . 10 . 1163 . 1 1 2 ARG HH21 H 5.417 1.733 -1.789 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH21 . . . . . . . . . c30448_6cxq 1 . 10 . 1164 . 1 1 2 ARG HH22 H 5.462 3.436 -2.100 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH22 . . . . . . . . . c30448_6cxq 1 . 10 . 1165 . 1 1 2 ARG N N 4.178 -1.720 2.549 . . . 1.0 . . . . . . . . . . . . A . 2 ARG N . . . . . . . . . c30448_6cxq 1 . 10 . 1166 . 1 1 2 ARG NE N 4.196 1.874 0.398 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NE . . . . . . . . . c30448_6cxq 1 . 10 . 1167 . 1 1 2 ARG NH1 N 4.260 4.140 -0.026 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH1 . . . . . . . . . c30448_6cxq 1 . 10 . 1168 . 1 1 2 ARG NH2 N 5.196 2.670 -1.516 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH2 . . . . . . . . . c30448_6cxq 1 . 10 . 1169 . 1 1 2 ARG O O 2.655 -2.513 0.369 . . . 1.0 . . . . . . . . . . . . A . 2 ARG O . . . . . . . . . c30448_6cxq 1 . 10 . 1170 . 1 1 3 PHE C C -0.654 -2.271 -0.244 . . . 1.0 . . . . . . . . . . . . A . 3 PHE C . . . . . . . . . c30448_6cxq 1 . 10 . 1171 . 1 1 3 PHE CA C 0.036 -3.336 0.598 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CA . . . . . . . . . c30448_6cxq 1 . 10 . 1172 . 1 1 3 PHE CB C -0.989 -4.295 1.205 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CB . . . . . . . . . c30448_6cxq 1 . 10 . 1173 . 1 1 3 PHE CD1 C -1.628 -6.708 1.263 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CD1 . . . . . . . . . c30448_6cxq 1 . 10 . 1174 . 1 1 3 PHE CD2 C -0.391 -5.939 -0.623 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CD2 . . . . . . . . . c30448_6cxq 1 . 10 . 1175 . 1 1 3 PHE CE1 C -1.655 -7.983 0.731 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CE1 . . . . . . . . . c30448_6cxq 1 . 10 . 1176 . 1 1 3 PHE CE2 C -0.414 -7.212 -1.161 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CE2 . . . . . . . . . c30448_6cxq 1 . 10 . 1177 . 1 1 3 PHE CG C -0.999 -5.674 0.598 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CG . . . . . . . . . c30448_6cxq 1 . 10 . 1178 . 1 1 3 PHE CZ C -1.047 -8.235 -0.483 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CZ . . . . . . . . . c30448_6cxq 1 . 10 . 1179 . 1 1 3 PHE H H 0.371 -2.445 2.485 . . . 1.0 . . . . . . . . . . . . A . 3 PHE H . . . . . . . . . c30448_6cxq 1 . 10 . 1180 . 1 1 3 PHE HA H 0.717 -3.879 -0.022 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HA . . . . . . . . . c30448_6cxq 1 . 10 . 1181 . 1 1 3 PHE HB2 H -0.782 -4.405 2.262 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HB2 . . . . . . . . . c30448_6cxq 1 . 10 . 1182 . 1 1 3 PHE HB3 H -1.973 -3.875 1.077 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HB3 . . . . . . . . . c30448_6cxq 1 . 10 . 1183 . 1 1 3 PHE HD1 H -2.105 -6.507 2.210 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HD1 . . . . . . . . . c30448_6cxq 1 . 10 . 1184 . 1 1 3 PHE HD2 H 0.103 -5.141 -1.156 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HD2 . . . . . . . . . c30448_6cxq 1 . 10 . 1185 . 1 1 3 PHE HE1 H -2.152 -8.781 1.263 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HE1 . . . . . . . . . c30448_6cxq 1 . 10 . 1186 . 1 1 3 PHE HE2 H 0.063 -7.406 -2.110 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HE2 . . . . . . . . . c30448_6cxq 1 . 10 . 1187 . 1 1 3 PHE HZ H -1.066 -9.231 -0.901 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HZ . . . . . . . . . c30448_6cxq 1 . 10 . 1188 . 1 1 3 PHE N N 0.804 -2.672 1.635 . . . 1.0 . . . . . . . . . . . . A . 3 PHE N . . . . . . . . . c30448_6cxq 1 . 10 . 1189 . 1 1 3 PHE O O -1.728 -2.485 -0.805 . . . 1.0 . . . . . . . . . . . . A . 3 PHE O . . . . . . . . . c30448_6cxq 1 . 10 . 1190 . 1 1 4 LEU C C -1.957 0.335 -0.695 . . . 1.0 . . . . . . . . . . . . A . 4 LEU C . . . . . . . . . c30448_6cxq 1 . 10 . 1191 . 1 1 4 LEU CA C -0.496 0.042 -1.032 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CA . . . . . . . . . c30448_6cxq 1 . 10 . 1192 . 1 1 4 LEU CB C -0.331 -0.168 -2.538 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CB . . . . . . . . . c30448_6cxq 1 . 10 . 1193 . 1 1 4 LEU CD1 C 1.967 -0.943 -3.174 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CD1 . . . . . . . . . c30448_6cxq 1 . 10 . 1194 . 1 1 4 LEU CD2 C 0.861 0.881 -4.479 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CD2 . . . . . . . . . c30448_6cxq 1 . 10 . 1195 . 1 1 4 LEU CG C 1.027 0.250 -3.105 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CG . . . . . . . . . c30448_6cxq 1 . 10 . 1196 . 1 1 4 LEU H H 0.836 -1.023 0.181 . . . 1.0 . . . . . . . . . . . . A . 4 LEU H . . . . . . . . . c30448_6cxq 1 . 10 . 1197 . 1 1 4 LEU HA H 0.109 0.887 -0.724 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HA . . . . . . . . . c30448_6cxq 1 . 10 . 1198 . 1 1 4 LEU HB2 H -0.480 -1.217 -2.752 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HB2 . . . . . . . . . c30448_6cxq 1 . 10 . 1199 . 1 1 4 LEU HB3 H -1.098 0.398 -3.046 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HB3 . . . . . . . . . c30448_6cxq 1 . 10 . 1200 . 1 1 4 LEU HD11 H 1.510 -1.727 -3.760 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD11 . . . . . . . . . c30448_6cxq 1 . 10 . 1201 . 1 1 4 LEU HD12 H 2.161 -1.307 -2.176 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD12 . . . . . . . . . c30448_6cxq 1 . 10 . 1202 . 1 1 4 LEU HD13 H 2.896 -0.643 -3.636 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD13 . . . . . . . . . c30448_6cxq 1 . 10 . 1203 . 1 1 4 LEU HD21 H 1.754 1.433 -4.732 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD21 . . . . . . . . . c30448_6cxq 1 . 10 . 1204 . 1 1 4 LEU HD22 H 0.014 1.551 -4.468 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD22 . . . . . . . . . c30448_6cxq 1 . 10 . 1205 . 1 1 4 LEU HD23 H 0.697 0.106 -5.213 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD23 . . . . . . . . . c30448_6cxq 1 . 10 . 1206 . 1 1 4 LEU HG H 1.471 0.986 -2.450 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HG . . . . . . . . . c30448_6cxq 1 . 10 . 1207 . 1 1 4 LEU N N -0.006 -1.109 -0.299 . . . 1.0 . . . . . . . . . . . . A . 4 LEU N . . . . . . . . . c30448_6cxq 1 . 10 . 1208 . 1 1 4 LEU O O -2.559 -0.341 0.140 . . . 1.0 . . . . . . . . . . . . A . 4 LEU O . . . . . . . . . c30448_6cxq 1 . 10 . 1209 . 1 1 5 ARG C C -4.745 1.589 -2.384 . . . 1.0 . . . . . . . . . . . . A . 5 ARG C . . . . . . . . . c30448_6cxq 1 . 10 . 1210 . 1 1 5 ARG CA C -3.908 1.729 -1.114 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CA . . . . . . . . . c30448_6cxq 1 . 10 . 1211 . 1 1 5 ARG CB C -3.981 3.167 -0.608 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CB . . . . . . . . . c30448_6cxq 1 . 10 . 1212 . 1 1 5 ARG CD C -1.844 4.295 -1.087 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CD . . . . . . . . . c30448_6cxq 1 . 10 . 1213 . 1 1 5 ARG CG C -3.272 4.147 -1.509 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CG . . . . . . . . . c30448_6cxq 1 . 10 . 1214 . 1 1 5 ARG CZ C 0.160 5.433 -1.961 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CZ . . . . . . . . . c30448_6cxq 1 . 10 . 1215 . 1 1 5 ARG H H -1.988 1.850 -2.000 . . . 1.0 . . . . . . . . . . . . A . 5 ARG H . . . . . . . . . c30448_6cxq 1 . 10 . 1216 . 1 1 5 ARG HA H -4.303 1.077 -0.357 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HA . . . . . . . . . c30448_6cxq 1 . 10 . 1217 . 1 1 5 ARG HB2 H -5.015 3.470 -0.535 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HB2 . . . . . . . . . c30448_6cxq 1 . 10 . 1218 . 1 1 5 ARG HB3 H -3.519 3.215 0.375 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HB3 . . . . . . . . . c30448_6cxq 1 . 10 . 1219 . 1 1 5 ARG HD2 H -1.825 4.968 -0.259 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HD2 . . . . . . . . . c30448_6cxq 1 . 10 . 1220 . 1 1 5 ARG HD3 H -1.475 3.327 -0.777 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HD3 . . . . . . . . . c30448_6cxq 1 . 10 . 1221 . 1 1 5 ARG HE H -1.319 4.696 -3.082 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HE . . . . . . . . . c30448_6cxq 1 . 10 . 1222 . 1 1 5 ARG HG2 H -3.298 3.787 -2.517 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HG2 . . . . . . . . . c30448_6cxq 1 . 10 . 1223 . 1 1 5 ARG HG3 H -3.762 5.107 -1.447 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HG3 . . . . . . . . . c30448_6cxq 1 . 10 . 1224 . 1 1 5 ARG HH11 H 0.100 5.277 0.055 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH11 . . . . . . . . . c30448_6cxq 1 . 10 . 1225 . 1 1 5 ARG HH12 H 1.496 6.075 -0.586 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH12 . . . . . . . . . c30448_6cxq 1 . 10 . 1226 . 1 1 5 ARG HH21 H 0.519 5.746 -3.925 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH21 . . . . . . . . . c30448_6cxq 1 . 10 . 1227 . 1 1 5 ARG HH22 H 1.734 6.342 -2.844 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH22 . . . . . . . . . c30448_6cxq 1 . 10 . 1228 . 1 1 5 ARG N N -2.519 1.347 -1.347 . . . 1.0 . . . . . . . . . . . . A . 5 ARG N . . . . . . . . . c30448_6cxq 1 . 10 . 1229 . 1 1 5 ARG NE N -1.002 4.815 -2.161 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NE . . . . . . . . . c30448_6cxq 1 . 10 . 1230 . 1 1 5 ARG NH1 N 0.623 5.609 -0.729 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NH1 . . . . . . . . . c30448_6cxq 1 . 10 . 1231 . 1 1 5 ARG NH2 N 0.862 5.877 -2.995 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NH2 . . . . . . . . . c30448_6cxq 1 . 10 . 1232 . 1 1 5 ARG O O -5.945 1.864 -2.377 . . . 1.0 . . . . . . . . . . . . A . 5 ARG O . . . . . . . . . c30448_6cxq 1 . 10 . 1233 . 1 1 6 HIS C C -6.108 0.240 -4.579 . . . 1.0 . . . . . . . . . . . . A . 6 HIS C . . . . . . . . . c30448_6cxq 1 . 10 . 1234 . 1 1 6 HIS CA C -4.795 1.000 -4.752 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CA . . . . . . . . . c30448_6cxq 1 . 10 . 1235 . 1 1 6 HIS CB C -3.896 0.263 -5.745 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CB . . . . . . . . . c30448_6cxq 1 . 10 . 1236 . 1 1 6 HIS CD2 C -2.902 -2.123 -5.975 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CD2 . . . . . . . . . c30448_6cxq 1 . 10 . 1237 . 1 1 6 HIS CE1 C -3.489 -2.905 -4.012 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CE1 . . . . . . . . . c30448_6cxq 1 . 10 . 1238 . 1 1 6 HIS CG C -3.562 -1.135 -5.324 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CG . . . . . . . . . c30448_6cxq 1 . 10 . 1239 . 1 1 6 HIS H H -3.150 0.968 -3.424 . . . 1.0 . . . . . . . . . . . . A . 6 HIS H . . . . . . . . . c30448_6cxq 1 . 10 . 1240 . 1 1 6 HIS HA H -5.011 1.985 -5.140 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HA . . . . . . . . . c30448_6cxq 1 . 10 . 1241 . 1 1 6 HIS HB2 H -4.397 0.209 -6.704 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HB2 . . . . . . . . . c30448_6cxq 1 . 10 . 1242 . 1 1 6 HIS HB3 H -2.966 0.810 -5.854 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HB3 . . . . . . . . . c30448_6cxq 1 . 10 . 1243 . 1 1 6 HIS HD1 H -4.407 -1.184 -3.394 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HD1 . . . . . . . . . c30448_6cxq 1 . 10 . 1244 . 1 1 6 HIS HD2 H -2.480 -2.065 -6.968 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HD2 . . . . . . . . . c30448_6cxq 1 . 10 . 1245 . 1 1 6 HIS HE1 H -3.623 -3.562 -3.166 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HE1 . . . . . . . . . c30448_6cxq 1 . 10 . 1246 . 1 1 6 HIS HE2 H -2.387 -4.046 -5.307 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HE2 . . . . . . . . . c30448_6cxq 1 . 10 . 1247 . 1 1 6 HIS N N -4.107 1.167 -3.476 . . . 1.0 . . . . . . . . . . . . A . 6 HIS N . . . . . . . . . c30448_6cxq 1 . 10 . 1248 . 1 1 6 HIS ND1 N -3.916 -1.657 -4.098 . . . 1.0 . . . . . . . . . . . . A . 6 HIS ND1 . . . . . . . . . c30448_6cxq 1 . 10 . 1249 . 1 1 6 HIS NE2 N -2.872 -3.211 -5.138 . . . 1.0 . . . . . . . . . . . . A . 6 HIS NE2 . . . . . . . . . c30448_6cxq 1 . 10 . 1250 . 1 1 6 HIS O O -6.296 -0.379 -3.511 . . . 1.0 . . . . . . . . . . . . A . 6 HIS O . . . . . . . . . c30448_6cxq 1 . 11 . 1251 . 1 1 1 HIS C C 4.880 -1.626 3.693 . . . 1.0 . . . . . . . . . . . . A . 1 HIS C . . . . . . . . . c30448_6cxq 1 . 11 . 1252 . 1 1 1 HIS CA C 6.388 -1.721 3.558 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CA . . . . . . . . . c30448_6cxq 1 . 11 . 1253 . 1 1 1 HIS CB C 6.775 -2.734 2.478 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CB . . . . . . . . . c30448_6cxq 1 . 11 . 1254 . 1 1 1 HIS CD2 C 6.537 -2.305 -0.070 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CD2 . . . . . . . . . c30448_6cxq 1 . 11 . 1255 . 1 1 1 HIS CE1 C 8.109 -0.793 -0.288 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CE1 . . . . . . . . . c30448_6cxq 1 . 11 . 1256 . 1 1 1 HIS CG C 7.085 -2.109 1.153 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CG . . . . . . . . . c30448_6cxq 1 . 11 . 1257 . 1 1 1 HIS H1 H 6.886 -3.151 4.950 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H1 . . . . . . . . . c30448_6cxq 1 . 11 . 1258 . 1 1 1 HIS H2 H 6.550 -1.601 5.605 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H2 . . . . . . . . . c30448_6cxq 1 . 11 . 1259 . 1 1 1 HIS H3 H 8.031 -1.886 4.786 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H3 . . . . . . . . . c30448_6cxq 1 . 11 . 1260 . 1 1 1 HIS HA H 6.758 -0.743 3.283 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HA . . . . . . . . . c30448_6cxq 1 . 11 . 1261 . 1 1 1 HIS HB2 H 7.650 -3.277 2.801 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HB2 . . . . . . . . . c30448_6cxq 1 . 11 . 1262 . 1 1 1 HIS HB3 H 5.958 -3.427 2.336 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HB3 . . . . . . . . . c30448_6cxq 1 . 11 . 1263 . 1 1 1 HIS HD1 H 8.646 -0.798 1.686 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HD1 . . . . . . . . . c30448_6cxq 1 . 11 . 1264 . 1 1 1 HIS HD2 H 5.733 -2.988 -0.310 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HD2 . . . . . . . . . c30448_6cxq 1 . 11 . 1265 . 1 1 1 HIS HE1 H 8.781 -0.063 -0.715 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HE1 . . . . . . . . . c30448_6cxq 1 . 11 . 1266 . 1 1 1 HIS HE2 H 6.951 -1.338 -1.887 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HE2 . . . . . . . . . c30448_6cxq 1 . 11 . 1267 . 1 1 1 HIS N N 7.021 -2.126 4.840 . . . 1.0 . . . . . . . . . . . . A . 1 HIS N . . . . . . . . . c30448_6cxq 1 . 11 . 1268 . 1 1 1 HIS ND1 N 8.067 -1.156 0.982 . . . 1.0 . . . . . . . . . . . . A . 1 HIS ND1 . . . . . . . . . c30448_6cxq 1 . 11 . 1269 . 1 1 1 HIS NE2 N 7.191 -1.476 -0.947 . . . 1.0 . . . . . . . . . . . . A . 1 HIS NE2 . . . . . . . . . c30448_6cxq 1 . 11 . 1270 . 1 1 1 HIS O O 4.357 -1.462 4.796 . . . 1.0 . . . . . . . . . . . . A . 1 HIS O . . . . . . . . . c30448_6cxq 1 . 11 . 1271 . 1 1 2 ARG C C 2.074 -2.332 1.460 . . . 1.0 . . . . . . . . . . . . A . 2 ARG C . . . . . . . . . c30448_6cxq 1 . 11 . 1272 . 1 1 2 ARG CA C 2.734 -1.561 2.588 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CA . . . . . . . . . c30448_6cxq 1 . 11 . 1273 . 1 1 2 ARG CB C 2.340 -0.086 2.496 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CB . . . . . . . . . c30448_6cxq 1 . 11 . 1274 . 1 1 2 ARG CD C 3.405 2.084 1.807 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CD . . . . . . . . . c30448_6cxq 1 . 11 . 1275 . 1 1 2 ARG CG C 3.548 0.807 2.619 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CG . . . . . . . . . c30448_6cxq 1 . 11 . 1276 . 1 1 2 ARG CZ C 1.824 3.526 3.032 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CZ . . . . . . . . . c30448_6cxq 1 . 11 . 1277 . 1 1 2 ARG H H 4.644 -1.788 1.709 . . . 1.0 . . . . . . . . . . . . A . 2 ARG H . . . . . . . . . c30448_6cxq 1 . 11 . 1278 . 1 1 2 ARG HA H 2.407 -1.932 3.522 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HA . . . . . . . . . c30448_6cxq 1 . 11 . 1279 . 1 1 2 ARG HB2 H 1.854 0.105 1.536 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB2 . . . . . . . . . c30448_6cxq 1 . 11 . 1280 . 1 1 2 ARG HB3 H 1.655 0.150 3.297 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB3 . . . . . . . . . c30448_6cxq 1 . 11 . 1281 . 1 1 2 ARG HD2 H 4.341 2.283 1.307 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD2 . . . . . . . . . c30448_6cxq 1 . 11 . 1282 . 1 1 2 ARG HD3 H 2.628 1.943 1.070 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD3 . . . . . . . . . c30448_6cxq 1 . 11 . 1283 . 1 1 2 ARG HE H 3.796 3.816 2.932 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HE . . . . . . . . . c30448_6cxq 1 . 11 . 1284 . 1 1 2 ARG HG2 H 3.713 1.052 3.657 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG2 . . . . . . . . . c30448_6cxq 1 . 11 . 1285 . 1 1 2 ARG HG3 H 4.383 0.246 2.258 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG3 . . . . . . . . . c30448_6cxq 1 . 11 . 1286 . 1 1 2 ARG HH11 H 0.963 1.951 2.099 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH11 . . . . . . . . . c30448_6cxq 1 . 11 . 1287 . 1 1 2 ARG HH12 H -0.123 2.985 2.963 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH12 . . . . . . . . . c30448_6cxq 1 . 11 . 1288 . 1 1 2 ARG HH21 H 2.366 5.175 4.067 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH21 . . . . . . . . . c30448_6cxq 1 . 11 . 1289 . 1 1 2 ARG HH22 H 0.672 4.814 4.080 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH22 . . . . . . . . . c30448_6cxq 1 . 11 . 1290 . 1 1 2 ARG N N 4.179 -1.688 2.566 . . . 1.0 . . . . . . . . . . . . A . 2 ARG N . . . . . . . . . c30448_6cxq 1 . 11 . 1291 . 1 1 2 ARG NE N 3.063 3.232 2.644 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NE . . . . . . . . . c30448_6cxq 1 . 11 . 1292 . 1 1 2 ARG NH1 N 0.804 2.757 2.668 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH1 . . . . . . . . . c30448_6cxq 1 . 11 . 1293 . 1 1 2 ARG NH2 N 1.602 4.592 3.789 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH2 . . . . . . . . . c30448_6cxq 1 . 11 . 1294 . 1 1 2 ARG O O 2.673 -2.546 0.407 . . . 1.0 . . . . . . . . . . . . A . 2 ARG O . . . . . . . . . c30448_6cxq 1 . 11 . 1295 . 1 1 3 PHE C C -0.636 -2.331 -0.230 . . . 1.0 . . . . . . . . . . . . A . 3 PHE C . . . . . . . . . c30448_6cxq 1 . 11 . 1296 . 1 1 3 PHE CA C 0.056 -3.379 0.632 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CA . . . . . . . . . c30448_6cxq 1 . 11 . 1297 . 1 1 3 PHE CB C -0.966 -4.334 1.250 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CB . . . . . . . . . c30448_6cxq 1 . 11 . 1298 . 1 1 3 PHE CD1 C -1.583 -6.750 1.355 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CD1 . . . . . . . . . c30448_6cxq 1 . 11 . 1299 . 1 1 3 PHE CD2 C -0.348 -6.008 -0.543 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CD2 . . . . . . . . . c30448_6cxq 1 . 11 . 1300 . 1 1 3 PHE CE1 C -1.597 -8.036 0.849 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CE1 . . . . . . . . . c30448_6cxq 1 . 11 . 1301 . 1 1 3 PHE CE2 C -0.358 -7.292 -1.055 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CE2 . . . . . . . . . c30448_6cxq 1 . 11 . 1302 . 1 1 3 PHE CG C -0.962 -5.724 0.671 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CG . . . . . . . . . c30448_6cxq 1 . 11 . 1303 . 1 1 3 PHE CZ C -0.983 -8.307 -0.358 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CZ . . . . . . . . . c30448_6cxq 1 . 11 . 1304 . 1 1 3 PHE H H 0.376 -2.457 2.507 . . . 1.0 . . . . . . . . . . . . A . 3 PHE H . . . . . . . . . c30448_6cxq 1 . 11 . 1305 . 1 1 3 PHE HA H 0.744 -3.929 0.025 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HA . . . . . . . . . c30448_6cxq 1 . 11 . 1306 . 1 1 3 PHE HB2 H -0.767 -4.422 2.311 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HB2 . . . . . . . . . c30448_6cxq 1 . 11 . 1307 . 1 1 3 PHE HB3 H -1.953 -3.925 1.106 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HB3 . . . . . . . . . c30448_6cxq 1 . 11 . 1308 . 1 1 3 PHE HD1 H -2.065 -6.535 2.296 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HD1 . . . . . . . . . c30448_6cxq 1 . 11 . 1309 . 1 1 3 PHE HD2 H 0.139 -5.217 -1.091 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HD2 . . . . . . . . . c30448_6cxq 1 . 11 . 1310 . 1 1 3 PHE HE1 H -2.087 -8.828 1.396 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HE1 . . . . . . . . . c30448_6cxq 1 . 11 . 1311 . 1 1 3 PHE HE2 H 0.123 -7.501 -1.999 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HE2 . . . . . . . . . c30448_6cxq 1 . 11 . 1312 . 1 1 3 PHE HZ H -0.992 -9.311 -0.756 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HZ . . . . . . . . . c30448_6cxq 1 . 11 . 1313 . 1 1 3 PHE N N 0.815 -2.694 1.663 . . . 1.0 . . . . . . . . . . . . A . 3 PHE N . . . . . . . . . c30448_6cxq 1 . 11 . 1314 . 1 1 3 PHE O O -1.703 -2.562 -0.797 . . . 1.0 . . . . . . . . . . . . A . 3 PHE O . . . . . . . . . c30448_6cxq 1 . 11 . 1315 . 1 1 4 LEU C C -1.949 0.270 -0.717 . . . 1.0 . . . . . . . . . . . . A . 4 LEU C . . . . . . . . . c30448_6cxq 1 . 11 . 1316 . 1 1 4 LEU CA C -0.489 -0.027 -1.050 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CA . . . . . . . . . c30448_6cxq 1 . 11 . 1317 . 1 1 4 LEU CB C -0.325 -0.263 -2.552 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CB . . . . . . . . . c30448_6cxq 1 . 11 . 1318 . 1 1 4 LEU CD1 C 1.734 -1.603 -3.049 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CD1 . . . . . . . . . c30448_6cxq 1 . 11 . 1319 . 1 1 4 LEU CD2 C 1.166 0.380 -4.462 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CD2 . . . . . . . . . c30448_6cxq 1 . 11 . 1320 . 1 1 4 LEU CG C 1.116 -0.214 -3.062 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CG . . . . . . . . . c30448_6cxq 1 . 11 . 1321 . 1 1 4 LEU H H 0.842 -1.067 0.189 . . . 1.0 . . . . . . . . . . . . A . 4 LEU H . . . . . . . . . c30448_6cxq 1 . 11 . 1322 . 1 1 4 LEU HA H 0.116 0.822 -0.757 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HA . . . . . . . . . c30448_6cxq 1 . 11 . 1323 . 1 1 4 LEU HB2 H -0.737 -1.234 -2.789 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HB2 . . . . . . . . . c30448_6cxq 1 . 11 . 1324 . 1 1 4 LEU HB3 H -0.895 0.489 -3.077 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HB3 . . . . . . . . . c30448_6cxq 1 . 11 . 1325 . 1 1 4 LEU HD11 H 2.811 -1.518 -3.030 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD11 . . . . . . . . . c30448_6cxq 1 . 11 . 1326 . 1 1 4 LEU HD12 H 1.431 -2.140 -3.935 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD12 . . . . . . . . . c30448_6cxq 1 . 11 . 1327 . 1 1 4 LEU HD13 H 1.400 -2.138 -2.172 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD13 . . . . . . . . . c30448_6cxq 1 . 11 . 1328 . 1 1 4 LEU HD21 H 1.959 -0.089 -5.024 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD21 . . . . . . . . . c30448_6cxq 1 . 11 . 1329 . 1 1 4 LEU HD22 H 1.352 1.442 -4.396 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD22 . . . . . . . . . c30448_6cxq 1 . 11 . 1330 . 1 1 4 LEU HD23 H 0.223 0.210 -4.959 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD23 . . . . . . . . . c30448_6cxq 1 . 11 . 1331 . 1 1 4 LEU HG H 1.700 0.417 -2.409 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HG . . . . . . . . . c30448_6cxq 1 . 11 . 1332 . 1 1 4 LEU N N 0.003 -1.165 -0.297 . . . 1.0 . . . . . . . . . . . . A . 4 LEU N . . . . . . . . . c30448_6cxq 1 . 11 . 1333 . 1 1 4 LEU O O -2.560 -0.412 0.107 . . . 1.0 . . . . . . . . . . . . A . 4 LEU O . . . . . . . . . c30448_6cxq 1 . 11 . 1334 . 1 1 5 ARG C C -4.674 1.710 -2.441 . . . 1.0 . . . . . . . . . . . . A . 5 ARG C . . . . . . . . . c30448_6cxq 1 . 11 . 1335 . 1 1 5 ARG CA C -3.889 1.682 -1.133 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CA . . . . . . . . . c30448_6cxq 1 . 11 . 1336 . 1 1 5 ARG CB C -3.949 3.055 -0.470 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CB . . . . . . . . . c30448_6cxq 1 . 11 . 1337 . 1 1 5 ARG CD C -1.811 4.203 -0.868 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CD . . . . . . . . . c30448_6cxq 1 . 11 . 1338 . 1 1 5 ARG CG C -3.250 4.125 -1.267 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CG . . . . . . . . . c30448_6cxq 1 . 11 . 1339 . 1 1 5 ARG CZ C 0.198 5.377 -1.681 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CZ . . . . . . . . . c30448_6cxq 1 . 11 . 1340 . 1 1 5 ARG H H -1.963 1.799 -2.005 . . . 1.0 . . . . . . . . . . . . A . 5 ARG H . . . . . . . . . c30448_6cxq 1 . 11 . 1341 . 1 1 5 ARG HA H -4.327 0.958 -0.472 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HA . . . . . . . . . c30448_6cxq 1 . 11 . 1342 . 1 1 5 ARG HB2 H -4.980 3.350 -0.348 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HB2 . . . . . . . . . c30448_6cxq 1 . 11 . 1343 . 1 1 5 ARG HB3 H -3.471 2.992 0.505 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HB3 . . . . . . . . . c30448_6cxq 1 . 11 . 1344 . 1 1 5 ARG HD2 H -1.759 4.798 0.016 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HD2 . . . . . . . . . c30448_6cxq 1 . 11 . 1345 . 1 1 5 ARG HD3 H -1.461 3.202 -0.653 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HD3 . . . . . . . . . c30448_6cxq 1 . 11 . 1346 . 1 1 5 ARG HE H -1.311 4.755 -2.832 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HE . . . . . . . . . c30448_6cxq 1 . 11 . 1347 . 1 1 5 ARG HG2 H -3.307 3.889 -2.310 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HG2 . . . . . . . . . c30448_6cxq 1 . 11 . 1348 . 1 1 5 ARG HG3 H -3.722 5.078 -1.078 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HG3 . . . . . . . . . c30448_6cxq 1 . 11 . 1349 . 1 1 5 ARG HH11 H 0.170 5.057 0.316 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH11 . . . . . . . . . c30448_6cxq 1 . 11 . 1350 . 1 1 5 ARG HH12 H 1.568 5.884 -0.284 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH12 . . . . . . . . . c30448_6cxq 1 . 11 . 1351 . 