data_c30496_6e5h ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID c30496_6e5h _Entry.Title ; Heterogeneous-Backbone Mimics of a Designed Disulfide-Rich Protein: Aib turn ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2018-07-20 _Entry.Accession_date 2018-07-20 _Entry.Last_release_date 2018-07-30 _Entry.Original_release_date 2018-07-30 _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' c30496_6e5h 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 C. Cabalteja C. C. . . c30496_6e5h 2 D. Mihalko D. S. . . c30496_6e5h 3 W. Horne W. S. . . c30496_6e5h stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID 'DE NOVO PROTEIN' . c30496_6e5h 'heterogeneous backbone foldamer' . c30496_6e5h stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 c30496_6e5h stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '1H chemical shifts' 187 c30496_6e5h 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 . . 2018-11-12 . original BMRB . c30496_6e5h stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 6E5H . c30496_6e5h stop_ save_ ############### # Citations # ############### save_citation_1 _Citation.Sf_category citations _Citation.Sf_framecode citation_1 _Citation.Entry_ID c30496_6e5h _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 30326175 _Citation.Full_citation . _Citation.Title ; Heterogeneous-Backbone Foldamer Mimics of a Computationally Designed, Disulfide-Rich Miniprotein ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev Chembiochem. _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 C. Cabalteja C. C. . . c30496_6e5h 1 2 D. Mihalko D. S. . . c30496_6e5h 1 3 W. Horne W. S. . . c30496_6e5h 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID c30496_6e5h _Assembly.ID 1 _Assembly.Name 'Designed peptide NC_HEE_D1: Aib turn mutant' _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 . . . . . . c30496_6e5h 1 stop_ loop_ _Bond.ID _Bond.Type _Bond.Value_order _Bond.Assembly_atom_ID_1 _Bond.Entity_assembly_ID_1 _Bond.Entity_assembly_name_1 _Bond.Entity_ID_1 _Bond.Comp_ID_1 _Bond.Comp_index_ID_1 _Bond.Seq_ID_1 _Bond.Atom_ID_1 _Bond.Assembly_atom_ID_2 _Bond.Entity_assembly_ID_2 _Bond.Entity_assembly_name_2 _Bond.Entity_ID_2 _Bond.Comp_ID_2 _Bond.Comp_index_ID_2 _Bond.Seq_ID_2 _Bond.Atom_ID_2 _Bond.Auth_entity_assembly_ID_1 _Bond.Auth_entity_assembly_name_1 _Bond.Auth_asym_ID_1 _Bond.Auth_seq_ID_1 _Bond.Auth_comp_ID_1 _Bond.Auth_atom_ID_1 _Bond.Auth_entity_assembly_ID_2 _Bond.Auth_entity_assembly_name_2 _Bond.Auth_asym_ID_2 _Bond.Auth_seq_ID_2 _Bond.Auth_comp_ID_2 _Bond.Auth_atom_ID_2 _Bond.Entry_ID _Bond.Assembly_ID 1 disulfide single . 1 . 1 CYS 4 4 SG . 1 . 1 CYS 18 18 SG . . . . . . . . . . . . c30496_6e5h 1 2 disulfide single . 1 . 1 CYS 14 14 SG . 1 . 1 CYS 27 27 SG . . . . . . . . . . . . c30496_6e5h 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID c30496_6e5h _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 ; NDKCKELKKRYXGCEVRCDX PRYEVHCX ; _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 28 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all disulfide bound' _Entity.Src_method syn _Entity.Parent_entity_ID 1 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 3260.814 _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 . ASN . c30496_6e5h 1 2 . ASP . c30496_6e5h 1 3 . LYS . c30496_6e5h 1 4 . CYS . c30496_6e5h 1 5 . LYS . c30496_6e5h 1 6 . GLU . c30496_6e5h 1 7 . LEU . c30496_6e5h 1 8 . LYS . c30496_6e5h 1 9 . LYS . c30496_6e5h 1 10 . ARG . c30496_6e5h 1 11 . TYR . c30496_6e5h 1 12 . AIB . c30496_6e5h 1 13 . GLY . c30496_6e5h 1 14 . CYS . c30496_6e5h 1 15 . GLU . c30496_6e5h 1 16 . VAL . c30496_6e5h 1 17 . ARG . c30496_6e5h 1 18 . CYS . c30496_6e5h 1 19 . ASP . c30496_6e5h 1 20 . DPR . c30496_6e5h 1 21 . PRO . c30496_6e5h 1 22 . ARG . c30496_6e5h 1 23 . TYR . c30496_6e5h 1 24 . GLU . c30496_6e5h 1 25 . VAL . c30496_6e5h 1 26 . HIS . c30496_6e5h 1 27 . CYS . c30496_6e5h 1 28 . NH2 . c30496_6e5h 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 . ASN 1 1 c30496_6e5h 1 . ASP 2 2 c30496_6e5h 1 . LYS 3 3 c30496_6e5h 1 . CYS 4 4 c30496_6e5h 1 . LYS 5 5 c30496_6e5h 1 . GLU 6 6 c30496_6e5h 1 . LEU 7 7 c30496_6e5h 1 . LYS 8 8 c30496_6e5h 1 . LYS 9 9 c30496_6e5h 1 . ARG 10 10 c30496_6e5h 1 . TYR 11 11 c30496_6e5h 1 . AIB 12 12 c30496_6e5h 1 . GLY 13 13 c30496_6e5h 1 . CYS 14 14 c30496_6e5h 1 . GLU 15 15 c30496_6e5h 1 . VAL 16 16 c30496_6e5h 1 . ARG 17 17 c30496_6e5h 1 . CYS 18 18 c30496_6e5h 1 . ASP 19 19 c30496_6e5h 1 . DPR 20 20 c30496_6e5h 1 . PRO 21 21 c30496_6e5h 1 . ARG 22 22 c30496_6e5h 1 . TYR 23 23 c30496_6e5h 1 . GLU 24 24 c30496_6e5h 1 . VAL 25 25 c30496_6e5h 1 . HIS 26 26 c30496_6e5h 1 . CYS 27 27 c30496_6e5h 1 . NH2 28 28 c30496_6e5h 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 c30496_6e5h _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 . 32630 'no natural source' . 'synthetic construct' . . . . . . . . . . . . . . . . . . . . c30496_6e5h 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 c30496_6e5h _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' . . . . . . . . . . . . . . . . c30496_6e5h 1 stop_ save_ ################################# # Polymer residues and ligands # ################################# save_chem_comp_DPR _Chem_comp.Sf_category chem_comp _Chem_comp.Sf_framecode chem_comp_DPR _Chem_comp.Entry_ID c30496_6e5h _Chem_comp.ID DPR _Chem_comp.Provenance PDB _Chem_comp.Name D-PROLINE _Chem_comp.Type 'D-PEPTIDE LINKING' _Chem_comp.BMRB_code DPR _Chem_comp.PDB_code DPR _Chem_comp.Ambiguous_flag no _Chem_comp.Initial_date 2012-11-20 _Chem_comp.Modified_date 2012-11-20 _Chem_comp.Release_status REL _Chem_comp.Replaced_by . _Chem_comp.Replaces . _Chem_comp.One_letter_code P _Chem_comp.Three_letter_code DPR _Chem_comp.Number_atoms_all 17 _Chem_comp.Number_atoms_nh 8 _Chem_comp.Atom_nomenclature_source . _Chem_comp.PubChem_code . _Chem_comp.Subcomponent_list . _Chem_comp.InChI_code InChI=1S/C5H9NO2/c7-5(8)4-2-1-3-6-4/h4,6H,1-3H2,(H,7,8)/t4-/m1/s1 _Chem_comp.Mon_nstd_flag . _Chem_comp.Mon_nstd_class . _Chem_comp.Mon_nstd_details . _Chem_comp.Mon_nstd_parent . _Chem_comp.Mon_nstd_parent_comp_ID . _Chem_comp.Std_deriv_one_letter_code . _Chem_comp.Std_deriv_three_letter_code . _Chem_comp.Std_deriv_BMRB_code . _Chem_comp.Std_deriv_PDB_code . _Chem_comp.Std_deriv_chem_comp_name . _Chem_comp.Synonyms . _Chem_comp.Formal_charge 0 _Chem_comp.Paramagnetic . _Chem_comp.Aromatic no _Chem_comp.Formula 'C5 H9 N O2' _Chem_comp.Formula_weight 115.130 _Chem_comp.Formula_mono_iso_wt_nat . _Chem_comp.Formula_mono_iso_wt_13C . _Chem_comp.Formula_mono_iso_wt_15N . _Chem_comp.Formula_mono_iso_wt_13C_15N . _Chem_comp.Image_file_name . _Chem_comp.Image_file_format . _Chem_comp.Topo_file_name . _Chem_comp.Topo_file_format . _Chem_comp.Struct_file_name . _Chem_comp.Struct_file_format . _Chem_comp.Stereochem_param_file_name . _Chem_comp.Stereochem_param_file_format . _Chem_comp.Model_details . _Chem_comp.Model_erf . _Chem_comp.Model_source . _Chem_comp.Model_coordinates_details . _Chem_comp.Model_coordinates_missing_flag yes _Chem_comp.Ideal_coordinates_details Corina _Chem_comp.Ideal_coordinates_missing_flag no _Chem_comp.Model_coordinates_db_code . _Chem_comp.Processing_site EBI _Chem_comp.Vendor . _Chem_comp.Vendor_product_code . _Chem_comp.Details . _Chem_comp.DB_query_date . _Chem_comp.DB_last_query_revised_last_date . loop_ _Chem_comp_descriptor.Descriptor _Chem_comp_descriptor.Type _Chem_comp_descriptor.Program _Chem_comp_descriptor.Program_version _Chem_comp_descriptor.Entry_ID _Chem_comp_descriptor.Comp_ID C1CC(NC1)C(=O)O SMILES 'OpenEye OEToolkits' 1.7.0 c30496_6e5h DPR C1C[C@@H](NC1)C(=O)O SMILES_CANONICAL 'OpenEye OEToolkits' 1.7.0 c30496_6e5h DPR InChI=1S/C5H9NO2/c7-5(8)4-2-1-3-6-4/h4,6H,1-3H2,(H,7,8)/t4-/m1/s1 InChI InChI 1.03 c30496_6e5h DPR O=C(O)C1NCCC1 SMILES ACDLabs 12.01 c30496_6e5h DPR OC(=O)[C@H]1CCCN1 SMILES_CANONICAL CACTVS 3.370 c30496_6e5h DPR OC(=O)[CH]1CCCN1 SMILES CACTVS 3.370 c30496_6e5h DPR ONIBWKKTOPOVIA-SCSAIBSYSA-N InChIKey InChI 1.03 c30496_6e5h DPR 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 '(2R)-pyrrolidine-2-carboxylic acid' 'SYSTEMATIC NAME' 'OpenEye OEToolkits' 1.7.0 c30496_6e5h DPR D-proline 'SYSTEMATIC NAME' ACDLabs 12.01 c30496_6e5h DPR 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 . . . . -4.206 . 7.451 . -17.843 . 0.814 0.974 0.670 1 . c30496_6e5h DPR CA CA CA CA . C . . R 0 . . . 1 no no . . . . -3.893 . 8.671 . -18.566 . -0.014 -0.244 0.598 2 . c30496_6e5h DPR CB CB CB CB . C . . N 0 . . . 1 no no . . . . -5.242 . 9.255 . -18.952 . 0.728 -1.247 -0.310 3 . c30496_6e5h DPR CG CG CG CG . C . . N 0 . . . 1 no no . . . . -6.239 . 8.113 . -18.840 . 2.199 -0.759 -0.242 4 . c30496_6e5h DPR CD CD CD CD . C . . N 0 . . . 1 no no . . . . -5.571 . 6.986 . -18.070 . 2.016 0.777 -0.168 5 . c30496_6e5h DPR C C C C . C . . N 0 . . . 1 no no . . . . -2.999 . 8.379 . -19.774 . -1.360 0.086 0.006 6 . c30496_6e5h DPR O O O O . O . . N 0 . . . 1 no no . . . . -3.431 . 7.734 . -20.727 . -1.509 1.105 -0.626 7 . c30496_6e5h DPR OXT OXT OXT OXT . O . . N 0 . . . 1 no yes . . . . . . . . . . -2.393 -0.753 0.180 8 . c30496_6e5h DPR H H H HT1 . H . . N 0 . . . 1 no yes . . . . -3.576 . 6.736 . -18.147 . 0.293 1.784 0.370 9 . c30496_6e5h DPR HA HA HA HA . H . . N 0 . . . 1 no no . . . . -3.318 . 9.388 . -17.962 . -0.138 -0.667 1.595 10 . c30496_6e5h DPR HB2 HB2 HB2 HB1 . H . . N 0 . . . 1 no no . . . . -5.517 . 10.078 . -18.276 . 0.639 -2.260 0.083 11 . c30496_6e5h DPR HB3 HB3 HB3 HB2 . H . . N 0 . . . 1 no no . . . . -5.215 . 9.648 . -19.979 . 0.351 -1.194 -1.331 12 . c30496_6e5h DPR HG2 HG2 HG2 HG1 . H . . N 0 . . . 1 no no . . . . -7.140 . 8.451 . -18.307 . 2.695 -1.137 0.653 13 . c30496_6e5h DPR HG3 HG3 HG3 HG2 . H . . N 0 . . . 1 no no . . . . -6.527 . 7.765 . -19.843 . 2.747 -1.045 -1.140 14 . c30496_6e5h DPR HD2 HD2 HD2 HD1 . H . . N 0 . . . 1 no no . . . . -5.580 . 6.051 . -18.650 . 1.855 1.188 -1.165 15 . c30496_6e5h DPR HD3 HD3 HD3 HD2 . H . . N 0 . . . 1 no no . . . . -6.088 . 6.796 . -17.118 . 2.885 1.241 0.299 16 . c30496_6e5h DPR HXT HXT HXT HXT . H . . N 0 . . . 1 no yes . . . . . . . . . . -3.237 -0.500 -0.219 17 . c30496_6e5h DPR stop_ loop_ _Chem_comp_bond.ID _Chem_comp_bond.Type _Chem_comp_bond.Value_order _Chem_comp_bond.Atom_ID_1 _Chem_comp_bond.Atom_ID_2 _Chem_comp_bond.Aromatic_flag _Chem_comp_bond.Stereo_config _Chem_comp_bond.Ordinal _Chem_comp_bond.Details _Chem_comp_bond.Entry_ID _Chem_comp_bond.Comp_ID 1 . SING N CA no N 1 . c30496_6e5h DPR 2 . SING N CD no N 2 . c30496_6e5h DPR 3 . SING N H no N 3 . c30496_6e5h DPR 4 . SING CA CB no N 4 . c30496_6e5h DPR 5 . SING CA C no N 5 . c30496_6e5h DPR 6 . SING CA HA no N 6 . c30496_6e5h DPR 7 . SING CB CG no N 7 . c30496_6e5h DPR 8 . SING CB HB2 no N 8 . c30496_6e5h DPR 9 . SING CB HB3 no N 9 . c30496_6e5h DPR 10 . SING CG CD no N 10 . c30496_6e5h DPR 11 . SING CG HG2 no N 11 . c30496_6e5h DPR 12 . SING CG HG3 no N 12 . c30496_6e5h DPR 13 . SING CD HD2 no N 13 . c30496_6e5h DPR 14 . SING CD HD3 no N 14 . c30496_6e5h DPR 15 . DOUB C O no N 15 . c30496_6e5h DPR 16 . SING C OXT no N 16 . c30496_6e5h DPR 17 . SING OXT HXT no N 17 . c30496_6e5h DPR stop_ save_ save_chem_comp_NH2 _Chem_comp.Sf_category chem_comp _Chem_comp.Sf_framecode chem_comp_NH2 _Chem_comp.Entry_ID c30496_6e5h _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 c30496_6e5h NH2 N SMILES ACDLabs 10.04 c30496_6e5h NH2 QGZKDVFQNNGYKY-UHFFFAOYAF InChIKey InChI 1.02b c30496_6e5h NH2 [NH2] SMILES CACTVS 3.341 c30496_6e5h NH2 [NH2] SMILES 'OpenEye OEToolkits' 1.5.0 c30496_6e5h NH2 [NH2] SMILES_CANONICAL CACTVS 3.341 c30496_6e5h NH2 [NH2] SMILES_CANONICAL 'OpenEye OEToolkits' 1.5.0 c30496_6e5h 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 c30496_6e5h NH2 l^{2}-azane 'SYSTEMATIC NAME' 'OpenEye OEToolkits' 1.5.0 c30496_6e5h 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 . c30496_6e5h NH2 HN1 HN1 HN1 1HN . H . . N 0 . . . 1 no no . . . . 9.517 . 8.769 . -7.044 . -0.385 -0.545 -0.771 2 . c30496_6e5h NH2 HN2 HN2 HN2 2HN . H . . N 0 . . . 1 no no . . . . 10.323 . 9.890 . -8.082 . 1.020 0.000 0.000 3 . c30496_6e5h 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 . c30496_6e5h NH2 2 . SING N HN2 no N 2 . c30496_6e5h NH2 stop_ save_ save_chem_comp_AIB _Chem_comp.Sf_category chem_comp _Chem_comp.Sf_framecode chem_comp_AIB _Chem_comp.Entry_ID c30496_6e5h _Chem_comp.ID AIB _Chem_comp.Provenance PDB _Chem_comp.Name 'ALPHA-AMINOISOBUTYRIC ACID' _Chem_comp.Type 'L-PEPTIDE LINKING' _Chem_comp.BMRB_code AIB _Chem_comp.PDB_code AIB _Chem_comp.Ambiguous_flag no _Chem_comp.Initial_date 2012-11-20 _Chem_comp.Modified_date 2012-11-20 _Chem_comp.Release_status REL _Chem_comp.Replaced_by . _Chem_comp.Replaces . _Chem_comp.One_letter_code A _Chem_comp.Three_letter_code AIB _Chem_comp.Number_atoms_all 16 _Chem_comp.Number_atoms_nh 7 _Chem_comp.Atom_nomenclature_source . _Chem_comp.PubChem_code . _Chem_comp.Subcomponent_list . _Chem_comp.InChI_code InChI=1S/C4H9NO2/c1-4(2,5)3(6)7/h5H2,1-2H3,(H,6,7) _Chem_comp.Mon_nstd_flag . _Chem_comp.Mon_nstd_class . _Chem_comp.Mon_nstd_details . _Chem_comp.Mon_nstd_parent . _Chem_comp.Mon_nstd_parent_comp_ID ALA _Chem_comp.Std_deriv_one_letter_code . _Chem_comp.Std_deriv_three_letter_code . _Chem_comp.Std_deriv_BMRB_code . _Chem_comp.Std_deriv_PDB_code . _Chem_comp.Std_deriv_chem_comp_name . _Chem_comp.Synonyms . _Chem_comp.Formal_charge 0 _Chem_comp.Paramagnetic . _Chem_comp.Aromatic no _Chem_comp.Formula 'C4 H9 N O2' _Chem_comp.Formula_weight 103.120 _Chem_comp.Formula_mono_iso_wt_nat . _Chem_comp.Formula_mono_iso_wt_13C . _Chem_comp.Formula_mono_iso_wt_15N . _Chem_comp.Formula_mono_iso_wt_13C_15N . _Chem_comp.Image_file_name . _Chem_comp.Image_file_format . _Chem_comp.Topo_file_name . _Chem_comp.Topo_file_format . _Chem_comp.Struct_file_name . _Chem_comp.Struct_file_format . _Chem_comp.Stereochem_param_file_name . _Chem_comp.Stereochem_param_file_format . _Chem_comp.Model_details . _Chem_comp.Model_erf . _Chem_comp.Model_source . _Chem_comp.Model_coordinates_details . _Chem_comp.Model_coordinates_missing_flag no _Chem_comp.Ideal_coordinates_details . _Chem_comp.Ideal_coordinates_missing_flag no _Chem_comp.Model_coordinates_db_code 1AMT _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 CC(C)(C(=O)O)N SMILES 'OpenEye OEToolkits' 1.5.0 c30496_6e5h AIB CC(C)(C(=O)O)N SMILES_CANONICAL 'OpenEye OEToolkits' 1.5.0 c30496_6e5h AIB CC(C)(N)C(O)=O SMILES CACTVS 3.341 c30496_6e5h AIB CC(C)(N)C(O)=O SMILES_CANONICAL CACTVS 3.341 c30496_6e5h AIB FUOOLUPWFVMBKG-UHFFFAOYSA-N InChIKey InChI 1.03 c30496_6e5h AIB InChI=1S/C4H9NO2/c1-4(2,5)3(6)7/h5H2,1-2H3,(H,6,7) InChI InChI 1.03 c30496_6e5h AIB O=C(O)C(N)(C)C SMILES ACDLabs 10.04 c30496_6e5h AIB 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 '2-amino-2-methyl-propanoic acid' 'SYSTEMATIC NAME' 'OpenEye OEToolkits' 1.5.0 c30496_6e5h AIB 2-methyl-L-alanine 'SYSTEMATIC NAME' ACDLabs 10.04 c30496_6e5h AIB 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 . . . . 