1 1 5 ARG HH21 H 0.529 5.842 -3.620 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH21 . . . . . . . . . c30448_6cxq 1 . 11 . 1352 . 1 1 5 ARG HH22 H 1.772 6.330 -2.517 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH22 . . . . . . . . . c30448_6cxq 1 . 11 . 1353 . 1 1 5 ARG N N -2.501 1.293 -1.361 . . . 1.0 . . . . . . . . . . . . A . 5 ARG N . . . . . . . . . c30448_6cxq 1 . 11 . 1354 . 1 1 5 ARG NE N -0.977 4.794 -1.911 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NE . . . . . . . . . c30448_6cxq 1 . 11 . 1355 . 1 1 5 ARG NH1 N 0.685 5.445 -0.448 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NH1 . . . . . . . . . c30448_6cxq 1 . 11 . 1356 . 1 1 5 ARG NH2 N 0.889 5.892 -2.689 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NH2 . . . . . . . . . c30448_6cxq 1 . 11 . 1357 . 1 1 5 ARG O O -5.724 2.346 -2.531 . . . 1.0 . . . . . . . . . . . . A . 5 ARG O . . . . . . . . . c30448_6cxq 1 . 11 . 1358 . 1 1 6 HIS C C -6.267 0.549 -4.633 . . . 1.0 . . . . . . . . . . . . A . 6 HIS C . . . . . . . . . c30448_6cxq 1 . 11 . 1359 . 1 1 6 HIS CA C -4.808 0.979 -4.762 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CA . . . . . . . . . c30448_6cxq 1 . 11 . 1360 . 1 1 6 HIS CB C -4.063 0.023 -5.694 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CB . . . . . . . . . c30448_6cxq 1 . 11 . 1361 . 1 1 6 HIS CD2 C -4.958 -2.397 -5.419 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CD2 . . . . . . . . . c30448_6cxq 1 . 11 . 1362 . 1 1 6 HIS CE1 C -3.340 -3.197 -4.176 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CE1 . . . . . . . . . c30448_6cxq 1 . 11 . 1363 . 1 1 6 HIS CG C -4.067 -1.397 -5.219 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CG . . . . . . . . . c30448_6cxq 1 . 11 . 1364 . 1 1 6 HIS H H -3.314 0.540 -3.329 . . . 1.0 . . . . . . . . . . . . A . 6 HIS H . . . . . . . . . c30448_6cxq 1 . 11 . 1365 . 1 1 6 HIS HA H -4.773 1.974 -5.180 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HA . . . . . . . . . c30448_6cxq 1 . 11 . 1366 . 1 1 6 HIS HB2 H -4.530 0.046 -6.671 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HB2 . . . . . . . . . c30448_6cxq 1 . 11 . 1367 . 1 1 6 HIS HB3 H -3.032 0.344 -5.779 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HB3 . . . . . . . . . c30448_6cxq 1 . 11 . 1368 . 1 1 6 HIS HD1 H -2.271 -1.453 -4.117 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HD1 . . . . . . . . . c30448_6cxq 1 . 11 . 1369 . 1 1 6 HIS HD2 H -5.873 -2.334 -5.991 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HD2 . . . . . . . . . c30448_6cxq 1 . 11 . 1370 . 1 1 6 HIS HE1 H -2.733 -3.867 -3.585 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HE1 . . . . . . . . . c30448_6cxq 1 . 11 . 1371 . 1 1 6 HIS HE2 H -4.963 -4.352 -4.653 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HE2 . . . . . . . . . c30448_6cxq 1 . 11 . 1372 . 1 1 6 HIS N N -4.156 1.024 -3.457 . . . 1.0 . . . . . . . . . . . . A . 6 HIS N . . . . . . . . . c30448_6cxq 1 . 11 . 1373 . 1 1 6 HIS ND1 N -3.065 -1.931 -4.435 . . . 1.0 . . . . . . . . . . . . A . 6 HIS ND1 . . . . . . . . . c30448_6cxq 1 . 11 . 1374 . 1 1 6 HIS NE2 N -4.483 -3.504 -4.760 . . . 1.0 . . . . . . . . . . . . A . 6 HIS NE2 . . . . . . . . . c30448_6cxq 1 . 11 . 1375 . 1 1 6 HIS O O -7.084 0.972 -5.478 . . . 1.0 . . . . . . . . . . . . A . 6 HIS O . . . . . . . . . c30448_6cxq 1 . 12 . 1376 . 1 1 1 HIS C C 4.783 -1.715 3.719 . . . 1.0 . . . . . . . . . . . . A . 1 HIS C . . . . . . . . . c30448_6cxq 1 . 12 . 1377 . 1 1 1 HIS CA C 6.294 -1.806 3.623 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CA . . . . . . . . . c30448_6cxq 1 . 12 . 1378 . 1 1 1 HIS CB C 6.712 -2.757 2.499 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CB . . . . . . . . . c30448_6cxq 1 . 12 . 1379 . 1 1 1 HIS CD2 C 6.620 -1.988 0.023 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CD2 . . . . . . . . . c30448_6cxq 1 . 12 . 1380 . 1 1 1 HIS CE1 C 8.462 -0.799 -0.011 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CE1 . . . . . . . . . c30448_6cxq 1 . 12 . 1381 . 1 1 1 HIS CG C 7.169 -2.052 1.260 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CG . . . . . . . . . c30448_6cxq 1 . 12 . 1382 . 1 1 1 HIS H1 H 7.873 -2.556 4.709 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H1 . . . . . . . . . c30448_6cxq 1 . 12 . 1383 . 1 1 1 HIS H2 H 6.328 -3.103 5.220 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H2 . . . . . . . . . c30448_6cxq 1 . 12 . 1384 . 1 1 1 HIS H3 H 6.839 -1.506 5.584 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H3 . . . . . . . . . c30448_6cxq 1 . 12 . 1385 . 1 1 1 HIS HA H 6.673 -0.815 3.417 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HA . . . . . . . . . c30448_6cxq 1 . 12 . 1386 . 1 1 1 HIS HB2 H 7.524 -3.378 2.845 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HB2 . . . . . . . . . c30448_6cxq 1 . 12 . 1387 . 1 1 1 HIS HB3 H 5.872 -3.384 2.236 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HB3 . . . . . . . . . c30448_6cxq 1 . 12 . 1388 . 1 1 1 HIS HD1 H 8.945 -1.148 1.947 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HD1 . . . . . . . . . c30448_6cxq 1 . 12 . 1389 . 1 1 1 HIS HD2 H 5.705 -2.465 -0.297 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HD2 . . . . . . . . . c30448_6cxq 1 . 12 . 1390 . 1 1 1 HIS HE1 H 9.272 -0.169 -0.346 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HE1 . . . . . . . . . c30448_6cxq 1 . 12 . 1391 . 1 1 1 HIS HE2 H 7.350 -1.058 -1.711 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HE2 . . . . . . . . . c30448_6cxq 1 . 12 . 1392 . 1 1 1 HIS N N 6.887 -2.286 4.899 . . . 1.0 . . . . . . . . . . . . A . 1 HIS N . . . . . . . . . c30448_6cxq 1 . 12 . 1393 . 1 1 1 HIS ND1 N 8.322 -1.297 1.205 . . . 1.0 . . . . . . . . . . . . A . 1 HIS ND1 . . . . . . . . . c30448_6cxq 1 . 12 . 1394 . 1 1 1 HIS NE2 N 7.444 -1.204 -0.747 . . . 1.0 . . . . . . . . . . . . A . 1 HIS NE2 . . . . . . . . . c30448_6cxq 1 . 12 . 1395 . 1 1 1 HIS O O 4.227 -1.621 4.814 . . . 1.0 . . . . . . . . . . . . A . 1 HIS O . . . . . . . . . c30448_6cxq 1 . 12 . 1396 . 1 1 2 ARG C C 2.046 -2.271 1.366 . . . 1.0 . . . . . . . . . . . . A . 2 ARG C . . . . . . . . . c30448_6cxq 1 . 12 . 1397 . 1 1 2 ARG CA C 2.673 -1.569 2.554 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CA . . . . . . . . . c30448_6cxq 1 . 12 . 1398 . 1 1 2 ARG CB C 2.288 -0.089 2.534 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CB . . . . . . . . . c30448_6cxq 1 . 12 . 1399 . 1 1 2 ARG CD C 3.385 2.111 2.009 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CD . . . . . . . . . c30448_6cxq 1 . 12 . 1400 . 1 1 2 ARG CG C 3.495 0.788 2.748 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CG . . . . . . . . . c30448_6cxq 1 . 12 . 1401 . 1 1 2 ARG CZ C 3.304 3.764 3.835 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CZ . . . . . . . . . c30448_6cxq 1 . 12 . 1402 . 1 1 2 ARG H H 4.609 -1.746 1.723 . . . 1.0 . . . . . . . . . . . . A . 2 ARG H . . . . . . . . . c30448_6cxq 1 . 12 . 1403 . 1 1 2 ARG HA H 2.317 -1.990 3.456 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HA . . . . . . . . . c30448_6cxq 1 . 12 . 1404 . 1 1 2 ARG HB2 H 1.836 0.159 1.570 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB2 . . . . . . . . . c30448_6cxq 1 . 12 . 1405 . 1 1 2 ARG HB3 H 1.578 0.105 3.323 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB3 . . . . . . . . . c30448_6cxq 1 . 12 . 1406 . 1 1 2 ARG HD2 H 4.378 2.452 1.757 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD2 . . . . . . . . . c30448_6cxq 1 . 12 . 1407 . 1 1 2 ARG HD3 H 2.817 1.957 1.103 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD3 . . . . . . . . . c30448_6cxq 1 . 12 . 1408 . 1 1 2 ARG HE H 1.799 3.364 2.586 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HE . . . . . . . . . c30448_6cxq 1 . 12 . 1409 . 1 1 2 ARG HG2 H 3.627 0.971 3.804 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG2 . . . . . . . . . c30448_6cxq 1 . 12 . 1410 . 1 1 2 ARG HG3 H 4.339 0.244 2.383 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG3 . . . . . . . . . c30448_6cxq 1 . 12 . 1411 . 1 1 2 ARG HH11 H 5.069 2.790 3.664 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH11 . . . . . . . . . c30448_6cxq 1 . 12 . 1412 . 1 1 2 ARG HH12 H 4.986 3.957 4.940 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH12 . . . . . . . . . c30448_6cxq 1 . 12 . 1413 . 1 1 2 ARG HH21 H 1.688 4.897 4.265 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH21 . . . . . . . . . c30448_6cxq 1 . 12 . 1414 . 1 1 2 ARG HH22 H 3.066 5.153 5.283 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH22 . . . . . . . . . c30448_6cxq 1 . 12 . 1415 . 1 1 2 ARG N N 4.118 -1.700 2.569 . . . 1.0 . . . . . . . . . . . . A . 2 ARG N . . . . . . . . . c30448_6cxq 1 . 12 . 1416 . 1 1 2 ARG NE N 2.724 3.134 2.815 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NE . . . . . . . . . c30448_6cxq 1 . 12 . 1417 . 1 1 2 ARG NH1 N 4.556 3.480 4.174 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH1 . . . . . . . . . c30448_6cxq 1 . 12 . 1418 . 1 1 2 ARG NH2 N 2.631 4.680 4.517 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH2 . . . . . . . . . c30448_6cxq 1 . 12 . 1419 . 1 1 2 ARG O O 2.667 -2.403 0.311 . . . 1.0 . . . . . . . . . . . . A . 2 ARG O . . . . . . . . . c30448_6cxq 1 . 12 . 1420 . 1 1 3 PHE C C -0.602 -2.192 -0.393 . . . 1.0 . . . . . . . . . . . . A . 3 PHE C . . . . . . . . . c30448_6cxq 1 . 12 . 1421 . 1 1 3 PHE CA C 0.061 -3.289 0.428 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CA . . . . . . . . . c30448_6cxq 1 . 12 . 1422 . 1 1 3 PHE CB C -0.980 -4.273 0.957 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CB . . . . . . . . . c30448_6cxq 1 . 12 . 1423 . 1 1 3 PHE CD1 C -1.720 -6.651 0.755 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CD1 . . . . . . . . . c30448_6cxq 1 . 12 . 1424 . 1 1 3 PHE CD2 C -0.475 -5.722 -1.052 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CD2 . . . . . . . . . c30448_6cxq 1 . 12 . 1425 . 1 1 3 PHE CE1 C -1.806 -7.855 0.081 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CE1 . . . . . . . . . c30448_6cxq 1 . 12 . 1426 . 1 1 3 PHE CE2 C -0.558 -6.923 -1.731 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CE2 . . . . . . . . . c30448_6cxq 1 . 12 . 1427 . 1 1 3 PHE CG C -1.056 -5.573 0.201 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CG . . . . . . . . . c30448_6cxq 1 . 12 . 1428 . 1 1 3 PHE CZ C -1.224 -7.991 -1.164 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CZ . . . . . . . . . c30448_6cxq 1 . 12 . 1429 . 1 1 3 PHE H H 0.331 -2.493 2.368 . . . 1.0 . . . . . . . . . . . . A . 3 PHE H . . . . . . . . . c30448_6cxq 1 . 12 . 1430 . 1 1 3 PHE HA H 0.766 -3.807 -0.188 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HA . . . . . . . . . c30448_6cxq 1 . 12 . 1431 . 1 1 3 PHE HB2 H -0.750 -4.507 1.990 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HB2 . . . . . . . . . c30448_6cxq 1 . 12 . 1432 . 1 1 3 PHE HB3 H -1.950 -3.808 0.905 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HB3 . . . . . . . . . c30448_6cxq 1 . 12 . 1433 . 1 1 3 PHE HD1 H -2.176 -6.542 1.726 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HD1 . . . . . . . . . c30448_6cxq 1 . 12 . 1434 . 1 1 3 PHE HD2 H 0.045 -4.888 -1.499 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HD2 . . . . . . . . . c30448_6cxq 1 . 12 . 1435 . 1 1 3 PHE HE1 H -2.329 -8.688 0.528 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HE1 . . . . . . . . . c30448_6cxq 1 . 12 . 1436 . 1 1 3 PHE HE2 H -0.101 -7.026 -2.705 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HE2 . . . . . . . . . c30448_6cxq 1 . 12 . 1437 . 1 1 3 PHE HZ H -1.290 -8.930 -1.692 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HZ . . . . . . . . . c30448_6cxq 1 . 12 . 1438 . 1 1 3 PHE N N 0.790 -2.666 1.519 . . . 1.0 . . . . . . . . . . . . A . 3 PHE N . . . . . . . . . c30448_6cxq 1 . 12 . 1439 . 1 1 3 PHE O O -1.661 -2.383 -0.992 . . . 1.0 . . . . . . . . . . . . A . 3 PHE O . . . . . . . . . c30448_6cxq 1 . 12 . 1440 . 1 1 4 LEU C C -1.872 0.459 -0.737 . . . 1.0 . . . . . . . . . . . . A . 4 LEU C . . . . . . . . . c30448_6cxq 1 . 12 . 1441 . 1 1 4 LEU CA C -0.421 0.148 -1.092 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CA . . . . . . . . . c30448_6cxq 1 . 12 . 1442 . 1 1 4 LEU CB C -0.270 -0.031 -2.604 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CB . . . . . . . . . c30448_6cxq 1 . 12 . 1443 . 1 1 4 LEU CD1 C 2.012 -0.781 -3.324 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CD1 . . . . . . . . . c30448_6cxq 1 . 12 . 1444 . 1 1 4 LEU CD2 C 0.888 1.109 -4.516 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CD2 . . . . . . . . . c30448_6cxq 1 . 12 . 1445 . 1 1 4 LEU CG C 1.079 0.411 -3.177 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CG . . . . . . . . . c30448_6cxq 1 . 12 . 1446 . 1 1 4 LEU H H 0.876 -0.962 0.118 . . . 1.0 . . . . . . . . . . . . A . 4 LEU H . . . . . . . . . c30448_6cxq 1 . 12 . 1447 . 1 1 4 LEU HA H 0.203 0.972 -0.767 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HA . . . . . . . . . c30448_6cxq 1 . 12 . 1448 . 1 1 4 LEU HB2 H -0.412 -1.076 -2.837 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HB2 . . . . . . . . . c30448_6cxq 1 . 12 . 1449 . 1 1 4 LEU HB3 H -1.047 0.538 -3.092 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HB3 . . . . . . . . . c30448_6cxq 1 . 12 . 1450 . 1 1 4 LEU HD11 H 3.035 -0.455 -3.200 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD11 . . . . . . . . . c30448_6cxq 1 . 12 . 1451 . 1 1 4 LEU HD12 H 1.890 -1.215 -4.305 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD12 . . . . . . . . . c30448_6cxq 1 . 12 . 1452 . 1 1 4 LEU HD13 H 1.776 -1.518 -2.571 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD13 . . . . . . . . . c30448_6cxq 1 . 12 . 1453 . 1 1 4 LEU HD21 H -0.019 0.753 -4.981 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD21 . . . . . . . . . c30448_6cxq 1 . 12 . 1454 . 1 1 4 LEU HD22 H 1.730 0.893 -5.157 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD22 . . . . . . . . . c30448_6cxq 1 . 12 . 1455 . 1 1 4 LEU HD23 H 0.819 2.175 -4.359 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD23 . . . . . . . . . c30448_6cxq 1 . 12 . 1456 . 1 1 4 LEU HG H 1.539 1.112 -2.495 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HG . . . . . . . . . c30448_6cxq 1 . 12 . 1457 . 1 1 4 LEU N N 0.048 -1.030 -0.388 . . . 1.0 . . . . . . . . . . . . A . 4 LEU N . . . . . . . . . c30448_6cxq 1 . 12 . 1458 . 1 1 4 LEU O O -2.475 -0.213 0.100 . . . 1.0 . . . . . . . . . . . . A . 4 LEU O . . . . . . . . . c30448_6cxq 1 . 12 . 1459 . 1 1 5 ARG C C -4.702 1.589 -2.328 . . . 1.0 . . . . . . . . . . . . A . 5 ARG C . . . . . . . . . c30448_6cxq 1 . 12 . 1460 . 1 1 5 ARG CA C -3.807 1.885 -1.125 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CA . . . . . . . . . c30448_6cxq 1 . 12 . 1461 . 1 1 5 ARG CB C -3.868 3.373 -0.793 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CB . . . . . . . . . c30448_6cxq 1 . 12 . 1462 . 1 1 5 ARG CD C -1.752 4.442 -1.457 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CD . . . . . . . . . c30448_6cxq 1 . 12 . 1463 . 1 1 5 ARG CG C -3.188 4.235 -1.825 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CG . . . . . . . . . c30448_6cxq 1 . 12 . 1464 . 1 1 5 ARG CZ C 0.252 5.381 -2.541 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CZ . . . . . . . . . c30448_6cxq 1 . 12 . 1465 . 1 1 5 ARG H H -1.896 1.982 -2.032 . . . 1.0 . . . . . . . . . . . . A . 5 ARG H . . . . . . . . . c30448_6cxq 1 . 12 . 1466 . 1 1 5 ARG HA H -4.160 1.327 -0.277 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HA . . . . . . . . . c30448_6cxq 1 . 12 . 1467 . 1 1 5 ARG HB2 H -4.900 3.685 -0.726 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HB2 . . . . . . . . . c30448_6cxq 1 . 12 . 1468 . 1 1 5 ARG HB3 H -3.376 3.537 0.163 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HB3 . . . . . . . . . c30448_6cxq 1 . 12 . 1469 . 1 1 5 ARG HD2 H -1.716 5.246 -0.757 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HD2 . . . . . . . . . c30448_6cxq 1 . 12 . 1470 . 1 1 5 ARG HD3 H -1.382 3.538 -0.992 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HD3 . . . . . . . . . c30448_6cxq 1 . 12 . 1471 . 1 1 5 ARG HE H -1.266 4.505 -3.501 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HE . . . . . . . . . c30448_6cxq 1 . 12 . 1472 . 1 1 5 ARG HG2 H -3.233 3.751 -2.780 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HG2 . . . . . . . . . c30448_6cxq 1 . 12 . 1473 . 1 1 5 ARG HG3 H -3.684 5.193 -1.873 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HG3 . . . . . . . . . c30448_6cxq 1 . 12 . 1474 . 1 1 5 ARG HH11 H 0.235 5.549 -0.526 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH11 . . . . . . . . . c30448_6cxq 1 . 12 . 1475 . 1 1 5 ARG HH12 H 1.631 6.204 -1.313 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH12 . . . . . . . . . c30448_6cxq 1 . 12 . 1476 . 1 1 5 ARG HH21 H 0.573 5.366 -4.537 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH21 . . . . . . . . . c30448_6cxq 1 . 12 . 1477 . 1 1 5 ARG HH22 H 1.823 6.100 -3.590 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH22 . . . . . . . . . c30448_6cxq 1 . 12 . 1478 . 1 1 5 ARG N N -2.427 1.483 -1.376 . . . 1.0 . . . . . . . . . . . . A . 5 ARG N . . . . . . . . . c30448_6cxq 1 . 12 . 1479 . 1 1 5 ARG NE N -0.925 4.764 -2.617 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NE . . . . . . . . . c30448_6cxq 1 . 12 . 1480 . 1 1 5 ARG NH1 N 0.746 5.741 -1.363 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NH1 . . . . . . . . . c30448_6cxq 1 . 12 . 1481 . 1 1 5 ARG NH2 N 0.939 5.637 -3.647 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NH2 . . . . . . . . . c30448_6cxq 1 . 12 . 1482 . 1 1 5 ARG O O -5.908 1.830 -2.287 . . . 1.0 . . . . . . . . . . . . A . 5 ARG O . . . . . . . . . c30448_6cxq 1 . 12 . 1483 . 1 1 6 HIS C C -6.134 -0.008 -4.300 . . . 1.0 . . . . . . . . . . . . A . 6 HIS C . . . . . . . . . c30448_6cxq 1 . 12 . 1484 . 1 1 6 HIS CA C -4.848 0.753 -4.618 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CA . . . . . . . . . c30448_6cxq 1 . 12 . 1485 . 1 1 6 HIS CB C -3.978 -0.074 -5.566 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CB . . . . . . . . . c30448_6cxq 1 . 12 . 1486 . 1 1 6 HIS CD2 C -3.248 -1.772 -3.746 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CD2 . . . . . . . . . c30448_6cxq 1 . 12 . 1487 . 1 1 6 HIS CE1 C -3.128 -3.562 -5.008 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CE1 . . . . . . . . . c30448_6cxq 1 . 12 . 1488 . 1 1 6 HIS CG C -3.583 -1.405 -5.006 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CG . . . . . . . . . c30448_6cxq 1 . 12 . 1489 . 1 1 6 HIS H H -3.140 0.907 -3.380 . . . 1.0 . . . . . . . . . . . . A . 6 HIS H . . . . . . . . . c30448_6cxq 1 . 12 . 1490 . 1 1 6 HIS HA H -5.104 1.684 -5.101 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HA . . . . . . . . . c30448_6cxq 1 . 12 . 1491 . 1 1 6 HIS HB2 H -4.525 -0.250 -6.485 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HB2 . . . . . . . . . c30448_6cxq 1 . 12 . 1492 . 1 1 6 HIS HB3 H -3.072 0.478 -5.786 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HB3 . . . . . . . . . c30448_6cxq 1 . 12 . 1493 . 1 1 6 HIS HD1 H -3.682 -2.610 -6.732 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HD1 . . . . . . . . . c30448_6cxq 1 . 12 . 1494 . 1 1 6 HIS HD2 H -3.208 -1.127 -2.880 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HD2 . . . . . . . . . c30448_6cxq 1 . 12 . 1495 . 1 1 6 HIS HE1 H -2.980 -4.580 -5.336 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HE1 . . . . . . . . . c30448_6cxq 1 . 12 . 1496 . 1 1 6 HIS HE2 H -2.610 -3.639 -3.028 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HE2 . . . . . . . . . c30448_6cxq 1 . 12 . 1497 . 1 1 6 HIS N N -4.105 1.072 -3.402 . . . 1.0 . . . . . . . . . . . . A . 6 HIS N . . . . . . . . . c30448_6cxq 1 . 12 . 1498 . 1 1 6 HIS ND1 N -3.498 -2.549 -5.772 . . . 1.0 . . . . . . . . . . . . A . 6 HIS ND1 . . . . . . . . . c30448_6cxq 1 . 12 . 1499 . 1 1 6 HIS NE2 N -2.970 -3.117 -3.775 . . . 1.0 . . . . . . . . . . . . A . 6 HIS NE2 . . . . . . . . . c30448_6cxq 1 . 12 . 1500 . 1 1 6 HIS O O -6.048 -1.057 -3.628 . . . 1.0 . . . . . . . . . . . . A . 6 HIS O . . . . . . . . . c30448_6cxq 1 . 13 . 1501 . 1 1 1 HIS C C 4.844 -1.637 3.676 . . . 1.0 . . . . . . . . . . . . A . 1 HIS C . . . . . . . . . c30448_6cxq 1 . 13 . 1502 . 1 1 1 HIS CA C 6.350 -1.617 3.495 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CA . . . . . . . . . c30448_6cxq 1 . 13 . 1503 . 1 1 1 HIS CB C 6.775 -2.525 2.337 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CB . . . . . . . . . c30448_6cxq 1 . 13 . 1504 . 1 1 1 HIS CD2 C 8.602 -1.376 0.898 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CD2 . . . . . . . . . c30448_6cxq 1 . 13 . 1505 . 1 1 1 HIS CE1 C 7.335 -0.729 -0.770 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CE1 . . . . . . . . . c30448_6cxq 1 . 13 . 1506 . 1 1 1 HIS CG C 7.337 -1.779 1.168 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CG . . . . . . . . . c30448_6cxq 1 . 13 . 1507 . 1 1 1 HIS H1 H 6.963 -3.097 4.786 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H1 . . . . . . . . . c30448_6cxq 1 . 13 . 1508 . 1 1 1 HIS H2 H 6.582 -1.602 5.539 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H2 . . . . . . . . . c30448_6cxq 1 . 13 . 1509 . 1 1 1 HIS H3 H 8.043 -1.772 4.654 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H3 . . . . . . . . . c30448_6cxq 1 . 13 . 1510 . 1 1 1 HIS HA H 6.643 -0.599 3.280 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HA . . . . . . . . . c30448_6cxq 1 . 13 . 1511 . 1 1 1 HIS HB2 H 7.532 -3.211 2.687 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HB2 . . . . . . . . . c30448_6cxq 1 . 13 . 1512 . 1 1 1 HIS HB3 H 5.918 -3.087 1.994 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HB3 . . . . . . . . . c30448_6cxq 1 . 13 . 1513 . 1 1 1 HIS HD1 H 5.604 -1.498 0.003 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HD1 . . . . . . . . . c30448_6cxq 1 . 13 . 1514 . 1 1 1 HIS HD2 H 9.472 -1.537 1.519 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HD2 . . . . . . . . . c30448_6cxq 1 . 13 . 1515 . 1 1 1 HIS HE1 H 7.005 -0.290 -1.700 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HE1 . . . . . . . . . c30448_6cxq 1 . 13 . 1516 . 1 1 1 HIS HE2 H 9.327 -0.254 -0.722 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HE2 . . . . . . . . . c30448_6cxq 1 . 13 . 1517 . 1 1 1 HIS N N 7.047 -2.062 4.730 . . . 1.0 . . . . . . . . . . . . A . 1 HIS N . . . . . . . . . c30448_6cxq 1 . 13 . 1518 . 1 1 1 HIS ND1 N 6.568 -1.357 0.103 . . . 1.0 . . . . . . . . . . . . A . 1 HIS ND1 . . . . . . . . . c30448_6cxq 1 . 13 . 1519 . 1 1 1 HIS NE2 N 8.573 -0.727 -0.311 . . . 1.0 . . . . . . . . . . . . A . 1 HIS NE2 . . . . . . . . . c30448_6cxq 1 . 13 . 1520 . 1 1 1 HIS O O 4.345 -1.587 4.800 . . . 1.0 . . . . . . . . . . . . A . 1 HIS O . . . . . . . . . c30448_6cxq 1 . 13 . 1521 . 1 1 2 ARG C C 2.025 -2.388 1.480 . . . 1.0 . . . . . . . . . . . . A . 2 ARG C . . . . . . . . . c30448_6cxq 1 . 13 . 1522 . 1 1 2 ARG CA C 2.666 -1.639 2.633 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CA . . . . . . . . . c30448_6cxq 1 . 13 . 1523 . 1 1 2 ARG CB C 2.176 -0.190 2.633 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CB . . . . . . . . . c30448_6cxq 1 . 13 . 1524 . 1 1 2 ARG CD C 3.076 2.095 2.105 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CD . . . . . . . . . c30448_6cxq 1 . 13 . 1525 . 1 1 2 ARG CG C 3.322 0.771 2.811 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CG . . . . . . . . . c30448_6cxq 1 . 13 . 1526 . 1 1 2 ARG CZ C 1.671 4.092 2.437 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CZ . . . . . . . . . c30448_6cxq 1 . 13 . 1527 . 1 1 2 ARG H H 4.559 -1.672 1.693 . . . 1.0 . . . . . . . . . . . . A . 2 ARG H . . . . . . . . . c30448_6cxq 1 . 13 . 1528 . 1 1 2 ARG HA H 2.392 -2.080 3.553 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HA . . . . . . . . . c30448_6cxq 1 . 13 . 1529 . 1 1 2 ARG HB2 H 1.678 0.027 1.685 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB2 . . . . . . . . . c30448_6cxq 1 . 13 . 1530 . 1 1 2 ARG HB3 H 1.479 -0.050 3.445 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB3 . . . . . . . . . c30448_6cxq 1 . 13 . 1531 . 1 1 2 ARG HD2 H 3.952 2.715 2.214 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD2 . . . . . . . . . c30448_6cxq 1 . 13 . 1532 . 1 1 2 ARG HD3 H 2.901 1.901 1.056 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD3 . . . . . . . . . c30448_6cxq 1 . 13 . 1533 . 1 1 2 ARG HE H 1.302 2.291 3.215 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HE . . . . . . . . . c30448_6cxq 1 . 13 . 1534 . 1 1 2 ARG HG2 H 3.490 0.945 3.863 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG2 . . . . . . . . . c30448_6cxq 1 . 13 . 1535 . 1 1 2 ARG HG3 H 4.187 0.300 2.396 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG3 . . . . . . . . . c30448_6cxq 1 . 13 . 1536 . 1 1 2 ARG HH11 H 3.298 4.395 1.275 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH11 . . . . . . . . . c30448_6cxq 1 . 13 . 1537 . 1 1 2 ARG HH12 H 2.294 5.784 1.523 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH12 . . . . . . . . . c30448_6cxq 1 . 13 . 1538 . 1 1 2 ARG HH21 H -0.021 4.117 3.542 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH21 . . . . . . . . . c30448_6cxq 1 . 13 . 1539 . 1 1 2 ARG HH22 H 0.410 5.626 2.810 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH22 . . . . . . . . . c30448_6cxq 1 . 13 . 1540 . 