48.065 . 2.462 . -1.964 . -1.298 0.711 0.969 1 . c30496_6e5h AIB CA CA CA CA . C . . N 0 . . . 1 no no . . . . 46.920 . 3.266 . -2.573 . -0.053 0.002 0.646 2 . c30496_6e5h AIB C C C C . C . . N 0 . . . 1 no no . . . . 45.865 . 2.301 . -3.116 . 0.144 -0.009 -0.847 3 . c30496_6e5h AIB O O O O1 . O . . N 0 . . . 1 no no . . . . 44.700 . 2.587 . -2.746 . 1.261 -0.025 -1.308 4 . c30496_6e5h AIB OXT OXT OXT O2 . O . . N 0 . . . 1 no yes . . . . 46.136 . 1.294 . -3.808 . -0.919 -0.003 -1.665 5 . c30496_6e5h AIB CB1 CB1 CB1 CB1 . C . . N 0 . . . 1 no no . . . . 47.457 . 4.132 . -3.656 . 1.126 0.715 1.311 6 . c30496_6e5h AIB CB2 CB2 CB2 CB2 . C . . N 0 . . . 1 no no . . . . 46.329 . 4.215 . -1.516 . -0.136 -1.435 1.161 7 . c30496_6e5h AIB H H H 1HN . H . . N 0 . . . 1 no no . . . . 48.768 . 3.105 . -1.601 . -1.199 1.649 0.612 8 . c30496_6e5h AIB H2 H2 H2 2HN . H . . N 0 . . . 1 no yes . . . . 48.457 . 1.787 . -2.620 . -2.030 0.272 0.430 9 . c30496_6e5h AIB HO2 HO2 HO2 HO2 . H . . N 0 . . . 1 no no . . . . 45.480 . 0.694 . -4.145 . -0.792 -0.010 -2.624 10 . c30496_6e5h AIB HB11 HB11 HB11 1HB1 . H . . N 0 . . . 0 no no . . . . 46.620 . 4.719 . -4.101 . 0.983 0.723 2.391 11 . c30496_6e5h AIB HB12 HB12 HB12 2HB1 . H . . N 0 . . . 0 no no . . . . 48.291 . 4.782 . -3.304 . 2.050 0.189 1.071 12 . c30496_6e5h AIB HB13 HB13 HB13 3HB1 . H . . N 0 . . . 0 no no . . . . 48.022 . 3.551 . -4.422 . 1.185 1.739 0.944 13 . c30496_6e5h AIB HB21 HB21 HB21 1HB2 . H . . N 0 . . . 0 no no . . . . 45.492 . 4.802 . -1.961 . 0.787 -1.961 0.921 14 . c30496_6e5h AIB HB22 HB22 HB22 2HB2 . H . . N 0 . . . 0 no no . . . . 46.015 . 3.672 . -0.593 . -0.279 -1.426 2.242 15 . c30496_6e5h AIB HB23 HB23 HB23 3HB2 . H . . N 0 . . . 0 no no . . . . 47.106 . 4.871 . -1.060 . -0.976 -1.943 0.687 16 . c30496_6e5h AIB stop_ loop_ _Chem_comp_bond.ID _Chem_comp_bond.Type _Chem_comp_bond.Value_order _Chem_comp_bond.Atom_ID_1 _Chem_comp_bond.Atom_ID_2 _Chem_comp_bond.Aromatic_flag _Chem_comp_bond.Stereo_config _Chem_comp_bond.Ordinal _Chem_comp_bond.Details _Chem_comp_bond.Entry_ID _Chem_comp_bond.Comp_ID 1 . SING N CA no N 1 . c30496_6e5h AIB 2 . SING N H no N 2 . c30496_6e5h AIB 3 . SING N H2 no N 3 . c30496_6e5h AIB 4 . SING CA C no N 4 . c30496_6e5h AIB 5 . SING CA CB1 no N 5 . c30496_6e5h AIB 6 . SING CA CB2 no N 6 . c30496_6e5h AIB 7 . DOUB C O no N 7 . c30496_6e5h AIB 8 . SING C OXT no N 8 . c30496_6e5h AIB 9 . SING OXT HO2 no N 9 . c30496_6e5h AIB 10 . SING CB1 HB11 no N 10 . c30496_6e5h AIB 11 . SING CB1 HB12 no N 11 . c30496_6e5h AIB 12 . SING CB1 HB13 no N 12 . c30496_6e5h AIB 13 . SING CB2 HB21 no N 13 . c30496_6e5h AIB 14 . SING CB2 HB22 no N 14 . c30496_6e5h AIB 15 . SING CB2 HB23 no N 15 . c30496_6e5h AIB stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID c30496_6e5h _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details '0.2 mM NA DSS, 0.5 mM NA Designed peptide NC_HEE_D1: Aib turn mutant, 90% H2O/10% D2O' _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 DSS 'natural abundance' . . . . . . 0.2 . . mM . . . . c30496_6e5h 1 2 'Designed peptide NC_HEE_D1: Aib turn mutant' 'natural abundance' 1 $assembly 1 $entity_1 . . 0.5 . . mM . . . . c30496_6e5h 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 c30496_6e5h _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' 10 . mM c30496_6e5h 1 pH 4.0 . pH c30496_6e5h 1 pressure 1 . atm c30496_6e5h 1 temperature 275 . K c30496_6e5h 1 stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Software.Sf_category software _Software.Sf_framecode software_1 _Software.Entry_ID c30496_6e5h _Software.ID 1 _Software.Type . _Software.Name SPARKY _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Goddard . . c30496_6e5h 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' c30496_6e5h 1 stop_ save_ save_software_2 _Software.Sf_category software _Software.Sf_framecode software_2 _Software.Entry_ID c30496_6e5h _Software.ID 2 _Software.Type . _Software.Name ARIA _Software.Version 2.3 _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID "Linge, O'Donoghue and Nilges" . . c30496_6e5h 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'structure calculation' c30496_6e5h 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 c30496_6e5h _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 700 save_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID c30496_6e5h _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 NMR_spectrometer_1 Bruker Avance . 700 . . . c30496_6e5h 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 c30496_6e5h _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 TOCSY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . c30496_6e5h 1 2 '2D COSY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . c30496_6e5h 1 3 '2D NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . c30496_6e5h 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 c30496_6e5h _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID H 1 DSS 'methyl protons' . . . . ppm 0.000 internal direct 1.0 . . . . . c30496_6e5h 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 c30496_6e5h _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 TOCSY' . . . c30496_6e5h 1 2 '2D COSY' . . . c30496_6e5h 1 3 '2D NOESY' . . . c30496_6e5h 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 ASN HA H 1 4.342 0.000 . 1 . . . . A 1 ASN HA . c30496_6e5h 1 2 . 1 1 1 1 ASN HB2 H 1 3.013 0.000 . 1 . . . . A 1 ASN HB2 . c30496_6e5h 1 3 . 1 1 1 1 ASN HB3 H 1 3.013 0.000 . 1 . . . . A 1 ASN HB3 . c30496_6e5h 1 4 . 1 1 1 1 ASN HD21 H 1 7.059 0.000 . 2 . . . . A 1 ASN HD21 . c30496_6e5h 1 5 . 1 1 1 1 ASN HD22 H 1 7.771 0.000 . 2 . . . . A 1 ASN HD22 . c30496_6e5h 1 6 . 1 1 2 2 ASP H H 1 8.803 0.000 . 1 . . . . A 2 ASP H . c30496_6e5h 1 7 . 1 1 2 2 ASP HA H 1 4.700 0.003 . 1 . . . . A 2 ASP HA . c30496_6e5h 1 8 . 1 1 2 2 ASP HB2 H 1 2.836 0.001 . 2 . . . . A 2 ASP HB2 . c30496_6e5h 1 9 . 1 1 2 2 ASP HB3 H 1 2.700 0.001 . 2 . . . . A 2 ASP HB3 . c30496_6e5h 1 10 . 1 1 3 3 LYS H H 1 8.497 0.001 . 1 . . . . A 3 LYS H . c30496_6e5h 1 11 . 1 1 3 3 LYS HA H 1 4.052 0.000 . 1 . . . . A 3 LYS HA . c30496_6e5h 1 12 . 1 1 3 3 LYS HB2 H 1 1.771 0.000 . 1 . . . . A 3 LYS HB2 . c30496_6e5h 1 13 . 1 1 3 3 LYS HB3 H 1 1.771 0.000 . 1 . . . . A 3 LYS HB3 . c30496_6e5h 1 14 . 1 1 3 3 LYS HG2 H 1 1.336 0.002 . 2 . . . . A 3 LYS HG2 . c30496_6e5h 1 15 . 1 1 3 3 LYS HG3 H 1 1.204 0.001 . 2 . . . . A 3 LYS HG3 . c30496_6e5h 1 16 . 1 1 3 3 LYS HD2 H 1 1.587 0.000 . 1 . . . . A 3 LYS HD2 . c30496_6e5h 1 17 . 1 1 3 3 LYS HD3 H 1 1.587 0.000 . 1 . . . . A 3 LYS HD3 . c30496_6e5h 1 18 . 1 1 3 3 LYS HE2 H 1 2.815 0.000 . 1 . . . . A 3 LYS HE2 . c30496_6e5h 1 19 . 1 1 3 3 LYS HE3 H 1 2.815 0.000 . 1 . . . . A 3 LYS HE3 . c30496_6e5h 1 20 . 1 1 4 4 CYS H H 1 8.369 0.000 . 1 . . . . A 4 CYS H . c30496_6e5h 1 21 . 1 1 4 4 CYS HA H 1 4.201 0.001 . 1 . . . . A 4 CYS HA . c30496_6e5h 1 22 . 1 1 4 4 CYS HB2 H 1 3.289 0.001 . 1 . . . . A 4 CYS HB2 . c30496_6e5h 1 23 . 1 1 4 4 CYS HB3 H 1 3.289 0.001 . 1 . . . . A 4 CYS HB3 . c30496_6e5h 1 24 . 1 1 5 5 LYS H H 1 7.891 0.000 . 1 . . . . A 5 LYS H . c30496_6e5h 1 25 . 1 1 5 5 LYS HA H 1 3.904 0.001 . 1 . . . . A 5 LYS HA . c30496_6e5h 1 26 . 1 1 5 5 LYS HB2 H 1 1.853 0.001 . 1 . . . . A 5 LYS HB2 . c30496_6e5h 1 27 . 1 1 5 5 LYS HB3 H 1 1.853 0.001 . 1 . . . . A 5 LYS HB3 . c30496_6e5h 1 28 . 1 1 5 5 LYS HG2 H 1 1.548 0.000 . 2 . . . . A 5 LYS HG2 . c30496_6e5h 1 29 . 1 1 5 5 LYS HG3 H 1 1.372 0.000 . 2 . . . . A 5 LYS HG3 . c30496_6e5h 1 30 . 1 1 5 5 LYS HD2 H 1 1.696 0.000 . 1 . . . . A 5 LYS HD2 . c30496_6e5h 1 31 . 1 1 5 5 LYS HD3 H 1 1.696 0.000 . 1 . . . . A 5 LYS HD3 . c30496_6e5h 1 32 . 1 1 5 5 LYS HE2 H 1 2.985 0.000 . 1 . . . . A 5 LYS HE2 . c30496_6e5h 1 33 . 1 1 5 5 LYS HE3 H 1 2.985 0.000 . 1 . . . . A 5 LYS HE3 . c30496_6e5h 1 34 . 1 1 6 6 GLU H H 1 7.988 0.000 . 1 . . . . A 6 GLU H . c30496_6e5h 1 35 . 1 1 6 6 GLU HA H 1 4.043 0.001 . 1 . . . . A 6 GLU HA . c30496_6e5h 1 36 . 1 1 6 6 GLU HB2 H 1 2.093 0.001 . 1 . . . . A 6 GLU HB2 . c30496_6e5h 1 37 . 1 1 6 6 GLU HB3 H 1 2.093 0.001 . 1 . . . . A 6 GLU HB3 . c30496_6e5h 1 38 . 1 1 6 6 GLU HG2 H 1 2.440 0.001 . 2 . . . . A 6 GLU HG2 . c30496_6e5h 1 39 . 1 1 6 6 GLU HG3 H 1 2.331 0.001 . 2 . . . . A 6 GLU HG3 . c30496_6e5h 1 40 . 1 1 7 7 LEU H H 1 8.177 0.001 . 1 . . . . A 7 LEU H . c30496_6e5h 1 41 . 1 1 7 7 LEU HA H 1 4.063 0.001 . 1 . . . . A 7 LEU HA . c30496_6e5h 1 42 . 1 1 7 7 LEU HB2 H 1 1.879 0.001 . 2 . . . . A 7 LEU HB2 . c30496_6e5h 1 43 . 1 1 7 7 LEU HB3 H 1 1.353 0.002 . 2 . . . . A 7 LEU HB3 . c30496_6e5h 1 44 . 1 1 7 7 LEU HG H 1 1.643 0.002 . 1 . . . . A 7 LEU HG . c30496_6e5h 1 45 . 1 1 7 7 LEU HD11 H 1 0.484 0.001 . 2 . . . . A 7 LEU HD11 . c30496_6e5h 1 46 . 1 1 7 7 LEU HD12 H 1 0.484 0.001 . 2 . . . . A 7 LEU HD12 . c30496_6e5h 1 47 . 1 1 7 7 LEU HD13 H 1 0.484 0.001 . 2 . . . . A 7 LEU HD13 . c30496_6e5h 1 48 . 1 1 7 7 LEU HD21 H 1 0.694 0.001 . 2 . . . . A 7 LEU HD21 . c30496_6e5h 1 49 . 1 1 7 7 LEU HD22 H 1 0.694 0.001 . 2 . . . . A 7 LEU HD22 . c30496_6e5h 1 50 . 1 1 7 7 LEU HD23 H 1 0.694 0.001 . 2 . . . . A 7 LEU HD23 . c30496_6e5h 1 51 . 1 1 8 8 LYS H H 1 8.230 0.000 . 1 . . . . A 8 LYS H . c30496_6e5h 1 52 . 1 1 8 8 LYS HA H 1 4.010 0.001 . 1 . . . . A 8 LYS HA . c30496_6e5h 1 53 . 1 1 8 8 LYS HB2 H 1 1.854 0.002 . 1 . . . . A 8 LYS HB2 . c30496_6e5h 1 54 . 1 1 8 8 LYS HB3 H 1 1.854 0.002 . 1 . . . . A 8 LYS HB3 . c30496_6e5h 1 55 . 1 1 8 8 LYS HG2 H 1 1.454 0.000 . 1 . . . . A 8 LYS HG2 . c30496_6e5h 1 56 . 1 1 8 8 LYS HG3 H 1 1.454 0.000 . 1 . . . . A 8 LYS HG3 . c30496_6e5h 1 57 . 1 1 8 8 LYS HD2 H 1 1.679 0.000 . 1 . . . . A 8 LYS HD2 . c30496_6e5h 1 58 . 1 1 8 8 LYS HD3 H 1 1.679 0.000 . 1 . . . . A 8 LYS HD3 . c30496_6e5h 1 59 . 1 1 8 8 LYS HE2 H 1 3.033 0.000 . 1 . . . . A 8 LYS HE2 . c30496_6e5h 1 60 . 1 1 8 8 LYS HE3 H 1 3.033 0.000 . 1 . . . . A 8 LYS HE3 . c30496_6e5h 1 61 . 1 1 9 9 LYS H H 1 7.484 0.001 . 1 . . . . A 9 LYS H . c30496_6e5h 1 62 . 1 1 9 9 LYS HA H 1 4.112 0.001 . 1 . . . . A 9 LYS HA . c30496_6e5h 1 63 . 1 1 9 9 LYS HB2 H 1 1.852 0.001 . 1 . . . . A 9 LYS HB2 . c30496_6e5h 1 64 . 1 1 9 9 LYS HB3 H 1 1.852 0.001 . 1 . . . . A 9 LYS HB3 . c30496_6e5h 1 65 . 1 1 9 9 LYS HG2 H 1 1.511 0.000 . 2 . . . . A 9 LYS HG2 . c30496_6e5h 1 66 . 1 1 9 9 LYS HG3 H 1 1.407 0.000 . 2 . . . . A 9 LYS HG3 . c30496_6e5h 1 67 . 1 1 9 9 LYS HD2 H 1 1.671 0.000 . 1 . . . . A 9 LYS HD2 . c30496_6e5h 1 68 . 1 1 9 9 LYS HD3 H 1 1.671 0.000 . 1 . . . . A 9 LYS HD3 . c30496_6e5h 1 69 . 1 1 9 9 LYS HE2 H 1 2.962 0.000 . 1 . . . . A 9 LYS HE2 . c30496_6e5h 1 70 . 1 1 9 9 LYS HE3 H 1 2.962 0.000 . 1 . . . . A 9 LYS HE3 . c30496_6e5h 1 71 . 1 1 10 10 ARG H H 1 7.778 0.003 . 1 . . . . A 10 ARG H . c30496_6e5h 1 72 . 1 1 10 10 ARG HA H 1 4.046 0.003 . 1 . . . . A 10 ARG HA . c30496_6e5h 1 73 . 1 1 10 10 ARG HB2 H 1 1.743 0.001 . 2 . . . . A 10 ARG HB2 . c30496_6e5h 1 74 . 1 1 10 10 ARG HB3 H 1 1.552 0.003 . 2 . . . . A 10 ARG HB3 . c30496_6e5h 1 75 . 1 1 10 10 ARG HG2 H 1 1.243 0.000 . 2 . . . . A 10 ARG HG2 . c30496_6e5h 1 76 . 1 1 10 10 ARG HG3 H 1 0.972 0.001 . 2 . . . . A 10 ARG HG3 . c30496_6e5h 1 77 . 1 1 10 10 ARG HD2 H 1 2.904 0.030 . 2 . . . . A 10 ARG HD2 . c30496_6e5h 1 78 . 1 1 10 10 ARG HD3 H 1 2.844 0.004 . 2 . . . . A 10 ARG HD3 . c30496_6e5h 1 79 . 1 1 10 10 ARG HE H 1 7.037 0.001 . 1 . . . . A 10 ARG HE . c30496_6e5h 1 80 . 1 1 11 11 TYR H H 1 7.849 0.001 . 1 . . . . A 11 TYR H . c30496_6e5h 1 81 . 1 1 11 11 TYR HA H 1 4.666 0.002 . 1 . . . . A 11 TYR HA . c30496_6e5h 1 82 . 1 1 11 11 TYR HB2 H 1 3.005 0.000 . 2 . . . . A 11 TYR HB2 . c30496_6e5h 1 83 . 1 1 11 11 TYR HB3 H 1 2.580 0.001 . 2 . . . . A 11 TYR HB3 . c30496_6e5h 1 84 . 1 1 11 11 TYR HD1 H 1 7.173 0.000 . 1 . . . . A 11 TYR HD1 . c30496_6e5h 1 85 . 1 1 11 11 TYR HD2 H 1 7.173 0.000 . 1 . . . . A 11 TYR HD2 . c30496_6e5h 1 86 . 1 1 11 11 TYR HE1 H 1 6.739 0.000 . 1 . . . . A 11 TYR HE1 . c30496_6e5h 1 87 . 1 1 11 11 TYR HE2 H 1 6.739 0.000 . 1 . . . . A 11 TYR HE2 . c30496_6e5h 1 88 . 1 1 12 12 AIB H H 1 7.272 0.001 . 1 . . . . A 12 AIB H . c30496_6e5h 1 89 . 1 1 12 12 AIB HB11 H 1 1.430 0.000 . 2 . . . . A 12 AIB HB11 . c30496_6e5h 1 90 . 1 1 12 12 AIB HB21 H 1 1.609 0.000 . 2 . . . . A 12 AIB HB21 . c30496_6e5h 1 91 . 1 1 13 13 GLY H H 1 8.550 0.000 . 1 . . . . A 13 GLY H . c30496_6e5h 1 92 . 1 1 13 13 GLY HA2 H 1 4.066 0.001 . 2 . . . . A 13 GLY HA2 . c30496_6e5h 1 93 . 1 1 13 13 GLY HA3 H 1 3.969 0.000 . 2 . . . . A 13 GLY HA3 . c30496_6e5h 1 94 . 1 1 14 14 CYS H H 1 8.149 0.000 . 1 . . . . A 14 CYS H . c30496_6e5h 1 95 . 1 1 14 14 CYS HA H 1 5.157 0.001 . 1 . . . . A 14 CYS HA . c30496_6e5h 1 96 . 1 1 14 14 CYS HB2 H 1 3.505 0.001 . 2 . . . . A 14 CYS HB2 . c30496_6e5h 1 97 . 1 1 14 14 CYS HB3 H 1 2.558 0.002 . 2 . . . . A 14 CYS HB3 . c30496_6e5h 1 98 . 1 1 15 15 GLU H H 1 8.478 0.000 . 1 . . . . A 15 GLU H . c30496_6e5h 1 99 . 1 1 15 15 GLU HA H 1 4.621 0.000 . 1 . . . . A 15 GLU HA . c30496_6e5h 1 100 . 1 1 15 15 GLU HB2 H 1 2.156 0.000 . 1 . . . . A 15 GLU HB2 . c30496_6e5h 1 101 . 1 1 15 15 GLU HB3 H 1 2.156 0.000 . 1 . . . . A 15 GLU HB3 . c30496_6e5h 1 102 . 1 1 15 15 GLU HG2 H 1 2.467 0.004 . 2 . . . . A 15 GLU HG2 . c30496_6e5h 1 103 . 1 1 15 15 GLU HG3 H 1 2.340 0.000 . 2 . . . . A 15 GLU HG3 . c30496_6e5h 1 104 . 1 1 16 16 VAL H H 1 8.762 0.001 . 1 . . . . A 16 VAL H . c30496_6e5h 1 105 . 1 1 16 16 VAL HA H 1 4.839 0.000 . 1 . . . . A 16 VAL HA . c30496_6e5h 1 106 . 1 1 16 16 VAL HB H 1 1.962 0.001 . 1 . . . . A 16 VAL HB . c30496_6e5h 1 107 . 