1 1 2 ARG N N 4.115 -1.666 2.566 . . . 1.0 . . . . . . . . . . . . A . 2 ARG N . . . . . . . . . c30448_6cxq 1 . 13 . 1541 . 1 1 2 ARG NE N 1.922 2.803 2.655 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NE . . . . . . . . . c30448_6cxq 1 . 13 . 1542 . 1 1 2 ARG NH1 N 2.488 4.816 1.683 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH1 . . . . . . . . . c30448_6cxq 1 . 13 . 1543 . 1 1 2 ARG NH2 N 0.598 4.658 2.973 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH2 . . . . . . . . . c30448_6cxq 1 . 13 . 1544 . 1 1 2 ARG O O 2.645 -2.592 0.436 . . . 1.0 . . . . . . . . . . . . A . 2 ARG O . . . . . . . . . c30448_6cxq 1 . 13 . 1545 . 1 1 3 PHE C C -0.653 -2.332 -0.261 . . . 1.0 . . . . . . . . . . . . A . 3 PHE C . . . . . . . . . c30448_6cxq 1 . 13 . 1546 . 1 1 3 PHE CA C 0.012 -3.402 0.595 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CA . . . . . . . . . c30448_6cxq 1 . 13 . 1547 . 1 1 3 PHE CB C -1.030 -4.356 1.178 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CB . . . . . . . . . c30448_6cxq 1 . 13 . 1548 . 1 1 3 PHE CD1 C -1.697 -6.762 1.208 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CD1 . . . . . . . . . c30448_6cxq 1 . 13 . 1549 . 1 1 3 PHE CD2 C -0.422 -5.993 -0.653 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CD2 . . . . . . . . . c30448_6cxq 1 . 13 . 1550 . 1 1 3 PHE CE1 C -1.730 -8.032 0.665 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CE1 . . . . . . . . . c30448_6cxq 1 . 13 . 1551 . 1 1 3 PHE CE2 C -0.451 -7.261 -1.201 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CE2 . . . . . . . . . c30448_6cxq 1 . 13 . 1552 . 1 1 3 PHE CG C -1.045 -5.730 0.560 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CG . . . . . . . . . c30448_6cxq 1 . 13 . 1553 . 1 1 3 PHE CZ C -1.106 -8.283 -0.541 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CZ . . . . . . . . . c30448_6cxq 1 . 13 . 1554 . 1 1 3 PHE H H 0.303 -2.509 2.488 . . . 1.0 . . . . . . . . . . . . A . 3 PHE H . . . . . . . . . c30448_6cxq 1 . 13 . 1555 . 1 1 3 PHE HA H 0.706 -3.948 -0.009 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HA . . . . . . . . . c30448_6cxq 1 . 13 . 1556 . 1 1 3 PHE HB2 H -0.841 -4.477 2.237 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HB2 . . . . . . . . . c30448_6cxq 1 . 13 . 1557 . 1 1 3 PHE HB3 H -2.008 -3.926 1.038 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HB3 . . . . . . . . . c30448_6cxq 1 . 13 . 1558 . 1 1 3 PHE HD1 H -2.186 -6.563 2.149 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HD1 . . . . . . . . . c30448_6cxq 1 . 13 . 1559 . 1 1 3 PHE HD2 H 0.088 -5.196 -1.173 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HD2 . . . . . . . . . c30448_6cxq 1 . 13 . 1560 . 1 1 3 PHE HE1 H -2.243 -8.829 1.184 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HE1 . . . . . . . . . c30448_6cxq 1 . 13 . 1561 . 1 1 3 PHE HE2 H 0.038 -7.454 -2.145 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HE2 . . . . . . . . . c30448_6cxq 1 . 13 . 1562 . 1 1 3 PHE HZ H -1.130 -9.275 -0.967 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HZ . . . . . . . . . c30448_6cxq 1 . 13 . 1563 . 1 1 3 PHE N N 0.758 -2.741 1.651 . . . 1.0 . . . . . . . . . . . . A . 3 PHE N . . . . . . . . . c30448_6cxq 1 . 13 . 1564 . 1 1 3 PHE O O -1.710 -2.545 -0.856 . . . 1.0 . . . . . . . . . . . . A . 3 PHE O . . . . . . . . . c30448_6cxq 1 . 13 . 1565 . 1 1 4 LEU C C -1.936 0.293 -0.714 . . . 1.0 . . . . . . . . . . . . A . 4 LEU C . . . . . . . . . c30448_6cxq 1 . 13 . 1566 . 1 1 4 LEU CA C -0.474 -0.013 -1.029 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CA . . . . . . . . . c30448_6cxq 1 . 13 . 1567 . 1 1 4 LEU CB C -0.289 -0.224 -2.533 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CB . . . . . . . . . c30448_6cxq 1 . 13 . 1568 . 1 1 4 LEU CD1 C 1.346 -2.123 -2.608 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CD1 . . . . . . . . . c30448_6cxq 1 . 13 . 1569 . 1 1 4 LEU CD2 C 1.313 -0.429 -4.448 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CD2 . . . . . . . . . c30448_6cxq 1 . 13 . 1570 . 1 1 4 LEU CG C 1.113 -0.661 -2.958 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CG . . . . . . . . . c30448_6cxq 1 . 13 . 1571 . 1 1 4 LEU H H 0.821 -1.087 0.218 . . . 1.0 . . . . . . . . . . . . A . 4 LEU H . . . . . . . . . c30448_6cxq 1 . 13 . 1572 . 1 1 4 LEU HA H 0.135 0.825 -0.711 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HA . . . . . . . . . c30448_6cxq 1 . 13 . 1573 . 1 1 4 LEU HB2 H -0.993 -0.977 -2.858 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HB2 . . . . . . . . . c30448_6cxq 1 . 13 . 1574 . 1 1 4 LEU HB3 H -0.521 0.702 -3.036 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HB3 . . . . . . . . . c30448_6cxq 1 . 13 . 1575 . 1 1 4 LEU HD11 H 0.427 -2.674 -2.737 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD11 . . . . . . . . . c30448_6cxq 1 . 13 . 1576 . 1 1 4 LEU HD12 H 1.671 -2.200 -1.581 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD12 . . . . . . . . . c30448_6cxq 1 . 13 . 1577 . 1 1 4 LEU HD13 H 2.105 -2.532 -3.258 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD13 . . . . . . . . . c30448_6cxq 1 . 13 . 1578 . 1 1 4 LEU HD21 H 0.631 0.335 -4.788 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD21 . . . . . . . . . c30448_6cxq 1 . 13 . 1579 . 1 1 4 LEU HD22 H 1.122 -1.347 -4.984 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD22 . . . . . . . . . c30448_6cxq 1 . 13 . 1580 . 1 1 4 LEU HD23 H 2.329 -0.111 -4.630 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD23 . . . . . . . . . c30448_6cxq 1 . 13 . 1581 . 1 1 4 LEU HG H 1.845 -0.070 -2.426 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HG . . . . . . . . . c30448_6cxq 1 . 13 . 1582 . 1 1 4 LEU N N -0.006 -1.170 -0.289 . . . 1.0 . . . . . . . . . . . . A . 4 LEU N . . . . . . . . . c30448_6cxq 1 . 13 . 1583 . 1 1 4 LEU O O -2.573 -0.408 0.072 . . . 1.0 . . . . . . . . . . . . A . 4 LEU O . . . . . . . . . c30448_6cxq 1 . 13 . 1584 . 1 1 5 ARG C C -4.632 1.718 -2.426 . . . 1.0 . . . . . . . . . . . . A . 5 ARG C . . . . . . . . . c30448_6cxq 1 . 13 . 1585 . 1 1 5 ARG CA C -3.845 1.749 -1.119 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CA . . . . . . . . . c30448_6cxq 1 . 13 . 1586 . 1 1 5 ARG CB C -3.898 3.152 -0.521 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CB . . . . . . . . . c30448_6cxq 1 . 13 . 1587 . 1 1 5 ARG CD C -1.742 4.262 -0.932 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CD . . . . . . . . . c30448_6cxq 1 . 13 . 1588 . 1 1 5 ARG CG C -3.173 4.174 -1.357 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CG . . . . . . . . . c30448_6cxq 1 . 13 . 1589 . 1 1 5 ARG CZ C 0.305 5.340 -1.781 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CZ . . . . . . . . . c30448_6cxq 1 . 13 . 1590 . 1 1 5 ARG H H -1.900 1.867 -1.946 . . . 1.0 . . . . . . . . . . . . A . 5 ARG H . . . . . . . . . c30448_6cxq 1 . 13 . 1591 . 1 1 5 ARG HA H -4.283 1.058 -0.423 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HA . . . . . . . . . c30448_6cxq 1 . 13 . 1592 . 1 1 5 ARG HB2 H -4.927 3.465 -0.430 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HB2 . . . . . . . . . c30448_6cxq 1 . 13 . 1593 . 1 1 5 ARG HB3 H -3.436 3.130 0.463 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HB3 . . . . . . . . . c30448_6cxq 1 . 13 . 1594 . 1 1 5 ARG HD2 H -1.701 4.917 -0.091 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HD2 . . . . . . . . . c30448_6cxq 1 . 13 . 1595 . 1 1 5 ARG HD3 H -1.410 3.275 -0.641 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HD3 . . . . . . . . . c30448_6cxq 1 . 13 . 1596 . 1 1 5 ARG HE H -1.200 4.682 -2.918 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HE . . . . . . . . . c30448_6cxq 1 . 13 . 1597 . 1 1 5 ARG HG2 H -3.210 3.884 -2.388 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HG2 . . . . . . . . . c30448_6cxq 1 . 13 . 1598 . 1 1 5 ARG HG3 H -3.642 5.138 -1.228 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HG3 . . . . . . . . . c30448_6cxq 1 . 13 . 1599 . 1 1 5 ARG HH11 H 0.237 5.145 0.231 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH11 . . . . . . . . . c30448_6cxq 1 . 13 . 1600 . 1 1 5 ARG HH12 H 1.664 5.901 -0.394 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH12 . . . . . . . . . c30448_6cxq 1 . 13 . 1601 . 1 1 5 ARG HH21 H 0.677 5.676 -3.739 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH21 . . . . . . . . . c30448_6cxq 1 . 13 . 1602 . 1 1 5 ARG HH22 H 1.914 6.203 -2.647 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH22 . . . . . . . . . c30448_6cxq 1 . 13 . 1603 . 1 1 5 ARG N N -2.459 1.347 -1.332 . . . 1.0 . . . . . . . . . . . . A . 5 ARG N . . . . . . . . . c30448_6cxq 1 . 13 . 1604 . 1 1 5 ARG NE N -0.879 4.770 -1.994 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NE . . . . . . . . . c30448_6cxq 1 . 13 . 1605 . 1 1 5 ARG NH1 N 0.773 5.473 -0.546 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NH1 . . . . . . . . . c30448_6cxq 1 . 13 . 1606 . 1 1 5 ARG NH2 N 1.024 5.775 -2.807 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NH2 . . . . . . . . . c30448_6cxq 1 . 13 . 1607 . 1 1 5 ARG O O -5.703 2.316 -2.528 . . . 1.0 . . . . . . . . . . . . A . 5 ARG O . . . . . . . . . c30448_6cxq 1 . 13 . 1608 . 1 1 6 HIS C C -6.194 0.467 -4.585 . . . 1.0 . . . . . . . . . . . . A . 6 HIS C . . . . . . . . . c30448_6cxq 1 . 13 . 1609 . 1 1 6 HIS CA C -4.745 0.925 -4.727 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CA . . . . . . . . . c30448_6cxq 1 . 13 . 1610 . 1 1 6 HIS CB C -3.979 -0.043 -5.630 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CB . . . . . . . . . c30448_6cxq 1 . 13 . 1611 . 1 1 6 HIS CD2 C -4.330 -1.973 -3.932 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CD2 . . . . . . . . . c30448_6cxq 1 . 13 . 1612 . 1 1 6 HIS CE1 C -2.883 -3.396 -4.761 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CE1 . . . . . . . . . c30448_6cxq 1 . 13 . 1613 . 1 1 6 HIS CG C -3.759 -1.389 -5.012 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CG . . . . . . . . . c30448_6cxq 1 . 13 . 1614 . 1 1 6 HIS H H -3.236 0.572 -3.288 . . . 1.0 . . . . . . . . . . . . A . 6 HIS H . . . . . . . . . c30448_6cxq 1 . 13 . 1615 . 1 1 6 HIS HA H -4.731 1.908 -5.176 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HA . . . . . . . . . c30448_6cxq 1 . 13 . 1616 . 1 1 6 HIS HB2 H -4.536 -0.186 -6.548 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HB2 . . . . . . . . . c30448_6cxq 1 . 13 . 1617 . 1 1 6 HIS HB3 H -3.008 0.382 -5.859 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HB3 . . . . . . . . . c30448_6cxq 1 . 13 . 1618 . 1 1 6 HIS HD1 H -2.282 -2.178 -6.292 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HD1 . . . . . . . . . c30448_6cxq 1 . 13 . 1619 . 1 1 6 HIS HD2 H -5.087 -1.539 -3.294 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HD2 . . . . . . . . . c30448_6cxq 1 . 13 . 1620 . 1 1 6 HIS HE1 H -2.282 -4.280 -4.911 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HE1 . . . . . . . . . c30448_6cxq 1 . 13 . 1621 . 1 1 6 HIS HE2 H -3.930 -3.839 -3.058 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HE2 . . . . . . . . . c30448_6cxq 1 . 13 . 1622 . 1 1 6 HIS N N -4.094 1.024 -3.426 . . . 1.0 . . . . . . . . . . . . A . 6 HIS N . . . . . . . . . c30448_6cxq 1 . 13 . 1623 . 1 1 6 HIS ND1 N -2.856 -2.306 -5.508 . . . 1.0 . . . . . . . . . . . . A . 6 HIS ND1 . . . . . . . . . c30448_6cxq 1 . 13 . 1624 . 1 1 6 HIS NE2 N -3.768 -3.218 -3.798 . . . 1.0 . . . . . . . . . . . . A . 6 HIS NE2 . . . . . . . . . c30448_6cxq 1 . 13 . 1625 . 1 1 6 HIS O O -6.593 0.108 -3.457 . . . 1.0 . . . . . . . . . . . . A . 6 HIS O . . . . . . . . . c30448_6cxq 1 . 14 . 1626 . 1 1 1 HIS C C 4.903 -1.575 3.671 . . . 1.0 . . . . . . . . . . . . A . 1 HIS C . . . . . . . . . c30448_6cxq 1 . 14 . 1627 . 1 1 1 HIS CA C 6.410 -1.674 3.520 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CA . . . . . . . . . c30448_6cxq 1 . 14 . 1628 . 1 1 1 HIS CB C 6.785 -2.735 2.482 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CB . . . . . . . . . c30448_6cxq 1 . 14 . 1629 . 1 1 1 HIS CD2 C 7.244 -2.596 -0.067 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CD2 . . . . . . . . . c30448_6cxq 1 . 14 . 1630 . 1 1 1 HIS CE1 C 8.417 -0.744 -0.081 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CE1 . . . . . . . . . c30448_6cxq 1 . 14 . 1631 . 1 1 1 HIS CG C 7.333 -2.162 1.212 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CG . . . . . . . . . c30448_6cxq 1 . 14 . 1632 . 1 1 1 HIS H1 H 7.015 -1.183 5.424 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H1 . . . . . . . . . c30448_6cxq 1 . 14 . 1633 . 1 1 1 HIS H2 H 8.046 -2.285 4.608 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H2 . . . . . . . . . c30448_6cxq 1 . 14 . 1634 . 1 1 1 HIS H3 H 6.535 -2.816 5.226 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H3 . . . . . . . . . c30448_6cxq 1 . 14 . 1635 . 1 1 1 HIS HA H 6.776 -0.709 3.196 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HA . . . . . . . . . c30448_6cxq 1 . 14 . 1636 . 1 1 1 HIS HB2 H 7.536 -3.388 2.901 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HB2 . . . . . . . . . c30448_6cxq 1 . 14 . 1637 . 1 1 1 HIS HB3 H 5.908 -3.315 2.235 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HB3 . . . . . . . . . c30448_6cxq 1 . 14 . 1638 . 1 1 1 HIS HD1 H 8.313 -0.444 1.941 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HD1 . . . . . . . . . c30448_6cxq 1 . 14 . 1639 . 1 1 1 HIS HD2 H 6.731 -3.485 -0.408 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HD2 . . . . . . . . . c30448_6cxq 1 . 14 . 1640 . 1 1 1 HIS HE1 H 9.000 0.101 -0.416 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HE1 . . . . . . . . . c30448_6cxq 1 . 14 . 1641 . 1 1 1 HIS HE2 H 8.105 -1.799 -1.808 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HE2 . . . . . . . . . c30448_6cxq 1 . 14 . 1642 . 1 1 1 HIS N N 7.060 -2.021 4.811 . . . 1.0 . . . . . . . . . . . . A . 1 HIS N . . . . . . . . . c30448_6cxq 1 . 14 . 1643 . 1 1 1 HIS ND1 N 8.074 -1.000 1.169 . . . 1.0 . . . . . . . . . . . . A . 1 HIS ND1 . . . . . . . . . c30448_6cxq 1 . 14 . 1644 . 1 1 1 HIS NE2 N 7.926 -1.698 -0.850 . . . 1.0 . . . . . . . . . . . . A . 1 HIS NE2 . . . . . . . . . c30448_6cxq 1 . 14 . 1645 . 1 1 1 HIS O O 4.396 -1.360 4.772 . . . 1.0 . . . . . . . . . . . . A . 1 HIS O . . . . . . . . . c30448_6cxq 1 . 14 . 1646 . 1 1 2 ARG C C 2.073 -2.376 1.497 . . . 1.0 . . . . . . . . . . . . A . 2 ARG C . . . . . . . . . c30448_6cxq 1 . 14 . 1647 . 1 1 2 ARG CA C 2.742 -1.568 2.593 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CA . . . . . . . . . c30448_6cxq 1 . 14 . 1648 . 1 1 2 ARG CB C 2.341 -0.098 2.459 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CB . . . . . . . . . c30448_6cxq 1 . 14 . 1649 . 1 1 2 ARG CD C 3.378 2.016 1.588 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CD . . . . . . . . . c30448_6cxq 1 . 14 . 1650 . 1 1 2 ARG CG C 3.550 0.800 2.482 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CG . . . . . . . . . c30448_6cxq 1 . 14 . 1651 . 1 1 2 ARG CZ C 5.366 1.845 0.142 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CZ . . . . . . . . . c30448_6cxq 1 . 14 . 1652 . 1 1 2 ARG H H 4.641 -1.834 1.701 . . . 1.0 . . . . . . . . . . . . A . 2 ARG H . . . . . . . . . c30448_6cxq 1 . 14 . 1653 . 1 1 2 ARG HA H 2.427 -1.911 3.541 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HA . . . . . . . . . c30448_6cxq 1 . 14 . 1654 . 1 1 2 ARG HB2 H 1.808 0.053 1.517 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB2 . . . . . . . . . c30448_6cxq 1 . 14 . 1655 . 1 1 2 ARG HB3 H 1.697 0.172 3.282 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB3 . . . . . . . . . c30448_6cxq 1 . 14 . 1656 . 1 1 2 ARG HD2 H 2.323 2.175 1.418 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD2 . . . . . . . . . c30448_6cxq 1 . 14 . 1657 . 1 1 2 ARG HD3 H 3.795 2.877 2.089 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD3 . . . . . . . . . c30448_6cxq 1 . 14 . 1658 . 1 1 2 ARG HE H 3.478 1.731 -0.492 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HE . . . . . . . . . c30448_6cxq 1 . 14 . 1659 . 1 1 2 ARG HG2 H 3.747 1.116 3.495 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG2 . . . . . . . . . c30448_6cxq 1 . 14 . 1660 . 1 1 2 ARG HG3 H 4.374 0.214 2.135 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG3 . . . . . . . . . c30448_6cxq 1 . 14 . 1661 . 1 1 2 ARG HH11 H 5.778 2.119 2.104 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH11 . . . . . . . . . c30448_6cxq 1 . 14 . 1662 . 1 1 2 ARG HH12 H 7.158 1.996 1.066 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH12 . . . . . . . . . c30448_6cxq 1 . 14 . 1663 . 1 1 2 ARG HH21 H 5.292 1.569 -1.858 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH21 . . . . . . . . . c30448_6cxq 1 . 14 . 1664 . 1 1 2 ARG HH22 H 6.883 1.684 -1.184 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH22 . . . . . . . . . c30448_6cxq 1 . 14 . 1665 . 1 1 2 ARG N N 4.188 -1.692 2.558 . . . 1.0 . . . . . . . . . . . . A . 2 ARG N . . . . . . . . . c30448_6cxq 1 . 14 . 1666 . 1 1 2 ARG NE N 4.045 1.848 0.299 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NE . . . . . . . . . c30448_6cxq 1 . 14 . 1667 . 1 1 2 ARG NH1 N 6.166 1.999 1.190 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH1 . . . . . . . . . c30448_6cxq 1 . 14 . 1668 . 1 1 2 ARG NH2 N 5.890 1.686 -1.066 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH2 . . . . . . . . . c30448_6cxq 1 . 14 . 1669 . 1 1 2 ARG O O 2.670 -2.643 0.455 . . . 1.0 . . . . . . . . . . . . A . 2 ARG O . . . . . . . . . c30448_6cxq 1 . 14 . 1670 . 1 1 3 PHE C C -0.659 -2.399 -0.177 . . . 1.0 . . . . . . . . . . . . A . 3 PHE C . . . . . . . . . c30448_6cxq 1 . 14 . 1671 . 1 1 3 PHE CA C 0.038 -3.423 0.709 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CA . . . . . . . . . c30448_6cxq 1 . 14 . 1672 . 1 1 3 PHE CB C -0.980 -4.356 1.365 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CB . . . . . . . . . c30448_6cxq 1 . 14 . 1673 . 1 1 3 PHE CD1 C -1.610 -6.765 1.539 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CD1 . . . . . . . . . c30448_6cxq 1 . 14 . 1674 . 1 1 3 PHE CD2 C -0.397 -6.079 -0.393 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CD2 . . . . . . . . . c30448_6cxq 1 . 14 . 1675 . 1 1 3 PHE CE1 C -1.639 -8.063 1.065 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CE1 . . . . . . . . . c30448_6cxq 1 . 14 . 1676 . 1 1 3 PHE CE2 C -0.422 -7.375 -0.873 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CE2 . . . . . . . . . c30448_6cxq 1 . 14 . 1677 . 1 1 3 PHE CG C -0.992 -5.761 0.821 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CG . . . . . . . . . c30448_6cxq 1 . 14 . 1678 . 1 1 3 PHE CZ C -1.044 -8.369 -0.142 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CZ . . . . . . . . . c30448_6cxq 1 . 14 . 1679 . 1 1 3 PHE H H 0.371 -2.428 2.544 . . . 1.0 . . . . . . . . . . . . A . 3 PHE H . . . . . . . . . c30448_6cxq 1 . 14 . 1680 . 1 1 3 PHE HA H 0.719 -3.992 0.113 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HA . . . . . . . . . c30448_6cxq 1 . 14 . 1681 . 1 1 3 PHE HB2 H -0.767 -4.418 2.425 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HB2 . . . . . . . . . c30448_6cxq 1 . 14 . 1682 . 1 1 3 PHE HB3 H -1.967 -3.945 1.225 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HB3 . . . . . . . . . c30448_6cxq 1 . 14 . 1683 . 1 1 3 PHE HD1 H -2.077 -6.524 2.481 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HD1 . . . . . . . . . c30448_6cxq 1 . 14 . 1684 . 1 1 3 PHE HD2 H 0.088 -5.305 -0.967 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HD2 . . . . . . . . . c30448_6cxq 1 . 14 . 1685 . 1 1 3 PHE HE1 H -2.127 -8.838 1.639 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HE1 . . . . . . . . . c30448_6cxq 1 . 14 . 1686 . 1 1 3 PHE HE2 H 0.045 -7.611 -1.818 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HE2 . . . . . . . . . c30448_6cxq 1 . 14 . 1687 . 1 1 3 PHE HZ H -1.064 -9.382 -0.515 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HZ . . . . . . . . . c30448_6cxq 1 . 14 . 1688 . 1 1 3 PHE N N 0.807 -2.709 1.712 . . . 1.0 . . . . . . . . . . . . A . 3 PHE N . . . . . . . . . c30448_6cxq 1 . 14 . 1689 . 1 1 3 PHE O O -1.729 -2.647 -0.734 . . . 1.0 . . . . . . . . . . . . A . 3 PHE O . . . . . . . . . c30448_6cxq 1 . 14 . 1690 . 1 1 4 LEU C C -1.972 0.197 -0.718 . . . 1.0 . . . . . . . . . . . . A . 4 LEU C . . . . . . . . . c30448_6cxq 1 . 14 . 1691 . 1 1 4 LEU CA C -0.517 -0.118 -1.059 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CA . . . . . . . . . c30448_6cxq 1 . 14 . 1692 . 1 1 4 LEU CB C -0.374 -0.401 -2.556 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CB . . . . . . . . . c30448_6cxq 1 . 14 . 1693 . 1 1 4 LEU CD1 C 1.783 -1.585 -3.033 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CD1 . . . . . . . . . c30448_6cxq 1 . 14 . 1694 . 1 1 4 LEU CD2 C 1.009 0.254 -4.542 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CD2 . . . . . . . . . c30448_6cxq 1 . 14 . 1695 . 1 1 4 LEU CG C 1.045 -0.258 -3.109 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CG . . . . . . . . . c30448_6cxq 1 . 14 . 1696 . 1 1 4 LEU H H 0.819 -1.123 0.201 . . . 1.0 . . . . . . . . . . . . A . 4 LEU H . . . . . . . . . c30448_6cxq 1 . 14 . 1697 . 1 1 4 LEU HA H 0.095 0.737 -0.800 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HA . . . . . . . . . c30448_6cxq 1 . 14 . 1698 . 1 1 4 LEU HB2 H -0.712 -1.410 -2.744 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HB2 . . . . . . . . . c30448_6cxq 1 . 14 . 1699 . 1 1 4 LEU HB3 H -1.016 0.281 -3.093 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HB3 . . . . . . . . . c30448_6cxq 1 . 14 . 1700 . 1 1 4 LEU HD11 H 2.578 -1.598 -3.764 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD11 . . . . . . . . . c30448_6cxq 1 . 14 . 1701 . 1 1 4 LEU HD12 H 1.095 -2.392 -3.235 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD12 . . . . . . . . . c30448_6cxq 1 . 14 . 1702 . 1 1 4 LEU HD13 H 2.202 -1.708 -2.045 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD13 . . . . . . . . . c30448_6cxq 1 . 14 . 1703 . 1 1 4 LEU HD21 H 0.280 1.045 -4.623 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD21 . . . . . . . . . c30448_6cxq 1 . 14 . 1704 . 1 1 4 LEU HD22 H 0.740 -0.554 -5.206 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD22 . . . . . . . . . c30448_6cxq 1 . 14 . 1705 . 1 1 4 LEU HD23 H 1.984 0.633 -4.813 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD23 . . . . . . . . . c30448_6cxq 1 . 14 . 1706 . 1 1 4 LEU HG H 1.587 0.460 -2.510 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HG . . . . . . . . . c30448_6cxq 1 . 14 . 1707 . 1 1 4 LEU N N -0.021 -1.235 -0.278 . . . 1.0 . . . . . . . . . . . . A . 4 LEU N . . . . . . . . . c30448_6cxq 1 . 14 . 1708 . 1 1 4 LEU O O -2.584 -0.473 0.114 . . . 1.0 . . . . . . . . . . . . A . 4 LEU O . . . . . . . . . c30448_6cxq 1 . 14 . 1709 . 1 1 5 ARG C C -4.677 1.720 -2.439 . . . 1.0 . . . . . . . . . . . . A . 5 ARG C . . . . . . . . . c30448_6cxq 1 . 14 . 1710 . 1 1 5 ARG CA C -3.899 1.629 -1.129 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CA . . . . . . . . . c30448_6cxq 1 . 14 . 1711 . 1 1 5 ARG CB C -3.936 2.977 -0.415 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CB . . . . . . . . . c30448_6cxq 1 . 14 . 1712 . 1 1 5 ARG CD C -1.767 4.088 -0.750 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CD . . . . . . . . . c30448_6cxq 1 . 14 . 1713 . 1 1 5 ARG CG C -3.204 4.060 -1.165 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CG . . . . . . . . . c30448_6cxq 1 . 14 . 1714 . 1 1 5 ARG CZ C 0.273 5.253 -1.497 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CZ . . . . . . . . . c30448_6cxq 1 . 14 . 1715 . 1 1 5 ARG H H -1.978 1.719 -2.014 . . . 1.0 . . . . . . . . . . . . A . 5 ARG H . . . . . . . . . c30448_6cxq 1 . 14 . 1716 . 1 1 5 ARG HA H -4.354 0.889 -0.497 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HA . . . . . . . . . c30448_6cxq 1 . 14 . 1717 . 1 1 5 ARG HB2 H -4.961 3.292 -0.293 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HB2 . . . . . . . . . c30448_6cxq 1 . 14 . 1718 . 1 1 5 ARG HB3 H -3.471 2.868 0.561 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HB3 . . . . . . . . . c30448_6cxq 1 . 14 . 1719 . 1 1 5 ARG HD2 H -1.710 4.644 0.158 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HD2 . . . . . . . . . c30448_6cxq 1 . 14 . 1720 . 1 1 5 ARG HD3 H -1.440 3.072 -0.576 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HD3 . . . . . . . . . c30448_6cxq 1 . 14 . 1721 . 1 1 5 ARG HE H -1.238 4.713 -2.685 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HE . . . . . . . . . c30448_6cxq 1 . 14 . 1722 . 1 1 5 ARG HG2 H -3.256 3.863 -2.217 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HG2 . . . . . . . . . c30448_6cxq 1 . 14 . 1723 . 1 1 5 ARG HG3 H -3.655 5.015 -0.944 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HG3 . . . . . . . . . c30448_6cxq 1 . 14 . 1724 . 1 1 5 ARG HH11 H 0.220 4.853 0.485 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH11 . . . . . . . . . c30448_6cxq 1 . 14 . 1725 . 1 1 5 ARG HH12 H 1.640 5.673 -0.069 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH12 . . . . . . . . . c30448_6cxq 1 . 14 . 1726 . 1 1 5 ARG HH21 H 0.631 5.790 -3.412 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH21 . . . . . . . . . c30448_6cxq 1 . 14 . 1727 . 1 1 5 ARG HH22 H 1.874 6.206 -2.280 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH22 . . . . . . . . . c30448_6cxq 1 . 14 . 1728 . 1 1 5 ARG N N -2.518 1.223 -1.364 . . . 