1 1 16 16 VAL HG11 H 1 0.851 0.001 . 2 . . . . A 16 VAL HG11 . c30496_6e5h 1 108 . 1 1 16 16 VAL HG12 H 1 0.851 0.001 . 2 . . . . A 16 VAL HG12 . c30496_6e5h 1 109 . 1 1 16 16 VAL HG13 H 1 0.851 0.001 . 2 . . . . A 16 VAL HG13 . c30496_6e5h 1 110 . 1 1 16 16 VAL HG21 H 1 0.908 0.002 . 2 . . . . A 16 VAL HG21 . c30496_6e5h 1 111 . 1 1 16 16 VAL HG22 H 1 0.908 0.002 . 2 . . . . A 16 VAL HG22 . c30496_6e5h 1 112 . 1 1 16 16 VAL HG23 H 1 0.908 0.002 . 2 . . . . A 16 VAL HG23 . c30496_6e5h 1 113 . 1 1 17 17 ARG H H 1 8.965 0.001 . 1 . . . . A 17 ARG H . c30496_6e5h 1 114 . 1 1 17 17 ARG HA H 1 4.685 0.001 . 1 . . . . A 17 ARG HA . c30496_6e5h 1 115 . 1 1 17 17 ARG HB2 H 1 1.833 0.007 . 2 . . . . A 17 ARG HB2 . c30496_6e5h 1 116 . 1 1 17 17 ARG HB3 H 1 1.721 0.001 . 2 . . . . A 17 ARG HB3 . c30496_6e5h 1 117 . 1 1 17 17 ARG HG2 H 1 1.598 0.000 . 2 . . . . A 17 ARG HG2 . c30496_6e5h 1 118 . 1 1 17 17 ARG HG3 H 1 1.511 0.003 . 2 . . . . A 17 ARG HG3 . c30496_6e5h 1 119 . 1 1 17 17 ARG HD2 H 1 3.151 0.001 . 1 . . . . A 17 ARG HD2 . c30496_6e5h 1 120 . 1 1 17 17 ARG HD3 H 1 3.151 0.001 . 1 . . . . A 17 ARG HD3 . c30496_6e5h 1 121 . 1 1 17 17 ARG HE H 1 7.250 0.001 . 1 . . . . A 17 ARG HE . c30496_6e5h 1 122 . 1 1 18 18 CYS H H 1 8.947 0.000 . 1 . . . . A 18 CYS H . c30496_6e5h 1 123 . 1 1 18 18 CYS HA H 1 4.770 0.000 . 1 . . . . A 18 CYS HA . c30496_6e5h 1 124 . 1 1 18 18 CYS HB2 H 1 3.656 0.001 . 2 . . . . A 18 CYS HB2 . c30496_6e5h 1 125 . 1 1 18 18 CYS HB3 H 1 3.109 0.001 . 2 . . . . A 18 CYS HB3 . c30496_6e5h 1 126 . 1 1 19 19 ASP H H 1 8.611 0.000 . 1 . . . . A 19 ASP H . c30496_6e5h 1 127 . 1 1 19 19 ASP HA H 1 5.139 0.002 . 1 . . . . A 19 ASP HA . c30496_6e5h 1 128 . 1 1 19 19 ASP HB2 H 1 2.678 0.000 . 2 . . . . A 19 ASP HB2 . c30496_6e5h 1 129 . 1 1 19 19 ASP HB3 H 1 2.472 0.002 . 2 . . . . A 19 ASP HB3 . c30496_6e5h 1 130 . 1 1 20 20 DPR HA H 1 4.702 0.001 . 1 . . . . A 20 DPR HA . c30496_6e5h 1 131 . 1 1 20 20 DPR HB2 H 1 2.313 0.000 . 2 . . . . A 20 DPR HB2 . c30496_6e5h 1 132 . 1 1 20 20 DPR HB3 H 1 1.929 0.001 . 2 . . . . A 20 DPR HB3 . c30496_6e5h 1 133 . 1 1 20 20 DPR HD2 H 1 3.889 0.002 . 2 . . . . A 20 DPR HD2 . c30496_6e5h 1 134 . 1 1 20 20 DPR HD3 H 1 3.478 0.001 . 2 . . . . A 20 DPR HD3 . c30496_6e5h 1 135 . 1 1 20 20 DPR HG2 H 1 2.170 0.000 . 2 . . . . A 20 DPR HG2 . c30496_6e5h 1 136 . 1 1 20 20 DPR HG3 H 1 2.034 0.003 . 2 . . . . A 20 DPR HG3 . c30496_6e5h 1 137 . 1 1 21 21 PRO HA H 1 4.563 0.001 . 1 . . . . A 21 PRO HA . c30496_6e5h 1 138 . 1 1 21 21 PRO HB2 H 1 2.219 0.001 . 2 . . . . A 21 PRO HB2 . c30496_6e5h 1 139 . 1 1 21 21 PRO HB3 H 1 2.137 0.000 . 2 . . . . A 21 PRO HB3 . c30496_6e5h 1 140 . 1 1 21 21 PRO HG2 H 1 2.088 0.000 . 2 . . . . A 21 PRO HG2 . c30496_6e5h 1 141 . 1 1 21 21 PRO HG3 H 1 1.872 0.000 . 2 . . . . A 21 PRO HG3 . c30496_6e5h 1 142 . 1 1 21 21 PRO HD2 H 1 3.977 0.002 . 2 . . . . A 21 PRO HD2 . c30496_6e5h 1 143 . 1 1 21 21 PRO HD3 H 1 3.710 0.000 . 2 . . . . A 21 PRO HD3 . c30496_6e5h 1 144 . 1 1 22 22 ARG H H 1 7.657 0.001 . 1 . . . . A 22 ARG H . c30496_6e5h 1 145 . 1 1 22 22 ARG HA H 1 4.446 0.002 . 1 . . . . A 22 ARG HA . c30496_6e5h 1 146 . 1 1 22 22 ARG HB2 H 1 1.828 0.000 . 1 . . . . A 22 ARG HB2 . c30496_6e5h 1 147 . 1 1 22 22 ARG HB3 H 1 1.828 0.000 . 1 . . . . A 22 ARG HB3 . c30496_6e5h 1 148 . 1 1 22 22 ARG HG2 H 1 1.551 0.001 . 1 . . . . A 22 ARG HG2 . c30496_6e5h 1 149 . 1 1 22 22 ARG HG3 H 1 1.551 0.001 . 1 . . . . A 22 ARG HG3 . c30496_6e5h 1 150 . 1 1 22 22 ARG HD2 H 1 3.194 0.000 . 1 . . . . A 22 ARG HD2 . c30496_6e5h 1 151 . 1 1 22 22 ARG HD3 H 1 3.194 0.000 . 1 . . . . A 22 ARG HD3 . c30496_6e5h 1 152 . 1 1 22 22 ARG HE H 1 7.226 0.004 . 1 . . . . A 22 ARG HE . c30496_6e5h 1 153 . 1 1 23 23 TYR H H 1 8.203 0.000 . 1 . . . . A 23 TYR H . c30496_6e5h 1 154 . 1 1 23 23 TYR HA H 1 5.195 0.002 . 1 . . . . A 23 TYR HA . c30496_6e5h 1 155 . 1 1 23 23 TYR HB2 H 1 2.789 0.001 . 2 . . . . A 23 TYR HB2 . c30496_6e5h 1 156 . 1 1 23 23 TYR HB3 H 1 2.712 0.002 . 2 . . . . A 23 TYR HB3 . c30496_6e5h 1 157 . 1 1 23 23 TYR HD1 H 1 6.913 0.000 . 1 . . . . A 23 TYR HD1 . c30496_6e5h 1 158 . 1 1 23 23 TYR HD2 H 1 6.913 0.000 . 1 . . . . A 23 TYR HD2 . c30496_6e5h 1 159 . 1 1 23 23 TYR HE1 H 1 6.719 0.000 . 1 . . . . A 23 TYR HE1 . c30496_6e5h 1 160 . 1 1 23 23 TYR HE2 H 1 6.719 0.000 . 1 . . . . A 23 TYR HE2 . c30496_6e5h 1 161 . 1 1 24 24 GLU H H 1 8.736 0.000 . 1 . . . . A 24 GLU H . c30496_6e5h 1 162 . 1 1 24 24 GLU HA H 1 4.607 0.000 . 1 . . . . A 24 GLU HA . c30496_6e5h 1 163 . 1 1 24 24 GLU HB2 H 1 1.911 0.000 . 1 . . . . A 24 GLU HB2 . c30496_6e5h 1 164 . 1 1 24 24 GLU HB3 H 1 1.911 0.000 . 1 . . . . A 24 GLU HB3 . c30496_6e5h 1 165 . 1 1 24 24 GLU HG2 H 1 2.270 0.000 . 1 . . . . A 24 GLU HG2 . c30496_6e5h 1 166 . 1 1 24 24 GLU HG3 H 1 2.270 0.000 . 1 . . . . A 24 GLU HG3 . c30496_6e5h 1 167 . 1 1 25 25 VAL H H 1 8.616 0.000 . 1 . . . . A 25 VAL H . c30496_6e5h 1 168 . 1 1 25 25 VAL HA H 1 4.614 0.002 . 1 . . . . A 25 VAL HA . c30496_6e5h 1 169 . 1 1 25 25 VAL HB H 1 1.692 0.004 . 1 . . . . A 25 VAL HB . c30496_6e5h 1 170 . 1 1 25 25 VAL HG11 H 1 0.396 0.001 . 2 . . . . A 25 VAL HG11 . c30496_6e5h 1 171 . 1 1 25 25 VAL HG12 H 1 0.396 0.001 . 2 . . . . A 25 VAL HG12 . c30496_6e5h 1 172 . 1 1 25 25 VAL HG13 H 1 0.396 0.001 . 2 . . . . A 25 VAL HG13 . c30496_6e5h 1 173 . 1 1 25 25 VAL HG21 H 1 0.584 0.001 . 2 . . . . A 25 VAL HG21 . c30496_6e5h 1 174 . 1 1 25 25 VAL HG22 H 1 0.584 0.001 . 2 . . . . A 25 VAL HG22 . c30496_6e5h 1 175 . 1 1 25 25 VAL HG23 H 1 0.584 0.001 . 2 . . . . A 25 VAL HG23 . c30496_6e5h 1 176 . 1 1 26 26 HIS H H 1 9.122 0.000 . 1 . . . . A 26 HIS H . c30496_6e5h 1 177 . 1 1 26 26 HIS HA H 1 4.989 0.001 . 1 . . . . A 26 HIS HA . c30496_6e5h 1 178 . 1 1 26 26 HIS HB2 H 1 3.281 0.001 . 2 . . . . A 26 HIS HB2 . c30496_6e5h 1 179 . 1 1 26 26 HIS HB3 H 1 3.149 0.000 . 2 . . . . A 26 HIS HB3 . c30496_6e5h 1 180 . 1 1 26 26 HIS HD2 H 1 7.215 0.000 . 1 . . . . A 26 HIS HD2 . c30496_6e5h 1 181 . 1 1 26 26 HIS HE1 H 1 8.597 0.000 . 1 . . . . A 26 HIS HE1 . c30496_6e5h 1 182 . 1 1 27 27 CYS H H 1 9.198 0.000 . 1 . . . . A 27 CYS H . c30496_6e5h 1 183 . 1 1 27 27 CYS HA H 1 4.850 0.000 . 1 . . . . A 27 CYS HA . c30496_6e5h 1 184 . 1 1 27 27 CYS HB2 H 1 3.231 0.000 . 2 . . . . A 27 CYS HB2 . c30496_6e5h 1 185 . 1 1 27 27 CYS HB3 H 1 2.855 0.000 . 2 . . . . A 27 CYS HB3 . c30496_6e5h 1 186 . 1 1 28 28 NH2 HN1 H 1 7.198 0.000 . 2 . . . . A 28 NH2 HN1 . c30496_6e5h 1 187 . 1 1 28 28 NH2 HN2 H 1 7.833 0.000 . 2 . . . . A 28 NH2 HN2 . c30496_6e5h 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 c30496_6e5h _Conformer_stat_list.ID 1 _Conformer_stat_list.Conf_family_coord_set_ID 1 _Conformer_stat_list.Conf_family_coord_set_label $Original_constraints_and_structures _Conformer_stat_list.Conformer_submitted_total_num 10 save_ ##################################### # 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 c30496_6e5h _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 . . . c30496_6e5h 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 . . . . c30496_6e5h 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 ASN C C 9.710 -3.259 2.152 . . . 1.0 . . . . . . . . . . . . A . 1 ASN C . . . . . . . . . c30496_6e5h 1 . 1 . 2 . 1 1 1 ASN CA C 10.479 -3.999 3.236 . . . 1.0 . . . . . . . . . . . . A . 1 ASN CA . . . . . . . . . c30496_6e5h 1 . 1 . 3 . 1 1 1 ASN CB C 11.980 -3.748 3.072 . . . 1.0 . . . . . . . . . . . . A . 1 ASN CB . . . . . . . . . c30496_6e5h 1 . 1 . 4 . 1 1 1 ASN CG C 12.794 -4.307 4.222 . . . 1.0 . . . . . . . . . . . . A . 1 ASN CG . . . . . . . . . c30496_6e5h 1 . 1 . 5 . 1 1 1 ASN H1 H 9.146 -5.601 3.229 . . . 1.0 . . . . . . . . . . . . A . 1 ASN H1 . . . . . . . . . c30496_6e5h 1 . 1 . 6 . 1 1 1 ASN H2 H 10.613 -5.928 4.009 . . . 1.0 . . . . . . . . . . . . A . 1 ASN H2 . . . . . . . . . c30496_6e5h 1 . 1 . 7 . 1 1 1 ASN H3 H 10.553 -5.870 2.321 . . . 1.0 . . . . . . . . . . . . A . 1 ASN H3 . . . . . . . . . c30496_6e5h 1 . 1 . 8 . 1 1 1 ASN HA H 10.163 -3.624 4.198 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HA . . . . . . . . . c30496_6e5h 1 . 1 . 9 . 1 1 1 ASN HB2 H 12.318 -4.214 2.160 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HB2 . . . . . . . . . c30496_6e5h 1 . 1 . 10 . 1 1 1 ASN HB3 H 12.155 -2.685 3.014 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HB3 . . . . . . . . . c30496_6e5h 1 . 1 . 11 . 1 1 1 ASN HD21 H 14.370 -4.532 3.031 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HD21 . . . . . . . . . c30496_6e5h 1 . 1 . 12 . 1 1 1 ASN HD22 H 14.593 -5.012 4.678 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HD22 . . . . . . . . . c30496_6e5h 1 . 1 . 13 . 1 1 1 ASN N N 10.181 -5.449 3.193 . . . 1.0 . . . . . . . . . . . . A . 1 ASN N . . . . . . . . . c30496_6e5h 1 . 1 . 14 . 1 1 1 ASN ND2 N 14.042 -4.654 3.952 . . . 1.0 . . . . . . . . . . . . A . 1 ASN ND2 . . . . . . . . . c30496_6e5h 1 . 1 . 15 . 1 1 1 ASN O O 9.525 -2.045 2.232 . . . 1.0 . . . . . . . . . . . . A . 1 ASN O . . . . . . . . . c30496_6e5h 1 . 1 . 16 . 1 1 1 ASN OD1 O 12.306 -4.422 5.348 . . . 1.0 . . . . . . . . . . . . A . 1 ASN OD1 . . . . . . . . . c30496_6e5h 1 . 1 . 17 . 1 1 2 ASP C C 6.997 -3.280 0.643 . . . 1.0 . . . . . . . . . . . . A . 2 ASP C . . . . . . . . . c30496_6e5h 1 . 1 . 18 . 1 1 2 ASP CA C 8.406 -3.424 0.100 . . . 1.0 . . . . . . . . . . . . A . 2 ASP CA . . . . . . . . . c30496_6e5h 1 . 1 . 19 . 1 1 2 ASP CB C 8.382 -4.312 -1.150 . . . 1.0 . . . . . . . . . . . . A . 2 ASP CB . . . . . . . . . c30496_6e5h 1 . 1 . 20 . 1 1 2 ASP CG C 9.712 -4.370 -1.866 . . . 1.0 . . . . . . . . . . . . A . 2 ASP CG . . . . . . . . . c30496_6e5h 1 . 1 . 21 . 1 1 2 ASP H H 9.503 -4.938 1.087 . . . 1.0 . . . . . . . . . . . . A . 2 ASP H . . . . . . . . . c30496_6e5h 1 . 1 . 22 . 1 1 2 ASP HA H 8.787 -2.448 -0.159 . . . 1.0 . . . . . . . . . . . . A . 2 ASP HA . . . . . . . . . c30496_6e5h 1 . 1 . 23 . 1 1 2 ASP HB2 H 8.106 -5.315 -0.866 . . . 1.0 . . . . . . . . . . . . A . 2 ASP HB2 . . . . . . . . . c30496_6e5h 1 . 1 . 24 . 1 1 2 ASP HB3 H 7.643 -3.925 -1.835 . . . 1.0 . . . . . . . . . . . . A . 2 ASP HB3 . . . . . . . . . c30496_6e5h 1 . 1 . 25 . 1 1 2 ASP N N 9.262 -3.992 1.137 . . . 1.0 . . . . . . . . . . . . A . 2 ASP N . . . . . . . . . c30496_6e5h 1 . 1 . 26 . 1 1 2 ASP O O 6.121 -4.083 0.336 . . . 1.0 . . . . . . . . . . . . A . 2 ASP O . . . . . . . . . c30496_6e5h 1 . 1 . 27 . 1 1 2 ASP OD1 O 10.492 -5.316 -1.616 . . . 1.0 . . . . . . . . . . . . A . 2 ASP OD1 . . . . . . . . . c30496_6e5h 1 . 1 . 28 . 1 1 2 ASP OD2 O 9.983 -3.477 -2.691 . . . 1.0 . . . . . . . . . . . . A . 2 ASP OD2 . . . . . . . . . c30496_6e5h 1 . 1 . 29 . 1 1 3 LYS C C 4.367 -1.815 1.269 . . . 1.0 . . . . . . . . . . . . A . 3 LYS C . . . . . . . . . c30496_6e5h 1 . 1 . 30 . 1 1 3 LYS CA C 5.542 -2.100 2.185 . . . 1.0 . . . . . . . . . . . . A . 3 LYS CA . . . . . . . . . c30496_6e5h 1 . 1 . 31 . 1 1 3 LYS CB C 5.673 -1.018 3.260 . . . 1.0 . . . . . . . . . . . . A . 3 LYS CB . . . . . . . . . c30496_6e5h 1 . 1 . 32 . 1 1 3 LYS CD C 6.074 -2.699 5.082 . . . 1.0 . . . . . . . . . . . . A . 3 LYS CD . . . . . . . . . c30496_6e5h 1 . 1 . 33 . 1 1 3 LYS CE C 7.025 -3.183 6.159 . . . 1.0 . . . . . . . . . . . . A . 3 LYS CE . . . . . . . . . c30496_6e5h 1 . 1 . 34 . 1 1 3 LYS CG C 6.577 -1.429 4.413 . . . 1.0 . . . . . . . . . . . . A . 3 LYS CG . . . . . . . . . c30496_6e5h 1 . 1 . 35 . 1 1 3 LYS H H 7.483 -1.569 1.539 . . . 1.0 . . . . . . . . . . . . A . 3 LYS H . . . . . . . . . c30496_6e5h 1 . 1 . 36 . 1 1 3 LYS HA H 5.353 -3.040 2.673 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HA . . . . . . . . . c30496_6e5h 1 . 1 . 37 . 1 1 3 LYS HB2 H 6.079 -0.124 2.809 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HB2 . . . . . . . . . c30496_6e5h 1 . 1 . 38 . 1 1 3 LYS HB3 H 4.693 -0.800 3.658 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HB3 . . . . . . . . . c30496_6e5h 1 . 1 . 39 . 1 1 3 LYS HD2 H 5.113 -2.501 5.530 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HD2 . . . . . . . . . c30496_6e5h 1 . 1 . 40 . 1 1 3 LYS HD3 H 5.971 -3.473 4.338 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HD3 . . . . . . . . . c30496_6e5h 1 . 1 . 41 . 1 1 3 LYS HE2 H 7.999 -3.337 5.719 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HE2 . . . . . . . . . c30496_6e5h 1 . 1 . 42 . 1 1 3 LYS HE3 H 7.091 -2.428 6.927 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HE3 . . . . . . . . . c30496_6e5h 1 . 1 . 43 . 1 1 3 LYS HG2 H 7.575 -1.604 4.037 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HG2 . . . . . . . . . c30496_6e5h 1 . 1 . 44 . 1 1 3 LYS HG3 H 6.599 -0.633 5.142 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HG3 . . . . . . . . . c30496_6e5h 1 . 1 . 45 . 1 1 3 LYS HZ1 H 6.411 -5.177 6.029 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HZ1 . . . . . . . . . c30496_6e5h 1 . 1 . 46 . 1 1 3 LYS HZ2 H 5.665 -4.305 7.276 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HZ2 . . . . . . . . . c30496_6e5h 1 . 1 . 47 . 1 1 3 LYS HZ3 H 7.270 -4.809 7.442 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HZ3 . . . . . . . . . c30496_6e5h 1 . 1 . 48 . 1 1 3 LYS N N 6.785 -2.250 1.447 . . . 1.0 . . . . . . . . . . . . A . 3 LYS N . . . . . . . . . c30496_6e5h 1 . 1 . 49 . 1 1 3 LYS NZ N 6.560 -4.456 6.769 . . . 1.0 . . . . . . . . . . . . A . 3 LYS NZ . . . . . . . . . c30496_6e5h 1 . 1 . 50 . 1 1 3 LYS O O 3.246 -2.203 1.569 . . . 1.0 . . . . . . . . . . . . A . 3 LYS O . . . . . . . . . c30496_6e5h 1 . 1 . 51 . 1 1 4 CYS C C 3.053 -2.275 -1.328 . . . 1.0 . . . . . . . . . . . . A . 4 CYS C . . . . . . . . . c30496_6e5h 1 . 1 . 52 . 1 1 4 CYS CA C 3.578 -0.933 -0.834 . . . 1.0 . . . . . . . . . . . . A . 4 CYS CA . . . . . . . . . c30496_6e5h 1 . 1 . 53 . 1 1 4 CYS CB C 4.107 -0.102 -2.005 . . . 1.0 . . . . . . . . . . . . A . 4 CYS CB . . . . . . . . . c30496_6e5h 1 . 1 . 54 . 1 1 4 CYS H H 5.529 -0.829 -0.018 . . . 1.0 . . . . . . . . . . . . A . 4 CYS H . . . . . . . . . c30496_6e5h 1 . 1 . 55 . 1 1 4 CYS HA H 2.774 -0.400 -0.349 . . . 1.0 . . . . . . . . . . . . A . 4 CYS HA . . . . . . . . . c30496_6e5h 1 . 1 . 56 . 1 1 4 CYS HB2 H 4.532 0.813 -1.627 . . . 1.0 . . . . . . . . . . . . A . 4 CYS HB2 . . . . . . . . . c30496_6e5h 1 . 1 . 57 . 1 1 4 CYS HB3 H 4.876 -0.665 -2.514 . . . 1.0 . . . . . . . . . . . . A . 4 CYS HB3 . . . . . . . . . c30496_6e5h 1 . 1 . 58 . 1 1 4 CYS N N 4.623 -1.162 0.150 . . . 1.0 . . . . . . . . . . . . A . 4 CYS N . . . . . . . . . c30496_6e5h 1 . 1 . 59 . 1 1 4 CYS O O 1.846 -2.510 -1.371 . . . 1.0 . . . . . . . . . . . . A . 4 CYS O . . . . . . . . . c30496_6e5h 1 . 1 . 60 . 1 1 4 CYS SG S 2.841 0.345 -3.238 . . . 1.0 . . . . . . . . . . . . A . 4 CYS SG . . . . . . . . . c30496_6e5h 1 . 1 . 61 . 1 1 5 LYS C C 2.973 -5.298 -0.989 . . . 1.0 . . . . . . . . . . . . A . 5 LYS C . . . . . . . . . c30496_6e5h 1 . 1 . 62 . 1 1 5 LYS CA C 3.629 -4.505 -2.106 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CA . . . . . . . . . c30496_6e5h 1 . 1 . 63 . 1 1 5 LYS CB C 4.868 -5.250 -2.613 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CB . . . . . . . . . c30496_6e5h 1 . 1 . 64 . 1 1 5 LYS CD C 5.581 -3.511 -4.316 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CD . . . . . . . . . c30496_6e5h 1 . 1 . 65 . 1 1 5 LYS CE C 5.946 -3.274 -5.773 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CE . . . . . . . . . c30496_6e5h 1 . 1 . 66 . 1 1 5 LYS CG C 5.226 -4.969 -4.068 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CG . . . . . . . . . c30496_6e5h 1 . 1 . 67 . 1 1 5 LYS H H 4.922 -2.934 -1.552 . . . 1.0 . . . . . . . . . . . . A . 5 LYS H . . . . . . . . . c30496_6e5h 1 . 1 . 68 . 1 1 5 LYS HA H 2.925 -4.400 -2.916 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HA . . . . . . . . . c30496_6e5h 1 . 1 . 69 . 1 1 5 LYS HB2 H 5.712 -4.973 -2.001 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HB2 . . . . . . . . . c30496_6e5h 1 . 1 . 70 . 1 1 5 LYS HB3 H 4.698 -6.312 -2.508 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HB3 . . . . . . . . . c30496_6e5h 1 . 1 . 71 . 1 1 5 LYS HD2 H 4.732 -2.894 -4.061 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HD2 . . . . . . . . . c30496_6e5h 1 . 1 . 72 . 1 1 5 LYS HD3 H 6.423 -3.244 -3.693 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HD3 . . . . . . . . . c30496_6e5h 1 . 1 . 73 . 1 1 5 LYS HE2 H 6.221 -2.238 -5.899 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HE2 . . . . . . . . . c30496_6e5h 1 . 1 . 74 . 1 1 5 LYS HE3 H 6.788 -3.901 -6.028 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HE3 . . . . . . . . . c30496_6e5h 1 . 1 . 75 . 1 1 5 LYS HG2 H 6.073 -5.577 -4.337 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HG2 . . . . . . . . . c30496_6e5h 1 . 1 . 76 . 1 1 5 LYS HG3 H 4.384 -5.234 -4.691 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HG3 . . . . . . . . . c30496_6e5h 1 . 1 . 77 . 1 1 5 LYS HZ1 H 4.478 -4.557 -6.524 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HZ1 . . . . . . . . . c30496_6e5h 1 . 1 . 78 . 1 1 5 LYS HZ2 H 5.121 -3.505 -7.678 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HZ2 . . . . . . . . . c30496_6e5h 1 . 1 . 79 . 1 1 5 LYS HZ3 H 4.029 -2.927 -6.526 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HZ3 . . . . . . . . . c30496_6e5h 1 . 1 . 80 . 1 1 5 LYS N N 3.979 -3.171 -1.647 . . . 1.0 . . . . . . . . . . . . A . 5 LYS N . . . . . . . . . c30496_6e5h 1 . 1 . 81 . 1 1 5 LYS NZ N 4.815 -3.587 -6.687 . . . 1.0 . . . . . . . . . . . . A . 5 LYS NZ . . . . . . . . . c30496_6e5h 1 . 1 . 82 . 1 1 5 LYS O O 1.911 -5.874 -1.179 . . . 1.0 . . . . . . . . . . . . A . 5 LYS O . . . . . . . . . c30496_6e5h 1 . 1 . 83 . 1 1 6 GLU C C 1.686 -5.658 1.678 . . . 1.0 . . . . . . . . . . . . A . 6 GLU C . . . . . . . . . c30496_6e5h 1 . 1 . 84 . 1 1 6 GLU CA C 3.114 -6.061 1.322 . . . 1.0 . . . . . . . . . . . . A . 6 GLU CA . . . . . . . . . c30496_6e5h 1 . 1 . 85 . 1 1 6 GLU CB C 4.049 -5.871 2.525 . . . 1.0 . . . . . . . . . . . . A . 6 GLU CB . . . . . . . . . c30496_6e5h 1 . 1 . 86 . 1 1 6 GLU CD C 6.428 -6.133 3.394 . . . 1.0 . . . . . . . . . . . . A . 6 GLU CD . . . . . . . . . c30496_6e5h 1 . 1 . 87 . 1 1 6 GLU CG C 5.402 -6.555 2.357 . . . 1.0 . . . . . . . . . . . . A . 6 GLU CG . . . . . . . . . c30496_6e5h 1 . 1 . 88 . 1 1 6 GLU H H 4.413 -4.758 0.278 . . . 1.0 . . . . . . . . . . . . A . 6 GLU H . . . . . . . . . c30496_6e5h 1 . 1 . 89 . 1 1 6 GLU HA H 3.114 -7.104 1.040 . . . 1.0 . . . . . . . . . . . . A . 6 GLU HA . . . . . . . . . c30496_6e5h 1 . 1 . 90 . 1 1 6 GLU HB2 H 4.217 -4.815 2.671 . . . 1.0 . . . . . . . . . . . . A . 6 GLU HB2 . . . . . . . . . c30496_6e5h 1 . 1 . 91 . 1 1 6 GLU HB3 H 3.571 -6.275 3.406 . . . 1.0 . . . . . . . . . . . . A . 6 GLU HB3 . . . . . . . . . c30496_6e5h 1 . 1 . 92 . 1 1 6 GLU HG2 H 5.259 -7.621 2.435 . . . 1.0 . . . . . . . . . . . . A . 6 GLU HG2 . . . . . . . . . c30496_6e5h 1 . 1 . 93 . 1 1 6 GLU HG3 H 5.790 -6.320 1.376 . . . 1.0 . . . . . . . . . . . . A . 6 GLU HG3 . . . . . . . . . c30496_6e5h 1 . 1 . 94 . 1 1 6 GLU N N 3.601 -5.297 0.179 . . . 1.0 . . . . . . . . . . . . A . 6 GLU N . . . . . . . . . c30496_6e5h 1 . 1 . 95 . 1 1 6 GLU O O 0.828 -6.514 1.893 . . . 1.0 . . . . . . . . . . . . A . 6 GLU O . . . . . . . . . c30496_6e5h 1 . 1 . 96 . 1 1 6 GLU OE1 O 6.149 -6.243 4.610 . . . 1.0 . . . . . . . . . . . . A . 6 GLU OE1 . . . . . . . . . c30496_6e5h 1 . 1 . 97 . 1 1 6 GLU OE2 O 7.537 -5.718 2.999 . . . 1.0 . . . . . . . . . . . . A . 6 GLU OE2 . . . . . . . . . c30496_6e5h 1 . 1 . 98 . 1 1 7 LEU C C -0.889 -4.178 0.909 . . . 1.0 . . . . . . . . . . . . A . 7 LEU C . . . . . . . . . c30496_6e5h 1 . 1 . 99 . 1 1 7 LEU CA C 0.100 -3.856 2.023 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CA . . . . . . . . . c30496_6e5h 1 . 1 . 100 . 1 1 7 LEU CB C 0.150 -2.348 2.270 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CB . . . . . . . . . c30496_6e5h 1 . 1 . 101 . 1 1 7 LEU CD1 C 1.145 -0.401 3.503 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CD1 . . . . . . . . . c30496_6e5h 1 . 1 . 102 . 1 1 7 LEU CD2 C 0.365 -2.396 4.777 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CD2 . . . . . . . . . c30496_6e5h 1 . 1 . 103 . 1 1 7 LEU CG C 0.990 -1.912 3.477 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CG . . . . . . . . . c30496_6e5h 1 . 1 . 104 . 1 1 7 LEU H H 2.142 -3.719 1.487 . . . 1.0 . . . . . . . . . . . . A . 7 LEU H . . . . . . . . . c30496_6e5h 1 . 1 . 105 . 1 1 7 LEU HA H -0.226 -4.348 2.926 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HA . . . . . . . . . c30496_6e5h 1 . 1 . 106 . 1 1 7 LEU HB2 H 0.556 -1.877 1.387 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HB2 . . . . . . . . . c30496_6e5h 1 . 1 . 107 . 1 1 7 LEU HB3 H -0.858 -1.995 2.414 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HB3 . . . . . . . . . c30496_6e5h 1 . 1 . 108 . 1 1 7 LEU HD11 H 1.750 -0.115 4.351 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD11 . . . . . . . . . c30496_6e5h 1 . 1 . 109 . 1 1 7 LEU HD12 H 0.172 0.060 3.586 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD12 . . . . . . . . . c30496_6e5h 1 . 1 . 110 . 1 1 7 LEU HD13 H 1.624 -0.070 2.593 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD13 . . . . . . . . . c30496_6e5h 1 . 1 . 111 . 1 1 7 LEU HD21 H 0.280 -3.471 4.761 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD21 . . . . . . . . . c30496_6e5h 1 . 1 . 112 . 1 1 7 LEU HD22 H -0.615 -1.958 4.889 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD22 . . . . . . . . . c30496_6e5h 1 . 1 . 113 . 1 1 7 LEU HD23 H 0.988 -2.097 5.608 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD23 . . . . . . . . . c30496_6e5h 1 . 1 . 114 . 1 1 7 LEU HG H 1.977 -2.349 3.396 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HG . . . . . . . . . c30496_6e5h 1 . 1 . 115 . 1 1 7 LEU N N 1.426 -4.359 1.699 . . . 1.0 . . . . . . . . . . . . A . 7 LEU N . . . . . . . . . c30496_6e5h 1 . 1 . 116 . 1 1 7 LEU O O -2.013 -4.598 1.174 . . . 1.0 . . . . . . . . . . . . A . 7 LEU O . . . . . . . . . c30496_6e5h 1 . 1 . 117 . 1 1 8 LYS C C -1.548 -5.750 -1.727 . . . 1.0 . . . . . . . . . . . . A . 8 LYS C . . . . . . . . . c30496_6e5h 1 . 1 . 118 . 1 1 8 LYS CA C -1.332 -4.256 -1.483 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CA . . . . . . . . . c30496_6e5h 1 . 1 . 119 . 1 1 8 LYS CB C -0.770 -3.591 -2.740 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CB . . . . . . . . . c30496_6e5h 1 . 1 . 120 . 1 1 8 LYS CD C -0.367 -1.445 -4.005 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CD . . . . . . . . . c30496_6e5h 1 . 1 . 121 . 1 1 8 LYS CE C -1.037 -1.965 -5.268 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CE . . . . . . . . . c30496_6e5h 1 . 1 . 122 . 1 1 8 LYS CG C -0.951 -2.081 -2.755 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CG . . . . . . . . . c30496_6e5h 1 . 1 . 123 . 1 1 8 LYS H H 0.463 -3.697 -0.491 . . . 1.0 . . . . . . . . . . . . A . 8 LYS H . . . . . . . . . c30496_6e5h 1 . 1 . 124 . 1 1 8 LYS HA H -2.288 -3.811 -1.259 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HA . . . . . . . . . c30496_6e5h 1 . 1 . 125 . 1 1 8 LYS HB2 H 0.285 -3.807 -2.808 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HB2 . . . . . . . . . c30496_6e5h 1 . 1 . 126 . 1 1 8 LYS HB3 H -1.269 -4.001 -3.603 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HB3 . . . . . . . . . c30496_6e5h 1 . 1 . 127 . 1 1 8 LYS HD2 H -0.508 -0.376 -3.951 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HD2 . . . . . . . . . c30496_6e5h 1 . 1 . 128 . 1 1 8 LYS HD3 H 0.687 -1.669 -4.050 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HD3 . . . . . . . . . c30496_6e5h 1 . 1 . 129 . 1 1 8 LYS HE2 H -0.643 -1.425 -6.115 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HE2 . . . . . . . . . c30496_6e5h 1 . 1 . 130 . 1 1 8 LYS HE3 H -0.809 -3.014 -5.374 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HE3 . . . . . . . . . c30496_6e5h 1 . 1 . 131 . 1 1 8 LYS HG2 H -2.005 -1.860 -2.716 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HG2 . . . . . . . . . c30496_6e5h 1 . 1 . 132 . 1 1 8 LYS HG3 H -0.462 -1.662 -1.888 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HG3 . . . . . . . . . c30496_6e5h 1 . 1 . 133 . 1 1 8 LYS HZ1 H -2.919 -2.337 -4.443 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ1 . . . . . . . . . c30496_6e5h 1 . 1 . 134 . 1 1 8 LYS HZ2 H -2.935 -2.124 -6.117 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ2 . . . . . . . . . c30496_6e5h 1 . 1 . 135 . 1 1 8 LYS HZ3 H -2.755 -0.789 -5.100 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ3 . . . . . . . . . c30496_6e5h 1 . 1 . 136 . 1 1 8 LYS N N -0.460 -4.007 -0.337 . . . 1.0 . . . . . . . . . . . . A . 8 LYS N . . . . . . . . . c30496_6e5h 1 . 1 . 137 . 1 1 8 LYS NZ N -2.513 -1.791 -5.230 . . . 1.0 . . . . . . . . . . . . A . 8 LYS NZ . . . . . . . . . c30496_6e5h 1 . 1 . 138 . 1 1 8 LYS O O -2.435 -6.141 -2.488 . . . 1.0 . . . . . . . . . . . . A . 8 LYS O . . . . . . . . . c30496_6e5h 1 . 1 . 139 . 1 1 9 LYS C C -1.789 -8.505 -0.022 . . . 1.0 . . . . . . . . . . . . A . 9 LYS C . . . . . . . . . c30496_6e5h 1 . 1 . 140 . 1 1 9 LYS CA C -0.903 -8.023 -1.164 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CA . . . . . . . . . c30496_6e5h 1 . 1 . 141 . 1 1 9 LYS CB C 0.453 -8.739 -1.122 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CB . . . . . . . . . c30496_6e5h 1 . 1 . 142 . 1 1 9 LYS CD C 2.672 -9.154 -2.231 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CD . . . . . . . . . c30496_6e5h 1 . 1 . 143 . 1 1 9 LYS CE C 3.502 -8.956 -3.490 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CE . . . . . . . . . c30496_6e5h 1 . 1 . 144 . 1 1 9 LYS CG C 1.295 -8.525 -2.370 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CG . . . . . . . . . c30496_6e5h 1 . 1 . 145 . 1 1 9 LYS H H 0.046 -6.212 -0.613 . . . 1.0 . . . . . . . . . . . . A . 9 LYS H . . . . . . . . . c30496_6e5h 1 . 1 . 146 . 1 1 9 LYS HA H -1.391 -8.252 -2.098 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HA . . . . . . . . . c30496_6e5h 1 . 1 . 147 . 1 1 9 LYS HB2 H 1.012 -8.376 -0.271 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HB2 . . . . . . . . . c30496_6e5h 1 . 1 . 148 . 1 1 9 LYS HB3 H 0.284 -9.799 -1.005 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HB3 . . . . . . . . . c30496_6e5h 1 . 1 . 149 . 1 1 9 LYS HD2 H 3.184 -8.694 -1.400 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HD2 . . . . . . . . . c30496_6e5h 1 . 1 . 150 . 1 1 9 LYS HD3 H 2.557 -10.211 -2.047 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HD3 . . . . . . . . . c30496_6e5h 1 . 1 . 151 . 1 1 9 LYS HE2 H 2.989 -9.418 -4.320 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HE2 . . . . . . . . . c30496_6e5h 1 . 1 . 152 . 1 1 9 LYS HE3 H 3.603 -7.897 -3.675 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HE3 . . . . . . . . . c30496_6e5h 1 . 1 . 153 . 1 1 9 LYS HG2 H 0.793 -8.970 -3.214 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HG2 . . . . . . . . . c30496_6e5h 1 . 1 . 154 . 1 1 9 LYS HG3 H 1.411 -7.464 -2.537 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HG3 . . . . . . . . . c30496_6e5h 1 . 1 . 155 . 1 1 9 LYS HZ1 H 5.395 -9.079 -2.615 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HZ1 . . . . . . . . . c30496_6e5h 1 . 1 . 156 . 1 1 9 LYS HZ2 H 5.375 -9.459 -4.263 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HZ2 . . . . . . . . . c30496_6e5h 1 . 1 . 157 . 1 1 9 LYS HZ3 H 4.781 -10.565 -3.135 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HZ3 . . . . . . . . . c30496_6e5h 1 . 1 . 158 . 1 1 9 LYS N N -0.724 -6.579 -1.104 . . . 1.0 . . . . . . . . . . . . A . 9 LYS N . . . . . . . . . c30496_6e5h 1 . 1 . 159 . 1 1 9 LYS NZ N 4.856 -9.557 -3.367 . . . 1.0 . . . . . . . . . . . . A . 9 LYS NZ . . . . . . . . . c30496_6e5h 1 . 1 . 160 . 1 1 9 LYS O O -2.672 -9.341 -0.220 . . . 1.0 . . . . . . . . . . . . A . 9 LYS O . . . . . . . . . c30496_6e5h 1 . 1 . 161 . 1 1 10 ARG C C -3.771 -7.854 2.236 . . . 1.0 . . . . . . . . . . . . A . 10 ARG C . . . . . . . . . c30496_6e5h 1 . 1 . 162 . 1 1 10 ARG CA C -2.338 -8.363 2.344 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CA . . . . . . . . . c30496_6e5h 1 . 1 . 163 . 1 1 10 ARG CB C -1.691 -7.834 3.626 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CB . . . . . . . . . c30496_6e5h 1 . 1 . 164 . 1 1 10 ARG CD C 0.314 -7.839 5.148 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CD . . . . . . . . . c30496_6e5h 1 . 