1.0 . . . . . . . . . . . . A . 5 ARG N . . . . . . . . . c30448_6cxq 1 . 14 . 1729 . 1 1 5 ARG NE N -0.912 4.706 -1.760 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NE . . . . . . . . . c30448_6cxq 1 . 14 . 1730 . 1 1 5 ARG NH1 N 0.750 5.260 -0.258 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NH1 . . . . . . . . . c30448_6cxq 1 . 14 . 1731 . 1 1 5 ARG NH2 N 0.984 5.794 -2.477 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NH2 . . . . . . . . . c30448_6cxq 1 . 14 . 1732 . 1 1 5 ARG O O -5.735 2.347 -2.499 . . . 1.0 . . . . . . . . . . . . A . 5 ARG O . . . . . . . . . c30448_6cxq 1 . 14 . 1733 . 1 1 6 HIS C C -6.242 0.659 -4.702 . . . 1.0 . . . . . . . . . . . . A . 6 HIS C . . . . . . . . . c30448_6cxq 1 . 14 . 1734 . 1 1 6 HIS CA C -4.790 1.119 -4.797 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CA . . . . . . . . . c30448_6cxq 1 . 14 . 1735 . 1 1 6 HIS CB C -4.024 0.230 -5.778 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CB . . . . . . . . . c30448_6cxq 1 . 14 . 1736 . 1 1 6 HIS CD2 C -4.871 -2.174 -5.295 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CD2 . . . . . . . . . c30448_6cxq 1 . 14 . 1737 . 1 1 6 HIS CE1 C -2.991 -3.035 -4.564 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CE1 . . . . . . . . . c30448_6cxq 1 . 14 . 1738 . 1 1 6 HIS CG C -3.932 -1.199 -5.340 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CG . . . . . . . . . c30448_6cxq 1 . 14 . 1739 . 1 1 6 HIS H H -3.298 0.619 -3.383 . . . 1.0 . . . . . . . . . . . . A . 6 HIS H . . . . . . . . . c30448_6cxq 1 . 14 . 1740 . 1 1 6 HIS HA H -4.769 2.137 -5.158 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HA . . . . . . . . . c30448_6cxq 1 . 14 . 1741 . 1 1 6 HIS HB2 H -4.525 0.251 -6.739 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HB2 . . . . . . . . . c30448_6cxq 1 . 14 . 1742 . 1 1 6 HIS HB3 H -3.015 0.612 -5.888 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HB3 . . . . . . . . . c30448_6cxq 1 . 14 . 1743 . 1 1 6 HIS HD1 H -1.902 -1.316 -4.786 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HD1 . . . . . . . . . c30448_6cxq 1 . 14 . 1744 . 1 1 6 HIS HD2 H -5.907 -2.080 -5.587 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HD2 . . . . . . . . . c30448_6cxq 1 . 14 . 1745 . 1 1 6 HIS HE1 H -2.261 -3.729 -4.175 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HE1 . . . . . . . . . c30448_6cxq 1 . 14 . 1746 . 1 1 6 HIS HE2 H -4.672 -4.191 -4.746 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HE2 . . . . . . . . . c30448_6cxq 1 . 14 . 1747 . 1 1 6 HIS N N -4.145 1.099 -3.489 . . . 1.0 . . . . . . . . . . . . A . 6 HIS N . . . . . . . . . c30448_6cxq 1 . 14 . 1748 . 1 1 6 HIS ND1 N -2.766 -1.770 -4.875 . . . 1.0 . . . . . . . . . . . . A . 6 HIS ND1 . . . . . . . . . c30448_6cxq 1 . 14 . 1749 . 1 1 6 HIS NE2 N -4.260 -3.304 -4.809 . . . 1.0 . . . . . . . . . . . . A . 6 HIS NE2 . . . . . . . . . c30448_6cxq 1 . 14 . 1750 . 1 1 6 HIS O O -6.963 0.765 -5.716 . . . 1.0 . . . . . . . . . . . . A . 6 HIS O . . . . . . . . . c30448_6cxq 1 . 15 . 1751 . 1 1 1 HIS C C 4.872 -1.683 3.694 . . . 1.0 . . . . . . . . . . . . A . 1 HIS C . . . . . . . . . c30448_6cxq 1 . 15 . 1752 . 1 1 1 HIS CA C 6.379 -1.818 3.571 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CA . . . . . . . . . c30448_6cxq 1 . 15 . 1753 . 1 1 1 HIS CB C 6.747 -2.873 2.524 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CB . . . . . . . . . c30448_6cxq 1 . 15 . 1754 . 1 1 1 HIS CD2 C 7.513 -2.696 0.052 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CD2 . . . . . . . . . c30448_6cxq 1 . 15 . 1755 . 1 1 1 HIS CE1 C 8.857 -0.976 0.256 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CE1 . . . . . . . . . c30448_6cxq 1 . 15 . 1756 . 1 1 1 HIS CG C 7.493 -2.316 1.352 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CG . . . . . . . . . c30448_6cxq 1 . 15 . 1757 . 1 1 1 HIS H1 H 6.798 -3.211 5.026 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H1 . . . . . . . . . c30448_6cxq 1 . 15 . 1758 . 1 1 1 HIS H2 H 6.555 -1.616 5.611 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H2 . . . . . . . . . c30448_6cxq 1 . 15 . 1759 . 1 1 1 HIS H3 H 8.014 -2.024 4.803 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H3 . . . . . . . . . c30448_6cxq 1 . 15 . 1760 . 1 1 1 HIS HA H 6.775 -0.859 3.272 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HA . . . . . . . . . c30448_6cxq 1 . 15 . 1761 . 1 1 1 HIS HB2 H 7.370 -3.625 2.985 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HB2 . . . . . . . . . c30448_6cxq 1 . 15 . 1762 . 1 1 1 HIS HB3 H 5.845 -3.337 2.155 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HB3 . . . . . . . . . c30448_6cxq 1 . 15 . 1763 . 1 1 1 HIS HD1 H 8.546 -0.734 2.264 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HD1 . . . . . . . . . c30448_6cxq 1 . 15 . 1764 . 1 1 1 HIS HD2 H 6.959 -3.514 -0.384 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HD2 . . . . . . . . . c30448_6cxq 1 . 15 . 1765 . 1 1 1 HIS HE1 H 9.556 -0.185 0.028 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HE1 . . . . . . . . . c30448_6cxq 1 . 15 . 1766 . 1 1 1 HIS HE2 H 8.654 -1.939 -1.540 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HE2 . . . . . . . . . c30448_6cxq 1 . 15 . 1767 . 1 1 1 HIS N N 6.992 -2.202 4.870 . . . 1.0 . . . . . . . . . . . . A . 1 HIS N . . . . . . . . . c30448_6cxq 1 . 15 . 1768 . 1 1 1 HIS ND1 N 8.346 -1.236 1.446 . . . 1.0 . . . . . . . . . . . . A . 1 HIS ND1 . . . . . . . . . c30448_6cxq 1 . 15 . 1769 . 1 1 1 HIS NE2 N 8.368 -1.847 -0.607 . . . 1.0 . . . . . . . . . . . . A . 1 HIS NE2 . . . . . . . . . c30448_6cxq 1 . 15 . 1770 . 1 1 1 HIS O O 4.344 -1.513 4.793 . . . 1.0 . . . . . . . . . . . . A . 1 HIS O . . . . . . . . . c30448_6cxq 1 . 15 . 1771 . 1 1 2 ARG C C 2.075 -2.288 1.419 . . . 1.0 . . . . . . . . . . . . A . 2 ARG C . . . . . . . . . c30448_6cxq 1 . 15 . 1772 . 1 1 2 ARG CA C 2.740 -1.553 2.568 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CA . . . . . . . . . c30448_6cxq 1 . 15 . 1773 . 1 1 2 ARG CB C 2.386 -0.067 2.497 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CB . . . . . . . . . c30448_6cxq 1 . 15 . 1774 . 1 1 2 ARG CD C 3.510 2.068 1.790 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CD . . . . . . . . . c30448_6cxq 1 . 15 . 1775 . 1 1 2 ARG CG C 3.619 0.791 2.608 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CG . . . . . . . . . c30448_6cxq 1 . 15 . 1776 . 1 1 2 ARG CZ C 5.726 2.151 0.714 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CZ . . . . . . . . . c30448_6cxq 1 . 15 . 1777 . 1 1 2 ARG H H 4.653 -1.826 1.708 . . . 1.0 . . . . . . . . . . . . A . 2 ARG H . . . . . . . . . c30448_6cxq 1 . 15 . 1778 . 1 1 2 ARG HA H 2.393 -1.932 3.490 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HA . . . . . . . . . c30448_6cxq 1 . 15 . 1779 . 1 1 2 ARG HB2 H 1.888 0.147 1.548 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB2 . . . . . . . . . c30448_6cxq 1 . 15 . 1780 . 1 1 2 ARG HB3 H 1.722 0.179 3.312 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB3 . . . . . . . . . c30448_6cxq 1 . 15 . 1781 . 1 1 2 ARG HD2 H 2.492 2.176 1.448 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD2 . . . . . . . . . c30448_6cxq 1 . 15 . 1782 . 1 1 2 ARG HD3 H 3.768 2.907 2.421 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD3 . . . . . . . . . c30448_6cxq 1 . 15 . 1783 . 1 1 2 ARG HE H 3.990 1.973 -0.254 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HE . . . . . . . . . c30448_6cxq 1 . 15 . 1784 . 1 1 2 ARG HG2 H 3.798 1.036 3.644 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG2 . . . . . . . . . c30448_6cxq 1 . 15 . 1785 . 1 1 2 ARG HG3 H 4.435 0.203 2.245 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG3 . . . . . . . . . c30448_6cxq 1 . 15 . 1786 . 1 1 2 ARG HH11 H 5.769 2.277 2.732 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH11 . . . . . . . . . c30448_6cxq 1 . 15 . 1787 . 1 1 2 ARG HH12 H 7.314 2.335 1.951 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH12 . . . . . . . . . c30448_6cxq 1 . 15 . 1788 . 1 1 2 ARG HH21 H 6.020 2.050 -1.283 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH21 . . . . . . . . . c30448_6cxq 1 . 15 . 1789 . 1 1 2 ARG HH22 H 7.457 2.207 -0.328 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH22 . . . . . . . . . c30448_6cxq 1 . 15 . 1790 . 1 1 2 ARG N N 4.182 -1.718 2.560 . . . 1.0 . . . . . . . . . . . . A . 2 ARG N . . . . . . . . . c30448_6cxq 1 . 15 . 1791 . 1 1 2 ARG NE N 4.401 2.055 0.632 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NE . . . . . . . . . c30448_6cxq 1 . 15 . 1792 . 1 1 2 ARG NH1 N 6.318 2.263 1.896 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH1 . . . . . . . . . c30448_6cxq 1 . 15 . 1793 . 1 1 2 ARG NH2 N 6.461 2.134 -0.389 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH2 . . . . . . . . . c30448_6cxq 1 . 15 . 1794 . 1 1 2 ARG O O 2.667 -2.462 0.354 . . . 1.0 . . . . . . . . . . . . A . 2 ARG O . . . . . . . . . c30448_6cxq 1 . 15 . 1795 . 1 1 3 PHE C C -0.630 -2.247 -0.265 . . . 1.0 . . . . . . . . . . . . A . 3 PHE C . . . . . . . . . c30448_6cxq 1 . 15 . 1796 . 1 1 3 PHE CA C 0.058 -3.319 0.569 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CA . . . . . . . . . c30448_6cxq 1 . 15 . 1797 . 1 1 3 PHE CB C -0.967 -4.287 1.160 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CB . . . . . . . . . c30448_6cxq 1 . 15 . 1798 . 1 1 3 PHE CD1 C -1.643 -6.691 1.137 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CD1 . . . . . . . . . c30448_6cxq 1 . 15 . 1799 . 1 1 3 PHE CD2 C -0.421 -5.870 -0.736 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CD2 . . . . . . . . . c30448_6cxq 1 . 15 . 1800 . 1 1 3 PHE CE1 C -1.698 -7.944 0.558 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CE1 . . . . . . . . . c30448_6cxq 1 . 15 . 1801 . 1 1 3 PHE CE2 C -0.471 -7.121 -1.321 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CE2 . . . . . . . . . c30448_6cxq 1 . 15 . 1802 . 1 1 3 PHE CG C -1.007 -5.642 0.503 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CG . . . . . . . . . c30448_6cxq 1 . 15 . 1803 . 1 1 3 PHE CZ C -1.110 -8.160 -0.673 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CZ . . . . . . . . . c30448_6cxq 1 . 15 . 1804 . 1 1 3 PHE H H 0.385 -2.461 2.473 . . . 1.0 . . . . . . . . . . . . A . 3 PHE H . . . . . . . . . c30448_6cxq 1 . 15 . 1805 . 1 1 3 PHE HA H 0.744 -3.854 -0.053 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HA . . . . . . . . . c30448_6cxq 1 . 15 . 1806 . 1 1 3 PHE HB2 H -0.742 -4.439 2.208 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HB2 . . . . . . . . . c30448_6cxq 1 . 15 . 1807 . 1 1 3 PHE HB3 H -1.948 -3.850 1.065 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HB3 . . . . . . . . . c30448_6cxq 1 . 15 . 1808 . 1 1 3 PHE HD1 H -2.104 -6.519 2.098 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HD1 . . . . . . . . . c30448_6cxq 1 . 15 . 1809 . 1 1 3 PHE HD2 H 0.078 -5.059 -1.246 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HD2 . . . . . . . . . c30448_6cxq 1 . 15 . 1810 . 1 1 3 PHE HE1 H -2.198 -8.754 1.068 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HE1 . . . . . . . . . c30448_6cxq 1 . 15 . 1811 . 1 1 3 PHE HE2 H -0.010 -7.287 -2.284 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HE2 . . . . . . . . . c30448_6cxq 1 . 15 . 1812 . 1 1 3 PHE HZ H -1.150 -9.138 -1.128 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HZ . . . . . . . . . c30448_6cxq 1 . 15 . 1813 . 1 1 3 PHE N N 0.820 -2.666 1.619 . . . 1.0 . . . . . . . . . . . . A . 3 PHE N . . . . . . . . . c30448_6cxq 1 . 15 . 1814 . 1 1 3 PHE O O -1.697 -2.461 -0.841 . . . 1.0 . . . . . . . . . . . . A . 3 PHE O . . . . . . . . . c30448_6cxq 1 . 15 . 1815 . 1 1 4 LEU C C -1.951 0.351 -0.699 . . . 1.0 . . . . . . . . . . . . A . 4 LEU C . . . . . . . . . c30448_6cxq 1 . 15 . 1816 . 1 1 4 LEU CA C -0.482 0.079 -1.020 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CA . . . . . . . . . c30448_6cxq 1 . 15 . 1817 . 1 1 4 LEU CB C -0.295 -0.108 -2.527 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CB . . . . . . . . . c30448_6cxq 1 . 15 . 1818 . 1 1 4 LEU CD1 C 1.993 -0.984 -3.057 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CD1 . . . . . . . . . c30448_6cxq 1 . 15 . 1819 . 1 1 4 LEU CD2 C 1.002 0.841 -4.452 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CD2 . . . . . . . . . c30448_6cxq 1 . 15 . 1820 . 1 1 4 LEU CG C 1.097 0.244 -3.055 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CG . . . . . . . . . c30448_6cxq 1 . 15 . 1821 . 1 1 4 LEU H H 0.846 -0.994 0.193 . . . 1.0 . . . . . . . . . . . . A . 4 LEU H . . . . . . . . . c30448_6cxq 1 . 15 . 1822 . 1 1 4 LEU HA H 0.111 0.924 -0.691 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HA . . . . . . . . . c30448_6cxq 1 . 15 . 1823 . 1 1 4 LEU HB2 H -0.498 -1.142 -2.768 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HB2 . . . . . . . . . c30448_6cxq 1 . 15 . 1824 . 1 1 4 LEU HB3 H -1.016 0.511 -3.038 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HB3 . . . . . . . . . c30448_6cxq 1 . 15 . 1825 . 1 1 4 LEU HD11 H 1.630 -1.697 -2.332 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD11 . . . . . . . . . c30448_6cxq 1 . 15 . 1826 . 1 1 4 LEU HD12 H 3.002 -0.694 -2.803 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD12 . . . . . . . . . c30448_6cxq 1 . 15 . 1827 . 1 1 4 LEU HD13 H 1.985 -1.434 -4.039 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD13 . . . . . . . . . c30448_6cxq 1 . 15 . 1828 . 1 1 4 LEU HD21 H 0.967 1.918 -4.382 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD21 . . . . . . . . . c30448_6cxq 1 . 15 . 1829 . 1 1 4 LEU HD22 H 0.105 0.482 -4.936 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD22 . . . . . . . . . c30448_6cxq 1 . 15 . 1830 . 1 1 4 LEU HD23 H 1.865 0.545 -5.029 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD23 . . . . . . . . . c30448_6cxq 1 . 15 . 1831 . 1 1 4 LEU HG H 1.545 0.982 -2.405 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HG . . . . . . . . . c30448_6cxq 1 . 15 . 1832 . 1 1 4 LEU N N 0.009 -1.079 -0.297 . . . 1.0 . . . . . . . . . . . . A . 4 LEU N . . . . . . . . . c30448_6cxq 1 . 15 . 1833 . 1 1 4 LEU O O -2.556 -0.342 0.118 . . . 1.0 . . . . . . . . . . . . A . 4 LEU O . . . . . . . . . c30448_6cxq 1 . 15 . 1834 . 1 1 5 ARG C C -4.711 1.664 -2.426 . . . 1.0 . . . . . . . . . . . . A . 5 ARG C . . . . . . . . . c30448_6cxq 1 . 15 . 1835 . 1 1 5 ARG CA C -3.913 1.727 -1.126 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CA . . . . . . . . . c30448_6cxq 1 . 15 . 1836 . 1 1 5 ARG CB C -4.008 3.130 -0.534 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CB . . . . . . . . . c30448_6cxq 1 . 15 . 1837 . 1 1 5 ARG CD C -1.902 4.319 -0.985 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CD . . . . . . . . . c30448_6cxq 1 . 15 . 1838 . 1 1 5 ARG CG C -3.336 4.176 -1.385 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CG . . . . . . . . . c30448_6cxq 1 . 15 . 1839 . 1 1 5 ARG CZ C 0.064 5.530 -1.846 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CZ . . . . . . . . . c30448_6cxq 1 . 15 . 1840 . 1 1 5 ARG H H -1.984 1.883 -1.985 . . . 1.0 . . . . . . . . . . . . A . 5 ARG H . . . . . . . . . c30448_6cxq 1 . 15 . 1841 . 1 1 5 ARG HA H -4.325 1.027 -0.424 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HA . . . . . . . . . c30448_6cxq 1 . 15 . 1842 . 1 1 5 ARG HB2 H -5.047 3.405 -0.426 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HB2 . . . . . . . . . c30448_6cxq 1 . 15 . 1843 . 1 1 5 ARG HB3 H -3.529 3.129 0.442 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HB3 . . . . . . . . . c30448_6cxq 1 . 15 . 1844 . 1 1 5 ARG HD2 H -1.873 4.956 -0.130 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HD2 . . . . . . . . . c30448_6cxq 1 . 15 . 1845 . 1 1 5 ARG HD3 H -1.521 3.341 -0.724 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HD3 . . . . . . . . . c30448_6cxq 1 . 15 . 1846 . 1 1 5 ARG HE H -1.409 4.789 -2.973 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HE . . . . . . . . . c30448_6cxq 1 . 15 . 1847 . 1 1 5 ARG HG2 H -3.380 3.881 -2.415 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HG2 . . . . . . . . . c30448_6cxq 1 . 15 . 1848 . 1 1 5 ARG HG3 H -3.838 5.122 -1.250 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HG3 . . . . . . . . . c30448_6cxq 1 . 15 . 1849 . 1 1 5 ARG HH11 H 0.034 5.311 0.165 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH11 . . . . . . . . . c30448_6cxq 1 . 15 . 1850 . 1 1 5 ARG HH12 H 1.401 6.164 -0.468 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH12 . . . . . . . . . c30448_6cxq 1 . 15 . 1851 . 1 1 5 ARG HH21 H 0.391 5.910 -3.804 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH21 . . . . . . . . . c30448_6cxq 1 . 15 . 1852 . 1 1 5 ARG HH22 H 1.605 6.504 -2.719 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH22 . . . . . . . . . c30448_6cxq 1 . 15 . 1853 . 1 1 5 ARG N N -2.517 1.366 -1.346 . . . 1.0 . . . . . . . . . . . . A . 5 ARG N . . . . . . . . . c30448_6cxq 1 . 15 . 1854 . 1 1 5 ARG NE N -1.084 4.889 -2.052 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NE . . . . . . . . . c30448_6cxq 1 . 15 . 1855 . 1 1 5 ARG NH1 N 0.538 5.681 -0.615 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NH1 . . . . . . . . . c30448_6cxq 1 . 15 . 1856 . 1 1 5 ARG NH2 N 0.742 6.021 -2.874 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NH2 . . . . . . . . . c30448_6cxq 1 . 15 . 1857 . 1 1 5 ARG O O -5.821 2.192 -2.507 . . . 1.0 . . . . . . . . . . . . A . 5 ARG O . . . . . . . . . c30448_6cxq 1 . 15 . 1858 . 1 1 6 HIS C C -6.201 0.315 -4.589 . . . 1.0 . . . . . . . . . . . . A . 6 HIS C . . . . . . . . . c30448_6cxq 1 . 15 . 1859 . 1 1 6 HIS CA C -4.801 0.904 -4.739 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CA . . . . . . . . . c30448_6cxq 1 . 15 . 1860 . 1 1 6 HIS CB C -3.968 0.032 -5.680 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CB . . . . . . . . . c30448_6cxq 1 . 15 . 1861 . 1 1 6 HIS CD2 C -4.479 -2.506 -5.521 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CD2 . . . . . . . . . c30448_6cxq 1 . 15 . 1862 . 1 1 6 HIS CE1 C -2.948 -3.050 -4.050 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CE1 . . . . . . . . . c30448_6cxq 1 . 15 . 1863 . 1 1 6 HIS CG C -3.804 -1.377 -5.200 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CG . . . . . . . . . c30448_6cxq 1 . 15 . 1864 . 1 1 6 HIS H H -3.253 0.627 -3.324 . . . 1.0 . . . . . . . . . . . . A . 6 HIS H . . . . . . . . . c30448_6cxq 1 . 15 . 1865 . 1 1 6 HIS HA H -4.882 1.895 -5.160 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HA . . . . . . . . . c30448_6cxq 1 . 15 . 1866 . 1 1 6 HIS HB2 H -4.449 -0.002 -6.650 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HB2 . . . . . . . . . c30448_6cxq 1 . 15 . 1867 . 1 1 6 HIS HB3 H -2.980 0.467 -5.782 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HB3 . . . . . . . . . c30448_6cxq 1 . 15 . 1868 . 1 1 6 HIS HD1 H -2.202 -1.155 -3.850 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HD1 . . . . . . . . . c30448_6cxq 1 . 15 . 1869 . 1 1 6 HIS HD2 H -5.300 -2.586 -6.221 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HD2 . . . . . . . . . c30448_6cxq 1 . 15 . 1870 . 1 1 6 HIS HE1 H -2.330 -3.621 -3.372 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HE1 . . . . . . . . . c30448_6cxq 1 . 15 . 1871 . 1 1 6 HIS HE2 H -4.155 -4.480 -4.882 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HE2 . . . . . . . . . c30448_6cxq 1 . 15 . 1872 . 1 1 6 HIS N N -4.140 1.024 -3.444 . . . 1.0 . . . . . . . . . . . . A . 6 HIS N . . . . . . . . . c30448_6cxq 1 . 15 . 1873 . 1 1 6 HIS ND1 N -2.852 -1.752 -4.276 . . . 1.0 . . . . . . . . . . . . A . 6 HIS ND1 . . . . . . . . . c30448_6cxq 1 . 15 . 1874 . 1 1 6 HIS NE2 N -3.928 -3.531 -4.793 . . . 1.0 . . . . . . . . . . . . A . 6 HIS NE2 . . . . . . . . . c30448_6cxq 1 . 15 . 1875 . 1 1 6 HIS O O -6.527 -0.161 -3.482 . . . 1.0 . . . . . . . . . . . . A . 6 HIS O . . . . . . . . . c30448_6cxq 1 . 16 . 1876 . 1 1 1 HIS C C 4.812 -1.717 3.718 . . . 1.0 . . . . . . . . . . . . A . 1 HIS C . . . . . . . . . c30448_6cxq 1 . 16 . 1877 . 1 1 1 HIS CA C 6.322 -1.825 3.620 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CA . . . . . . . . . c30448_6cxq 1 . 16 . 1878 . 1 1 1 HIS CB C 6.727 -2.797 2.508 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CB . . . . . . . . . c30448_6cxq 1 . 16 . 1879 . 1 1 1 HIS CD2 C 8.779 -4.371 2.300 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CD2 . . . . . . . . . c30448_6cxq 1 . 16 . 1880 . 1 1 1 HIS CE1 C 10.344 -2.926 2.819 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CE1 . . . . . . . . . c30448_6cxq 1 . 16 . 1881 . 1 1 1 HIS CG C 8.173 -3.185 2.545 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CG . . . . . . . . . c30448_6cxq 1 . 16 . 1882 . 1 1 1 HIS H1 H 6.726 -3.311 4.985 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H1 . . . . . . . . . c30448_6cxq 1 . 16 . 1883 . 1 1 1 HIS H2 H 6.453 -1.762 5.673 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H2 . . . . . . . . . c30448_6cxq 1 . 16 . 1884 . 1 1 1 HIS H3 H 7.933 -2.099 4.871 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H3 . . . . . . . . . c30448_6cxq 1 . 16 . 1885 . 1 1 1 HIS HA H 6.712 -0.841 3.398 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HA . . . . . . . . . c30448_6cxq 1 . 16 . 1886 . 1 1 1 HIS HB2 H 6.140 -3.699 2.598 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HB2 . . . . . . . . . c30448_6cxq 1 . 16 . 1887 . 1 1 1 HIS HB3 H 6.529 -2.340 1.550 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HB3 . . . . . . . . . c30448_6cxq 1 . 16 . 1888 . 1 1 1 HIS HD1 H 9.062 -1.356 3.100 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HD1 . . . . . . . . . c30448_6cxq 1 . 16 . 1889 . 1 1 1 HIS HD2 H 8.292 -5.293 2.016 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HD2 . . . . . . . . . c30448_6cxq 1 . 16 . 1890 . 1 1 1 HIS HE1 H 11.308 -2.484 3.026 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HE1 . . . . . . . . . c30448_6cxq 1 . 16 . 1891 . 1 1 1 HIS HE2 H 10.807 -4.889 2.465 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HE2 . . . . . . . . . c30448_6cxq 1 . 16 . 1892 . 1 1 1 HIS N N 6.912 -2.291 4.903 . . . 1.0 . . . . . . . . . . . . A . 1 HIS N . . . . . . . . . c30448_6cxq 1 . 16 . 1893 . 1 1 1 HIS ND1 N 9.181 -2.301 2.869 . . . 1.0 . . . . . . . . . . . . A . 1 HIS ND1 . . . . . . . . . c30448_6cxq 1 . 16 . 1894 . 1 1 1 HIS NE2 N 10.128 -4.182 2.477 . . . 1.0 . . . . . . . . . . . . A . 1 HIS NE2 . . . . . . . . . c30448_6cxq 1 . 16 . 1895 . 1 1 1 HIS O O 4.260 -1.601 4.812 . . . 1.0 . . . . . . . . . . . . A . 1 HIS O . . . . . . . . . c30448_6cxq 1 . 16 . 1896 . 1 1 2 ARG C C 2.063 -2.273 1.376 . . . 1.0 . . . . . . . . . . . . A . 2 ARG C . . . . . . . . . c30448_6cxq 1 . 16 . 1897 . 1 1 2 ARG CA C 2.699 -1.568 2.558 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CA . . . . . . . . . c30448_6cxq 1 . 16 . 1898 . 1 1 2 ARG CB C 2.325 -0.085 2.529 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CB . . . . . . . . . c30448_6cxq 1 . 16 . 1899 . 1 1 2 ARG CD C 3.434 2.101 1.966 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CD . . . . . . . . . c30448_6cxq 1 . 16 . 1900 . 1 1 2 ARG CG C 3.541 0.784 2.720 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CG . . . . . . . . . c30448_6cxq 1 . 16 . 1901 . 1 1 2 ARG CZ C 4.428 3.752 3.502 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CZ . . . . . . . . . c30448_6cxq 1 . 16 . 1902 . 1 1 2 ARG H H 4.630 -1.777 1.723 . . . 1.0 . . . . . . . . . . . . A . 2 ARG H . . . . . . . . . c30448_6cxq 1 . 16 . 1903 . 1 1 2 ARG HA H 2.342 -1.981 3.463 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HA . . . . . . . . . c30448_6cxq 1 . 16 . 1904 . 1 1 2 ARG HB2 H 1.861 0.158 1.570 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB2 . . . . . . . . . c30448_6cxq 1 . 16 . 1905 . 1 1 2 ARG HB3 H 1.627 0.121 3.326 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB3 . . . . . . . . . c30448_6cxq 1 . 16 . 1906 . 1 1 2 ARG HD2 H 4.299 2.206 1.329 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD2 . . . . . . . . . c30448_6cxq 1 . 16 . 1907 . 1 1 2 ARG HD3 H 2.541 2.083 1.359 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD3 . . . . . . . . . c30448_6cxq 1 . 16 . 1908 . 1 1 2 ARG HE H 2.493 3.657 3.020 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HE . . . . . . . . . c30448_6cxq 1 . 16 . 1909 . 1 1 2 ARG HG2 H 3.686 0.979 3.771 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG2 . . . . . . . . . c30448_6cxq 1 . 16 . 1910 . 1 1 2 ARG HG3 H 4.377 0.229 2.352 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG3 . . . . . . . . . c30448_6cxq 1 . 16 . 1911 . 1 1 2 ARG HH11 H 5.750 2.439 2.715 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH11 . . . . . . . . . c30448_6cxq 1 . 16 . 1912 . 1 1 2 ARG HH12 H 6.422 3.608 3.800 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH12 . . . . . . . . . c30448_6cxq 1 . 16 . 1913 . 1 1 2 ARG HH21 H 3.376 5.196 4.447 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH21 . . . . . . . . . c30448_6cxq 1 . 16 . 1914 . 1 1 2 ARG HH22 H 5.075 5.173 4.785 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH22 . . . . . . . . . c30448_6cxq 1 . 16 . 1915 . 1 1 2 ARG N N 4.143 -1.713 2.570 . . . 1.0 . . . . . . . . . . . . A . 2 ARG N . . . . . . . . . c30448_6cxq 1 . 16 . 1916 . 1 1 2 ARG NE N 3.370 3.245 2.872 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NE . . . . . . . . . c30448_6cxq 1 . 16 . 1917 . 1 1 2 ARG NH1 N 5.632 3.223 3.324 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH1 . . . . . . . . . c30448_6cxq 1 . 16 . 1918 . 1 1 2 ARG NH2 N 4.281 4.792 4.311 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH2 . . . . . . . . . c30448_6cxq 1 . 16 . 1919 . 1 1 2 ARG O O 2.682 -2.421 0.322 . . . 1.0 . . . . . . . . . . . . A . 2 ARG O . . . . . . . . . c30448_6cxq 1 . 16 . 1920 . 1 1 3 PHE C C -0.607 -2.185 -0.365 . . . 1.0 . . . . . . . . . . . . A . 3 PHE C . . . . . . . . . c30448_6cxq 1 . 16 . 1921 . 1 1 3 PHE CA C 0.068 -3.281 0.450 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CA . . . . . . . . . c30448_6cxq 1 . 16 . 1922 . 1 1 3 PHE CB C -0.966 -4.270 0.988 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CB . . . . . . . . . c30448_6cxq 1 . 16 . 1923 . 1 1 3 PHE CD1 C -1.591 -6.688 0.932 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CD1 . . . . . . . . . c30448_6cxq 1 . 16 . 1924 . 1 1 3 PHE CD2 C -0.294 -5.841 -0.878 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CD2 . . . . . . . . . c30448_6cxq 1 . 16 . 1925 . 1 1 3 PHE CE1 C -1.590 -7.942 0.352 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CE1 . . . . . . . . . c30448_6cxq 1 . 16 . 1926 . 1 1 3 PHE CE2 C -0.289 -7.092 -1.465 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CE2 . . . . . . . . . c30448_6cxq 1 . 16 . 1927 . 1 1 3 PHE CG C -0.945 -5.625 0.330 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CG . . . . . . . . . c30448_6cxq 1 . 16 . 1928 . 1 1 3 PHE CZ C -0.938 -8.144 -0.849 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CZ . . . . . . . . . c30448_6cxq 1 . 16 . 1929 . 1 1 3 PHE H H 0.348 -2.471 2.382 . . . 1.0 . . . . . . . . . . . . A . 3 PHE H . . . . . . . . . c30448_6cxq 1 . 16 . 1930 . 1 1 3 PHE HA H 0.770 -3.793 -0.173 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HA . . . . . . . . . c30448_6cxq 1 . 16 . 1931 . 1 1 3 PHE HB2 H -0.790 -4.419 2.047 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HB2 . . . . . . . . . c30448_6cxq 1 . 16 . 1932 . 1 1 3 PHE HB3 H -1.950 -3.854 0.846 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HB3 . . . . . . . . . c30448_6cxq 1 . 16 . 1933 . 1 1 3 PHE HD1 H -2.102 -6.526 1.869 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HD1 . . . . . . . . . c30448_6cxq 1 . 16 . 1934 . 1 1 3 PHE HD2 H 0.213 -5.021 -1.364 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HD2 . . . . . . . . . c30448_6cxq 1 . 16 . 1935 . 1 1 3 PHE HE1 H -2.099 -8.762 0.836 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HE1 . . . . . . . . . c30448_6cxq 1 . 16 . 1936 . 1 1 3 PHE HE2 H 0.222 -7.248 -2.403 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HE2 . . . . . . . . . c30448_6cxq 1 . 16 . 1937 . 1 1 3 PHE HZ H -0.936 -9.123 -1.305 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HZ . . . . . . . . . c30448_6cxq 1 . 16 . 1938 . 1 1 3 PHE N N 0.803 -2.655 1.535 . . . 1.0 . . . . . . . . . . . . A . 3 PHE N . . . . . . . . . c30448_6cxq 1 . 16 . 1939 . 1 1 3 PHE O O -1.668 -2.380 -0.958 . . . 1.0 . . . . . . . . . . . . A . 3 PHE O . . . . . . . . . c30448_6cxq 1 . 16 . 1940 . 1 1 4 LEU C C -1.902 0.444 -0.725 . . . 1.0 . . . . . . . . . . . . A . 4 LEU C . . . . . . . . . c30448_6cxq 1 . 16 . 1941 . 1 1 4 LEU CA C -0.441 0.157 -1.062 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CA . . . . . . . . . c30448_6cxq 1 . 16 . 1942 . 1 1 4 LEU CB C -0.267 -0.007 -2.573 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CB . . . . . . . . . c30448_6cxq 1 . 16 . 1943 . 1 1 4 LEU CD1 C 2.022 -0.829 -3.182 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CD1 . . . . . . . . . c30448_6cxq 1 . 16 . 1944 . 1 1 4 LEU CD2 C 0.981 1.036 -4.482 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CD2 . . . . . . . . . c30448_6cxq 1 . 16 . 1945 . 1 1 4 LEU CG C 1.110 0.385 -3.112 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CG . . . . . . . . . c30448_6cxq 1 . 16 . 1946 . 1 1 4 LEU H H 0.870 -0.950 0.140 . . . 1.0 . . . . . . . . . . . . A . 4 LEU H . . . . . . . . . c30448_6cxq 1 . 16 . 1947 . 1 1 4 LEU HA H 0.166 0.987 -0.722 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HA . . . . . . . . . c30448_6cxq 1 . 16 . 1948 . 1 1 4 LEU HB2 H -0.447 -1.043 -2.824 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HB2 . . . . . . . . . c30448_6cxq 1 . 16 . 1949 . 1 1 4 LEU HB3 H -1.009 0.600 -3.068 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HB3 . . . . . . . . . c30448_6cxq 1 . 16 . 1950 . 1 1 4 LEU HD11 H 2.692 -0.729 -4.023 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD11 . . . . . . . . . c30448_6cxq 1 . 16 . 1951 . 1 1 4 LEU HD12 H 1.425 -1.721 -3.301 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD12 . . . . . . . . . c30448_6cxq 1 . 16 . 1952 . 1 1 4 LEU HD13 H 2.597 -0.900 -2.270 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD13 . . . . . . . . . c30448_6cxq 1 . 16 . 1953 . 1 1 4 LEU HD21 H 1.768 1.764 -4.610 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD21 . . . . . . . . . c30448_6cxq 1 . 16 . 1954 . 1 1 4 LEU HD22 H 0.021 1.525 -4.558 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD22 . . . . . . . . . c30448_6cxq 1 . 16 . 1955 . 1 1 4 LEU HD23 H 1.061 0.280 -5.248 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD23 . . . . . . . . . c30448_6cxq 1 . 16 . 1956 . 1 1 4 LEU HG H 1.561 1.103 -2.441 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HG . . . . . . . . . c30448_6cxq 1 . 16 . 1957 . 1 1 4 LEU N N 0.038 -1.020 -0.362 . . . 1.0 . . . . . . . . . . . . A . 4 LEU N . . . . . . . . . c30448_6cxq 1 . 16 . 1958 . 1 1 4 LEU O O -2.509 -0.249 0.091 . . . 1.0 . . . . . . . . . . . . A . 4 LEU O . . . . . . . . . c30448_6cxq 1 . 16 . 1959 . 1 1 5 ARG C C -4.698 1.639 -2.381 . . . 1.0 . . . . . . . . . . . . A . 5 ARG C . . . . . . . . . c30448_6cxq 1 . 16 . 1960 . 1 1 5 ARG CA C -3.851 1.849 -1.128 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CA . . . . . . . . . c30448_6cxq 1 . 16 . 1961 . 1 1 5 ARG CB C -3.933 3.309 -0.693 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CB . . . . . . . . . c30448_6cxq 1 . 16 . 1962 . 1 1 5 ARG CD C -1.830 4.444 -1.278 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CD . . . . . . . . . c30448_6cxq 1 . 16 . 1963 . 1 1 5 ARG CG C -3.263 4.250 -1.660 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CG . . . . . . . . . c30448_6cxq 1 . 16 . 1964 . 1 1 5 ARG CZ C 0.153 5.497 -2.295 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CZ . . . . . . . . . c30448_6cxq 1 . 16 . 1965 . 1 1 5 ARG H H -1.926 1.985 -2.000 . . . 1.0 . . . . . . . . . . . . A . 5 ARG H . . . . . . . . . c30448_6cxq 1 . 16 . 1966 . 1 1 5 ARG HA H -4.230 1.230 -0.337 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HA . . . . . . . . . c30448_6cxq 1 . 16 . 1967 . 1 1 5 ARG HB2 H -4.969 3.601 -0.607 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HB2 . . . . . . . . . c30448_6cxq 1 . 16 . 1968 . 1 1 5 ARG HB3 H -3.446 3.413 0.274 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HB3 . . . . . . . . . c30448_6cxq 1 . 16 . 1969 . 1 1 5 ARG HD2 H -1.801 5.196 -0.523 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HD2 . . . . . . . . . c30448_6cxq 1 . 16 . 1970 . 1 1 5 ARG HD3 H -1.453 3.512 -0.879 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HD3 . . . . . . . . . c30448_6cxq 1 . 16 . 1971 . 1 1 5 ARG HE H -1.336 4.637 -3.311 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HE . . . . . . . . . c30448_6cxq 1 . 16 . 1972 . 1 1 5 ARG HG2 H -3.305 3.836 -2.648 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HG2 . . . . . . . . . c30448_6cxq 1 . 16 . 1973 . 1 1 5 ARG HG3 H -3.768 5.204 -1.638 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HG3 . . . . . . . . . c30448_6cxq 1 . 16 . 1974 . 1 1 5 ARG HH11 H 0.123 5.553 -0.274 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH11 . . . . . . . . . c30448_6cxq 1 . 16 . 1975 . 1 1 5 ARG HH12 H 1.504 6.287 -1.016 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH12 . . . . . . . . . c30448_6cxq 1 . 16 . 1976 . 1 1 5 ARG HH21 H 0.482 5.602 -4.286 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH21 . . . . . . . . . c30448_6cxq 1 . 16 . 1977 . 1 1 5 ARG HH22 H 1.708 6.315 -3.293 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH22 . . . . . . . . . c30448_6cxq 1 . 16 . 1978 . 1 1 5 ARG N N -2.461 1.470 -1.360 . . . 1.0 . . . . . . . . . . . . A . 5 ARG N . . . . . . . . . c30448_6cxq 1 . 16 . 1979 . 1 1 5 ARG NE N -1.006 4.853 -2.413 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NE . . . . . . . . . c30448_6cxq 1 . 16 . 1980 . 1 1 5 ARG NH1 N 0.632 5.804 -1.096 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NH1 . . . . . . . . . c30448_6cxq 1 . 16 . 1981 . 1 1 5 ARG NH2 N 0.837 5.832 -3.381 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NH2 . . . . . . . . . c30448_6cxq 1 . 16 . 1982 . 1 1 5 ARG O O -5.854 2.060 -2.435 . . . 1.0 . . . . . . . . . . . . A . 5 ARG O . . . . . . . . . c30448_6cxq 1 . 16 . 1983 . 1 1 6 HIS C C -6.180 0.090 -4.391 . . . 1.0 . . . . . . . . . . . . A . 6 HIS C . . . . . . . . . c30448_6cxq 1 . 16 . 1984 . 1 1 6 HIS CA C -4.822 0.740 -4.644 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CA . . . . . . . . . c30448_6cxq 1 . 16 . 1985 . 1 1 6 HIS CB C -3.978 -0.155 -5.553 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CB . . . . . . . . . c30448_6cxq 1 . 16 . 1986 . 1 1 6 HIS CD2 C -3.029 -1.877 -3.861 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CD2 . . . . . . . . . c30448_6cxq 1 . 16 . 1987 . 1 1 6 HIS CE1 C -3.768 -3.706 -4.818 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CE1 . . . . . . . . . c30448_6cxq 1 . 16 . 1988 . 1 1 6 HIS CG C -3.708 -1.509 -4.973 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CG . . . . . . . . . c30448_6cxq 1 . 16 . 1989 . 1 1 6 HIS H H -3.193 0.686 -3.296 . . . 1.0 . . . . . . . . . . . . A . 6 HIS H . . . . . . . . . c30448_6cxq 1 . 16 . 1990 . 1 1 6 HIS HA H -4.975 1.691 -5.133 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HA . . . . . . . . . c30448_6cxq 1 . 16 . 1991 . 1 1 6 HIS HB2 H -4.498 -0.294 -6.493 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HB2 . . . . . . . . . c30448_6cxq 1 . 16 . 1992 . 1 1 6 HIS HB3 H -3.024 0.327 -5.736 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HB3 . . . . . . . . . c30448_6cxq 1 . 16 . 1993 . 1 1 6 HIS HD1 H -4.685 -2.744 -6.374 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HD1 . . . . . . . . . c30448_6cxq 1 . 16 . 1994 . 1 1 6 HIS HD2 H -2.537 -1.216 -3.162 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HD2 . . . . . . . . . c30448_6cxq 1 . 16 . 1995 . 1 1 6 HIS HE1 H -3.975 -4.745 -5.027 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HE1 . . . . . . . . . c30448_6cxq 1 . 16 . 1996 . 1 1 6 HIS HE2 H -2.605 -3.801 -3.135 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HE2 . . . . . . . . . c30448_6cxq 1 . 16 . 1997 . 1 1 6 HIS N N -4.118 0.994 -3.391 . . . 1.0 . . . . . . . . . . . . A . 6 HIS N . . . . . . . . . c30448_6cxq 1 . 16 . 1998 . 1 1 6 HIS ND1 N -4.158 -2.678 -5.550 . . . 1.0 . . . . . . . . . . . . A . 6 HIS ND1 . . . . . . . . . c30448_6cxq 1 . 16 . 1999 . 1 1 6 HIS NE2 N -3.081 -3.247 -3.788 . . . 1.0 . . . . . . . . . . . . A . 6 HIS NE2 . . . . . . . . . c30448_6cxq 1 . 16 . 2000 . 1 1 6 HIS O O -7.165 0.512 -5.033 . . . 1.0 . . . . . . . . . . . . A . 6 HIS O . . . . . . . . . c30448_6cxq 1 . 17 . 2001 . 1 1 1 HIS C C 4.843 -1.689 3.699 . . . 1.0 . . . . . . . . . . . . A . 1 HIS C . . . . . . . . . c30448_6cxq 1 . 17 . 2002 . 1 1 1 HIS CA C 6.352 -1.755 3.563 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CA . . . . . . . . . c30448_6cxq 1 . 17 . 2003 . 1 1 1 HIS CB C 6.757 -2.694 2.423 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CB . . . . . . . . . c30448_6cxq 1 . 17 . 2004 . 1 1 1 HIS CD2 C 7.334 -2.274 -0.071 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CD2 . . . . . . . . . c30448_6cxq 1 . 17 . 2005 . 1 1 1 HIS CE1 C 8.515 -0.445 0.177 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CE1 . . . . . . . . . c30448_6cxq 1 . 17 . 2006 . 1 1 1 HIS CG C 7.365 -1.987 1.252 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CG . . . . . . . . . c30448_6cxq 1 . 17 . 2007 . 1 1 1 HIS H1 H 6.491 -1.780 5.615 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H1 . . . . . . . . . c30448_6cxq 1 . 17 . 2008 . 1 1 1 HIS H2 H 7.988 -1.951 4.795 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H2 . . . . . . . . . c30448_6cxq 1 . 17 . 2009 . 1 1 1 HIS H3 H 6.885 -3.265 4.855 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H3 . . . . . . . . . c30448_6cxq 1 . 17 . 2010 . 1 1 1 HIS HA H 6.710 -0.756 3.352 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HA . . . . . . . . . c30448_6cxq 1 . 17 . 2011 . 1 1 1 HIS HB2 H 7.481 -3.405 2.792 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HB2 . . . . . . . . . c30448_6cxq 1 . 17 . 2012 . 1 1 1 HIS HB3 H 5.884 -3.225 2.074 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HB3 . . . . . . . . . c30448_6cxq 1 . 17 . 2013 . 1 1 1 HIS HD1 H 8.321 -0.372 2.212 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HD1 . . . . . . . . . c30448_6cxq 1 . 17 . 2014 . 1 1 1 HIS HD2 H 6.833 -3.114 -0.533 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HD2 . . . . . . . . . c30448_6cxq 1 . 17 . 2015 . 1 1 1 HIS HE1 H 9.118 0.427 -0.035 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HE1 . . . . . . . . . c30448_6cxq 1 . 17 . 2016 . 1 1 1 HIS HE2 H 8.281 -1.297 -1.670 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HE2 . . . . . . . . . c30448_6cxq 1 . 17 . 2017 . 1 1 1 HIS N N 6.986 -2.231 4.820 . . . 1.0 . . . . . . . . . . . . A . 1 HIS N . . . . . . . . . c30448_6cxq 1 . 17 . 2018 . 1 1 1 HIS ND1 N 8.114 -0.835 1.374 . . . 1.0 . . . . . . . . . . . . A . 1 HIS ND1 . . . . . . . . . c30448_6cxq 1 . 17 . 2019 . 1 1 1 HIS NE2 N 8.056 -1.301 -0.716 . . . 1.0 . . . . . . . . . . . . A . 1 HIS NE2 . . . . . . . . . c30448_6cxq 1 . 17 . 2020 . 1 1 1 HIS O O 4.315 -1.600 4.808 . . . 1.0 . . . . . . . . . . . . A . 1 HIS O . . . . . . . . . c30448_6cxq 1 . 17 . 2021 . 1 1 2 ARG C C 2.053 -2.301 1.424 . . . 1.0 . . . . . . . . . . . . A . 2 ARG C . . . . . . . . . c30448_6cxq 1 . 17 . 2022 . 1 1 2 ARG CA C 2.699 -1.583 2.593 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CA . . . . . . . . . c30448_6cxq 1 . 17 . 2023 . 1 1 2 ARG CB C 2.288 -0.110 2.579 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CB . . . . . . . . . c30448_6cxq 1 . 17 . 2024 . 1 1 2 ARG CD C 3.326 2.115 2.044 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CD . . . . . . . . . c30448_6cxq 1 . 17 . 2025 . 1 1 2 ARG CG C 3.481 0.790 2.771 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CG . . . . . . . . . c30448_6cxq 1 . 17 . 2026 . 1 1 2 ARG CZ C 1.576 3.396 3.220 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CZ . . . . . . . . . c30448_6cxq 1 . 17 . 2027 . 1 1 2 ARG H H 4.614 -1.730 1.709 . . . 1.0 . . . . . . . . . . . . A . 2 ARG H . . . . . . . . . c30448_6cxq 1 . 17 . 2028 . 1 1 2 ARG HA H 2.376 -2.007 3.505 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HA . . . . . . . . . c30448_6cxq 1 . 17 . 2029 . 1 1 2 ARG HB2 H 1.814 0.128 1.624 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB2 . . . . . . . . . c30448_6cxq 1 . 17 . 2030 . 1 1 2 ARG HB3 H 1.588 0.071 3.380 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB3 . . . . . . . . . c30448_6cxq 1 . 17 . 2031 . 1 1 2 ARG HD2 H 4.283 2.400 1.634 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD2 . . . . . . . . . c30448_6cxq 1 . 17 . 2032 . 1 1 2 ARG HD3 H 2.615 1.990 1.241 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD3 . . . . . . . . . c30448_6cxq 1 . 17 . 2033 . 1 1 2 ARG HE H 3.535 3.760 3.335 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HE . . . . . . . . . c30448_6cxq 1 . 17 . 2034 . 1 1 2 ARG HG2 H 3.635 0.968 3.824 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG2 . . . . . . . . . c30448_6cxq 1 . 17 . 2035 . 1 1 2 ARG HG3 H 4.327 0.266 2.382 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG3 . . . . . . . . . c30448_6cxq 1 . 17 . 2036 . 1 1 2 ARG HH11 H 0.872 1.877 2.085 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH11 . . . . . . . . . c30448_6cxq 1 . 17 . 2037 . 1 1 2 ARG HH12 H -0.332 2.799 2.919 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH12 . . . . . . . . . c30448_6cxq 1 . 17 . 2038 . 1 1 2 ARG HH21 H 1.950 4.970 4.432 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH21 . . . . . . . . . c30448_6cxq 1 . 17 . 2039 . 1 1 2 ARG HH22 H 0.279 4.553 4.251 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH22 . . . . . . . . . c30448_6cxq 1 . 17 . 2040 . 1 1 2 ARG N N 4.146 -1.689 2.568 . . . 1.0 . . . . . . . . . . . . A . 2 ARG N . . . . . . . . . c30448_6cxq 1 . 17 . 2041 . 1 1 2 ARG NE N 2.858 3.177 2.932 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NE . . . . . . . . . c30448_6cxq 1 . 17 . 2042 . 1 1 2 ARG NH1 N 0.628 2.627 2.698 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH1 . . . . . . . . . c30448_6cxq 1 . 17 . 2043 . 1 1 2 ARG NH2 N 1.241 4.388 4.034 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH2 . . . . . . . . . c30448_6cxq 1 . 17 . 2044 . 1 1 2 ARG O O 2.660 -2.457 0.364 . . . 1.0 . . . . . . . . . . . . A . 2 ARG O . . . . . . . . . c30448_6cxq 1 . 17 . 2045 . 1 1 3 PHE C C -0.625 -2.237 -0.299 . . . 1.0 . . . . . . . . . . . . A . 3 PHE C . . . . . . . . . c30448_6cxq 1 . 17 . 2046 . 1 1 3 PHE CA C 0.048 -3.322 0.530 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CA . . . . . . . . . c30448_6cxq 1 . 17 . 2047 . 1 1 3 PHE CB C -0.987 -4.294 1.091 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CB . . . . . . . . . c30448_6cxq 1 . 17 . 2048 . 1 1 3 PHE CD1 C -1.761 -6.663 0.919 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CD1 . . . . . . . . . c30448_6cxq 1 . 17 . 2049 . 1 1 3 PHE CD2 C -0.551 -5.757 -0.923 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CD2 . . . . . . . . . c30448_6cxq 1 . 17 . 2050 . 1 1 3 PHE CE1 C -1.880 -7.868 0.254 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CE1 . . . . . . . . . c30448_6cxq 1 . 17 . 2051 . 1 1 3 PHE CE2 C -0.666 -6.960 -1.594 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CE2 . . . . . . . . . c30448_6cxq 1 . 17 . 2052 . 1 1 3 PHE CG C -1.098 -5.596 0.343 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CG . . . . . . . . . c30448_6cxq 1 . 17 . 2053 . 1 1 3 PHE CZ C -1.331 -8.017 -1.004 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CZ . . . . . . . . . c30448_6cxq 1 . 17 . 2054 . 1 1 3 PHE H H 0.349 -2.493 2.451 . . . 1.0 . . . . . . . . . . . . A . 3 PHE H . . . . . . . . . c30448_6cxq 1 . 17 . 2055 . 1 1 3 PHE HA H 0.741 -3.852 -0.088 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HA . . . . . . . . . c30448_6cxq 1 . 17 . 2056 . 1 1 3 PHE HB2 H -0.731 -4.526 2.118 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HB2 . . . . . . . . . c30448_6cxq 1 . 17 . 2057 . 1 1 3 PHE HB3 H -1.953 -3.819 1.064 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HB3 . . . . . . . . . c30448_6cxq 1 . 17 . 2058 . 1 1 3 PHE HD1 H -2.191 -6.543 1.901 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HD1 . . . . . . . . . c30448_6cxq 1 . 17 . 2059 . 1 1 3 PHE HD2 H -0.032 -4.932 -1.387 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HD2 . . . . . . . . . c30448_6cxq 1 . 17 . 2060 . 1 1 3 PHE HE1 H -2.400 -8.693 0.718 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HE1 . . . . . . . . . c30448_6cxq 1 . 17 . 2061 . 1 1 3 PHE HE2 H -0.235 -7.073 -2.578 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HE2 . . . . . . . . . c30448_6cxq 1 . 17 . 2062 . 1 1 3 PHE HZ H -1.422 -8.958 -1.526 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HZ . . . . . . . . . c30448_6cxq 1 . 17 . 2063 . 1 1 3 PHE N N 0.796 -2.684 1.600 . . . 1.0 . . . . . . . . . . . . A . 3 PHE N . . . . . . . . . c30448_6cxq 1 . 17 . 2064 . 1 1 3 PHE O O -1.683 -2.442 -0.895 . . . 1.0 . . . . . . . . . . . . A . 3 PHE O . . . . . . . . . c30448_6cxq 1 . 17 . 2065 . 1 1 4 LEU C C -1.931 0.373 -0.710 . . . 1.0 . . . . . . . . . . . . A . 4 LEU C . . . . . . . . . c30448_6cxq 1 . 17 . 2066 . 1 1 4 LEU CA C -0.461 0.099 -1.020 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CA . . . . . . . . . c30448_6cxq 1 . 17 . 2067 . 1 1 4 LEU CB C -0.256 -0.070 -2.527 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CB . . . . . . . . . c30448_6cxq 1 . 17 . 2068 . 1 1 4 LEU CD1 C 1.829 -1.386 -2.986 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CD1 . . . . . . . . . c30448_6cxq 1 . 17 . 2069 . 1 1 4 LEU CD2 C 1.287 0.620 -4.378 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CD2 . . . . . . . . . c30448_6cxq 1 . 17 . 2070 . 1 1 4 LEU CG C 1.200 -0.001 -2.992 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CG . . . . . . . . . c30448_6cxq 1 . 17 . 2071 . 1 1 4 LEU H H 0.846 -0.994 0.198 . . . 1.0 . . . . . . . . . . . . A . 4 LEU H . . . . . . . . . c30448_6cxq 1 . 17 . 2072 . 1 1 4 LEU HA H 0.132 0.937 -0.674 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HA . . . . . . . . . c30448_6cxq 1 . 17 . 2073 . 1 1 4 LEU HB2 H -0.661 -1.029 -2.818 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HB2 . . . . . . . . . c30448_6cxq 1 . 17 . 2074 . 1 1 4 LEU HB3 H -0.810 0.705 -3.034 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HB3 . . . . . . . . . c30448_6cxq 1 . 17 . 2075 . 1 1 4 LEU HD11 H 1.592 -1.893 -3.910 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD11 . . . . . . . . . c30448_6cxq 1 . 17 . 2076 . 1 1 4 LEU HD12 H 1.441 -1.954 -2.154 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD12 . . . . . . . . . c30448_6cxq 1 . 17 . 2077 . 1 1 4 LEU HD13 H 2.901 -1.294 -2.891 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD13 . . . . . . . . . c30448_6cxq 1 . 17 . 2078 . 1 1 4 LEU HD21 H 1.462 1.682 -4.287 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD21 . . . . . . . . . c30448_6cxq 1 . 17 . 2079 . 1 1 4 LEU HD22 H 0.361 0.452 -4.907 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD22 . . . . . . . . . c30448_6cxq 1 . 17 . 2080 . 1 1 4 LEU HD23 H 2.101 0.167 -4.925 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD23 . . . . . . . . . c30448_6cxq 1 . 17 . 2081 . 1 1 4 LEU HG H 1.760 0.622 -2.310 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HG . . . . . . . . . c30448_6cxq 1 . 17 . 2082 . 1 1 4 LEU N N 0.017 -1.071 -0.306 . . . 1.0 . . . . . . . . . . . . A . 4 LEU N . . . . . . . . . c30448_6cxq 1 . 17 . 2083 . 1 1 4 LEU O O -2.550 -0.333 0.085 . . . 1.0 . . . . . . . . . . . . A . 4 LEU O . . . . . . . . . c30448_6cxq 1 . 17 . 2084 . 1 1 5 ARG C C -4.685 1.655 -2.420 . . . 1.0 . . . . . . . . . . . . A . 5 ARG C . . . . . . . . . c30448_6cxq 1 . 17 . 2085 . 1 1 5 ARG CA C -3.880 1.772 -1.128 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CA . . . . . . . . . c30448_6cxq 1 . 17 . 2086 . 1 1 5 ARG CB C -3.973 3.197 -0.591 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CB . . . . . . . . . c30448_6cxq 1 . 17 . 2087 . 1 1 5 ARG CD C -1.853 4.358 -1.047 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CD . . . . . . . . . c30448_6cxq 1 . 17 . 2088 . 1 1 5 ARG CG C -3.279 4.203 -1.472 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CG . . . . . . . . . c30448_6cxq 1 . 17 . 2089 . 1 1 5 ARG CZ C 0.157 5.467 -1.944 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CZ . . . . . . . . . c30448_6cxq 1 . 17 . 2090 . 1 1 5 ARG H H -1.940 1.933 -1.961 . . . 1.0 . . . . . . . . . . . . A . 5 ARG H . . . . . . . . . c30448_6cxq 1 . 17 . 2091 . 1 1 5 ARG HA H -4.286 1.099 -0.396 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HA . . . . . . . . . c30448_6cxq 1 . 17 . 2092 . 1 1 5 ARG HB2 H -5.011 3.484 -0.511 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HB2 . . . . . . . . . c30448_6cxq 1 . 17 . 2093 . 1 1 5 ARG HB3 H -3.510 3.231 0.392 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HB3 . . . . . . . . . c30448_6cxq 1 . 17 . 2094 . 1 1 5 ARG HD2 H -1.837 5.054 -0.239 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HD2 . . . . . . . . . c30448_6cxq 1 . 17 . 2095 . 1 1 5 ARG HD3 H -1.490 3.398 -0.708 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HD3 . . . . . . . . . c30448_6cxq 1 . 17 . 2096 . 1 1 5 ARG HE H -1.316 4.695 -3.051 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HE . . . . . . . . . c30448_6cxq 1 . 17 . 2097 . 1 1 5 ARG HG2 H -3.303 3.864 -2.488 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HG2 . . . . . . . . . c30448_6cxq 1 . 17 . 2098 . 1 1 5 ARG HG3 H -3.780 5.156 -1.388 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HG3 . . . . . . . . . c30448_6cxq 1 . 17 . 2099 . 1 1 5 ARG HH11 H 0.088 5.369 0.075 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH11 . . . . . . . . . c30448_6cxq 1 . 17 . 2100 . 1 1 5 ARG HH12 H 1.487 6.148 -0.583 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH12 . . . . . . . . . c30448_6cxq 1 . 17 . 2101 . 1 1 5 ARG HH21 H 0.526 5.719 -3.915 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH21 . . . . . . . . . c30448_6cxq 1 . 17 . 2102 . 1 1 5 ARG HH22 H 1.736 6.347 -2.847 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH22 . . . . . . . . . c30448_6cxq 1 . 17 . 2103 . 1 1 5 ARG N N -2.483 1.405 -1.341 . . . 1.0 . . . . . . . . . . . . A . 5 ARG N . . . . . . . . . c30448_6cxq 1 . 17 . 2104 . 1 1 5 ARG NE N -1.004 4.843 -2.132 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NE . . . . . . . . . c30448_6cxq 1 . 17 . 2105 . 1 1 5 ARG NH1 N 0.615 5.678 -0.717 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NH1 . . . . . . . . . c30448_6cxq 1 . 