1 . 165 . 1 1 10 ARG CG C -0.328 -8.443 3.908 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CG . . . . . . . . . c30496_6e5h 1 . 1 . 166 . 1 1 10 ARG CZ C 2.576 -7.710 6.133 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CZ . . . . . . . . . c30496_6e5h 1 . 1 . 167 . 1 1 10 ARG H H -0.834 -7.318 1.275 . . . 1.0 . . . . . . . . . . . . A . 10 ARG H . . . . . . . . . c30496_6e5h 1 . 1 . 168 . 1 1 10 ARG HA H -2.359 -9.441 2.383 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HA . . . . . . . . . c30496_6e5h 1 . 1 . 169 . 1 1 10 ARG HB2 H -1.573 -6.763 3.543 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HB2 . . . . . . . . . c30496_6e5h 1 . 1 . 170 . 1 1 10 ARG HB3 H -2.340 -8.052 4.460 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HB3 . . . . . . . . . c30496_6e5h 1 . 1 . 171 . 1 1 10 ARG HD2 H 0.329 -6.763 5.042 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HD2 . . . . . . . . . c30496_6e5h 1 . 1 . 172 . 1 1 10 ARG HD3 H -0.278 -8.105 6.013 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HD3 . . . . . . . . . c30496_6e5h 1 . 1 . 173 . 1 1 10 ARG HE H 1.962 -9.119 4.851 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HE . . . . . . . . . c30496_6e5h 1 . 1 . 174 . 1 1 10 ARG HG2 H -0.446 -9.507 4.057 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HG2 . . . . . . . . . c30496_6e5h 1 . 1 . 175 . 1 1 10 ARG HG3 H 0.315 -8.264 3.056 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HG3 . . . . . . . . . c30496_6e5h 1 . 1 . 176 . 1 1 10 ARG HH11 H 2.904 -6.192 7.431 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HH11 . . . . . . . . . c30496_6e5h 1 . 1 . 177 . 1 1 10 ARG HH12 H 1.293 -6.284 6.794 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HH12 . . . . . . . . . c30496_6e5h 1 . 1 . 178 . 1 1 10 ARG HH21 H 4.085 -8.992 5.694 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HH21 . . . . . . . . . c30496_6e5h 1 . 1 . 179 . 1 1 10 ARG HH22 H 4.486 -7.727 6.809 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HH22 . . . . . . . . . c30496_6e5h 1 . 1 . 180 . 1 1 10 ARG N N -1.556 -7.977 1.174 . . . 1.0 . . . . . . . . . . . . A . 10 ARG N . . . . . . . . . c30496_6e5h 1 . 1 . 181 . 1 1 10 ARG NE N 1.687 -8.313 5.346 . . . 1.0 . . . . . . . . . . . . A . 10 ARG NE . . . . . . . . . c30496_6e5h 1 . 1 . 182 . 1 1 10 ARG NH1 N 2.231 -6.643 6.841 . . . 1.0 . . . . . . . . . . . . A . 10 ARG NH1 . . . . . . . . . c30496_6e5h 1 . 1 . 183 . 1 1 10 ARG NH2 N 3.814 -8.182 6.219 . . . 1.0 . . . . . . . . . . . . A . 10 ARG NH2 . . . . . . . . . c30496_6e5h 1 . 1 . 184 . 1 1 10 ARG O O -4.724 -8.582 2.518 . . . 1.0 . . . . . . . . . . . . A . 10 ARG O . . . . . . . . . c30496_6e5h 1 . 1 . 185 . 1 1 11 TYR C C -5.777 -6.203 0.258 . . . 1.0 . . . . . . . . . . . . A . 11 TYR C . . . . . . . . . c30496_6e5h 1 . 1 . 186 . 1 1 11 TYR CA C -5.238 -5.999 1.670 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CA . . . . . . . . . c30496_6e5h 1 . 1 . 187 . 1 1 11 TYR CB C -5.182 -4.507 1.986 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CB . . . . . . . . . c30496_6e5h 1 . 1 . 188 . 1 1 11 TYR CD1 C -5.808 -4.245 4.411 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CD1 . . . . . . . . . c30496_6e5h 1 . 1 . 189 . 1 1 11 TYR CD2 C -3.549 -3.831 3.782 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CD2 . . . . . . . . . c30496_6e5h 1 . 1 . 190 . 1 1 11 TYR CE1 C -5.503 -3.946 5.722 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CE1 . . . . . . . . . c30496_6e5h 1 . 1 . 191 . 1 1 11 TYR CE2 C -3.235 -3.533 5.091 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CE2 . . . . . . . . . c30496_6e5h 1 . 1 . 192 . 1 1 11 TYR CG C -4.838 -4.193 3.420 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CG . . . . . . . . . c30496_6e5h 1 . 1 . 193 . 1 1 11 TYR CZ C -4.215 -3.591 6.057 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CZ . . . . . . . . . c30496_6e5h 1 . 1 . 194 . 1 1 11 TYR H H -3.123 -6.074 1.594 . . . 1.0 . . . . . . . . . . . . A . 11 TYR H . . . . . . . . . c30496_6e5h 1 . 1 . 195 . 1 1 11 TYR HA H -5.903 -6.479 2.372 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HA . . . . . . . . . c30496_6e5h 1 . 1 . 196 . 1 1 11 TYR HB2 H -4.437 -4.041 1.359 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HB2 . . . . . . . . . c30496_6e5h 1 . 1 . 197 . 1 1 11 TYR HB3 H -6.143 -4.072 1.775 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HB3 . . . . . . . . . c30496_6e5h 1 . 1 . 198 . 1 1 11 TYR HD1 H -6.817 -4.527 4.143 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HD1 . . . . . . . . . c30496_6e5h 1 . 1 . 199 . 1 1 11 TYR HD2 H -2.783 -3.787 3.021 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HD2 . . . . . . . . . c30496_6e5h 1 . 1 . 200 . 1 1 11 TYR HE1 H -6.271 -3.992 6.478 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HE1 . . . . . . . . . c30496_6e5h 1 . 1 . 201 . 1 1 11 TYR HE2 H -2.226 -3.256 5.350 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HE2 . . . . . . . . . c30496_6e5h 1 . 1 . 202 . 1 1 11 TYR HH H -4.347 -3.917 7.950 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HH . . . . . . . . . c30496_6e5h 1 . 1 . 203 . 1 1 11 TYR N N -3.921 -6.605 1.816 . . . 1.0 . . . . . . . . . . . . A . 11 TYR N . . . . . . . . . c30496_6e5h 1 . 1 . 204 . 1 1 11 TYR O O -6.138 -5.238 -0.421 . . . 1.0 . . . . . . . . . . . . A . 11 TYR O . . . . . . . . . c30496_6e5h 1 . 1 . 205 . 1 1 11 TYR OH O -3.906 -3.287 7.362 . . . 1.0 . . . . . . . . . . . . A . 11 TYR OH . . . . . . . . . c30496_6e5h 1 . 1 . 206 . 1 1 12 ABA C C -7.784 -7.400 -1.652 . . . 1.0 . . . . . . . . . . . . A . 12 AIB C . . . . . . . . . c30496_6e5h 1 . 1 . 207 . 1 1 12 ABA CA C -6.320 -7.846 -1.499 . . . 1.0 . . . . . . . . . . . . A . 12 AIB CA . . . . . . . . . c30496_6e5h 1 . 1 . 208 . 1 1 12 ABA H H -5.522 -8.175 0.442 . . . 1.0 . . . . . . . . . . . . A . 12 AIB H . . . . . . . . . c30496_6e5h 1 . 1 . 209 . 1 1 12 ABA N N -5.825 -7.466 -0.167 . . . 1.0 . . . . . . . . . . . . A . 12 AIB N . . . . . . . . . c30496_6e5h 1 . 1 . 210 . 1 1 12 ABA O O -8.703 -8.131 -1.276 . . . 1.0 . . . . . . . . . . . . A . 12 AIB O . . . . . . . . . c30496_6e5h 1 . 1 . 211 . 1 1 13 GLY C C -9.456 -4.245 -1.946 . . . 1.0 . . . . . . . . . . . . A . 13 GLY C . . . . . . . . . c30496_6e5h 1 . 1 . 212 . 1 1 13 GLY CA C -9.330 -5.692 -2.375 . . . 1.0 . . . . . . . . . . . . A . 13 GLY CA . . . . . . . . . c30496_6e5h 1 . 1 . 213 . 1 1 13 GLY H H -7.223 -5.669 -2.477 . . . 1.0 . . . . . . . . . . . . A . 13 GLY H . . . . . . . . . c30496_6e5h 1 . 1 . 214 . 1 1 13 GLY HA2 H -9.596 -5.769 -3.418 . . . 1.0 . . . . . . . . . . . . A . 13 GLY HA2 . . . . . . . . . c30496_6e5h 1 . 1 . 215 . 1 1 13 GLY HA3 H -10.014 -6.290 -1.794 . . . 1.0 . . . . . . . . . . . . A . 13 GLY HA3 . . . . . . . . . c30496_6e5h 1 . 1 . 216 . 1 1 13 GLY N N -7.989 -6.207 -2.196 . . . 1.0 . . . . . . . . . . . . A . 13 GLY N . . . . . . . . . c30496_6e5h 1 . 1 . 217 . 1 1 13 GLY O O -10.360 -3.538 -2.390 . . . 1.0 . . . . . . . . . . . . A . 13 GLY O . . . . . . . . . c30496_6e5h 1 . 1 . 218 . 1 1 14 CYS C C -7.792 -1.501 -1.496 . . . 1.0 . . . . . . . . . . . . A . 14 CYS C . . . . . . . . . c30496_6e5h 1 . 1 . 219 . 1 1 14 CYS CA C -8.585 -2.430 -0.593 . . . 1.0 . . . . . . . . . . . . A . 14 CYS CA . . . . . . . . . c30496_6e5h 1 . 1 . 220 . 1 1 14 CYS CB C -8.013 -2.351 0.818 . . . 1.0 . . . . . . . . . . . . A . 14 CYS CB . . . . . . . . . c30496_6e5h 1 . 1 . 221 . 1 1 14 CYS H H -7.840 -4.400 -0.782 . . . 1.0 . . . . . . . . . . . . A . 14 CYS H . . . . . . . . . c30496_6e5h 1 . 1 . 222 . 1 1 14 CYS HA H -9.613 -2.107 -0.572 . . . 1.0 . . . . . . . . . . . . A . 14 CYS HA . . . . . . . . . c30496_6e5h 1 . 1 . 223 . 1 1 14 CYS HB2 H -6.981 -2.655 0.793 . . . 1.0 . . . . . . . . . . . . A . 14 CYS HB2 . . . . . . . . . c30496_6e5h 1 . 1 . 224 . 1 1 14 CYS HB3 H -8.071 -1.327 1.160 . . . 1.0 . . . . . . . . . . . . A . 14 CYS HB3 . . . . . . . . . c30496_6e5h 1 . 1 . 225 . 1 1 14 CYS N N -8.550 -3.798 -1.090 . . . 1.0 . . . . . . . . . . . . A . 14 CYS N . . . . . . . . . c30496_6e5h 1 . 1 . 226 . 1 1 14 CYS O O -6.907 -1.934 -2.236 . . . 1.0 . . . . . . . . . . . . A . 14 CYS O . . . . . . . . . c30496_6e5h 1 . 1 . 227 . 1 1 14 CYS SG S -8.871 -3.389 2.042 . . . 1.0 . . . . . . . . . . . . A . 14 CYS SG . . . . . . . . . c30496_6e5h 1 . 1 . 228 . 1 1 15 GLU C C -6.203 1.269 -1.322 . . . 1.0 . . . . . . . . . . . . A . 15 GLU C . . . . . . . . . c30496_6e5h 1 . 1 . 229 . 1 1 15 GLU CA C -7.390 0.798 -2.149 . . . 1.0 . . . . . . . . . . . . A . 15 GLU CA . . . . . . . . . c30496_6e5h 1 . 1 . 230 . 1 1 15 GLU CB C -8.315 1.976 -2.472 . . . 1.0 . . . . . . . . . . . . A . 15 GLU CB . . . . . . . . . c30496_6e5h 1 . 1 . 231 . 1 1 15 GLU CD C -7.138 2.801 -4.551 . . . 1.0 . . . . . . . . . . . . A . 15 GLU CD . . . . . . . . . c30496_6e5h 1 . 1 . 232 . 1 1 15 GLU CG C -7.619 3.141 -3.159 . . . 1.0 . . . . . . . . . . . . A . 15 GLU CG . . . . . . . . . c30496_6e5h 1 . 1 . 233 . 1 1 15 GLU H H -8.855 0.049 -0.835 . . . 1.0 . . . . . . . . . . . . A . 15 GLU H . . . . . . . . . c30496_6e5h 1 . 1 . 234 . 1 1 15 GLU HA H -7.029 0.364 -3.069 . . . 1.0 . . . . . . . . . . . . A . 15 GLU HA . . . . . . . . . c30496_6e5h 1 . 1 . 235 . 1 1 15 GLU HB2 H -9.106 1.629 -3.119 . . . 1.0 . . . . . . . . . . . . A . 15 GLU HB2 . . . . . . . . . c30496_6e5h 1 . 1 . 236 . 1 1 15 GLU HB3 H -8.750 2.337 -1.551 . . . 1.0 . . . . . . . . . . . . A . 15 GLU HB3 . . . . . . . . . c30496_6e5h 1 . 1 . 237 . 1 1 15 GLU HG2 H -8.310 3.966 -3.228 . . . 1.0 . . . . . . . . . . . . A . 15 GLU HG2 . . . . . . . . . c30496_6e5h 1 . 1 . 238 . 1 1 15 GLU HG3 H -6.767 3.436 -2.562 . . . 1.0 . . . . . . . . . . . . A . 15 GLU HG3 . . . . . . . . . c30496_6e5h 1 . 1 . 239 . 1 1 15 GLU N N -8.112 -0.222 -1.417 . . . 1.0 . . . . . . . . . . . . A . 15 GLU N . . . . . . . . . c30496_6e5h 1 . 1 . 240 . 1 1 15 GLU O O -6.340 2.134 -0.456 . . . 1.0 . . . . . . . . . . . . A . 15 GLU O . . . . . . . . . c30496_6e5h 1 . 1 . 241 . 1 1 15 GLU OE1 O -6.102 2.115 -4.680 . . . 1.0 . . . . . . . . . . . . A . 15 GLU OE1 . . . . . . . . . c30496_6e5h 1 . 1 . 242 . 1 1 15 GLU OE2 O -7.786 3.232 -5.527 . . . 1.0 . . . . . . . . . . . . A . 15 GLU OE2 . . . . . . . . . c30496_6e5h 1 . 1 . 243 . 1 1 16 VAL C C -3.087 2.097 -1.692 . . . 1.0 . . . . . . . . . . . . A . 16 VAL C . . . . . . . . . c30496_6e5h 1 . 1 . 244 . 1 1 16 VAL CA C -3.842 1.071 -0.865 . . . 1.0 . . . . . . . . . . . . A . 16 VAL CA . . . . . . . . . c30496_6e5h 1 . 1 . 245 . 1 1 16 VAL CB C -2.906 -0.117 -0.568 . . . 1.0 . . . . . . . . . . . . A . 16 VAL CB . . . . . . . . . c30496_6e5h 1 . 1 . 246 . 1 1 16 VAL CG1 C -1.684 0.352 0.212 . . . 1.0 . . . . . . . . . . . . A . 16 VAL CG1 . . . . . . . . . c30496_6e5h 1 . 1 . 247 . 1 1 16 VAL CG2 C -3.642 -1.217 0.187 . . . 1.0 . . . . . . . . . . . . A . 16 VAL CG2 . . . . . . . . . c30496_6e5h 1 . 1 . 248 . 1 1 16 VAL H H -5.011 -0.051 -2.221 . . . 1.0 . . . . . . . . . . . . A . 16 VAL H . . . . . . . . . c30496_6e5h 1 . 1 . 249 . 1 1 16 VAL HA H -4.131 1.522 0.072 . . . 1.0 . . . . . . . . . . . . A . 16 VAL HA . . . . . . . . . c30496_6e5h 1 . 1 . 250 . 1 1 16 VAL HB H -2.568 -0.522 -1.509 . . . 1.0 . . . . . . . . . . . . A . 16 VAL HB . . . . . . . . . c30496_6e5h 1 . 1 . 251 . 1 1 16 VAL HG11 H -1.121 1.051 -0.391 . . . 1.0 . . . . . . . . . . . . A . 16 VAL HG11 . . . . . . . . . c30496_6e5h 1 . 1 . 252 . 1 1 16 VAL HG12 H -1.063 -0.496 0.457 . . . 1.0 . . . . . . . . . . . . A . 16 VAL HG12 . . . . . . . . . c30496_6e5h 1 . 1 . 253 . 1 1 16 VAL HG13 H -2.003 0.840 1.120 . . . 1.0 . . . . . . . . . . . . A . 16 VAL HG13 . . . . . . . . . c30496_6e5h 1 . 1 . 254 . 1 1 16 VAL HG21 H -2.950 -2.009 0.434 . . . 1.0 . . . . . . . . . . . . A . 16 VAL HG21 . . . . . . . . . c30496_6e5h 1 . 1 . 255 . 1 1 16 VAL HG22 H -4.431 -1.613 -0.435 . . . 1.0 . . . . . . . . . . . . A . 16 VAL HG22 . . . . . . . . . c30496_6e5h 1 . 1 . 256 . 1 1 16 VAL HG23 H -4.065 -0.812 1.091 . . . 1.0 . . . . . . . . . . . . A . 16 VAL HG23 . . . . . . . . . c30496_6e5h 1 . 1 . 257 . 1 1 16 VAL N N -5.050 0.670 -1.559 . . . 1.0 . . . . . . . . . . . . A . 16 VAL N . . . . . . . . . c30496_6e5h 1 . 1 . 258 . 1 1 16 VAL O O -2.461 1.761 -2.701 . . . 1.0 . . . . . . . . . . . . A . 16 VAL O . . . . . . . . . c30496_6e5h 1 . 1 . 259 . 1 1 17 ARG C C -1.057 4.548 -1.449 . . . 1.0 . . . . . . . . . . . . A . 17 ARG C . . . . . . . . . c30496_6e5h 1 . 1 . 260 . 1 1 17 ARG CA C -2.480 4.417 -1.964 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CA . . . . . . . . . c30496_6e5h 1 . 1 . 261 . 1 1 17 ARG CB C -3.222 5.739 -1.789 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CB . . . . . . . . . c30496_6e5h 1 . 1 . 262 . 1 1 17 ARG CD C -3.286 8.203 -2.257 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CD . . . . . . . . . c30496_6e5h 1 . 1 . 263 . 1 1 17 ARG CG C -2.605 6.884 -2.575 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CG . . . . . . . . . c30496_6e5h 1 . 1 . 264 . 1 1 17 ARG CZ C -5.665 8.756 -1.897 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CZ . . . . . . . . . c30496_6e5h 1 . 1 . 265 . 1 1 17 ARG H H -3.688 3.548 -0.465 . . . 1.0 . . . . . . . . . . . . A . 17 ARG H . . . . . . . . . c30496_6e5h 1 . 1 . 266 . 1 1 17 ARG HA H -2.447 4.168 -3.011 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HA . . . . . . . . . c30496_6e5h 1 . 1 . 267 . 1 1 17 ARG HB2 H -4.244 5.613 -2.115 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HB2 . . . . . . . . . c30496_6e5h 1 . 1 . 268 . 1 1 17 ARG HB3 H -3.216 6.004 -0.744 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HB3 . . . . . . . . . c30496_6e5h 1 . 1 . 269 . 1 1 17 ARG HD2 H -3.203 8.386 -1.197 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HD2 . . . . . . . . . c30496_6e5h 1 . 1 . 270 . 1 1 17 ARG HD3 H -2.782 8.992 -2.798 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HD3 . . . . . . . . . c30496_6e5h 1 . 1 . 271 . 1 1 17 ARG HE H -4.942 7.777 -3.487 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HE . . . . . . . . . c30496_6e5h 1 . 1 . 272 . 1 1 17 ARG HG2 H -1.558 6.960 -2.320 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HG2 . . . . . . . . . c30496_6e5h 1 . 1 . 273 . 1 1 17 ARG HG3 H -2.707 6.680 -3.630 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HG3 . . . . . . . . . c30496_6e5h 1 . 1 . 274 . 1 1 17 ARG HH11 H -4.437 9.278 -0.357 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH11 . . . . . . . . . c30496_6e5h 1 . 1 . 275 . 1 1 17 ARG HH12 H -6.111 9.709 -0.164 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH12 . . . . . . . . . c30496_6e5h 1 . 1 . 276 . 1 1 17 ARG HH21 H -7.135 8.345 -3.231 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH21 . . . . . . . . . c30496_6e5h 1 . 1 . 277 . 1 1 17 ARG HH22 H -7.644 9.187 -1.804 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH22 . . . . . . . . . c30496_6e5h 1 . 1 . 278 . 1 1 17 ARG N N -3.163 3.345 -1.271 . . . 1.0 . . . . . . . . . . . . A . 17 ARG N . . . . . . . . . c30496_6e5h 1 . 1 . 279 . 1 1 17 ARG NE N -4.702 8.199 -2.630 . . . 1.0 . . . . . . . . . . . . A . 17 ARG NE . . . . . . . . . c30496_6e5h 1 . 1 . 280 . 1 1 17 ARG NH1 N -5.384 9.290 -0.713 . . . 1.0 . . . . . . . . . . . . A . 17 ARG NH1 . . . . . . . . . c30496_6e5h 1 . 1 . 281 . 1 1 17 ARG NH2 N -6.915 8.760 -2.345 . . . 1.0 . . . . . . . . . . . . A . 17 ARG NH2 . . . . . . . . . c30496_6e5h 1 . 1 . 282 . 1 1 17 ARG O O -0.833 4.928 -0.297 . . . 1.0 . . . . . . . . . . . . A . 17 ARG O . . . . . . . . . c30496_6e5h 1 . 1 . 283 . 1 1 18 CYS C C 1.805 5.708 -2.372 . . . 1.0 . . . . . . . . . . . . A . 18 CYS C . . . . . . . . . c30496_6e5h 1 . 1 . 284 . 1 1 18 CYS CA C 1.296 4.336 -1.954 . . . 1.0 . . . . . . . . . . . . A . 18 CYS CA . . . . . . . . . c30496_6e5h 1 . 1 . 285 . 1 1 18 CYS CB C 2.112 3.235 -2.632 . . . 1.0 . . . . . . . . . . . . A . 18 CYS CB . . . . . . . . . c30496_6e5h 1 . 1 . 286 . 1 1 18 CYS H H -0.349 3.867 -3.180 . . . 1.0 . . . . . . . . . . . . A . 18 CYS H . . . . . . . . . c30496_6e5h 1 . 1 . 287 . 1 1 18 CYS HA H 1.385 4.238 -0.883 . . . 1.0 . . . . . . . . . . . . A . 18 CYS HA . . . . . . . . . c30496_6e5h 1 . 1 . 288 . 1 1 18 CYS HB2 H 2.036 3.348 -3.702 . . . 1.0 . . . . . . . . . . . . A . 18 CYS HB2 . . . . . . . . . c30496_6e5h 1 . 1 . 289 . 1 1 18 CYS HB3 H 3.145 3.329 -2.336 . . . 1.0 . . . . . . . . . . . . A . 18 CYS HB3 . . . . . . . . . c30496_6e5h 1 . 1 . 290 . 1 1 18 CYS N N -0.105 4.210 -2.297 . . . 1.0 . . . . . . . . . . . . A . 18 CYS N . . . . . . . . . c30496_6e5h 1 . 1 . 291 . 1 1 18 CYS O O 1.729 6.074 -3.548 . . . 1.0 . . . . . . . . . . . . A . 18 CYS O . . . . . . . . . c30496_6e5h 1 . 1 . 292 . 1 1 18 CYS SG S 1.563 1.545 -2.213 . . . 1.0 . . . . . . . . . . . . A . 18 CYS SG . . . . . . . . . c30496_6e5h 1 . 1 . 293 . 1 1 19 ASP C C 4.099 8.022 -0.895 . . . 1.0 . . . . . . . . . . . . A . 19 ASP C . . . . . . . . . c30496_6e5h 1 . 1 . 294 . 1 1 19 ASP CA C 2.810 7.806 -1.679 . . . 1.0 . . . . . . . . . . . . A . 19 ASP CA . . . . . . . . . c30496_6e5h 1 . 1 . 295 . 1 1 19 ASP CB C 1.778 8.873 -1.302 . . . 1.0 . . . . . . . . . . . . A . 19 ASP CB . . . . . . . . . c30496_6e5h 1 . 1 . 296 . 1 1 19 ASP CG C 2.205 10.269 -1.714 . . . 1.0 . . . . . . . . . . . . A . 19 ASP CG . . . . . . . . . c30496_6e5h 1 . 1 . 297 . 1 1 19 ASP H H 2.285 6.145 -0.483 . . . 1.0 . . . . . . . . . . . . A . 19 ASP H . . . . . . . . . c30496_6e5h 1 . 1 . 298 . 1 1 19 ASP HA H 3.021 7.875 -2.733 . . . 1.0 . . . . . . . . . . . . A . 19 ASP HA . . . . . . . . . c30496_6e5h 1 . 1 . 299 . 1 1 19 ASP HB2 H 0.841 8.645 -1.787 . . . 1.0 . . . . . . . . . . . . A . 19 ASP HB2 . . . . . . . . . c30496_6e5h 1 . 1 . 300 . 1 1 19 ASP HB3 H 1.636 8.861 -0.232 . . . 1.0 . . . . . . . . . . . . A . 19 ASP HB3 . . . . . . . . . c30496_6e5h 1 . 1 . 301 . 1 1 19 ASP N N 2.284 6.477 -1.409 . . . 1.0 . . . . . . . . . . . . A . 19 ASP N . . . . . . . . . c30496_6e5h 1 . 1 . 302 . 1 1 19 ASP O O 4.085 8.591 0.199 . . . 1.0 . . . . . . . . . . . . A . 19 ASP O . . . . . . . . . c30496_6e5h 1 . 1 . 303 . 1 1 19 ASP OD1 O 2.796 10.990 -0.884 . . . 1.0 . . . . . . . . . . . . A . 19 ASP OD1 . . . . . . . . . c30496_6e5h 1 . 1 . 304 . 1 1 19 ASP OD2 O 1.942 10.659 -2.873 . . . 1.0 . . . . . . . . . . . . A . 19 ASP OD2 . . . . . . . . . c30496_6e5h 1 . 1 . 305 . 1 1 20 DPR C C 6.526 6.927 0.581 . . . 1.0 . . . . . . . . . . . . A . 20 DPR C . . . . . . . . . c30496_6e5h 1 . 1 . 306 . 1 1 20 DPR CA C 6.525 7.658 -0.757 . . . 1.0 . . . . . . . . . . . . A . 20 DPR CA . . . . . . . . . c30496_6e5h 1 . 1 . 307 . 1 1 20 DPR CB C 7.516 7.014 -1.728 . . . 1.0 . . . . . . . . . . . . A . 20 DPR CB . . . . . . . . . c30496_6e5h 1 . 1 . 308 . 1 1 20 DPR CD C 5.349 6.841 -2.717 . . . 1.0 . . . . . . . . . . . . A . 20 DPR CD . . . . . . . . . c30496_6e5h 1 . 1 . 309 . 1 1 20 DPR CG C 6.809 6.970 -3.038 . . . 1.0 . . . . . . . . . . . . A . 20 DPR CG . . . . . . . . . c30496_6e5h 1 . 1 . 310 . 1 1 20 DPR HA H 6.798 8.689 -0.604 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HA . . . . . . . . . c30496_6e5h 1 . 1 . 311 . 1 1 20 DPR HB2 H 8.409 7.618 -1.782 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HB2 . . . . . . . . . c30496_6e5h 1 . 1 . 312 . 1 1 20 DPR HB3 H 7.766 6.024 -1.382 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HB3 . . . . . . . . . c30496_6e5h 1 . 1 . 313 . 1 1 20 DPR HD2 H 4.754 7.321 -3.477 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HD2 . . . . . . . . . c30496_6e5h 1 . 1 . 314 . 1 1 20 DPR HD3 H 5.071 5.801 -2.618 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HD3 . . . . . . . . . c30496_6e5h 1 . 1 . 315 . 1 1 20 DPR HG2 H 6.992 7.883 -3.583 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HG2 . . . . . . . . . c30496_6e5h 1 . 1 . 316 . 1 1 20 DPR HG3 H 7.145 6.118 -3.610 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HG3 . . . . . . . . . c30496_6e5h 1 . 1 . 317 . 1 1 20 DPR N N 5.232 7.540 -1.429 . . . 1.0 . . . . . . . . . . . . A . 20 DPR N . . . . . . . . . c30496_6e5h 1 . 1 . 318 . 1 1 20 DPR O O 6.282 5.723 0.641 . . . 1.0 . . . . . . . . . . . . A . 20 DPR O . . . . . . . . . c30496_6e5h 1 . 1 . 319 . 1 1 21 PRO C C 5.379 7.106 3.628 . . . 1.0 . . . . . . . . . . . . A . 21 PRO C . . . . . . . . . c30496_6e5h 1 . 1 . 320 . 1 1 21 PRO CA C 6.780 7.096 3.022 . . . 1.0 . . . . . . . . . . . . A . 21 PRO CA . . . . . . . . . c30496_6e5h 1 . 1 . 321 . 1 1 21 PRO CB C 7.702 8.042 3.784 . . . 1.0 . . . . . . . . . . . . A . 21 PRO CB . . . . . . . . . c30496_6e5h 1 . 1 . 322 . 1 1 21 PRO CD C 7.206 9.071 1.672 . . . 1.0 . . . . . . . . . . . . A . 21 PRO CD . . . . . . . . . c30496_6e5h 1 . 1 . 323 . 1 1 21 PRO CG C 7.511 9.361 3.120 . . . 1.0 . . . . . . . . . . . . A . 21 PRO CG . . . . . . . . . c30496_6e5h 1 . 1 . 324 . 1 1 21 PRO HA H 7.179 6.094 3.050 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HA . . . . . . . . . c30496_6e5h 1 . 1 . 325 . 1 1 21 PRO HB2 H 7.411 8.073 4.824 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HB2 . . . . . . . . . c30496_6e5h 1 . 1 . 326 . 1 1 21 PRO HB3 H 8.724 7.702 3.699 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HB3 . . . . . . . . . c30496_6e5h 1 . 1 . 327 . 1 1 21 PRO HD2 H 6.396 9.695 1.323 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HD2 . . . . . . . . . c30496_6e5h 1 . 1 . 328 . 1 1 21 PRO HD3 H 8.085 9.222 1.066 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HD3 . . . . . . . . . c30496_6e5h 1 . 1 . 329 . 1 1 21 PRO HG2 H 6.686 9.883 3.577 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HG2 . . . . . . . . . c30496_6e5h 1 . 1 . 330 . 1 1 21 PRO HG3 H 8.415 9.948 3.201 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HG3 . . . . . . . . . c30496_6e5h 1 . 1 . 331 . 1 1 21 PRO N N 6.810 7.649 1.671 . . . 1.0 . . . . . . . . . . . . A . 21 PRO N . . . . . . . . . c30496_6e5h 1 . 1 . 332 . 1 1 21 PRO O O 5.201 6.827 4.812 . . . 1.0 . . . . . . . . . . . . A . 21 PRO O . . . . . . . . . c30496_6e5h 1 . 1 . 333 . 1 1 22 ARG C C 2.201 6.381 2.586 . . . 1.0 . . . . . . . . . . . . A . 22 ARG C . . . . . . . . . c30496_6e5h 1 . 1 . 334 . 1 1 22 ARG CA C 3.008 7.463 3.282 . . . 1.0 . . . . . . . . . . . . A . 22 ARG CA . . . . . . . . . c30496_6e5h 1 . 1 . 335 . 1 1 22 ARG CB C 2.371 8.828 3.028 . . . 1.0 . . . . . . . . . . . . A . 22 ARG CB . . . . . . . . . c30496_6e5h 1 . 1 . 336 . 1 1 22 ARG CD C 2.371 11.301 3.501 . . . 1.0 . . . . . . . . . . . . A . 22 ARG CD . . . . . . . . . c30496_6e5h 1 . 1 . 337 . 1 1 22 ARG CG C 3.057 9.967 3.762 . . . 1.0 . . . . . . . . . . . . A . 22 ARG CG . . . . . . . . . c30496_6e5h 1 . 1 . 338 . 1 1 22 ARG CZ C 2.306 12.962 1.672 . . . 1.0 . . . . . . . . . . . . A . 22 ARG CZ . . . . . . . . . c30496_6e5h 1 . 1 . 339 . 1 1 22 ARG H H 4.581 7.682 1.884 . . . 1.0 . . . . . . . . . . . . A . 22 ARG H . . . . . . . . . c30496_6e5h 1 . 1 . 340 . 1 1 22 ARG HA H 3.012 7.267 4.344 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HA . . . . . . . . . c30496_6e5h 1 . 1 . 341 . 1 1 22 ARG HB2 H 2.408 9.035 1.969 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HB2 . . . . . . . . . c30496_6e5h 1 . 1 . 342 . 1 1 22 ARG HB3 H 1.338 8.794 3.343 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HB3 . . . . . . . . . c30496_6e5h 1 . 1 . 343 . 1 1 22 ARG HD2 H 1.335 11.218 3.791 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HD2 . . . . . . . . . c30496_6e5h 1 . 1 . 344 . 1 1 22 ARG HD3 H 2.849 12.058 4.103 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HD3 . . . . . . . . . c30496_6e5h 1 . 1 . 345 . 1 1 22 ARG HE H 2.570 10.995 1.421 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HE . . . . . . . . . c30496_6e5h 1 . 1 . 346 . 1 1 22 ARG HG2 H 3.031 9.764 4.822 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HG2 . . . . . . . . . c30496_6e5h 1 . 1 . 347 . 1 1 22 ARG HG3 H 4.083 10.028 3.432 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HG3 . . . . . . . . . c30496_6e5h 1 . 1 . 348 . 1 1 22 ARG HH11 H 2.146 13.761 3.526 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HH11 . . . . . . . . . c30496_6e5h 1 . 1 . 349 . 1 1 22 ARG HH12 H 2.059 14.896 2.221 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HH12 . . . . . . . . . c30496_6e5h 1 . 1 . 350 . 1 1 22 ARG HH21 H 2.252 14.168 0.048 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HH21 . . . . . . . . . c30496_6e5h 1 . 1 . 351 . 1 1 22 ARG HH22 H 2.477 12.473 -0.288 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HH22 . . . . . . . . . c30496_6e5h 1 . 1 . 352 . 1 1 22 ARG N N 4.385 7.444 2.819 . . . 1.0 . . . . . . . . . . . . A . 22 ARG N . . . . . . . . . c30496_6e5h 1 . 1 . 353 . 1 1 22 ARG NE N 2.435 11.704 2.094 . . . 1.0 . . . . . . . . . . . . A . 22 ARG NE . . . . . . . . . c30496_6e5h 1 . 1 . 354 . 1 1 22 ARG NH1 N 2.159 13.951 2.543 . . . 1.0 . . . . . . . . . . . . A . 22 ARG NH1 . . . . . . . . . c30496_6e5h 1 . 1 . 355 . 1 1 22 ARG NH2 N 2.348 13.226 0.377 . . . 1.0 . . . . . . . . . . . . A . 22 ARG NH2 . . . . . . . . . c30496_6e5h 1 . 1 . 356 . 1 1 22 ARG O O 2.316 6.189 1.377 . . . 1.0 . . . . . . . . . . . . A . 22 ARG O . . . . . . . . . c30496_6e5h 1 . 1 . 357 . 1 1 23 TYR C C -0.866 4.807 3.330 . . . 1.0 . . . . . . . . . . . . A . 23 TYR C . . . . . . . . . c30496_6e5h 1 . 1 . 358 . 1 1 23 TYR CA C 0.544 4.633 2.801 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CA . . . . . . . . . c30496_6e5h 1 . 1 . 359 . 1 1 23 TYR CB C 1.063 3.239 3.147 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CB . . . . . . . . . c30496_6e5h 1 . 1 . 360 . 1 1 23 TYR CD1 C 3.531 3.116 3.658 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CD1 . . . . . . . . . c30496_6e5h 1 . 1 . 361 . 1 1 23 TYR CD2 C 2.814 2.668 1.431 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CD2 . . . . . . . . . c30496_6e5h 1 . 1 . 362 . 1 1 23 TYR CE1 C 4.843 2.901 3.284 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CE1 . . . . . . . . . c30496_6e5h 1 . 1 . 363 . 1 1 23 TYR CE2 C 4.122 2.451 1.048 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CE2 . . . . . . . . . c30496_6e5h 1 . 1 . 364 . 1 1 23 TYR CG C 2.497 3.003 2.737 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CG . . . . . . . . . c30496_6e5h 1 . 1 . 365 . 1 1 23 TYR CZ C 5.135 2.569 1.978 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CZ . . . . . . . . . c30496_6e5h 1 . 1 . 366 . 1 1 23 TYR H H 1.396 5.823 4.321 . . . 1.0 . . . . . . . . . . . . A . 23 TYR H . . . . . . . . . c30496_6e5h 1 . 1 . 367 . 1 1 23 TYR HA H 0.534 4.749 1.727 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HA . . . . . . . . . c30496_6e5h 1 . 1 . 368 . 1 1 23 TYR HB2 H 0.992 3.089 4.211 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HB2 . . . . . . . . . c30496_6e5h 1 . 1 . 369 . 1 1 23 TYR HB3 H 0.451 2.507 2.644 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HB3 . . . . . . . . . c30496_6e5h 1 . 1 . 370 . 1 1 23 TYR HD1 H 3.300 3.379 4.679 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HD1 . . . . . . . . . c30496_6e5h 1 . 1 . 371 . 1 1 23 TYR HD2 H 2.019 2.579 0.704 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HD2 . . . . . . . . . c30496_6e5h 1 . 1 . 372 . 1 1 23 TYR HE1 H 5.633 2.994 4.014 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HE1 . . . . . . . . . c30496_6e5h 1 . 1 . 373 . 1 1 23 TYR HE2 H 4.346 2.192 0.028 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HE2 . . . . . . . . . c30496_6e5h 1 . 1 . 374 . 1 1 23 TYR HH H 6.874 1.783 2.244 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HH . . . . . . . . . c30496_6e5h 1 . 1 . 375 . 1 1 23 TYR N N 1.407 5.660 3.354 . . . 1.0 . . . . . . . . . . . . A . 23 TYR N . . . . . . . . . c30496_6e5h 1 . 1 . 376 . 1 1 23 TYR O O -1.081 4.847 4.545 . . . 1.0 . . . . . . . . . . . . A . 23 TYR O . . . . . . . . . c30496_6e5h 1 . 1 . 377 . 1 1 23 TYR OH O 6.441 2.353 1.598 . . . 1.0 . . . . . . . . . . . . A . 23 TYR OH . . . . . . . . . c30496_6e5h 1 . 1 . 378 . 1 1 24 GLU C C -4.069 3.974 2.394 . . . 1.0 . . . . . . . . . . . . A . 24 GLU C . . . . . . . . . c30496_6e5h 1 . 1 . 379 . 1 1 24 GLU CA C -3.202 5.156 2.807 . . . 1.0 . . . . . . . . . . . . A . 24 GLU CA . . . . . . . . . c30496_6e5h 1 . 1 . 380 . 1 1 24 GLU CB C -3.723 6.450 2.179 . . . 1.0 . . . . . . . . . . . . A . 24 GLU CB . . . . . . . . . c30496_6e5h 1 . 1 . 381 . 1 1 24 GLU CD C -3.418 8.945 1.905 . . . 