17 . 2106 . 1 1 5 ARG NH2 N 0.865 5.878 -2.988 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NH2 . . . . . . . . . c30448_6cxq 1 . 17 . 2107 . 1 1 5 ARG O O -5.802 2.165 -2.511 . . . 1.0 . . . . . . . . . . . . A . 5 ARG O . . . . . . . . . c30448_6cxq 1 . 17 . 2108 . 1 1 6 HIS C C -6.207 0.310 -4.527 . . . 1.0 . . . . . . . . . . . . A . 6 HIS C . . . . . . . . . c30448_6cxq 1 . 17 . 2109 . 1 1 6 HIS CA C -4.777 0.816 -4.707 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CA . . . . . . . . . c30448_6cxq 1 . 17 . 2110 . 1 1 6 HIS CB C -3.984 -0.153 -5.589 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CB . . . . . . . . . c30448_6cxq 1 . 17 . 2111 . 1 1 6 HIS CD2 C -4.144 -2.737 -5.763 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CD2 . . . . . . . . . c30448_6cxq 1 . 17 . 2112 . 1 1 6 HIS CE1 C -3.905 -3.219 -3.638 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CE1 . . . . . . . . . c30448_6cxq 1 . 17 . 2113 . 1 1 6 HIS CG C -3.998 -1.568 -5.095 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CG . . . . . . . . . c30448_6cxq 1 . 17 . 2114 . 1 1 6 HIS H H -3.218 0.609 -3.292 . . . 1.0 . . . . . . . . . . . . A . 6 HIS H . . . . . . . . . c30448_6cxq 1 . 17 . 2115 . 1 1 6 HIS HA H -4.808 1.781 -5.190 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HA . . . . . . . . . c30448_6cxq 1 . 17 . 2116 . 1 1 6 HIS HB2 H -4.406 -0.147 -6.586 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HB2 . . . . . . . . . c30448_6cxq 1 . 17 . 2117 . 1 1 6 HIS HB3 H -2.951 0.175 -5.632 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HB3 . . . . . . . . . c30448_6cxq 1 . 17 . 2118 . 1 1 6 HIS HD1 H -3.725 -1.276 -3.025 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HD1 . . . . . . . . . c30448_6cxq 1 . 17 . 2119 . 1 1 6 HIS HD2 H -4.284 -2.854 -6.829 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HD2 . . . . . . . . . c30448_6cxq 1 . 17 . 2120 . 1 1 6 HIS HE1 H -3.820 -3.768 -2.711 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HE1 . . . . . . . . . c30448_6cxq 1 . 17 . 2121 . 1 1 6 HIS HE2 H -4.226 -4.699 -5.017 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HE2 . . . . . . . . . c30448_6cxq 1 . 17 . 2122 . 1 1 6 HIS N N -4.111 0.989 -3.420 . . . 1.0 . . . . . . . . . . . . A . 6 HIS N . . . . . . . . . c30448_6cxq 1 . 17 . 2123 . 1 1 6 HIS ND1 N -3.851 -1.905 -3.765 . . . 1.0 . . . . . . . . . . . . A . 6 HIS ND1 . . . . . . . . . c30448_6cxq 1 . 17 . 2124 . 1 1 6 HIS NE2 N -4.083 -3.747 -4.834 . . . 1.0 . . . . . . . . . . . . A . 6 HIS NE2 . . . . . . . . . c30448_6cxq 1 . 17 . 2125 . 1 1 6 HIS O O -6.506 -0.243 -3.447 . . . 1.0 . . . . . . . . . . . . A . 6 HIS O . . . . . . . . . c30448_6cxq 1 . 18 . 2126 . 1 1 1 HIS C C 4.849 -1.615 3.693 . . . 1.0 . . . . . . . . . . . . A . 1 HIS C . . . . . . . . . c30448_6cxq 1 . 18 . 2127 . 1 1 1 HIS CA C 6.358 -1.693 3.562 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CA . . . . . . . . . c30448_6cxq 1 . 18 . 2128 . 1 1 1 HIS CB C 6.763 -2.726 2.507 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CB . . . . . . . . . c30448_6cxq 1 . 18 . 2129 . 1 1 1 HIS CD2 C 8.434 -2.683 0.523 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CD2 . . . . . . . . . c30448_6cxq 1 . 18 . 2130 . 1 1 1 HIS CE1 C 8.137 -0.602 -0.100 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CE1 . . . . . . . . . c30448_6cxq 1 . 18 . 2131 . 1 1 1 HIS CG C 7.511 -2.138 1.351 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CG . . . . . . . . . c30448_6cxq 1 . 18 . 2132 . 1 1 1 HIS H1 H 8.016 -2.144 4.694 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H1 . . . . . . . . . c30448_6cxq 1 . 18 . 2133 . 1 1 1 HIS H2 H 6.584 -2.966 5.162 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H2 . . . . . . . . . c30448_6cxq 1 . 18 . 2134 . 1 1 1 HIS H3 H 6.783 -1.303 5.537 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H3 . . . . . . . . . c30448_6cxq 1 . 18 . 2135 . 1 1 1 HIS HA H 6.716 -0.716 3.266 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HA . . . . . . . . . c30448_6cxq 1 . 18 . 2136 . 1 1 1 HIS HB2 H 7.397 -3.469 2.967 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HB2 . . . . . . . . . c30448_6cxq 1 . 18 . 2137 . 1 1 1 HIS HB3 H 5.876 -3.207 2.121 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HB3 . . . . . . . . . c30448_6cxq 1 . 18 . 2138 . 1 1 1 HIS HD1 H 6.742 -0.176 1.335 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HD1 . . . . . . . . . c30448_6cxq 1 . 18 . 2139 . 1 1 1 HIS HD2 H 8.807 -3.697 0.558 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HD2 . . . . . . . . . c30448_6cxq 1 . 18 . 2140 . 1 1 1 HIS HE1 H 8.222 0.333 -0.633 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HE1 . . . . . . . . . c30448_6cxq 1 . 18 . 2141 . 1 1 1 HIS HE2 H 9.525 -1.786 -1.030 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HE2 . . . . . . . . . c30448_6cxq 1 . 18 . 2142 . 1 1 1 HIS N N 6.993 -2.059 4.855 . . . 1.0 . . . . . . . . . . . . A . 1 HIS N . . . . . . . . . c30448_6cxq 1 . 18 . 2143 . 1 1 1 HIS ND1 N 7.348 -0.833 0.934 . . . 1.0 . . . . . . . . . . . . A . 1 HIS ND1 . . . . . . . . . c30448_6cxq 1 . 18 . 2144 . 1 1 1 HIS NE2 N 8.807 -1.707 -0.368 . . . 1.0 . . . . . . . . . . . . A . 1 HIS NE2 . . . . . . . . . c30448_6cxq 1 . 18 . 2145 . 1 1 1 HIS O O 4.321 -1.466 4.795 . . . 1.0 . . . . . . . . . . . . A . 1 HIS O . . . . . . . . . c30448_6cxq 1 . 18 . 2146 . 1 1 2 ARG C C 2.059 -2.338 1.453 . . . 1.0 . . . . . . . . . . . . A . 2 ARG C . . . . . . . . . c30448_6cxq 1 . 18 . 2147 . 1 1 2 ARG CA C 2.708 -1.561 2.582 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CA . . . . . . . . . c30448_6cxq 1 . 18 . 2148 . 1 1 2 ARG CB C 2.301 -0.090 2.491 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CB . . . . . . . . . c30448_6cxq 1 . 18 . 2149 . 1 1 2 ARG CD C 3.345 2.103 1.846 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CD . . . . . . . . . c30448_6cxq 1 . 18 . 2150 . 1 1 2 ARG CG C 3.498 0.813 2.635 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CG . . . . . . . . . c30448_6cxq 1 . 18 . 2151 . 1 1 2 ARG CZ C 2.756 4.446 2.328 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CZ . . . . . . . . . c30448_6cxq 1 . 18 . 2152 . 1 1 2 ARG H H 4.623 -1.761 1.708 . . . 1.0 . . . . . . . . . . . . A . 2 ARG H . . . . . . . . . c30448_6cxq 1 . 18 . 2153 . 1 1 2 ARG HA H 2.383 -1.936 3.515 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HA . . . . . . . . . c30448_6cxq 1 . 18 . 2154 . 1 1 2 ARG HB2 H 1.827 0.100 1.525 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB2 . . . . . . . . . c30448_6cxq 1 . 18 . 2155 . 1 1 2 ARG HB3 H 1.603 0.135 3.283 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB3 . . . . . . . . . c30448_6cxq 1 . 18 . 2156 . 1 1 2 ARG HD2 H 4.324 2.442 1.543 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD2 . . . . . . . . . c30448_6cxq 1 . 18 . 2157 . 1 1 2 ARG HD3 H 2.746 1.904 0.970 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD3 . . . . . . . . . c30448_6cxq 1 . 18 . 2158 . 1 1 2 ARG HE H 2.202 2.878 3.430 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HE . . . . . . . . . c30448_6cxq 1 . 18 . 2159 . 1 1 2 ARG HG2 H 3.656 1.041 3.678 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG2 . . . . . . . . . c30448_6cxq 1 . 18 . 2160 . 1 1 2 ARG HG3 H 4.341 0.268 2.269 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG3 . . . . . . . . . c30448_6cxq 1 . 18 . 2161 . 1 1 2 ARG HH11 H 3.893 4.190 0.674 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH11 . . . . . . . . . c30448_6cxq 1 . 18 . 2162 . 1 1 2 ARG HH12 H 3.463 5.829 1.033 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH12 . . . . . . . . . c30448_6cxq 1 . 18 . 2163 . 1 1 2 ARG HH21 H 1.635 5.032 3.904 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH21 . . . . . . . . . c30448_6cxq 1 . 18 . 2164 . 1 1 2 ARG HH22 H 2.182 6.307 2.867 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH22 . . . . . . . . . c30448_6cxq 1 . 18 . 2165 . 1 1 2 ARG N N 4.154 -1.674 2.564 . . . 1.0 . . . . . . . . . . . . A . 2 ARG N . . . . . . . . . c30448_6cxq 1 . 18 . 2166 . 1 1 2 ARG NE N 2.702 3.152 2.633 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NE . . . . . . . . . c30448_6cxq 1 . 18 . 2167 . 1 1 2 ARG NH1 N 3.426 4.855 1.257 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH1 . . . . . . . . . c30448_6cxq 1 . 18 . 2168 . 1 1 2 ARG NH2 N 2.141 5.335 3.096 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH2 . . . . . . . . . c30448_6cxq 1 . 18 . 2169 . 1 1 2 ARG O O 2.661 -2.544 0.399 . . . 1.0 . . . . . . . . . . . . A . 2 ARG O . . . . . . . . . c30448_6cxq 1 . 18 . 2170 . 1 1 3 PHE C C -0.630 -2.363 -0.252 . . . 1.0 . . . . . . . . . . . . A . 3 PHE C . . . . . . . . . c30448_6cxq 1 . 18 . 2171 . 1 1 3 PHE CA C 0.052 -3.407 0.622 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CA . . . . . . . . . c30448_6cxq 1 . 18 . 2172 . 1 1 3 PHE CB C -0.978 -4.353 1.238 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CB . . . . . . . . . c30448_6cxq 1 . 18 . 2173 . 1 1 3 PHE CD1 C -1.606 -6.766 1.355 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CD1 . . . . . . . . . c30448_6cxq 1 . 18 . 2174 . 1 1 3 PHE CD2 C -0.356 -6.042 -0.540 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CD2 . . . . . . . . . c30448_6cxq 1 . 18 . 2175 . 1 1 3 PHE CE1 C -1.622 -8.055 0.857 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CE1 . . . . . . . . . c30448_6cxq 1 . 18 . 2176 . 1 1 3 PHE CE2 C -0.369 -7.330 -1.044 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CE2 . . . . . . . . . c30448_6cxq 1 . 18 . 2177 . 1 1 3 PHE CG C -0.975 -5.748 0.668 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CG . . . . . . . . . c30448_6cxq 1 . 18 . 2178 . 1 1 3 PHE CZ C -1.002 -8.337 -0.344 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CZ . . . . . . . . . c30448_6cxq 1 . 18 . 2179 . 1 1 3 PHE H H 0.361 -2.483 2.498 . . . 1.0 . . . . . . . . . . . . A . 3 PHE H . . . . . . . . . c30448_6cxq 1 . 18 . 2180 . 1 1 3 PHE HA H 0.744 -3.962 0.024 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HA . . . . . . . . . c30448_6cxq 1 . 18 . 2181 . 1 1 3 PHE HB2 H -0.786 -4.435 2.301 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HB2 . . . . . . . . . c30448_6cxq 1 . 18 . 2182 . 1 1 3 PHE HB3 H -1.962 -3.941 1.085 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HB3 . . . . . . . . . c30448_6cxq 1 . 18 . 2183 . 1 1 3 PHE HD1 H -2.092 -6.543 2.292 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HD1 . . . . . . . . . c30448_6cxq 1 . 18 . 2184 . 1 1 3 PHE HD2 H 0.138 -5.257 -1.090 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HD2 . . . . . . . . . c30448_6cxq 1 . 18 . 2185 . 1 1 3 PHE HE1 H -2.119 -8.841 1.407 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HE1 . . . . . . . . . c30448_6cxq 1 . 18 . 2186 . 1 1 3 PHE HE2 H 0.117 -7.547 -1.984 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HE2 . . . . . . . . . c30448_6cxq 1 . 18 . 2187 . 1 1 3 PHE HZ H -1.014 -9.344 -0.736 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HZ . . . . . . . . . c30448_6cxq 1 . 18 . 2188 . 1 1 3 PHE N N 0.803 -2.715 1.654 . . . 1.0 . . . . . . . . . . . . A . 3 PHE N . . . . . . . . . c30448_6cxq 1 . 18 . 2189 . 1 1 3 PHE O O -1.700 -2.591 -0.816 . . . 1.0 . . . . . . . . . . . . A . 3 PHE O . . . . . . . . . c30448_6cxq 1 . 18 . 2190 . 1 1 4 LEU C C -1.920 0.252 -0.744 . . . 1.0 . . . . . . . . . . . . A . 4 LEU C . . . . . . . . . c30448_6cxq 1 . 18 . 2191 . 1 1 4 LEU CA C -0.469 -0.069 -1.095 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CA . . . . . . . . . c30448_6cxq 1 . 18 . 2192 . 1 1 4 LEU CB C -0.332 -0.331 -2.596 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CB . . . . . . . . . c30448_6cxq 1 . 18 . 2193 . 1 1 4 LEU CD1 C 1.759 -1.621 -3.094 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CD1 . . . . . . . . . c30448_6cxq 1 . 18 . 2194 . 1 1 4 LEU CD2 C 1.098 0.295 -4.558 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CD2 . . . . . . . . . c30448_6cxq 1 . 18 . 2195 . 1 1 4 LEU CG C 1.097 -0.253 -3.139 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CG . . . . . . . . . c30448_6cxq 1 . 18 . 2196 . 1 1 4 LEU H H 0.855 -1.103 0.155 . . . 1.0 . . . . . . . . . . . . A . 4 LEU H . . . . . . . . . c30448_6cxq 1 . 18 . 2197 . 1 1 4 LEU HA H 0.151 0.777 -0.823 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HA . . . . . . . . . c30448_6cxq 1 . 18 . 2198 . 1 1 4 LEU HB2 H -0.722 -1.316 -2.805 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HB2 . . . . . . . . . c30448_6cxq 1 . 18 . 2199 . 1 1 4 LEU HB3 H -0.933 0.395 -3.122 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HB3 . . . . . . . . . c30448_6cxq 1 . 18 . 2200 . 1 1 4 LEU HD11 H 1.425 -2.211 -3.934 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD11 . . . . . . . . . c30448_6cxq 1 . 18 . 2201 . 1 1 4 LEU HD12 H 1.492 -2.120 -2.174 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD12 . . . . . . . . . c30448_6cxq 1 . 18 . 2202 . 1 1 4 LEU HD13 H 2.832 -1.503 -3.141 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD13 . . . . . . . . . c30448_6cxq 1 . 18 . 2203 . 1 1 4 LEU HD21 H 1.966 0.921 -4.702 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD21 . . . . . . . . . c30448_6cxq 1 . 18 . 2204 . 1 1 4 LEU HD22 H 0.203 0.878 -4.720 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD22 . . . . . . . . . c30448_6cxq 1 . 18 . 2205 . 1 1 4 LEU HD23 H 1.126 -0.525 -5.261 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD23 . . . . . . . . . c30448_6cxq 1 . 18 . 2206 . 1 1 4 LEU HG H 1.674 0.418 -2.520 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HG . . . . . . . . . c30448_6cxq 1 . 18 . 2207 . 1 1 4 LEU N N 0.017 -1.202 -0.330 . . . 1.0 . . . . . . . . . . . . A . 4 LEU N . . . . . . . . . c30448_6cxq 1 . 18 . 2208 . 1 1 4 LEU O O -2.536 -0.428 0.076 . . . 1.0 . . . . . . . . . . . . A . 4 LEU O . . . . . . . . . c30448_6cxq 1 . 18 . 2209 . 1 1 5 ARG C C -4.641 1.728 -2.419 . . . 1.0 . . . . . . . . . . . . A . 5 ARG C . . . . . . . . . c30448_6cxq 1 . 18 . 2210 . 1 1 5 ARG CA C -3.836 1.704 -1.123 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CA . . . . . . . . . c30448_6cxq 1 . 18 . 2211 . 1 1 5 ARG CB C -3.864 3.086 -0.476 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CB . . . . . . . . . c30448_6cxq 1 . 18 . 2212 . 1 1 5 ARG CD C -1.708 4.186 -0.907 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CD . . . . . . . . . c30448_6cxq 1 . 18 . 2213 . 1 1 5 ARG CG C -3.151 4.132 -1.293 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CG . . . . . . . . . c30448_6cxq 1 . 18 . 2214 . 1 1 5 ARG CZ C 0.320 5.295 -1.763 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CZ . . . . . . . . . c30448_6cxq 1 . 18 . 2215 . 1 1 5 ARG H H -1.917 1.797 -2.013 . . . 1.0 . . . . . . . . . . . . A . 5 ARG H . . . . . . . . . c30448_6cxq 1 . 18 . 2216 . 1 1 5 ARG HA H -4.273 0.995 -0.446 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HA . . . . . . . . . c30448_6cxq 1 . 18 . 2217 . 1 1 5 ARG HB2 H -4.888 3.403 -0.350 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HB2 . . . . . . . . . c30448_6cxq 1 . 18 . 2218 . 1 1 5 ARG HB3 H -3.380 3.026 0.495 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HB3 . . . . . . . . . c30448_6cxq 1 . 18 . 2219 . 1 1 5 ARG HD2 H -1.635 4.797 -0.036 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HD2 . . . . . . . . . c30448_6cxq 1 . 18 . 2220 . 1 1 5 ARG HD3 H -1.377 3.183 -0.676 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HD3 . . . . . . . . . c30448_6cxq 1 . 18 . 2221 . 1 1 5 ARG HE H -1.217 4.693 -2.886 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HE . . . . . . . . . c30448_6cxq 1 . 18 . 2222 . 1 1 5 ARG HG2 H -3.222 3.883 -2.333 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HG2 . . . . . . . . . c30448_6cxq 1 . 18 . 2223 . 1 1 5 ARG HG3 H -3.603 5.095 -1.112 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HG3 . . . . . . . . . c30448_6cxq 1 . 18 . 2224 . 1 1 5 ARG HH11 H 0.306 5.011 0.240 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH11 . . . . . . . . . c30448_6cxq 1 . 18 . 2225 . 1 1 5 ARG HH12 H 1.718 5.791 -0.388 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH12 . . . . . . . . . c30448_6cxq 1 . 18 . 2226 . 1 1 5 ARG HH21 H 0.641 5.719 -3.712 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH21 . . . . . . . . . c30448_6cxq 1 . 18 . 2227 . 1 1 5 ARG HH22 H 1.908 6.193 -2.631 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH22 . . . . . . . . . c30448_6cxq 1 . 18 . 2228 . 1 1 5 ARG N N -2.458 1.293 -1.370 . . . 1.0 . . . . . . . . . . . . A . 5 ARG N . . . . . . . . . c30448_6cxq 1 . 18 . 2229 . 1 1 5 ARG NE N -0.872 4.739 -1.969 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NE . . . . . . . . . c30448_6cxq 1 . 18 . 2230 . 1 1 5 ARG NH1 N 0.822 5.372 -0.536 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NH1 . . . . . . . . . c30448_6cxq 1 . 18 . 2231 . 1 1 5 ARG NH2 N 1.013 5.775 -2.786 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NH2 . . . . . . . . . c30448_6cxq 1 . 18 . 2232 . 1 1 5 ARG O O -5.685 2.376 -2.499 . . . 1.0 . . . . . . . . . . . . A . 5 ARG O . . . . . . . . . c30448_6cxq 1 . 18 . 2233 . 1 1 6 HIS C C -6.288 0.580 -4.569 . . . 1.0 . . . . . . . . . . . . A . 6 HIS C . . . . . . . . . c30448_6cxq 1 . 18 . 2234 . 1 1 6 HIS CA C -4.821 0.972 -4.728 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CA . . . . . . . . . c30448_6cxq 1 . 18 . 2235 . 1 1 6 HIS CB C -4.115 -0.020 -5.654 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CB . . . . . . . . . c30448_6cxq 1 . 18 . 2236 . 1 1 6 HIS CD2 C -3.336 -2.036 -4.218 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CD2 . . . . . . . . . c30448_6cxq 1 . 18 . 2237 . 1 1 6 HIS CE1 C -4.780 -3.519 -4.940 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CE1 . . . . . . . . . c30448_6cxq 1 . 18 . 2238 . 1 1 6 HIS CG C -4.121 -1.425 -5.138 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CG . . . . . . . . . c30448_6cxq 1 . 18 . 2239 . 1 1 6 HIS H H -3.311 0.530 -3.315 . . . 1.0 . . . . . . . . . . . . A . 6 HIS H . . . . . . . . . c30448_6cxq 1 . 18 . 2240 . 1 1 6 HIS HA H -4.768 1.959 -5.164 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HA . . . . . . . . . c30448_6cxq 1 . 18 . 2241 . 1 1 6 HIS HB2 H -4.610 -0.018 -6.617 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HB2 . . . . . . . . . c30448_6cxq 1 . 18 . 2242 . 1 1 6 HIS HB3 H -3.083 0.286 -5.777 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HB3 . . . . . . . . . c30448_6cxq 1 . 18 . 2243 . 1 1 6 HIS HD1 H -5.717 -2.248 -6.241 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HD1 . . . . . . . . . c30448_6cxq 1 . 18 . 2244 . 1 1 6 HIS HD2 H -2.522 -1.583 -3.669 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HD2 . . . . . . . . . c30448_6cxq 1 . 18 . 2245 . 1 1 6 HIS HE1 H -5.323 -4.442 -5.077 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HE1 . . . . . . . . . c30448_6cxq 1 . 18 . 2246 . 1 1 6 HIS HE2 H -3.440 -3.993 -3.465 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HE2 . . . . . . . . . c30448_6cxq 1 . 18 . 2247 . 1 1 6 HIS N N -4.148 1.023 -3.435 . . . 1.0 . . . . . . . . . . . . A . 6 HIS N . . . . . . . . . c30448_6cxq 1 . 18 . 2248 . 1 1 6 HIS ND1 N -5.015 -2.382 -5.571 . . . 1.0 . . . . . . . . . . . . A . 6 HIS ND1 . . . . . . . . . c30448_6cxq 1 . 18 . 2249 . 1 1 6 HIS NE2 N -3.766 -3.335 -4.115 . . . 1.0 . . . . . . . . . . . . A . 6 HIS NE2 . . . . . . . . . c30448_6cxq 1 . 18 . 2250 . 1 1 6 HIS O O -7.160 1.372 -4.987 . . . 1.0 . . . . . . . . . . . . A . 6 HIS O . . . . . . . . . c30448_6cxq 1 . 19 . 2251 . 1 1 1 HIS C C 4.828 -1.654 3.695 . . . 1.0 . . . . . . . . . . . . A . 1 HIS C . . . . . . . . . c30448_6cxq 1 . 19 . 2252 . 1 1 1 HIS CA C 6.338 -1.646 3.543 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CA . . . . . . . . . c30448_6cxq 1 . 19 . 2253 . 1 1 1 HIS CB C 6.777 -2.534 2.376 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CB . . . . . . . . . c30448_6cxq 1 . 19 . 2254 . 1 1 1 HIS CD2 C 9.023 -3.833 2.429 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CD2 . . . . . . . . . c30448_6cxq 1 . 19 . 2255 . 1 1 1 HIS CE1 C 10.373 -2.152 2.029 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CE1 . . . . . . . . . c30448_6cxq 1 . 19 . 2256 . 1 1 1 HIS CG C 8.260 -2.721 2.293 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CG . . . . . . . . . c30448_6cxq 1 . 19 . 2257 . 1 1 1 HIS H1 H 6.629 -1.571 5.579 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H1 . . . . . . . . . c30448_6cxq 1 . 19 . 2258 . 1 1 1 HIS H2 H 8.029 -1.971 4.670 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H2 . . . . . . . . . c30448_6cxq 1 . 19 . 2259 . 1 1 1 HIS H3 H 6.786 -3.134 4.892 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H3 . . . . . . . . . c30448_6cxq 1 . 19 . 2260 . 1 1 1 HIS HA H 6.646 -0.627 3.356 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HA . . . . . . . . . c30448_6cxq 1 . 19 . 2261 . 1 1 1 HIS HB2 H 6.325 -3.509 2.484 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HB2 . . . . . . . . . c30448_6cxq 1 . 19 . 2262 . 1 1 1 HIS HB3 H 6.446 -2.089 1.450 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HB3 . . . . . . . . . c30448_6cxq 1 . 19 . 2263 . 1 1 1 HIS HD1 H 8.889 -0.749 1.900 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HD1 . . . . . . . . . c30448_6cxq 1 . 19 . 2264 . 1 1 1 HIS HD2 H 8.668 -4.833 2.631 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HD2 . . . . . . . . . c30448_6cxq 1 . 19 . 2265 . 1 1 1 HIS HE1 H 11.266 -1.569 1.856 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HE1 . . . . . . . . . c30448_6cxq 1 . 19 . 2266 . 1 1 1 HIS HE2 H 11.114 -4.021 2.415 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HE2 . . . . . . . . . c30448_6cxq 1 . 19 . 2267 . 1 1 1 HIS N N 7.006 -2.123 4.783 . . . 1.0 . . . . . . . . . . . . A . 1 HIS N . . . . . . . . . c30448_6cxq 1 . 19 . 2268 . 1 1 1 HIS ND1 N 9.137 -1.686 2.044 . . . 1.0 . . . . . . . . . . . . A . 1 HIS ND1 . . . . . . . . . c30448_6cxq 1 . 19 . 2269 . 1 1 1 HIS NE2 N 10.332 -3.451 2.260 . . . 1.0 . . . . . . . . . . . . A . 1 HIS NE2 . . . . . . . . . c30448_6cxq 1 . 19 . 2270 . 1 1 1 HIS O O 4.310 -1.619 4.812 . . . 1.0 . . . . . . . . . . . . A . 1 HIS O . . . . . . . . . c30448_6cxq 1 . 19 . 2271 . 1 1 2 ARG C C 2.035 -2.347 1.454 . . . 1.0 . . . . . . . . . . . . A . 2 ARG C . . . . . . . . . c30448_6cxq 1 . 19 . 2272 . 1 1 2 ARG CA C 2.669 -1.610 2.618 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CA . . . . . . . . . c30448_6cxq 1 . 19 . 2273 . 1 1 2 ARG CB C 2.198 -0.155 2.618 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CB . . . . . . . . . c30448_6cxq 1 . 19 . 2274 . 1 1 2 ARG CD C 3.141 2.132 2.167 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CD . . . . . . . . . c30448_6cxq 1 . 19 . 2275 . 1 1 2 ARG CG C 3.351 0.789 2.846 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CG . . . . . . . . . c30448_6cxq 1 . 19 . 2276 . 1 1 2 ARG CZ C 2.800 4.487 2.807 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CZ . . . . . . . . . c30448_6cxq 1 . 19 . 2277 . 1 1 2 ARG H H 4.576 -1.646 1.707 . . . 1.0 . . . . . . . . . . . . A . 2 ARG H . . . . . . . . . c30448_6cxq 1 . 19 . 2278 . 1 1 2 ARG HA H 2.375 -2.052 3.533 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HA . . . . . . . . . c30448_6cxq 1 . 19 . 2279 . 1 1 2 ARG HB2 H 1.733 0.079 1.657 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB2 . . . . . . . . . c30448_6cxq 1 . 19 . 2280 . 1 1 2 ARG HB3 H 1.476 -0.015 3.408 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB3 . . . . . . . . . c30448_6cxq 1 . 19 . 2281 . 1 1 2 ARG HD2 H 4.026 2.376 1.599 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD2 . . . . . . . . . c30448_6cxq 1 . 19 . 2282 . 1 1 2 ARG HD3 H 2.295 2.057 1.500 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD3 . . . . . . . . . c30448_6cxq 1 . 19 . 2283 . 1 1 2 ARG HE H 2.785 2.945 4.072 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HE . . . . . . . . . c30448_6cxq 1 . 19 . 2284 . 1 1 2 ARG HG2 H 3.495 0.935 3.906 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG2 . . . . . . . . . c30448_6cxq 1 . 19 . 2285 . 1 1 2 ARG HG3 H 4.220 0.316 2.443 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG3 . . . . . . . . . c30448_6cxq 1 . 19 . 2286 . 1 1 2 ARG HH11 H 3.112 4.194 0.830 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH11 . . . . . . . . . c30448_6cxq 1 . 19 . 2287 . 1 1 2 ARG HH12 H 2.869 5.841 1.306 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH12 . . . . . . . . . c30448_6cxq 1 . 19 . 2288 . 1 1 2 ARG HH21 H 2.465 5.110 4.700 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH21 . . . . . . . . . c30448_6cxq 1 . 19 . 2289 . 1 1 2 ARG HH22 H 2.502 6.361 3.502 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH22 . . . . . . . . . c30448_6cxq 1 . 19 . 2290 . 1 1 2 ARG N N 4.118 -1.653 2.573 . . . 1.0 . . . . . . . . . . . . A . 2 ARG N . . . . . . . . . c30448_6cxq 1 . 19 . 2291 . 1 1 2 ARG NE N 2.891 3.200 3.132 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NE . . . . . . . . . c30448_6cxq 1 . 19 . 2292 . 1 1 2 ARG NH1 N 2.938 4.872 1.544 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH1 . . . . . . . . . c30448_6cxq 1 . 19 . 2293 . 1 1 2 ARG NH2 N 2.570 5.394 3.746 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH2 . . . . . . . . . c30448_6cxq 1 . 19 . 2294 . 1 1 2 ARG O O 2.650 -2.515 0.401 . . . 1.0 . . . . . . . . . . . . A . 2 ARG O . . . . . . . . . c30448_6cxq 1 . 19 . 2295 . 1 1 3 PHE C C -0.630 -2.312 -0.287 . . . 1.0 . . . . . . . . . . . . A . 3 PHE C . . . . . . . . . c30448_6cxq 1 . 19 . 2296 . 1 1 3 PHE CA C 0.037 -3.386 0.560 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CA . . . . . . . . . c30448_6cxq 1 . 19 . 2297 . 1 1 3 PHE CB C -1.003 -4.349 1.129 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CB . . . . . . . . . c30448_6cxq 1 . 19 . 2298 . 1 1 3 PHE CD1 C -1.721 -6.740 1.055 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CD1 . . . . . . . . . c30448_6cxq 1 . 19 . 2299 . 1 1 3 PHE CD2 C -0.468 -5.904 -0.792 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CD2 . . . . . . . . . c30448_6cxq 1 . 19 . 2300 . 1 1 3 PHE CE1 C -1.792 -7.981 0.451 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CE1 . . . . . . . . . c30448_6cxq 1 . 19 . 2301 . 1 1 3 PHE CE2 C -0.536 -7.143 -1.402 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CE2 . . . . . . . . . c30448_6cxq 1 . 19 . 2302 . 1 1 3 PHE CG C -1.061 -5.690 0.446 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CG . . . . . . . . . c30448_6cxq 1 . 19 . 2303 . 1 1 3 PHE CZ C -1.199 -8.182 -0.780 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CZ . . . . . . . . . c30448_6cxq 1 . 19 . 2304 . 1 1 3 PHE H H 0.324 -2.529 2.471 . . . 1.0 . . . . . . . . . . . . A . 3 PHE H . . . . . . . . . c30448_6cxq 1 . 19 . 2305 . 1 1 3 PHE HA H 0.735 -3.924 -0.046 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HA . . . . . . . . . c30448_6cxq 1 . 19 . 2306 . 1 1 3 PHE HB2 H -0.784 -4.525 2.175 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HB2 . . . . . . . . . c30448_6cxq 1 . 19 . 2307 . 1 1 3 PHE HB3 H -1.976 -3.897 1.040 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HB3 . . . . . . . . . c30448_6cxq 1 . 19 . 2308 . 1 1 3 PHE HD1 H -2.186 -6.579 2.015 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HD1 . . . . . . . . . c30448_6cxq 1 . 19 . 2309 . 1 1 3 PHE HD2 H 0.049 -5.093 -1.282 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HD2 . . . . . . . . . c30448_6cxq 1 . 19 . 2310 . 1 1 3 PHE HE1 H -2.312 -8.792 0.940 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HE1 . . . . . . . . . c30448_6cxq 1 . 19 . 2311 . 1 1 3 PHE HE2 H -0.070 -7.298 -2.364 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HE2 . . . . . . . . . c30448_6cxq 1 . 19 . 2312 . 1 1 3 PHE HZ H -1.253 -9.151 -1.254 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HZ . . . . . . . . . c30448_6cxq 1 . 19 . 2313 . 1 1 3 PHE N N 0.777 -2.732 1.626 . . . 1.0 . . . . . . . . . . . . A . 3 PHE N . . . . . . . . . c30448_6cxq 1 . 19 . 2314 . 1 1 3 PHE O O -1.692 -2.518 -0.875 . . . 1.0 . . . . . . . . . . . . A . 3 PHE O . . . . . . . . . c30448_6cxq 1 . 19 . 2315 . 1 1 4 LEU C C -1.910 0.315 -0.724 . . . 1.0 . . . . . . . . . . . . A . 4 LEU C . . . . . . . . . c30448_6cxq 1 . 19 . 2316 . 1 1 4 LEU CA C -0.451 0.008 -1.050 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CA . . . . . . . . . c30448_6cxq 1 . 19 . 2317 . 1 1 4 LEU CB C -0.278 -0.197 -2.556 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CB . . . . . . . . . c30448_6cxq 1 . 19 . 2318 . 1 1 4 LEU CD1 C 1.663 -1.747 -2.895 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CD1 . . . . . . . . . c30448_6cxq 1 . 19 . 2319 . 1 1 4 LEU CD2 C 1.294 0.157 -4.473 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CD2 . . . . . . . . . c30448_6cxq 1 . 19 . 2320 . 1 1 4 LEU CG C 1.170 -0.315 -3.032 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CG . . . . . . . . . c30448_6cxq 1 . 19 . 2321 . 1 1 4 LEU H H 0.852 -1.071 0.184 . . . 1.0 . . . . . . . . . . . . A . 4 LEU H . . . . . . . . . c30448_6cxq 1 . 19 . 2322 . 1 1 4 LEU HA H 0.160 0.844 -0.733 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HA . . . . . . . . . c30448_6cxq 1 . 19 . 2323 . 1 1 4 LEU HB2 H -0.803 -1.098 -2.837 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HB2 . . . . . . . . . c30448_6cxq 1 . 19 . 2324 . 1 1 4 LEU HB3 H -0.733 0.639 -3.065 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HB3 . . . . . . . . . c30448_6cxq 1 . 19 . 2325 . 1 1 4 LEU HD11 H 1.151 -2.226 -2.073 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD11 . . . . . . . . . c30448_6cxq 1 . 19 . 2326 . 1 1 4 LEU HD12 H 2.726 -1.745 -2.705 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD12 . . . . . . . . . c30448_6cxq 1 . 19 . 2327 . 1 1 4 LEU HD13 H 1.460 -2.286 -3.808 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD13 . . . . . . . . . c30448_6cxq 1 . 19 . 2328 . 1 1 4 LEU HD21 H 1.159 -0.682 -5.140 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD21 . . . . . . . . . c30448_6cxq 1 . 19 . 2329 . 1 1 4 LEU HD22 H 2.273 0.587 -4.629 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD22 . . . . . . . . . c30448_6cxq 1 . 19 . 2330 . 1 1 4 LEU HD23 H 0.538 0.902 -4.674 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD23 . . . . . . . . . c30448_6cxq 1 . 19 . 2331 . 1 1 4 LEU HG H 1.798 0.315 -2.418 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HG . . . . . . . . . c30448_6cxq 1 . 19 . 2332 . 1 1 4 LEU N N 0.020 -1.151 -0.317 . . . 1.0 . . . . . . . . . . . . A . 4 LEU N . . . . . . . . . c30448_6cxq 1 . 19 . 2333 . 1 1 4 LEU O O -2.538 -0.378 0.076 . . . 1.0 . . . . . . . . . . . . A . 4 LEU O . . . . . . . . . c30448_6cxq 1 . 19 . 2334 . 1 1 5 ARG C C -4.619 1.723 -2.433 . . . 1.0 . . . . . . . . . . . . A . 5 ARG C . . . . . . . . . c30448_6cxq 1 . 19 . 2335 . 1 1 5 ARG CA C -3.825 1.763 -1.130 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CA . . . . . . . . . c30448_6cxq 1 . 19 . 2336 . 1 1 5 ARG CB C -3.874 3.170 -0.542 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CB . . . . . . . . . c30448_6cxq 1 . 19 . 2337 . 1 1 5 ARG CD C -1.721 4.272 -0.988 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CD . . . . . . . . . c30448_6cxq 1 . 19 . 2338 . 1 1 5 ARG CG C -3.157 4.185 -1.393 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CG . . . . . . . . . c30448_6cxq 1 . 19 . 2339 . 1 1 5 ARG CZ C 0.316 5.340 -1.878 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CZ . . . . . . . . . c30448_6cxq 1 . 19 . 2340 . 1 1 5 ARG H H -1.889 1.872 -1.977 . . . 1.0 . . . . . . . . . . . . A . 5 ARG H . . . . . . . . . c30448_6cxq 1 . 19 . 2341 . 1 1 5 ARG HA H -4.260 1.076 -0.428 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HA . . . . . . . . . c30448_6cxq 1 . 19 . 2342 . 1 1 5 ARG HB2 H -4.901 3.484 -0.442 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HB2 . . . . . . . . . c30448_6cxq 1 . 19 . 2343 . 1 1 5 ARG HB3 H -3.401 3.155 0.437 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HB3 . . . . . . . . . c30448_6cxq 1 . 19 . 2344 . 1 1 5 ARG HD2 H -1.666 4.935 -0.155 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HD2 . . . . . . . . . c30448_6cxq 1 . 19 . 2345 . 1 1 5 ARG HD3 H -1.388 3.287 -0.691 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HD3 . . . . . . . . . c30448_6cxq 1 . 19 . 2346 . 1 1 5 ARG HE H -1.202 4.660 -2.986 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HE . . . . . . . . . c30448_6cxq 1 . 19 . 2347 . 1 1 5 ARG HG2 H -3.209 3.888 -2.422 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HG2 . . . . . . . . . c30448_6cxq 1 . 19 . 2348 . 1 1 5 ARG HG3 H -3.622 5.151 -1.264 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HG3 . . . . . . . . . c30448_6cxq 1 . 19 . 2349 . 1 1 5 ARG HH11 H 0.272 5.183 0.138 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH11 . . . . . . . . . c30448_6cxq 1 . 19 . 2350 . 1 1 5 ARG HH12 H 1.690 5.929 -0.517 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH12 . . . . . . . . . c30448_6cxq 1 . 19 . 2351 . 1 1 5 ARG HH21 H 0.666 5.641 -3.846 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH21 . . . . . . . . . c30448_6cxq 1 . 19 . 2352 . 1 1 5 ARG HH22 H 1.914 6.190 -2.777 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH22 . . . . . . . . . c30448_6cxq 1 . 19 . 2353 . 1 1 5 ARG N N -2.441 1.359 -1.351 . . . 1.0 . . . . . . . . . . . . A . 5 ARG N . . . . . . . . . c30448_6cxq 1 . 19 . 2354 . 1 1 5 ARG NE N -0.870 4.765 -2.068 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NE . . . . . . . . . c30448_6cxq 1 . 19 . 2355 . 1 1 5 ARG NH1 N 0.798 5.496 -0.652 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NH1 . . . . . . . . . c30448_6cxq 1 . 19 . 2356 . 1 1 5 ARG NH2 N 1.023 5.758 -2.919 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NH2 . . . . . . . . . c30448_6cxq 1 . 19 . 2357 . 1 1 5 ARG O O -5.654 2.377 -2.559 . . . 1.0 . . . . . . . . . . . . A . 5 ARG O . . . . . . . . . c30448_6cxq 1 . 19 . 2358 . 1 1 6 HIS C C -6.263 0.502 -4.536 . . . 1.0 . . . . . . . . . . . . A . 6 HIS C . . . . . . . . . c30448_6cxq 1 . 19 . 2359 . 1 1 6 HIS CA C -4.783 0.843 -4.700 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CA . . . . . . . . . c30448_6cxq 1 . 19 . 2360 . 1 1 6 HIS CB C -4.093 -0.223 -5.553 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CB . . . . . . . . . c30448_6cxq 1 . 19 . 2361 . 1 1 6 HIS CD2 C -3.950 -2.054 -3.720 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CD2 . . . . . . . . . c30448_6cxq 1 . 19 . 2362 . 1 1 6 HIS CE1 C -4.546 -3.776 -4.939 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CE1 . . . . . . . . . c30448_6cxq 1 . 19 . 2363 . 1 1 6 HIS CG C -4.184 -1.602 -4.975 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CG . . . . . . . . . c30448_6cxq 1 . 19 . 2364 . 1 1 6 HIS H H -3.292 0.465 -3.247 . . . 1.0 . . . . . . . . . . . . A . 6 HIS H . . . . . . . . . c30448_6cxq 1 . 19 . 2365 . 1 1 6 HIS HA H -4.698 1.799 -5.196 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HA . . . . . . . . . c30448_6cxq 1 . 19 . 2366 . 1 1 6 HIS HB2 H -4.553 -0.244 -6.533 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HB2 . . . . . . . . . c30448_6cxq 1 . 19 . 2367 . 1 1 6 HIS HB3 H -3.043 0.029 -5.652 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HB3 . . . . . . . . . c30448_6cxq 1 . 19 . 2368 . 1 1 6 HIS HD1 H -4.790 -2.705 -6.666 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HD1 . . . . . . . . . c30448_6cxq 1 . 19 . 2369 . 1 1 6 HIS HD2 H -3.639 -1.459 -2.872 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HD2 . . . . . . . . . c30448_6cxq 1 . 19 . 2370 . 1 1 6 HIS HE1 H -4.793 -4.781 -5.247 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HE1 . . . . . . . . . c30448_6cxq 1 . 19 . 2371 . 1 1 6 HIS HE2 H -4.010 -4.016 -2.977 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HE2 . . . . . . . . . c30448_6cxq 1 . 19 . 2372 . 1 1 6 HIS N N -4.123 0.959 -3.404 . . . 1.0 . . . . . . . . . . . . A . 6 HIS N . . . . . . . . . c30448_6cxq 1 . 19 . 2373 . 1 1 6 HIS ND1 N -4.554 -2.706 -5.714 . . . 1.0 . . . . . . . . . . . . A . 6 HIS ND1 . . . . . . . . . c30448_6cxq 1 . 19 . 2374 . 1 1 6 HIS NE2 N -4.182 -3.407 -3.725 . . . 1.0 . . . . . . . . . . . . A . 6 HIS NE2 . . . . . . . . . c30448_6cxq 1 . 19 . 2375 . 1 1 6 HIS O O -6.668 0.153 -3.407 . . . 1.0 . . . . . . . . . . . . A . 6 HIS O . . . . . . . . . c30448_6cxq 1 . 20 . 2376 . 1 1 1 HIS C C 4.890 -1.604 3.686 . . . 1.0 . . . . . . . . . . . . A . 1 HIS C . . . . . . . . . c30448_6cxq 1 . 20 . 2377 . 1 1 1 HIS CA C 6.397 -1.732 3.557 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CA . . . . . . . . . c30448_6cxq 1 . 20 . 2378 . 1 1 1 HIS CB C 6.767 -2.806 2.530 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CB . . . . . . . . . c30448_6cxq 1 . 20 . 2379 . 1 1 1 HIS CD2 C 8.290 -2.836 0.431 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CD2 . . . . . . . . . c30448_6cxq 1 . 20 . 2380 . 1 1 1 HIS CE1 C 7.968 -0.770 -0.228 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CE1 . . . . . . . . . c30448_6cxq 1 . 20 . 2381 . 1 1 1 HIS CG C 7.435 -2.258 1.308 . . . 1.0 . . . . . . . . . . . . A . 1 HIS CG . . . . . . . . . c30448_6cxq 1 . 20 . 2382 . 1 1 1 HIS H1 H 6.542 -1.532 5.600 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H1 . . . . . . . . . c30448_6cxq 1 . 20 . 2383 . 1 1 1 HIS H2 H 8.031 -1.840 4.803 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H2 . . . . . . . . . c30448_6cxq 1 . 20 . 2384 . 1 1 1 HIS H3 H 6.888 -3.104 5.011 . . . 1.0 . . . . . . . . . . . . A . 1 HIS H3 . . . . . . . . . c30448_6cxq 1 . 20 . 2385 . 1 1 1 HIS HA H 6.785 -0.776 3.234 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HA . . . . . . . . . c30448_6cxq 1 . 20 . 2386 . 1 1 1 HIS HB2 H 7.441 -3.514 2.987 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HB2 . . . . . . . . . c30448_6cxq 1 . 20 . 2387 . 1 1 1 HIS HB3 H 5.870 -3.321 2.217 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HB3 . . . . . . . . . c30448_6cxq 1 . 20 . 2388 . 1 1 1 HIS HD1 H 6.687 -0.288 1.294 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HD1 . . . . . . . . . c30448_6cxq 1 . 20 . 2389 . 1 1 1 HIS HD2 H 8.655 -3.852 0.468 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HD2 . . . . . . . . . c30448_6cxq 1 . 20 . 2390 . 1 1 1 HIS HE1 H 8.021 0.149 -0.793 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HE1 . . . . . . . . . c30448_6cxq 1 . 20 . 2391 . 1 1 1 HIS HE2 H 9.274 -1.995 -1.222 . . . 1.0 . . . . . . . . . . . . A . 1 HIS HE2 . . . . . . . . . c30448_6cxq 1 . 20 . 2392 . 1 1 1 HIS N N 7.021 -2.084 4.860 . . . 1.0 . . . . . . . . . . . . A . 1 HIS N . . . . . . . . . c30448_6cxq 1 . 20 . 2393 . 1 1 1 HIS ND1 N 7.254 -0.964 0.868 . . . 1.0 . . . . . . . . . . . . A . 1 HIS ND1 . . . . . . . . . c30448_6cxq 1 . 20 . 2394 . 1 1 1 HIS NE2 N 8.606 -1.890 -0.512 . . . 1.0 . . . . . . . . . . . . A . 1 HIS NE2 . . . . . . . . . c30448_6cxq 1 . 20 . 2395 . 1 1 1 HIS O O 4.370 -1.386 4.780 . . . 1.0 . . . . . . . . . . . . A . 1 HIS O . . . . . . . . . c30448_6cxq 1 . 20 . 2396 . 1 1 2 ARG C C 2.077 -2.330 1.462 . . . 1.0 . . . . . . . . . . . . A . 2 ARG C . . . . . . . . . c30448_6cxq 1 . 20 . 2397 . 1 1 2 ARG CA C 2.746 -1.546 2.575 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CA . . . . . . . . . c30448_6cxq 1 . 20 . 2398 . 1 1 2 ARG CB C 2.378 -0.066 2.450 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CB . . . . . . . . . c30448_6cxq 1 . 20 . 2399 . 1 1 2 ARG CD C 3.475 2.033 1.612 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CD . . . . . . . . . c30448_6cxq 1 . 20 . 2400 . 1 1 2 ARG CG C 3.605 0.806 2.499 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CG . . . . . . . . . c30448_6cxq 1 . 20 . 2401 . 1 1 2 ARG CZ C 4.302 2.837 -0.565 . . . 1.0 . . . . . . . . . . . . A . 2 ARG CZ . . . . . . . . . c30448_6cxq 1 . 20 . 2402 . 1 1 2 ARG H H 4.653 -1.843 1.710 . . . 1.0 . . . . . . . . . . . . A . 2 ARG H . . . . . . . . . c30448_6cxq 1 . 20 . 2403 . 1 1 2 ARG HA H 2.411 -1.891 3.515 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HA . . . . . . . . . c30448_6cxq 1 . 20 . 2404 . 1 1 2 ARG HB2 H 1.860 0.105 1.504 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB2 . . . . . . . . . c30448_6cxq 1 . 20 . 2405 . 1 1 2 ARG HB3 H 1.728 0.208 3.268 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HB3 . . . . . . . . . c30448_6cxq 1 . 20 . 2406 . 1 1 2 ARG HD2 H 2.434 2.174 1.363 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD2 . . . . . . . . . c30448_6cxq 1 . 20 . 2407 . 1 1 2 ARG HD3 H 3.835 2.895 2.156 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HD3 . . . . . . . . . c30448_6cxq 1 . 20 . 2408 . 1 1 2 ARG HE H 4.740 1.064 0.242 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HE . . . . . . . . . c30448_6cxq 1 . 20 . 2409 . 1 1 2 ARG HG2 H 3.793 1.111 3.518 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG2 . . . . . . . . . c30448_6cxq 1 . 20 . 2410 . 1 1 2 ARG HG3 H 4.422 0.205 2.161 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HG3 . . . . . . . . . c30448_6cxq 1 . 20 . 2411 . 1 1 2 ARG HH11 H 3.098 4.140 0.405 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH11 . . . . . . . . . c30448_6cxq 1 . 20 . 2412 . 1 1 2 ARG HH12 H 3.692 4.679 -1.129 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH12 . . . . . . . . . c30448_6cxq 1 . 20 . 2413 . 1 1 2 ARG HH21 H 5.522 1.775 -1.776 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH21 . . . . . . . . . c30448_6cxq 1 . 20 . 2414 . 1 1 2 ARG HH22 H 5.067 3.339 -2.366 . . . 1.0 . . . . . . . . . . . . A . 2 ARG HH22 . . . . . . . . . c30448_6cxq 1 . 20 . 2415 . 1 1 2 ARG N N 4.189 -1.699 2.561 . . . 1.0 . . . . . . . . . . . . A . 2 ARG N . . . . . . . . . c30448_6cxq 1 . 20 . 2416 . 1 1 2 ARG NE N 4.243 1.898 0.377 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NE . . . . . . . . . c30448_6cxq 1 . 20 . 2417 . 1 1 2 ARG NH1 N 3.643 3.979 -0.417 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH1 . . . . . . . . . c30448_6cxq 1 . 20 . 2418 . 1 1 2 ARG NH2 N 5.023 2.633 -1.659 . . . 1.0 . . . . . . . . . . . . A . 2 ARG NH2 . . . . . . . . . c30448_6cxq 1 . 20 . 2419 . 1 1 2 ARG O O 2.666 -2.554 0.404 . . . 1.0 . . . . . . . . . . . . A . 2 ARG O . . . . . . . . . c30448_6cxq 1 . 20 . 2420 . 1 1 3 PHE C C -0.640 -2.356 -0.209 . . . 1.0 . . . . . . . . . . . . A . 3 PHE C . . . . . . . . . c30448_6cxq 1 . 20 . 2421 . 1 1 3 PHE CA C 0.054 -3.393 0.664 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CA . . . . . . . . . c30448_6cxq 1 . 20 . 2422 . 1 1 3 PHE CB C -0.965 -4.335 1.302 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CB . . . . . . . . . c30448_6cxq 1 . 20 . 2423 . 1 1 3 PHE CD1 C -1.588 -6.748 1.438 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CD1 . . . . . . . . . c30448_6cxq 1 . 20 . 2424 . 1 1 3 PHE CD2 C -0.382 -6.027 -0.486 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CD2 . . . . . . . . . c30448_6cxq 1 . 20 . 2425 . 1 1 3 PHE CE1 C -1.614 -8.038 0.943 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CE1 . . . . . . . . . c30448_6cxq 1 . 20 . 2426 . 1 1 3 PHE CE2 C -0.405 -7.315 -0.987 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CE2 . . . . . . . . . c30448_6cxq 1 . 20 . 2427 . 1 1 3 PHE CG C -0.975 -5.730 0.735 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CG . . . . . . . . . c30448_6cxq 1 . 20 . 2428 . 1 1 3 PHE CZ C -1.021 -8.322 -0.271 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CZ . . . . . . . . . c30448_6cxq 1 . 20 . 2429 . 1 1 3 PHE H H 0.389 -2.450 2.526 . . . 1.0 . . . . . . . . . . . . A . 3 PHE H . . . . . . . . . c30448_6cxq 1 . 20 . 2430 . 1 1 3 PHE HA H 0.737 -3.953 0.061 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HA . . . . . . . . . c30448_6cxq 1 . 20 . 2431 . 1 1 3 PHE HB2 H -0.753 -4.416 2.362 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HB2 . . . . . . . . . c30448_6cxq 1 . 20 . 2432 . 1 1 3 PHE HB3 H -1.952 -3.923 1.167 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HB3 . . . . . . . . . c30448_6cxq 1 . 20 . 2433 . 1 1 3 PHE HD1 H -2.053 -6.523 2.385 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HD1 . . . . . . . . . c30448_6cxq 1 . 20 . 2434 . 1 1 3 PHE HD2 H 0.099 -5.242 -1.049 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HD2 . . . . . . . . . c30448_6cxq 1 . 20 . 2435 . 1 1 3 PHE HE1 H -2.098 -8.823 1.506 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HE1 . . . . . . . . . c30448_6cxq 1 . 20 . 2436 . 1 1 3 PHE HE2 H 0.060 -7.534 -1.938 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HE2 . . . . . . . . . c30448_6cxq 1 . 20 . 2437 . 1 1 3 PHE HZ H -1.040 -9.329 -0.661 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HZ . . . . . . . . . c30448_6cxq 1 . 20 . 2438 . 1 1 3 PHE N N 0.821 -2.694 1.681 . . . 1.0 . . . . . . . . . . . . A . 3 PHE N . . . . . . . . . c30448_6cxq 1 . 20 . 2439 . 1 1 3 PHE O O -1.713 -2.592 -0.765 . . . 1.0 . . . . . . . . . . . . A . 3 PHE O . . . . . . . . . c30448_6cxq 1 . 20 . 2440 . 1 1 4 LEU C C -1.949 0.240 -0.720 . . . 1.0 . . . . . . . . . . . . A . 4 LEU C . . . . . . . . . c30448_6cxq 1 . 20 . 2441 . 1 1 4 LEU CA C -0.493 -0.065 -1.063 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CA . . . . . . . . . c30448_6cxq 1 . 20 . 2442 . 1 1 4 LEU CB C -0.343 -0.324 -2.563 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CB . . . . . . . . . c30448_6cxq 1 . 20 . 2443 . 1 1 4 LEU CD1 C 1.961 -1.081 -3.197 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CD1 . . . . . . . . . c30448_6cxq 1 . 20 . 2444 . 1 1 4 LEU CD2 C 0.807 0.673 -4.557 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CD2 . . . . . . . . . c30448_6cxq 1 . 20 . 2445 . 1 1 4 LEU CG C 1.001 0.097 -3.161 . . . 1.0 . . . . . . . . . . . . A . 4 LEU CG . . . . . . . . . c30448_6cxq 1 . 20 . 2446 . 1 1 4 LEU H H 0.843 -1.090 0.182 . . . 1.0 . . . . . . . . . . . . A . 4 LEU H . . . . . . . . . c30448_6cxq 1 . 20 . 2447 . 1 1 4 LEU HA H 0.117 0.787 -0.788 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HA . . . . . . . . . c30448_6cxq 1 . 20 . 2448 . 1 1 4 LEU HB2 H -0.478 -1.381 -2.740 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HB2 . . . . . . . . . c30448_6cxq 1 . 20 . 2449 . 1 1 4 LEU HB3 H -1.126 0.212 -3.079 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HB3 . . . . . . . . . c30448_6cxq 1 . 20 . 2450 . 1 1 4 LEU HD11 H 1.463 -1.939 -3.623 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD11 . . . . . . . . . c30448_6cxq 1 . 20 . 2451 . 1 1 4 LEU HD12 H 2.283 -1.313 -2.193 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD12 . . . . . . . . . c30448_6cxq 1 . 20 . 2452 . 1 1 4 LEU HD13 H 2.820 -0.827 -3.801 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD13 . . . . . . . . . c30448_6cxq 1 . 20 . 2453 . 1 1 4 LEU HD21 H 1.658 0.420 -5.172 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD21 . . . . . . . . . c30448_6cxq 1 . 20 . 2454 . 1 1 4 LEU HD22 H 0.717 1.748 -4.493 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD22 . . . . . . . . . c30448_6cxq 1 . 20 . 2455 . 1 1 4 LEU HD23 H -0.090 0.262 -4.995 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HD23 . . . . . . . . . c30448_6cxq 1 . 20 . 2456 . 1 1 4 LEU HG H 1.438 0.865 -2.539 . . . 1.0 . . . . . . . . . . . . A . 4 LEU HG . . . . . . . . . c30448_6cxq 1 . 20 . 2457 . 1 1 4 LEU N N 0.002 -1.193 -0.297 . . . 1.0 . . . . . . . . . . . . A . 4 LEU N . . . . . . . . . c30448_6cxq 1 . 20 . 2458 . 1 1 4 LEU O O -2.553 -0.428 0.118 . . . 1.0 . . . . . . . . . . . . A . 4 LEU O . . . . . . . . . c30448_6cxq 1 . 20 . 2459 . 1 1 5 ARG C C -4.684 1.706 -2.434 . . . 1.0 . . . . . . . . . . . . A . 5 ARG C . . . . . . . . . c30448_6cxq 1 . 20 . 2460 . 1 1 5 ARG CA C -3.891 1.652 -1.131 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CA . . . . . . . . . c30448_6cxq 1 . 20 . 2461 . 1 1 5 ARG CB C -3.938 3.014 -0.447 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CB . . . . . . . . . c30448_6cxq 1 . 20 . 2462 . 1 1 5 ARG CD C -1.790 4.149 -0.836 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CD . . . . . . . . . c30448_6cxq 1 . 20 . 2463 . 1 1 5 ARG CG C -3.231 4.090 -1.232 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CG . . . . . . . . . c30448_6cxq 1 . 20 . 2464 . 1 1 5 ARG CZ C 0.222 5.333 -1.629 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CZ . . . . . . . . . c30448_6cxq 1 . 20 . 2465 . 1 1 5 ARG H H -1.974 1.755 -2.026 . . . 1.0 . . . . . . . . . . . . A . 5 ARG H . . . . . . . . . c30448_6cxq 1 . 20 . 2466 . 1 1 5 ARG HA H -4.330 0.921 -0.479 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HA . . . . . . . . . c30448_6cxq 1 . 20 . 2467 . 1 1 5 ARG HB2 H -4.966 3.316 -0.317 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HB2 . . . . . . . . . c30448_6cxq 1 . 20 . 2468 . 1 1 5 ARG HB3 H -3.457 2.934 0.525 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HB3 . . . . . . . . . c30448_6cxq 1 . 20 . 2469 . 1 1 5 ARG HD2 H -1.731 4.723 0.061 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HD2 . . . . . . . . . c30448_6cxq 1 . 20 . 2470 . 1 1 5 ARG HD3 H -1.447 3.141 -0.646 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HD3 . . . . . . . . . c30448_6cxq 1 . 20 . 2471 . 1 1 5 ARG HE H -1.291 4.740 -2.789 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HE . . . . . . . . . c30448_6cxq 1 . 20 . 2472 . 1 1 5 ARG HG2 H -3.293 3.867 -2.278 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HG2 . . . . . . . . . c30448_6cxq 1 . 20 . 2473 . 1 1 5 ARG HG3 H -3.695 5.043 -1.028 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HG3 . . . . . . . . . c30448_6cxq 1 . 20 . 2474 . 1 1 5 ARG HH11 H 0.199 4.974 0.362 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH11 . . . . . . . . . c30448_6cxq 1 . 20 . 2475 . 1 1 5 ARG HH12 H 1.600 5.805 -0.226 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH12 . . . . . . . . . c30448_6cxq 1 . 20 . 2476 . 1 1 5 ARG HH21 H 0.548 5.838 -3.559 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH21 . . . . . . . . . c30448_6cxq 1 . 20 . 2477 . 1 1 5 ARG HH22 H 1.797 6.298 -2.451 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH22 . . . . . . . . . c30448_6cxq 1 . 20 . 2478 . 1 1 5 ARG N N -2.506 1.257 -1.371 . . . 1.0 . . . . . . . . . . . . A . 5 ARG N . . . . . . . . . c30448_6cxq 1 . 20 . 2479 . 1 1 5 ARG NE N -0.955 4.759 -1.868 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NE . . . . . . . . . c30448_6cxq 1 . 20 . 2480 . 1 1 5 ARG NH1 N 0.713 5.374 -0.397 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NH1 . . . . . . . . . c30448_6cxq 1 . 20 . 2481 . 1 1 5 ARG NH2 N 0.912 5.867 -2.629 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NH2 . . . . . . . . . c30448_6cxq 1 . 20 . 2482 . 1 1 5 ARG O O -5.748 2.322 -2.496 . . . 1.0 . . . . . . . . . . . . A . 5 ARG O . . . . . . . . . c30448_6cxq 1 . 20 . 2483 . 1 1 6 HIS C C -6.270 0.586 -4.650 . . . 1.0 . . . . . . . . . . . . A . 