1.0 . . . . . . . . . . . . A . 24 GLU CD . . . . . . . . . c30496_6e5h 1 . 1 . 382 . 1 1 24 GLU CG C -2.876 7.669 2.511 . . . 1.0 . . . . . . . . . . . . A . 24 GLU CG . . . . . . . . . c30496_6e5h 1 . 1 . 383 . 1 1 24 GLU H H -1.588 4.851 1.468 . . . 1.0 . . . . . . . . . . . . A . 24 GLU H . . . . . . . . . c30496_6e5h 1 . 1 . 384 . 1 1 24 GLU HA H -3.234 5.248 3.882 . . . 1.0 . . . . . . . . . . . . A . 24 GLU HA . . . . . . . . . c30496_6e5h 1 . 1 . 385 . 1 1 24 GLU HB2 H -3.745 6.334 1.106 . . . 1.0 . . . . . . . . . . . . A . 24 GLU HB2 . . . . . . . . . c30496_6e5h 1 . 1 . 386 . 1 1 24 GLU HB3 H -4.727 6.629 2.532 . . . 1.0 . . . . . . . . . . . . A . 24 GLU HB3 . . . . . . . . . c30496_6e5h 1 . 1 . 387 . 1 1 24 GLU HG2 H -2.845 7.788 3.584 . . . 1.0 . . . . . . . . . . . . A . 24 GLU HG2 . . . . . . . . . c30496_6e5h 1 . 1 . 388 . 1 1 24 GLU HG3 H -1.875 7.509 2.140 . . . 1.0 . . . . . . . . . . . . A . 24 GLU HG3 . . . . . . . . . c30496_6e5h 1 . 1 . 389 . 1 1 24 GLU N N -1.818 4.927 2.424 . . . 1.0 . . . . . . . . . . . . A . 24 GLU N . . . . . . . . . c30496_6e5h 1 . 1 . 390 . 1 1 24 GLU O O -4.395 3.810 1.220 . . . 1.0 . . . . . . . . . . . . A . 24 GLU O . . . . . . . . . c30496_6e5h 1 . 1 . 391 . 1 1 24 GLU OE1 O -3.099 9.236 0.736 . . . 1.0 . . . . . . . . . . . . A . 24 GLU OE1 . . . . . . . . . c30496_6e5h 1 . 1 . 392 . 1 1 24 GLU OE2 O -4.159 9.667 2.602 . . . 1.0 . . . . . . . . . . . . A . 24 GLU OE2 . . . . . . . . . c30496_6e5h 1 . 1 . 393 . 1 1 25 VAL C C -6.721 2.321 3.240 . . . 1.0 . . . . . . . . . . . . A . 25 VAL C . . . . . . . . . c30496_6e5h 1 . 1 . 394 . 1 1 25 VAL CA C -5.243 1.974 3.107 . . . 1.0 . . . . . . . . . . . . A . 25 VAL CA . . . . . . . . . c30496_6e5h 1 . 1 . 395 . 1 1 25 VAL CB C -4.897 0.815 4.068 . . . 1.0 . . . . . . . . . . . . A . 25 VAL CB . . . . . . . . . c30496_6e5h 1 . 1 . 396 . 1 1 25 VAL CG1 C -5.822 -0.374 3.839 . . . 1.0 . . . . . . . . . . . . A . 25 VAL CG1 . . . . . . . . . c30496_6e5h 1 . 1 . 397 . 1 1 25 VAL CG2 C -3.442 0.397 3.903 . . . 1.0 . . . . . . . . . . . . A . 25 VAL CG2 . . . . . . . . . c30496_6e5h 1 . 1 . 398 . 1 1 25 VAL H H -4.137 3.338 4.284 . . . 1.0 . . . . . . . . . . . . A . 25 VAL H . . . . . . . . . c30496_6e5h 1 . 1 . 399 . 1 1 25 VAL HA H -5.049 1.649 2.094 . . . 1.0 . . . . . . . . . . . . A . 25 VAL HA . . . . . . . . . c30496_6e5h 1 . 1 . 400 . 1 1 25 VAL HB H -5.037 1.162 5.082 . . . 1.0 . . . . . . . . . . . . A . 25 VAL HB . . . . . . . . . c30496_6e5h 1 . 1 . 401 . 1 1 25 VAL HG11 H -5.548 -1.178 4.507 . . . 1.0 . . . . . . . . . . . . A . 25 VAL HG11 . . . . . . . . . c30496_6e5h 1 . 1 . 402 . 1 1 25 VAL HG12 H -5.733 -0.709 2.818 . . . 1.0 . . . . . . . . . . . . A . 25 VAL HG12 . . . . . . . . . c30496_6e5h 1 . 1 . 403 . 1 1 25 VAL HG13 H -6.843 -0.078 4.032 . . . 1.0 . . . . . . . . . . . . A . 25 VAL HG13 . . . . . . . . . c30496_6e5h 1 . 1 . 404 . 1 1 25 VAL HG21 H -3.224 -0.422 4.572 . . . 1.0 . . . . . . . . . . . . A . 25 VAL HG21 . . . . . . . . . c30496_6e5h 1 . 1 . 405 . 1 1 25 VAL HG22 H -2.798 1.233 4.134 . . . 1.0 . . . . . . . . . . . . A . 25 VAL HG22 . . . . . . . . . c30496_6e5h 1 . 1 . 406 . 1 1 25 VAL HG23 H -3.272 0.085 2.885 . . . 1.0 . . . . . . . . . . . . A . 25 VAL HG23 . . . . . . . . . c30496_6e5h 1 . 1 . 407 . 1 1 25 VAL N N -4.423 3.147 3.365 . . . 1.0 . . . . . . . . . . . . A . 25 VAL N . . . . . . . . . c30496_6e5h 1 . 1 . 408 . 1 1 25 VAL O O -7.198 2.652 4.326 . . . 1.0 . . . . . . . . . . . . A . 25 VAL O . . . . . . . . . c30496_6e5h 1 . 1 . 409 . 1 1 26 HIS C C -9.663 1.365 1.684 . . . 1.0 . . . . . . . . . . . . A . 26 HIS C . . . . . . . . . c30496_6e5h 1 . 1 . 410 . 1 1 26 HIS CA C -8.850 2.583 2.109 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CA . . . . . . . . . c30496_6e5h 1 . 1 . 411 . 1 1 26 HIS CB C -9.105 3.757 1.159 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CB . . . . . . . . . c30496_6e5h 1 . 1 . 412 . 1 1 26 HIS CD2 C -11.605 3.881 0.481 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CD2 . . . . . . . . . c30496_6e5h 1 . 1 . 413 . 1 1 26 HIS CE1 C -12.209 5.538 1.774 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CE1 . . . . . . . . . c30496_6e5h 1 . 1 . 414 . 1 1 26 HIS CG C -10.514 4.268 1.180 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CG . . . . . . . . . c30496_6e5h 1 . 1 . 415 . 1 1 26 HIS H H -6.990 2.005 1.288 . . . 1.0 . . . . . . . . . . . . A . 26 HIS H . . . . . . . . . c30496_6e5h 1 . 1 . 416 . 1 1 26 HIS HA H -9.141 2.867 3.107 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HA . . . . . . . . . c30496_6e5h 1 . 1 . 417 . 1 1 26 HIS HB2 H -8.455 4.573 1.427 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HB2 . . . . . . . . . c30496_6e5h 1 . 1 . 418 . 1 1 26 HIS HB3 H -8.880 3.447 0.152 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HB3 . . . . . . . . . c30496_6e5h 1 . 1 . 419 . 1 1 26 HIS HD1 H -10.368 5.803 2.620 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HD1 . . . . . . . . . c30496_6e5h 1 . 1 . 420 . 1 1 26 HIS HD2 H -11.648 3.081 -0.242 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HD2 . . . . . . . . . c30496_6e5h 1 . 1 . 421 . 1 1 26 HIS HE1 H -12.801 6.296 2.263 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HE1 . . . . . . . . . c30496_6e5h 1 . 1 . 422 . 1 1 26 HIS HE2 H -13.587 4.537 0.643 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HE2 . . . . . . . . . c30496_6e5h 1 . 1 . 423 . 1 1 26 HIS N N -7.432 2.263 2.128 . . . 1.0 . . . . . . . . . . . . A . 26 HIS N . . . . . . . . . c30496_6e5h 1 . 1 . 424 . 1 1 26 HIS ND1 N -10.928 5.309 1.981 . . . 1.0 . . . . . . . . . . . . A . 26 HIS ND1 . . . . . . . . . c30496_6e5h 1 . 1 . 425 . 1 1 26 HIS NE2 N -12.643 4.685 0.867 . . . 1.0 . . . . . . . . . . . . A . 26 HIS NE2 . . . . . . . . . c30496_6e5h 1 . 1 . 426 . 1 1 26 HIS O O -9.782 1.064 0.496 . . . 1.0 . . . . . . . . . . . . A . 26 HIS O . . . . . . . . . c30496_6e5h 1 . 1 . 427 . 1 1 27 CYS C C -12.494 -0.120 2.317 . . . 1.0 . . . . . . . . . . . . A . 27 CYS C . . . . . . . . . c30496_6e5h 1 . 1 . 428 . 1 1 27 CYS CA C -11.024 -0.509 2.396 . . . 1.0 . . . . . . . . . . . . A . 27 CYS CA . . . . . . . . . c30496_6e5h 1 . 1 . 429 . 1 1 27 CYS CB C -10.817 -1.556 3.487 . . . 1.0 . . . . . . . . . . . . A . 27 CYS CB . . . . . . . . . c30496_6e5h 1 . 1 . 430 . 1 1 27 CYS H H -10.050 0.930 3.590 . . . 1.0 . . . . . . . . . . . . A . 27 CYS H . . . . . . . . . c30496_6e5h 1 . 1 . 431 . 1 1 27 CYS HA H -10.720 -0.923 1.447 . . . 1.0 . . . . . . . . . . . . A . 27 CYS HA . . . . . . . . . c30496_6e5h 1 . 1 . 432 . 1 1 27 CYS HB2 H -11.101 -1.131 4.439 . . . 1.0 . . . . . . . . . . . . A . 27 CYS HB2 . . . . . . . . . c30496_6e5h 1 . 1 . 433 . 1 1 27 CYS HB3 H -11.445 -2.406 3.279 . . . 1.0 . . . . . . . . . . . . A . 27 CYS HB3 . . . . . . . . . c30496_6e5h 1 . 1 . 434 . 1 1 27 CYS N N -10.203 0.658 2.660 . . . 1.0 . . . . . . . . . . . . A . 27 CYS N . . . . . . . . . c30496_6e5h 1 . 1 . 435 . 1 1 27 CYS O O -13.220 -0.165 3.308 . . . 1.0 . . . . . . . . . . . . A . 27 CYS O . . . . . . . . . c30496_6e5h 1 . 1 . 436 . 1 1 27 CYS SG S -9.099 -2.149 3.634 . . . 1.0 . . . . . . . . . . . . A . 27 CYS SG . . . . . . . . . c30496_6e5h 1 . 1 . 437 . 1 1 28 NH2 HN1 H -12.286 0.292 0.390 . . . 1.0 . . . . . . . . . . . . A . 28 NH2 HN1 . . . . . . . . . c30496_6e5h 1 . 1 . 438 . 1 1 28 NH2 HN2 H -13.861 0.557 1.052 . . . 1.0 . . . . . . . . . . . . A . 28 NH2 HN2 . . . . . . . . . c30496_6e5h 1 . 1 . 439 . 1 1 28 NH2 N N -12.924 0.284 1.135 . . . 1.0 . . . . . . . . . . . . A . 28 NH2 N . . . . . . . . . c30496_6e5h 1 . 2 . 440 . 1 1 1 ASN C C 7.819 -0.182 -2.630 . . . 1.0 . . . . . . . . . . . . A . 1 ASN C . . . . . . . . . c30496_6e5h 1 . 2 . 441 . 1 1 1 ASN CA C 8.658 1.088 -2.515 . . . 1.0 . . . . . . . . . . . . A . 1 ASN CA . . . . . . . . . c30496_6e5h 1 . 2 . 442 . 1 1 1 ASN CB C 8.233 2.085 -3.598 . . . 1.0 . . . . . . . . . . . . A . 1 ASN CB . . . . . . . . . c30496_6e5h 1 . 2 . 443 . 1 1 1 ASN CG C 8.945 3.419 -3.485 . . . 1.0 . . . . . . . . . . . . A . 1 ASN CG . . . . . . . . . c30496_6e5h 1 . 2 . 444 . 1 1 1 ASN H1 H 10.403 0.158 -1.851 . . . 1.0 . . . . . . . . . . . . A . 1 ASN H1 . . . . . . . . . c30496_6e5h 1 . 2 . 445 . 1 1 1 ASN H2 H 10.664 1.657 -2.586 . . . 1.0 . . . . . . . . . . . . A . 1 ASN H2 . . . . . . . . . c30496_6e5h 1 . 2 . 446 . 1 1 1 ASN H3 H 10.303 0.304 -3.534 . . . 1.0 . . . . . . . . . . . . A . 1 ASN H3 . . . . . . . . . c30496_6e5h 1 . 2 . 447 . 1 1 1 ASN HA H 8.485 1.526 -1.544 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HA . . . . . . . . . c30496_6e5h 1 . 2 . 448 . 1 1 1 ASN HB2 H 8.450 1.667 -4.568 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HB2 . . . . . . . . . c30496_6e5h 1 . 2 . 449 . 1 1 1 ASN HB3 H 7.170 2.260 -3.518 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HB3 . . . . . . . . . c30496_6e5h 1 . 2 . 450 . 1 1 1 ASN HD21 H 7.419 4.340 -4.364 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HD21 . . . . . . . . . c30496_6e5h 1 . 2 . 451 . 1 1 1 ASN HD22 H 8.753 5.345 -3.917 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HD22 . . . . . . . . . c30496_6e5h 1 . 2 . 452 . 1 1 1 ASN N N 10.106 0.779 -2.629 . . . 1.0 . . . . . . . . . . . . A . 1 ASN N . . . . . . . . . c30496_6e5h 1 . 2 . 453 . 1 1 1 ASN ND2 N 8.307 4.474 -3.966 . . . 1.0 . . . . . . . . . . . . A . 1 ASN ND2 . . . . . . . . . c30496_6e5h 1 . 2 . 454 . 1 1 1 ASN O O 6.594 -0.117 -2.741 . . . 1.0 . . . . . . . . . . . . A . 1 ASN O . . . . . . . . . c30496_6e5h 1 . 2 . 455 . 1 1 1 ASN OD1 O 10.067 3.502 -2.981 . . . 1.0 . . . . . . . . . . . . A . 1 ASN OD1 . . . . . . . . . c30496_6e5h 1 . 2 . 456 . 1 1 2 ASP C C 6.787 -2.877 -1.617 . . . 1.0 . . . . . . . . . . . . A . 2 ASP C . . . . . . . . . c30496_6e5h 1 . 2 . 457 . 1 1 2 ASP CA C 7.816 -2.636 -2.725 . . . 1.0 . . . . . . . . . . . . A . 2 ASP CA . . . . . . . . . c30496_6e5h 1 . 2 . 458 . 1 1 2 ASP CB C 8.858 -3.760 -2.736 . . . 1.0 . . . . . . . . . . . . A . 2 ASP CB . . . . . . . . . c30496_6e5h 1 . 2 . 459 . 1 1 2 ASP CG C 8.254 -5.134 -2.955 . . . 1.0 . . . . . . . . . . . . A . 2 ASP CG . . . . . . . . . c30496_6e5h 1 . 2 . 460 . 1 1 2 ASP H H 9.455 -1.316 -2.429 . . . 1.0 . . . . . . . . . . . . A . 2 ASP H . . . . . . . . . c30496_6e5h 1 . 2 . 461 . 1 1 2 ASP HA H 7.302 -2.632 -3.675 . . . 1.0 . . . . . . . . . . . . A . 2 ASP HA . . . . . . . . . c30496_6e5h 1 . 2 . 462 . 1 1 2 ASP HB2 H 9.569 -3.576 -3.527 . . . 1.0 . . . . . . . . . . . . A . 2 ASP HB2 . . . . . . . . . c30496_6e5h 1 . 2 . 463 . 1 1 2 ASP HB3 H 9.377 -3.765 -1.790 . . . 1.0 . . . . . . . . . . . . A . 2 ASP HB3 . . . . . . . . . c30496_6e5h 1 . 2 . 464 . 1 1 2 ASP N N 8.483 -1.335 -2.576 . . . 1.0 . . . . . . . . . . . . A . 2 ASP N . . . . . . . . . c30496_6e5h 1 . 2 . 465 . 1 1 2 ASP O O 5.865 -3.689 -1.772 . . . 1.0 . . . . . . . . . . . . A . 2 ASP O . . . . . . . . . c30496_6e5h 1 . 2 . 466 . 1 1 2 ASP OD1 O 8.451 -6.016 -2.093 . . . 1.0 . . . . . . . . . . . . A . 2 ASP OD1 . . . . . . . . . c30496_6e5h 1 . 2 . 467 . 1 1 2 ASP OD2 O 7.597 -5.345 -3.996 . . . 1.0 . . . . . . . . . . . . A . 2 ASP OD2 . . . . . . . . . c30496_6e5h 1 . 2 . 468 . 1 1 3 LYS C C 4.571 -1.868 0.141 . . . 1.0 . . . . . . . . . . . . A . 3 LYS C . . . . . . . . . c30496_6e5h 1 . 2 . 469 . 1 1 3 LYS CA C 5.972 -2.247 0.592 . . . 1.0 . . . . . . . . . . . . A . 3 LYS CA . . . . . . . . . c30496_6e5h 1 . 2 . 470 . 1 1 3 LYS CB C 6.391 -1.367 1.772 . . . 1.0 . . . . . . . . . . . . A . 3 LYS CB . . . . . . . . . c30496_6e5h 1 . 2 . 471 . 1 1 3 LYS CD C 7.339 -3.264 3.110 . . . 1.0 . . . . . . . . . . . . A . 3 LYS CD . . . . . . . . . c30496_6e5h 1 . 2 . 472 . 1 1 3 LYS CE C 8.563 -3.832 3.803 . . . 1.0 . . . . . . . . . . . . A . 3 LYS CE . . . . . . . . . c30496_6e5h 1 . 2 . 473 . 1 1 3 LYS CG C 7.603 -1.885 2.532 . . . 1.0 . . . . . . . . . . . . A . 3 LYS CG . . . . . . . . . c30496_6e5h 1 . 2 . 474 . 1 1 3 LYS H H 7.672 -1.520 -0.441 . . . 1.0 . . . . . . . . . . . . A . 3 LYS H . . . . . . . . . c30496_6e5h 1 . 2 . 475 . 1 1 3 LYS HA H 5.959 -3.276 0.912 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HA . . . . . . . . . c30496_6e5h 1 . 2 . 476 . 1 1 3 LYS HB2 H 6.618 -0.381 1.403 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HB2 . . . . . . . . . c30496_6e5h 1 . 2 . 477 . 1 1 3 LYS HB3 H 5.564 -1.299 2.463 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HB3 . . . . . . . . . c30496_6e5h 1 . 2 . 478 . 1 1 3 LYS HD2 H 6.534 -3.194 3.826 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HD2 . . . . . . . . . c30496_6e5h 1 . 2 . 479 . 1 1 3 LYS HD3 H 7.053 -3.930 2.310 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HD3 . . . . . . . . . c30496_6e5h 1 . 2 . 480 . 1 1 3 LYS HE2 H 9.420 -3.705 3.158 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HE2 . . . . . . . . . c30496_6e5h 1 . 2 . 481 . 1 1 3 LYS HE3 H 8.723 -3.293 4.725 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HE3 . . . . . . . . . c30496_6e5h 1 . 2 . 482 . 1 1 3 LYS HG2 H 8.446 -1.942 1.862 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HG2 . . . . . . . . . c30496_6e5h 1 . 2 . 483 . 1 1 3 LYS HG3 H 7.828 -1.205 3.339 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HG3 . . . . . . . . . c30496_6e5h 1 . 2 . 484 . 1 1 3 LYS HZ1 H 7.635 -5.414 4.803 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HZ1 . . . . . . . . . c30496_6e5h 1 . 2 . 485 . 1 1 3 LYS HZ2 H 9.274 -5.672 4.485 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HZ2 . . . . . . . . . c30496_6e5h 1 . 2 . 486 . 1 1 3 LYS HZ3 H 8.140 -5.794 3.232 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HZ3 . . . . . . . . . c30496_6e5h 1 . 2 . 487 . 1 1 3 LYS N N 6.921 -2.144 -0.512 . . . 1.0 . . . . . . . . . . . . A . 3 LYS N . . . . . . . . . c30496_6e5h 1 . 2 . 488 . 1 1 3 LYS NZ N 8.393 -5.277 4.106 . . . 1.0 . . . . . . . . . . . . A . 3 LYS NZ . . . . . . . . . c30496_6e5h 1 . 2 . 489 . 1 1 3 LYS O O 3.593 -2.247 0.768 . . . 1.0 . . . . . . . . . . . . A . 3 LYS O . . . . . . . . . c30496_6e5h 1 . 2 . 490 . 1 1 4 CYS C C 2.449 -2.027 -1.973 . . . 1.0 . . . . . . . . . . . . A . 4 CYS C . . . . . . . . . c30496_6e5h 1 . 2 . 491 . 1 1 4 CYS CA C 3.191 -0.769 -1.523 . . . 