6 HIS C . . . . . . . . . c30448_6cxq 1 . 20 . 2484 . 1 1 6 HIS CA C -4.821 1.048 -4.775 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CA . . . . . . . . . c30448_6cxq 1 . 20 . 2485 . 1 1 6 HIS CB C -4.065 0.137 -5.744 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CB . . . . . . . . . c30448_6cxq 1 . 20 . 2486 . 1 1 6 HIS CD2 C -3.927 -1.851 -4.084 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CD2 . . . . . . . . . c30448_6cxq 1 . 20 . 2487 . 1 1 6 HIS CE1 C -4.064 -3.490 -5.534 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CE1 . . . . . . . . . c30448_6cxq 1 . 20 . 2488 . 1 1 6 HIS CG C -4.034 -1.297 -5.315 . . . 1.0 . . . . . . . . . . . . A . 6 HIS CG . . . . . . . . . c30448_6cxq 1 . 20 . 2489 . 1 1 6 HIS H H -3.308 0.593 -3.368 . . . 1.0 . . . . . . . . . . . . A . 6 HIS H . . . . . . . . . c30448_6cxq 1 . 20 . 2490 . 1 1 6 HIS HA H -4.809 2.057 -5.161 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HA . . . . . . . . . c30448_6cxq 1 . 20 . 2491 . 1 1 6 HIS HB2 H -4.540 0.182 -6.716 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HB2 . . . . . . . . . c30448_6cxq 1 . 20 . 2492 . 1 1 6 HIS HB3 H -3.040 0.483 -5.827 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HB3 . . . . . . . . . c30448_6cxq 1 . 20 . 2493 . 1 1 6 HIS HD1 H -4.203 -2.274 -7.174 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HD1 . . . . . . . . . c30448_6cxq 1 . 20 . 2494 . 1 1 6 HIS HD2 H -3.841 -1.319 -3.147 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HD2 . . . . . . . . . c30448_6cxq 1 . 20 . 2495 . 1 1 6 HIS HE1 H -4.106 -4.478 -5.967 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HE1 . . . . . . . . . c30448_6cxq 1 . 20 . 2496 . 1 1 6 HIS HE2 H -3.800 -3.875 -3.540 . . . 1.0 . . . . . . . . . . . . A . 6 HIS HE2 . . . . . . . . . c30448_6cxq 1 . 20 . 2497 . 1 1 6 HIS N N -4.160 1.064 -3.475 . . . 1.0 . . . . . . . . . . . . A . 6 HIS N . . . . . . . . . c30448_6cxq 1 . 20 . 2498 . 1 1 6 HIS ND1 N -4.117 -2.351 -6.201 . . . 1.0 . . . . . . . . . . . . A . 6 HIS ND1 . . . . . . . . . c30448_6cxq 1 . 20 . 2499 . 1 1 6 HIS NE2 N -3.948 -3.214 -4.248 . . . 1.0 . . . . . . . . . . . . A . 6 HIS NE2 . . . . . . . . . c30448_6cxq 1 . 20 . 2500 . 1 1 6 HIS O O -7.003 0.657 -5.659 . . . 1.0 . . . . . . . . . . . . A . 6 HIS O . . . . . . . . . c30448_6cxq 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 c30448_6cxq _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 6cxq.mr . . 'MR format' 1 comment 'Not applicable' 'Not applicable' 0 c30448_6cxq 1 1 6cxq.mr . . XPLOR/CNS 2 distance NOE simple 113 c30448_6cxq 1 1 6cxq.mr . . 'MR format' 3 'nomenclature mapping' 'Not applicable' 'Not applicable' 0 c30448_6cxq 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 c30448_6cxq _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 . . . . c30448_6cxq 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# . . c30448_6cxq 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# . . c30448_6cxq 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# . . c30448_6cxq 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# . . c30448_6cxq 1 3 1 OR . 1 1 4 4 LEU H H . . . 1 1 2 2 ARG HB2 H . . . . . 3.4 1.8 3.4 . . . . . A . 4 LEU H . . A . 2 ARG HB2 . . . 4 . HN . . . . . 2 . HB# . . c30448_6cxq 1 3 2 OR . 1 1 2 2 ARG HB3 H . . . 1 1 4 4 LEU H H . . . . . 3.4 1.8 3.4 . . . . . A . 2 ARG HB3 . . A . 4 LEU H . . . 2 . HB# . . . . . 4 . HN . . c30448_6cxq 1 4 1 OR . 1 1 4 4 LEU H H . . . 1 1 4 4 LEU HB2 H . . . . . 5.0 1.8 5.0 . . . . . A . 4 LEU H . . A . 4 LEU HB2 . . . 4 . HN . . . . . 4 . HB# . . c30448_6cxq 1 4 2 OR . 1 1 4 4 LEU H H . . . 1 1 4 4 LEU HB3 H . . . . . 5.0 1.8 5.0 . . . . . A . 4 LEU H . . A . 4 LEU HB3 . . . 4 . HN . . . . . 4 . HB# . . c30448_6cxq 1 5 1 OR . 1 1 4 4 LEU HA H . . . 1 1 2 2 ARG HB2 H . . . . . 3.4 1.8 3.4 . . . . . A . 4 LEU HA . . A . 2 ARG HB2 . . . 4 . HA . . . . . 2 . HB# . . c30448_6cxq 1 5 2 OR . 1 1 2 2 ARG HB3 H . . . 1 1 4 4 LEU HA H . . . . . 3.4 1.8 3.4 . . . . . A . 2 ARG HB3 . . A . 4 LEU HA . . . 2 . HB# . . . . . 4 . HA . . c30448_6cxq 1 6 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# . . c30448_6cxq 1 6 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# . . c30448_6cxq 1 7 1 OR . 1 1 4 4 LEU H H . . . 1 1 5 5 ARG HD2 H . . . . . 5.0 1.8 5.0 . . . . . A . 4 LEU H . . A . 5 ARG HD2 . . . 4 . HN . . . . . 5 . HD# . . c30448_6cxq 1 7 2 OR . 1 1 4 4 LEU H H . . . 1 1 5 5 ARG HD3 H . . . . . 5.0 1.8 5.0 . . . . . A . 4 LEU H . . A . 5 ARG HD3 . . . 4 . HN . . . . . 5 . HD# . . c30448_6cxq 1 8 1 OR . 1 1 3 3 PHE HA H . . . 1 1 3 3 PHE HD1 H . . . . . 2.8 1.8 2.8 . . . . . A . 3 PHE HA . . A . 3 PHE HD1 . . . 3 . HA . . . . . 3 . HD# . . c30448_6cxq 1 8 2 OR . 1 1 3 3 PHE HA H . . . 1 1 3 3 PHE HD2 H . . . . . 2.8 1.8 2.8 . . . . . A . 3 PHE HA . . A . 3 PHE HD2 . . . 3 . HA . . . . . 3 . HD# . . c30448_6cxq 1 9 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# . . c30448_6cxq 1 9 2 OR . 1 1 5 5 ARG HD3 H . . . 1 1 5 5 ARG HE H . . . . . 3.4 1.8 3.4 . . . . . A . 5 ARG HD3 . . A . 5 ARG HE . . . 5 . HD# . . . . . 5 . HE . . c30448_6cxq 1 10 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# . . c30448_6cxq 1 10 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# . . c30448_6cxq 1 11 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# . . c30448_6cxq 1 11 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 . . c30448_6cxq 1 12 1 OR . 1 1 4 4 LEU H H . . . 1 1 2 2 ARG HB2 H . . . . . 5.0 1.8 5.0 . . . . . A . 4 LEU H . . A . 2 ARG HB2 . . . 4 . HN . . . . . 2 . HB# . . c30448_6cxq 1 12 2 OR . 1 1 2 2 ARG HB3 H . . . 1 1 4 4 LEU H H . . . . . 5.0 1.8 5.0 . . . . . A . 2 ARG HB3 . . A . 4 LEU H . . . 2 . HB# . . . . . 4 . HN . . c30448_6cxq 1 13 1 OR . 1 1 4 4 LEU H H . . . 1 1 4 4 LEU HB2 H . . . . . 5.0 1.8 5.0 . . . . . A . 4 LEU H . . A . 4 LEU HB2 . . . 4 . HN . . . . . 4 . HB# . . c30448_6cxq 1 13 2 OR . 1 1 4 4 LEU H H . . . 1 1 4 4 LEU HB3 H . . . . . 5.0 1.8 5.0 . . . . . A . 4 LEU H . . A . 4 LEU HB3 . . . 4 . HN . . . . . 4 . HB# . . c30448_6cxq 1 14 1 OR . 1 1 3 3 PHE HB3 H . . . 1 1 3 3 PHE HD1 H . . . . . 3.4 1.8 3.4 . . . . . A . 3 PHE HB3 . . A . 3 PHE HD1 . . . 3 . HB1 . . . . . 3 . HD# . . c30448_6cxq 1 14 2 OR . 1 1 3 3 PHE HB3 H . . . 1 1 3 3 PHE HD2 H . . . . . 3.4 1.8 3.4 . . . . . A . 3 PHE HB3 . . A . 3 PHE HD2 . . . 3 . HB1 . . . . . 3 . HD# . . c30448_6cxq 1 15 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# . . c30448_6cxq 1 15 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# . . c30448_6cxq 1 16 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# . . c30448_6cxq 1 16 2 OR . 1 1 5 5 ARG HD3 H . . . 1 1 5 5 ARG HE H . . . . . 5.0 1.8 5.0 . . . . . A . 5 ARG HD3 . . A . 5 ARG HE . . . 5 . HD# . . . . . 5 . HE . . c30448_6cxq 1 17 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# . . c30448_6cxq 1 17 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# . . c30448_6cxq 1 18 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# . . c30448_6cxq 1 18 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# . . c30448_6cxq 1 19 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# . . c30448_6cxq 1 19 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 . . c30448_6cxq 1 20 1 OR . 1 1 2 2 ARG HB2 H . . . 1 1 2 2 ARG HD2 H . . . . . 3.4 1.8 3.4 . . . . . A . 2 ARG HB2 . . A . 2 ARG HD2 . . . 2 . HB# . . . . . 2 . HD# . . c30448_6cxq 1 20 2 OR . 1 1 2 2 ARG HB3 H . . . 1 1 2 2 ARG HD2 H . . . . . 3.4 1.8 3.4 . . . . . A . 2 ARG HB3 . . A . 2 ARG HD2 . . . 2 . HB# . . . . . 2 . HD# . . c30448_6cxq 1 20 3 OR . 1 1 2 2 ARG HD3 H . . . 1 1 2 2 ARG HB2 H . . . . . 3.4 1.8 3.4 . . . . . A . 2 ARG HD3 . . A . 2 ARG HB2 . . . 2 . HD# . . . . . 2 . HB# . . c30448_6cxq 1 20 4 OR . 1 1 2 2 ARG HB3 H . . . 1 1 2 2 ARG HD3 H . . . . . 3.4 1.8 3.4 . . . . . A . 2 ARG HB3 . . A . 2 ARG HD3 . . . 2 . HB# . . . . . 2 . HD# . . c30448_6cxq 1 21 1 OR . 1 1 6 6 HIS HB3 H . . . 1 1 4 4 LEU HB2 H . . . . . 3.4 1.8 3.4 . . . . . A . 6 HIS HB3 . . A . 4 LEU HB2 . . . 6 . HB1 . . . . . 4 . HB# . . c30448_6cxq 1 21 2 OR . 1 1 4 4 LEU HB3 H . . . 1 1 6 6 HIS HB3 H . . . . . 3.4 1.8 3.4 . . . . . A . 4 LEU HB3 . . A . 6 HIS HB3 . . . 4 . HB# . . . . . 6 . HB1 . . c30448_6cxq 1 22 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# . . c30448_6cxq 1 22 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 . . c30448_6cxq 1 23 1 OR . 1 1 2 2 ARG HA H . . . 1 1 1 1 HIS HB2 H . . . . . 5.0 1.8 5.0 . . . . . A . 2 ARG HA . . A . 1 HIS HB2 . . . 2 . HA . . . . . 1 . HB# . . c30448_6cxq 1 23 2 OR . 1 1 1 1 HIS HB3 H . . . 1 1 2 2 ARG HA H . . . . . 5.0 1.8 5.0 . . . . . A . 1 HIS HB3 . . A . 2 ARG HA . . . 1 . HB# . . . . . 2 . HA . . c30448_6cxq 1 24 1 OR . 1 1 5 5 ARG HA H . . . 1 1 4 4 LEU HB2 H . . . . . 5.0 1.8 5.0 . . . . . A . 5 ARG HA . . A . 4 LEU HB2 . . . 5 . HA . . . . . 4 . HB# . . c30448_6cxq 1 24 2 OR . 1 1 4 4 LEU HB3 H . . . 1 1 5 5 ARG HA H . . . . . 5.0 1.8 5.0 . . . . . A . 4 LEU HB3 . . A . 5 ARG HA . . . 4 . HB# . . . . . 5 . HA . . c30448_6cxq 1 25 1 OR . 1 1 2 2 ARG HG3 H . . . 1 1 2 2 ARG HD2 H . . . . . 3.4 1.8 3.4 . . . . . A . 2 ARG HG3 . . A . 2 ARG HD2 . . . 2 . HG1 . . . . . 2 . HD# . . c30448_6cxq 1 25 2 OR . 1 1 2 2 ARG HD3 H . . . 1 1 2 2 ARG HG3 H . . . . . 3.4 1.8 3.4 . . . . . A . 2 ARG HD3 . . A . 2 ARG HG3 . . . 2 . HD# . . . . . 2 . HG1 . . c30448_6cxq 1 26 1 OR . 1 1 2 2 ARG HB3 H . . . 1 1 2 2 ARG HD2 H . . . . . 3.4 1.8 3.4 . . . . . A . 2 ARG HB3 . . A . 2 ARG HD2 . . . 2 . HB# . . . . . 2 . HD# . . c30448_6cxq 1 26 2 OR . 1 1 2 2 ARG HB2 H . . . 1 1 2 2 ARG HD2 H . . . . . 3.4 1.8 3.4 . . . . . A . 2 ARG HB2 . . A . 2 ARG HD2 . . . 2 . HB# . . . . . 2 . HD# . . c30448_6cxq 1 26 3 OR . 1 1 2 2 ARG HD3 H . . . 1 1 2 2 ARG HB2 H . . . . . 3.4 1.8 3.4 . . . . . A . 2 ARG HD3 . . A . 2 ARG HB2 . . . 2 . HD# . . . . . 2 . HB# . . c30448_6cxq 1 26 4 OR . 1 1 2 2 ARG HB3 H . . . 1 1 2 2 ARG HD3 H . . . . . 3.4 1.8 3.4 . . . . . A . 2 ARG HB3 . . A . 2 ARG HD3 . . . 2 . HB# . . . . . 2 . HD# . . c30448_6cxq 1 27 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# . . c30448_6cxq 1 28 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# . . c30448_6cxq 1 29 1 OR . 1 1 4 4 LEU HA H . . . 1 1 2 2 ARG HD2 H . . . . . 3.4 1.8 3.4 . . . . . A . 4 LEU HA . . A . 2 ARG HD2 . . . 4 . HA . . . . . 2 . HD# . . c30448_6cxq 1 29 2 OR . 1 1 4 4 LEU HA H . . . 1 1 2 2 ARG HD3 H . . . . . 3.4 1.8 3.4 . . . . . A . 4 LEU HA . . A . 2 ARG HD3 . . . 4 . HA . . . . . 2 . HD# . . c30448_6cxq 1 30 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# . . c30448_6cxq 1 30 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# . . c30448_6cxq 1 31 1 OR . 1 1 4 4 LEU MD1 H . . . 1 1 4 4 LEU HB2 H . . . . . 2.8 1.8 2.8 . . . . . A . 4 LEU MD1 . . A . 4 LEU HB2 . . . 4 . HD1# . . . . . 4 . HB# . . c30448_6cxq 1 31 2 OR . 1 1 4 4 LEU HB3 H . . . 1 1 4 4 LEU MD1 H . . . . . 2.8 1.8 2.8 . . . . . A . 4 LEU HB3 . . A . 4 LEU MD1 . . . 4 . HB# . . . . . 4 . HD1# . . c30448_6cxq 1 32 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# . . c30448_6cxq 1 32 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 . . c30448_6cxq 1 33 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# . . c30448_6cxq 1 33 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 . . c30448_6cxq 1 34 1 OR . 1 1 2 2 ARG HG2 H . . . 1 1 2 2 ARG HD2 H . . . . . 3.4 1.8 3.4 . . . . . A . 2 ARG HG2 . . A . 2 ARG HD2 . . . 2 . HG2 . . . . . 2 . HD# . . c30448_6cxq 1 34 2 OR . 1 1 2 2 ARG HD3 H . . . 1 1 2 2 ARG HG2 H . . . . . 3.4 1.8 3.4 . . . . . A . 2 ARG HD3 . . A . 2 ARG HG2 . . . 2 . HD# . . . . . 2 . HG2 . . c30448_6cxq 1 35 1 . . 1 1 1 1 HIS HA H . . . 1 1 1 1 HIS HE1 H . . . . . 5.0 1.8 5.0 . . . . . A . 1 HIS HA . . A . 1 HIS HE1 . . . 1 . HA . . . . . 1 . HE1 . . c30448_6cxq 1 36 1 . . 1 1 1 1 HIS HA H . . . 1 1 2 2 ARG HG2 H . . . . . 5.0 1.8 5.0 . . . . . A . 1 HIS HA . . A . 2 ARG HG2 . . . 1 . HA . . . . . 2 . HG2 . . c30448_6cxq 1 37 1 . . 1 1 1 1 HIS HA H . . . 1 1 2 2 ARG HG2 H . . . . . 3.4 1.8 3.4 . . . . . A . 1 HIS HA . . A . 2 ARG HG2 . . . 1 . HA . . . . . 2 . HG2 . . c30448_6cxq 1 38 1 . . 1 1 2 2 ARG HD3 H . . . 1 1 2 2 ARG HG3 H . . . . . 5.0 1.8 5.0 . . . . . A . 2 ARG HD3 . . A . 2 ARG HG3 . . . 2 . HD1 . . . . . 2 . HG1 . . c30448_6cxq 1 39 1 . . 1 1 2 2 ARG HG2 H . . . 1 1 2 2 ARG HD2 H . . . . . 2.8 1.8 2.8 . . . . . A . 2 ARG HG2 . . A . 2 ARG HD2 . . . 2 . HG2 . . . . . 2 . HD2 . . c30448_6cxq 1 40 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 . . c30448_6cxq 1 41 1 . . 1 1 3 3 PHE H H . . . 1 1 2 2 ARG HA H . . . . . 3.4 1.8 3.4 . . . . . A . 3 PHE H . . A . 2 ARG HA . . . 3 . HN . . . . . 2 . HA . . c30448_6cxq 1 42 1 . . 1 1 3 3 PHE HA H . . . 1 1 3 3 PHE HB3 H . . . . . 2.8 1.8 2.8 . . . . . A . 3 PHE HA . . A . 3 PHE HB3 . . . 3 . HA . . . . . 3 . HB1 . . c30448_6cxq 1 43 1 . . 1 1 3 3 PHE HA H . . . 1 1 3 3 PHE HB3 H . . . . . 5.0 1.8 5.0 . . . . . A . 3 PHE HA . . A . 3 PHE HB3 . . . 3 . HA . . . . . 3 . HB1 . . c30448_6cxq 1 44 1 . . 1 1 3 3 PHE HA H . . . 1 1 3 3 PHE HB2 H . . . . . 2.8 1.8 2.8 . . . . . A . 3 PHE HA . . A . 3 PHE HB2 . . . 3 . HA . . . . . 3 . HB2 . . c30448_6cxq 1 45 1 . . 1 1 3 3 PHE HB3 H . . . 1 1 3 3 PHE HB2 H . . . . . 2.8 1.8 2.8 . . . . . A . 3 PHE HB3 . . A . 3 PHE HB2 . . . 3 . HB1 . . . . . 3 . HB2 . . c30448_6cxq 1 46 1 . . 1 1 3 3 PHE HB3 H . . . 1 1 3 3 PHE HB2 H . . . . . 2.8 1.8 2.8 . . . . . A . 3 PHE HB3 . . A . 3 PHE HB2 . . . 3 . HB1 . . . . . 3 . HB2 . . c30448_6cxq 1 47 1 . . 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 . HD1 . . c30448_6cxq 1 48 1 . . 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 . HD1 . . c30448_6cxq 1 49 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 . . c30448_6cxq 1 50 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 . . c30448_6cxq 1 51 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 . . c30448_6cxq 1 52 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 . . c30448_6cxq 1 53 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 . . c30448_6cxq 1 54 1 . . 1 1 4 4 LEU HA H . . . 1 1 2 2 ARG HB2 H . . . . . 2.8 1.8 2.8 . . . . . A . 4 LEU HA . . A . 2 ARG HB2 . . . 4 . HA . . . . . 2 . HB2 . . c30448_6cxq 1 55 1 . . 1 1 4 4 LEU H H . . . 1 1 2 2 ARG HG2 H . . . . . 5.0 1.8 5.0 . . . . . A . 4 LEU H . . A . 2 ARG HG2 . . . 4 . HN . . . . . 2 . HG2 . . c30448_6cxq 1 56 1 . . 1 1 4 4 LEU HA H . . . 1 1 3 3 PHE HA H . . . . . 5.0 1.8 5.0 . . . . . A . 4 LEU HA . . A . 3 PHE HA . . . 4 . HA . . . . . 3 . HA . . c30448_6cxq 1 57 1 . . 1 1 3 3 PHE HD2 H . . . 1 1 4 4 LEU HB2 H . . . . . 5.0 1.8 5.0 . . . . . A . 3 PHE HD2 . . A . 4 LEU HB2 . . . 3 . HD2 . . . . . 4 . HB2 . . c30448_6cxq 1 58 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 . . c30448_6cxq 1 59 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 . . c30448_6cxq 1 60 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 . . c30448_6cxq 1 61 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 . . c30448_6cxq 1 62 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 . . c30448_6cxq 1 63 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# . . c30448_6cxq 1 64 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# . . c30448_6cxq 1 65 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# . . c30448_6cxq 1 66 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# . . c30448_6cxq 1 67 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 . . c30448_6cxq 1 68 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 . . c30448_6cxq 1 69 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 . . c30448_6cxq 1 70 1 . . 1 1 4 4 LEU MD2 H . . . 1 1 4 4 LEU HG H . . . . . 3.4 1.8 3.4 . . . . . A . 4 LEU MD2 . . A . 4 LEU HG . . . 4 . HD2# . . . . . 4 . HG . . c30448_6cxq 1 71 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 . . c30448_6cxq 1 72 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 . . c30448_6cxq 1 73 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 . . c30448_6cxq 1 74 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 . . c30448_6cxq 1 75 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 . . c30448_6cxq 1 76 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 . . c30448_6cxq 1 77 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 . . c30448_6cxq 1 78 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 . . c30448_6cxq 1 79 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 . . c30448_6cxq 1 80 1 . . 1 1 5 5 ARG HB3 H . . . 1 1 5 5 ARG HB2 H . . . . . 2.8 1.8 2.8 . . . . . A . 5 ARG HB3 . . A . 5 ARG HB2 . . . 5 . HB1 . . . . . 5 . HB2 . . c30448_6cxq 1 81 1 . . 1 1 5 5 ARG HB3 H . . . 1 1 5 5 ARG HB2 H . . . . . 2.8 1.8 2.8 . . . . . A . 5 ARG HB3 . . A . 5 ARG HB2 . . . 5 . HB1 . . . . . 5 . HB2 . . c30448_6cxq 1 82 1 . . 1 1 5 5 ARG HB3 H . . . 1 1 5 5 ARG HB2 H . . . . . 3.4 1.8 3.4 . . . . . A . 5 ARG HB3 . . A . 5 ARG HB2 . . . 5 . HB1 . . . . . 5 . HB2 . . c30448_6cxq 1 83 1 . . 1 1 5 5 ARG HB3 H . . . 1 1 5 5 ARG HB2 H . . . . . 3.4 1.8 3.4 . . . . . A . 5 ARG HB3 . . A . 5 ARG HB2 . . . 5 . HB1 . . . . . 5 . HB2 . . c30448_6cxq 1 84 1 . . 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 . HD1 . . . . . 5 . HB1 . . c30448_6cxq 1 85 1 . . 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 . HD2 . . c30448_6cxq 1 86 1 . . 1 1 5 5 ARG HE H . . . 1 1 5 5 ARG HB3 H . . . . . 5.0 1.8 5.0 . . . . . A . 5 ARG HE . . A . 5 ARG HB3 . . . 5 . HE . . . . . 5 . HB1 . . c30448_6cxq 1 87 1 . . 1 1 5 5 ARG HB2 H . . . 1 1 5 5 ARG HG3 H . . . . . 3.4 1.8 3.4 . . . . . A . 5 ARG HB2 . . A . 5 ARG HG3 . . . 5 . HB2 . . . . . 5 . HG1 . . c30448_6cxq 1 88 1 . . 1 1 5 5 ARG HD3 H . . . 1 1 5 5 ARG HG3 H . . . . . 5.0 1.8 5.0 . . . . . A . 5 ARG HD3 . . A . 5 ARG HG3 . . . 5 . HD1 . . . . . 5 . HG1 . . c30448_6cxq 1 89 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 . . c30448_6cxq 1 90 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 . . c30448_6cxq 1 91 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 . . c30448_6cxq 1 92 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 . . c30448_6cxq 1 93 1 . . 1 1 5 5 ARG HG2 H . . . 1 1 5 5 ARG HD2 H . . . . . 2.8 1.8 2.8 . . . . . A . 5 ARG HG2 . . A . 5 ARG HD2 . . . 5 . HG2 . . . . . 5 . HD2 . . c30448_6cxq 1 94 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 . . c30448_6cxq 1 95 1 . . 1 1 5 5 ARG HA H . . . 1 1 6 6 HIS HA H . . . . . 5.0 1.8 5.0 . . . . . A . 5 ARG HA . . A . 6 HIS HA . . . 5 . HA . . . . . 6 . HA . . c30448_6cxq 1 96 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 . . c30448_6cxq 1 97 1 . . 1 1 5 5 ARG HA H . . . 1 1 6 6 HIS H H . . . . . 3.4 1.8 3.4 . . . . . A . 5 ARG HA . . A . 6 HIS H . . . 5 . HA . . . . . 6 . HN . . c30448_6cxq 1 98 1 . . 1 1 5 5 ARG HA H . . . 1 1 6 6 HIS H H . . . . . 5.0 1.8 5.0 . . . . . A . 5 ARG HA . . A . 6 HIS H . . . 5 . HA . . . . . 6 . HN . . c30448_6cxq 1 99 1 . . 1 1 6 6 HIS HB3 H . . . 1 1 6 6 HIS HA H . . . . . 2.8 1.8 2.8 . . . . . A . 6 HIS HB3 . . A . 6 HIS HA . . . 6 . HB1 . . . . . 6 . HA . . c30448_6cxq 1 100 1 . . 1 1 6 6 HIS HB3 H . . . 1 1 6 6 HIS HA H . . . . . 5.0 1.8 5.0 . . . . . A . 6 HIS HB3 . . A . 6 HIS HA . . . 6 . HB1 . . . . . 6 . HA . . c30448_6cxq 1 101 1 . . 1 1 6 6 HIS HA H . . . 1 1 6 6 HIS HB2 H . . . . . 3.4 1.8 3.4 . . . . . A . 6 HIS HA . . A . 6 HIS HB2 . . . 6 . HA . . . . . 6 . HB2 . . c30448_6cxq 1 102 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 . . c30448_6cxq 1 103 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 . . c30448_6cxq 1 104 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 . . c30448_6cxq 1 105 1 . . 1 1 6 6 HIS HB3 H . . . 1 1 6 6 HIS HD2 H . . . . . 5.0 1.8 5.0 . . . . . A . 6 HIS HB3 . . A . 6 HIS HD2 . . . 6 . HB1 . . . . . 6 . HD2 . . c30448_6cxq 1 106 1 . . 1 1 6 6 HIS HB3 H . . . 1 1 6 6 HIS HD2 H . . . . . 5.0 1.8 5.0 . . . . . A . 6 HIS HB3 . . A . 6 HIS HD2 . . . 6 . HB1 . . . . . 6 . HD2 . . c30448_6cxq 1 107 1 . . 1 1 6 6 HIS HB2 H . . . 1 1 6 6 HIS HD2 H . . . . . 5.0 1.8 5.0 . . . . . A . 6 HIS HB2 . . A . 6 HIS HD2 . . . 6 . HB2 . . . . . 6 . HD2 . . c30448_6cxq 1 108 1 . . 1 1 6 6 HIS HB2 H . . . 1 1 6 6 HIS HD2 H . . . . . 5.0 1.8 5.0 . . . . . A . 6 HIS HB2 . . A . 6 HIS HD2 . . . 6 . HB2 . . . . . 6 . HD2 . . c30448_6cxq 1 109 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 . . c30448_6cxq 1 110 1 . . 1 1 6 6 HIS HB3 H . . . 1 1 6 6 HIS H H . . . . . 5.0 1.8 5.0 . . . . . A . 6 HIS HB3 . . A . 6 HIS H . . . 6 . HB1 . . . . . 6 . HN . . c30448_6cxq 1 111 1 . . 1 1 6 6 HIS HB3 H . . . 1 1 6 6 HIS H H . . . . . 5.0 1.8 5.0 . . . . . A . 6 HIS HB3 . . A . 6 HIS H . . . 6 . HB1 . . . . . 6 . HN . . c30448_6cxq 1 112 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 . . c30448_6cxq 1 113 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 . . c30448_6cxq 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 noe6.10 2 68 2 81 c30448_6cxq 1 2 noe6.17 3 67 3 81 c30448_6cxq 1 3 noe6.19 4 67 4 81 c30448_6cxq 1 4 noe6.21 5 67 5 81 c30448_6cxq 1 5 noe6.27 6 67 6 81 c30448_6cxq 1 6 noe6.30 7 69 7 81 c30448_6cxq 1 7 noe6.40 8 67 8 81 c30448_6cxq 1 8 noe6.44 9 67 9 81 c30448_6cxq 1 9 noe6.47 10 67 10 81 c30448_6cxq 1 10 noe6.48 11 67 11 81 c30448_6cxq 1 11 noe6.52 12 67 12 81 c30448_6cxq 1 12 noe6.67 13 67 13 81 c30448_6cxq 1 13 noe6.69 14 67 14 81 c30448_6cxq 1 14 noe6.70 15 68 15 81 c30448_6cxq 1 15 noe6.71 16 68 16 81 c30448_6cxq 1 16 noe6.72 17 67 17 81 c30448_6cxq 1 17 noe6.73 18 67 18 81 c30448_6cxq 1 18 noe6.75 19 68 19 81 c30448_6cxq 1 19 noe6.82 20 67 20 81 c30448_6cxq 1 20 noe6.97 21 68 21 81 c30448_6cxq 1 21 noe6.101 22 68 22 82 c30448_6cxq 1 22 noe6.129 23 67 23 82 c30448_6cxq 1 23 noe6.130 24 67 24 82 c30448_6cxq 1 24 noe6.144 25 67 25 82 c30448_6cxq 1 25 noe6.145 26 68 26 82 c30448_6cxq 1 26 noe6.146 27 68 27 82 c30448_6cxq 1 27 noe6.154 28 67 28 82 c30448_6cxq 1 28 noe6.155 29 67 29 82 c30448_6cxq 1 29 noe6.158 30 67 30 82 c30448_6cxq 1 30 noe6.161 31 69 31 82 c30448_6cxq 1 31 noe6.162 32 69 32 82 c30448_6cxq 1 32 noe6.170 33 68 33 82 c30448_6cxq 1 33 noe6.171 34 68 34 82 c30448_6cxq 1 34 noe6.175 35 68 35 82 c30448_6cxq 1 35 noe6.60 36 67 36 81 c30448_6cxq 1 36 noe6.29 37 67 37 81 c30448_6cxq 1 37 noe6.85 38 67 38 81 c30448_6cxq 1 38 noe6.102 39 68 39 82 c30448_6cxq 1 39 noe6.99 40 68 40 81 c30448_6cxq 1 40 noe6.0 41 66 41 80 c30448_6cxq 1 41 noe6.58 42 66 42 81 c30448_6cxq 1 42 noe6.149 43 67 43 82 c30448_6cxq 1 43 noe6.152 44 67 44 82 c30448_6cxq 1 44 noe6.148 45 67 45 82 c30448_6cxq 1 45 noe6.91 46 68 46 81 c30448_6cxq 1 46 noe6.92 47 68 47 81 c30448_6cxq 1 47 noe6.13 48 68 48 81 c30448_6cxq 1 48 noe6.14 49 68 49 81 c30448_6cxq 1 49 noe6.6 50 66 50 80 c30448_6cxq 1 50 noe6.32 51 67 51 81 c30448_6cxq 1 51 noe6.65 52 67 52 81 c30448_6cxq 1 52 noe6.33 53 67 53 81 c30448_6cxq 1 53 noe6.64 54 67 54 81 c30448_6cxq 1 54 noe6.84 55 67 55 81 c30448_6cxq 1 55 noe6.20 56 67 56 81 c30448_6cxq 1 56 noe6.169 57 66 57 82 c30448_6cxq 1 57 noe6.159 58 68 58 82 c30448_6cxq 1 58 noe6.5 59 66 59 80 c30448_6cxq 1 59 noe6.37 60 67 60 81 c30448_6cxq 1 60 noe6.157 61 67 61 82 c30448_6cxq 1 61 noe6.36 62 67 62 81 c30448_6cxq 1 62 noe6.156 63 67 63 82 c30448_6cxq 1 63 noe6.24 64 68 64 81 c30448_6cxq 1 64 noe6.132 65 68 65 82 c30448_6cxq 1 65 noe6.25 66 68 66 81 c30448_6cxq 1 66 noe6.133 67 68 67 82 c30448_6cxq 1 67 noe6.83 68 66 68 81 c30448_6cxq 1 68 noe6.31 69 68 69 81 c30448_6cxq 1 69 noe6.164 70 68 70 82 c30448_6cxq 1 70 noe6.163 71 68 71 82 c30448_6cxq 1 71 noe6.4 72 66 72 80 c30448_6cxq 1 72 noe6.59 73 66 73 81 c30448_6cxq 1 73 noe6.23 74 66 74 81 c30448_6cxq 1 74 noe6.68 75 66 75 81 c30448_6cxq 1 75 noe6.7 76 66 76 80 c30448_6cxq 1 76 noe6.28 77 67 77 81 c30448_6cxq 1 77 noe6.87 78 67 78 81 c30448_6cxq 1 78 noe6.39 79 67 79 81 c30448_6cxq 1 79 noe6.88 80 67 80 81 c30448_6cxq 1 80 noe6.104 81 68 81 82 c30448_6cxq 1 81 noe6.105 82 68 82 82 c30448_6cxq 1 82 noe6.106 83 68 83 82 c30448_6cxq 1 83 noe6.107 84 68 84 82 c30448_6cxq 1 84 noe6.96 85 68 85 81 c30448_6cxq 1 85 noe6.95 86 68 86 81 c30448_6cxq 1 86 noe6.174 87 67 87 82 c30448_6cxq 1 87 noe6.114 88 68 88 82 c30448_6cxq 1 88 noe6.98 89 68 89 81 c30448_6cxq 1 89 noe6.86 90 67 90 81 c30448_6cxq 1 90 noe6.172 91 67 91 82 c30448_6cxq 1 91 noe6.108 92 68 92 82 c30448_6cxq 1 92 noe6.109 93 68 93 82 c30448_6cxq 1 93 noe6.103 94 68 94 82 c30448_6cxq 1 94 noe6.8 95 66 95 80 c30448_6cxq 1 95 noe6.168 96 66 96 82 c30448_6cxq 1 96 noe6.50 97 66 97 81 c30448_6cxq 1 97 noe6.2 98 66 98 80 c30448_6cxq 1 98 noe6.61 99 66 99 81 c30448_6cxq 1 99 noe6.147 100 67 100 82 c30448_6cxq 1 100 noe6.151 101 67 101 82 c30448_6cxq 1 101 noe6.150 102 67 102 82 c30448_6cxq 1 102 noe6.153 103 67 103 82 c30448_6cxq 1 103 noe6.93 104 68 104 81 c30448_6cxq 1 104 noe6.94 105 68 105 81 c30448_6cxq 1 105 noe6.11 106 68 106 81 c30448_6cxq 1 106 noe6.74 107 68 107 81 c30448_6cxq 1 107 noe6.12 108 68 108 81 c30448_6cxq 1 108 noe6.125 109 68 109 82 c30448_6cxq 1 109 noe6.9 110 66 110 80 c30448_6cxq 1 110 noe6.34 111 67 111 81 c30448_6cxq 1 111 noe6.63 112 67 112 81 c30448_6cxq 1 112 noe6.35 113 67 113 81 c30448_6cxq 1 113 noe6.62 114 67 114 81 c30448_6cxq 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: noe6.tbl' 1 1 1 29 c30448_6cxq 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 c30448_6cxq _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 6CXQ *TITLE HRFLRH PEPTIDE NMR STRUCTURE IN THE PRESENCE OF CO2 *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, CO2 AFFINITY, METAL BINDING *KEYWDS 2 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 6CXQ 0' save_