1.0 . . . . . . . . . . . . A . 4 CYS CA . . . . . . . . . c30496_6e5h 1 . 2 . 492 . 1 1 4 CYS CB C 3.388 0.192 -2.701 . . . 1.0 . . . . . . . . . . . . A . 4 CYS CB . . . . . . . . . c30496_6e5h 1 . 2 . 493 . 1 1 4 CYS H H 5.302 -0.823 -1.395 . . . 1.0 . . . . . . . . . . . . A . 4 CYS H . . . . . . . . . c30496_6e5h 1 . 2 . 494 . 1 1 4 CYS HA H 2.614 -0.279 -0.755 . . . 1.0 . . . . . . . . . . . . A . 4 CYS HA . . . . . . . . . c30496_6e5h 1 . 2 . 495 . 1 1 4 CYS HB2 H 3.958 1.044 -2.366 . . . 1.0 . . . . . . . . . . . . A . 4 CYS HB2 . . . . . . . . . c30496_6e5h 1 . 2 . 496 . 1 1 4 CYS HB3 H 3.942 -0.317 -3.477 . . . 1.0 . . . . . . . . . . . . A . 4 CYS HB3 . . . . . . . . . c30496_6e5h 1 . 2 . 497 . 1 1 4 CYS N N 4.480 -1.130 -0.954 . . . 1.0 . . . . . . . . . . . . A . 4 CYS N . . . . . . . . . c30496_6e5h 1 . 2 . 498 . 1 1 4 CYS O O 1.252 -2.184 -1.721 . . . 1.0 . . . . . . . . . . . . A . 4 CYS O . . . . . . . . . c30496_6e5h 1 . 2 . 499 . 1 1 4 CYS SG S 1.844 0.819 -3.441 . . . 1.0 . . . . . . . . . . . . A . 4 CYS SG . . . . . . . . . c30496_6e5h 1 . 2 . 500 . 1 1 5 LYS C C 2.401 -5.173 -1.960 . . . 1.0 . . . . . . . . . . . . A . 5 LYS C . . . . . . . . . c30496_6e5h 1 . 2 . 501 . 1 1 5 LYS CA C 2.584 -4.175 -3.091 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CA . . . . . . . . . c30496_6e5h 1 . 2 . 502 . 1 1 5 LYS CB C 3.428 -4.798 -4.207 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CB . . . . . . . . . c30496_6e5h 1 . 2 . 503 . 1 1 5 LYS CD C 4.048 -4.767 -6.652 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CD . . . . . . . . . c30496_6e5h 1 . 2 . 504 . 1 1 5 LYS CE C 5.475 -5.189 -6.346 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CE . . . . . . . . . c30496_6e5h 1 . 2 . 505 . 1 1 5 LYS CG C 3.420 -3.997 -5.500 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CG . . . . . . . . . c30496_6e5h 1 . 2 . 506 . 1 1 5 LYS H H 4.140 -2.791 -2.717 . . . 1.0 . . . . . . . . . . . . A . 5 LYS H . . . . . . . . . c30496_6e5h 1 . 2 . 507 . 1 1 5 LYS HA H 1.612 -3.928 -3.487 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HA . . . . . . . . . c30496_6e5h 1 . 2 . 508 . 1 1 5 LYS HB2 H 4.449 -4.878 -3.865 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HB2 . . . . . . . . . c30496_6e5h 1 . 2 . 509 . 1 1 5 LYS HB3 H 3.051 -5.787 -4.419 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HB3 . . . . . . . . . c30496_6e5h 1 . 2 . 510 . 1 1 5 LYS HD2 H 3.458 -5.651 -6.842 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HD2 . . . . . . . . . c30496_6e5h 1 . 2 . 511 . 1 1 5 LYS HD3 H 4.050 -4.139 -7.531 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HD3 . . . . . . . . . c30496_6e5h 1 . 2 . 512 . 1 1 5 LYS HE2 H 5.474 -5.781 -5.443 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HE2 . . . . . . . . . c30496_6e5h 1 . 2 . 513 . 1 1 5 LYS HE3 H 5.841 -5.789 -7.166 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HE3 . . . . . . . . . c30496_6e5h 1 . 2 . 514 . 1 1 5 LYS HG2 H 2.400 -3.759 -5.758 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HG2 . . . . . . . . . c30496_6e5h 1 . 2 . 515 . 1 1 5 LYS HG3 H 3.973 -3.085 -5.348 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HG3 . . . . . . . . . c30496_6e5h 1 . 2 . 516 . 1 1 5 LYS HZ1 H 6.555 -3.552 -7.066 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HZ1 . . . . . . . . . c30496_6e5h 1 . 2 . 517 . 1 1 5 LYS HZ2 H 7.293 -4.347 -5.766 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HZ2 . . . . . . . . . c30496_6e5h 1 . 2 . 518 . 1 1 5 LYS HZ3 H 5.960 -3.343 -5.498 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HZ3 . . . . . . . . . c30496_6e5h 1 . 2 . 519 . 1 1 5 LYS N N 3.179 -2.942 -2.600 . . . 1.0 . . . . . . . . . . . . A . 5 LYS N . . . . . . . . . c30496_6e5h 1 . 2 . 520 . 1 1 5 LYS NZ N 6.383 -4.026 -6.156 . . . 1.0 . . . . . . . . . . . . A . 5 LYS NZ . . . . . . . . . c30496_6e5h 1 . 2 . 521 . 1 1 5 LYS O O 1.425 -5.921 -1.945 . . . 1.0 . . . . . . . . . . . . A . 5 LYS O . . . . . . . . . c30496_6e5h 1 . 2 . 522 . 1 1 6 GLU C C 2.027 -5.677 1.006 . . . 1.0 . . . . . . . . . . . . A . 6 GLU C . . . . . . . . . c30496_6e5h 1 . 2 . 523 . 1 1 6 GLU CA C 3.217 -6.074 0.136 . . . 1.0 . . . . . . . . . . . . A . 6 GLU CA . . . . . . . . . c30496_6e5h 1 . 2 . 524 . 1 1 6 GLU CB C 4.503 -6.080 0.967 . . . 1.0 . . . . . . . . . . . . A . 6 GLU CB . . . . . . . . . c30496_6e5h 1 . 2 . 525 . 1 1 6 GLU CD C 6.900 -6.870 1.094 . . . 1.0 . . . . . . . . . . . . A . 6 GLU CD . . . . . . . . . c30496_6e5h 1 . 2 . 526 . 1 1 6 GLU CG C 5.725 -6.552 0.195 . . . 1.0 . . . . . . . . . . . . A . 6 GLU CG . . . . . . . . . c30496_6e5h 1 . 2 . 527 . 1 1 6 GLU H H 4.106 -4.579 -1.089 . . . 1.0 . . . . . . . . . . . . A . 6 GLU H . . . . . . . . . c30496_6e5h 1 . 2 . 528 . 1 1 6 GLU HA H 3.040 -7.070 -0.245 . . . 1.0 . . . . . . . . . . . . A . 6 GLU HA . . . . . . . . . c30496_6e5h 1 . 2 . 529 . 1 1 6 GLU HB2 H 4.691 -5.078 1.324 . . . 1.0 . . . . . . . . . . . . A . 6 GLU HB2 . . . . . . . . . c30496_6e5h 1 . 2 . 530 . 1 1 6 GLU HB3 H 4.365 -6.734 1.816 . . . 1.0 . . . . . . . . . . . . A . 6 GLU HB3 . . . . . . . . . c30496_6e5h 1 . 2 . 531 . 1 1 6 GLU HG2 H 5.466 -7.443 -0.356 . . . 1.0 . . . . . . . . . . . . A . 6 GLU HG2 . . . . . . . . . c30496_6e5h 1 . 2 . 532 . 1 1 6 GLU HG3 H 6.023 -5.778 -0.498 . . . 1.0 . . . . . . . . . . . . A . 6 GLU HG3 . . . . . . . . . c30496_6e5h 1 . 2 . 533 . 1 1 6 GLU N N 3.329 -5.178 -1.011 . . . 1.0 . . . . . . . . . . . . A . 6 GLU N . . . . . . . . . c30496_6e5h 1 . 2 . 534 . 1 1 6 GLU O O 1.281 -6.535 1.487 . . . 1.0 . . . . . . . . . . . . A . 6 GLU O . . . . . . . . . c30496_6e5h 1 . 2 . 535 . 1 1 6 GLU OE1 O 7.237 -8.063 1.234 . . . 1.0 . . . . . . . . . . . . A . 6 GLU OE1 . . . . . . . . . c30496_6e5h 1 . 2 . 536 . 1 1 6 GLU OE2 O 7.502 -5.937 1.656 . . . 1.0 . . . . . . . . . . . . A . 6 GLU OE2 . . . . . . . . . c30496_6e5h 1 . 2 . 537 . 1 1 7 LEU C C -0.583 -4.125 1.158 . . . 1.0 . . . . . . . . . . . . A . 7 LEU C . . . . . . . . . c30496_6e5h 1 . 2 . 538 . 1 1 7 LEU CA C 0.696 -3.871 1.933 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CA . . . . . . . . . c30496_6e5h 1 . 2 . 539 . 1 1 7 LEU CB C 0.843 -2.379 2.232 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CB . . . . . . . . . c30496_6e5h 1 . 2 . 540 . 1 1 7 LEU CD1 C 2.046 -0.507 3.395 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CD1 . . . . . . . . . c30496_6e5h 1 . 2 . 541 . 1 1 7 LEU CD2 C 1.651 -2.661 4.601 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CD2 . . . . . . . . . c30496_6e5h 1 . 2 . 542 . 1 1 7 LEU CG C 1.933 -2.018 3.247 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CG . . . . . . . . . c30496_6e5h 1 . 2 . 543 . 1 1 7 LEU H H 2.490 -3.735 0.819 . . . 1.0 . . . . . . . . . . . . A . 7 LEU H . . . . . . . . . c30496_6e5h 1 . 2 . 544 . 1 1 7 LEU HA H 0.647 -4.412 2.862 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HA . . . . . . . . . c30496_6e5h 1 . 2 . 545 . 1 1 7 LEU HB2 H 1.061 -1.871 1.304 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HB2 . . . . . . . . . c30496_6e5h 1 . 2 . 546 . 1 1 7 LEU HB3 H -0.102 -2.017 2.603 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HB3 . . . . . . . . . c30496_6e5h 1 . 2 . 547 . 1 1 7 LEU HD11 H 2.808 -0.272 4.122 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD11 . . . . . . . . . c30496_6e5h 1 . 2 . 548 . 1 1 7 LEU HD12 H 1.099 -0.105 3.723 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD12 . . . . . . . . . c30496_6e5h 1 . 2 . 549 . 1 1 7 LEU HD13 H 2.312 -0.069 2.442 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD13 . . . . . . . . . c30496_6e5h 1 . 2 . 550 . 1 1 7 LEU HD21 H 1.724 -3.735 4.514 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD21 . . . . . . . . . c30496_6e5h 1 . 2 . 551 . 1 1 7 LEU HD22 H 0.657 -2.393 4.926 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD22 . . . . . . . . . c30496_6e5h 1 . 2 . 552 . 1 1 7 LEU HD23 H 2.372 -2.309 5.324 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD23 . . . . . . . . . c30496_6e5h 1 . 2 . 553 . 1 1 7 LEU HG H 2.883 -2.390 2.890 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HG . . . . . . . . . c30496_6e5h 1 . 2 . 554 . 1 1 7 LEU N N 1.840 -4.374 1.190 . . . 1.0 . . . . . . . . . . . . A . 7 LEU N . . . . . . . . . c30496_6e5h 1 . 2 . 555 . 1 1 7 LEU O O -1.612 -4.446 1.742 . . . 1.0 . . . . . . . . . . . . A . 7 LEU O . . . . . . . . . c30496_6e5h 1 . 2 . 556 . 1 1 8 LYS C C -2.043 -5.763 -0.823 . . . 1.0 . . . . . . . . . . . . A . 8 LYS C . . . . . . . . . c30496_6e5h 1 . 2 . 557 . 1 1 8 LYS CA C -1.649 -4.300 -1.013 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CA . . . . . . . . . c30496_6e5h 1 . 2 . 558 . 1 1 8 LYS CB C -1.303 -4.019 -2.480 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CB . . . . . . . . . c30496_6e5h 1 . 2 . 559 . 1 1 8 LYS CD C -3.413 -4.954 -3.527 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CD . . . . . . . . . c30496_6e5h 1 . 2 . 560 . 1 1 8 LYS CE C -4.609 -4.652 -4.415 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CE . . . . . . . . . c30496_6e5h 1 . 2 . 561 . 1 1 8 LYS CG C -2.507 -3.743 -3.376 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CG . . . . . . . . . c30496_6e5h 1 . 2 . 562 . 1 1 8 LYS H H 0.316 -3.646 -0.567 . . . 1.0 . . . . . . . . . . . . A . 8 LYS H . . . . . . . . . c30496_6e5h 1 . 2 . 563 . 1 1 8 LYS HA H -2.474 -3.673 -0.715 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HA . . . . . . . . . c30496_6e5h 1 . 2 . 564 . 1 1 8 LYS HB2 H -0.651 -3.160 -2.523 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HB2 . . . . . . . . . c30496_6e5h 1 . 2 . 565 . 1 1 8 LYS HB3 H -0.777 -4.873 -2.880 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HB3 . . . . . . . . . c30496_6e5h 1 . 2 . 566 . 1 1 8 LYS HD2 H -2.849 -5.764 -3.964 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HD2 . . . . . . . . . c30496_6e5h 1 . 2 . 567 . 1 1 8 LYS HD3 H -3.768 -5.248 -2.550 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HD3 . . . . . . . . . c30496_6e5h 1 . 2 . 568 . 1 1 8 LYS HE2 H -4.256 -4.432 -5.410 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HE2 . . . . . . . . . c30496_6e5h 1 . 2 . 569 . 1 1 8 LYS HE3 H -5.247 -5.521 -4.444 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HE3 . . . . . . . . . c30496_6e5h 1 . 2 . 570 . 1 1 8 LYS HG2 H -3.077 -2.936 -2.945 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HG2 . . . . . . . . . c30496_6e5h 1 . 2 . 571 . 1 1 8 LYS HG3 H -2.151 -3.449 -4.352 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HG3 . . . . . . . . . c30496_6e5h 1 . 2 . 572 . 1 1 8 LYS HZ1 H -5.741 -3.679 -2.949 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ1 . . . . . . . . . c30496_6e5h 1 . 2 . 573 . 1 1 8 LYS HZ2 H -6.218 -3.315 -4.533 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ2 . . . . . . . . . c30496_6e5h 1 . 2 . 574 . 1 1 8 LYS HZ3 H -4.803 -2.641 -3.898 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ3 . . . . . . . . . c30496_6e5h 1 . 2 . 575 . 1 1 8 LYS N N -0.513 -3.986 -0.160 . . . 1.0 . . . . . . . . . . . . A . 8 LYS N . . . . . . . . . c30496_6e5h 1 . 2 . 576 . 1 1 8 LYS NZ N -5.394 -3.492 -3.913 . . . 1.0 . . . . . . . . . . . . A . 8 LYS NZ . . . . . . . . . c30496_6e5h 1 . 2 . 577 . 1 1 8 LYS O O -3.216 -6.081 -0.653 . . . 1.0 . . . . . . . . . . . . A . 8 LYS O . . . . . . . . . c30496_6e5h 1 . 2 . 578 . 1 1 9 LYS C C -1.857 -8.363 0.728 . . . 1.0 . . . . . . . . . . . . A . 9 LYS C . . . . . . . . . c30496_6e5h 1 . 2 . 579 . 1 1 9 LYS CA C -1.262 -8.070 -0.648 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CA . . . . . . . . . c30496_6e5h 1 . 2 . 580 . 1 1 9 LYS CB C 0.064 -8.818 -0.828 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CB . . . . . . . . . c30496_6e5h 1 . 2 . 581 . 1 1 9 LYS CD C -0.950 -10.994 -1.604 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CD . . . . . . . . . c30496_6e5h 1 . 2 . 582 . 1 1 9 LYS CE C -0.919 -12.507 -1.453 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CE . . . . . . . . . c30496_6e5h 1 . 2 . 583 . 1 1 9 LYS CG C -0.029 -10.319 -0.603 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CG . . . . . . . . . c30496_6e5h 1 . 2 . 584 . 1 1 9 LYS H H -0.129 -6.311 -0.949 . . . 1.0 . . . . . . . . . . . . A . 9 LYS H . . . . . . . . . c30496_6e5h 1 . 2 . 585 . 1 1 9 LYS HA H -1.957 -8.398 -1.404 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HA . . . . . . . . . c30496_6e5h 1 . 2 . 586 . 1 1 9 LYS HB2 H 0.421 -8.652 -1.833 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HB2 . . . . . . . . . c30496_6e5h 1 . 2 . 587 . 1 1 9 LYS HB3 H 0.785 -8.416 -0.131 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HB3 . . . . . . . . . c30496_6e5h 1 . 2 . 588 . 1 1 9 LYS HD2 H -1.960 -10.647 -1.440 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HD2 . . . . . . . . . c30496_6e5h 1 . 2 . 589 . 1 1 9 LYS HD3 H -0.635 -10.732 -2.604 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HD3 . . . . . . . . . c30496_6e5h 1 . 2 . 590 . 1 1 9 LYS HE2 H -1.542 -12.944 -2.218 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HE2 . . . . . . . . . c30496_6e5h 1 . 2 . 591 . 1 1 9 LYS HE3 H 0.098 -12.846 -1.586 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HE3 . . . . . . . . . c30496_6e5h 1 . 2 . 592 . 1 1 9 LYS HG2 H 0.958 -10.746 -0.698 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HG2 . . . . . . . . . c30496_6e5h 1 . 2 . 593 . 1 1 9 LYS HG3 H -0.404 -10.498 0.393 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HG3 . . . . . . . . . c30496_6e5h 1 . 2 . 594 . 1 1 9 LYS HZ1 H -1.338 -13.988 -0.045 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HZ1 . . . . . . . . . c30496_6e5h 1 . 2 . 595 . 1 1 9 LYS HZ2 H -2.399 -12.678 0.009 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HZ2 . . . . . . . . . c30496_6e5h 1 . 2 . 596 . 1 1 9 LYS HZ3 H -0.837 -12.524 0.636 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HZ3 . . . . . . . . . c30496_6e5h 1 . 2 . 597 . 1 1 9 LYS N N -1.046 -6.639 -0.825 . . . 1.0 . . . . . . . . . . . . A . 9 LYS N . . . . . . . . . c30496_6e5h 1 . 2 . 598 . 1 1 9 LYS NZ N -1.407 -12.953 -0.121 . . . 1.0 . . . . . . . . . . . . A . 9 LYS NZ . . . . . . . . . c30496_6e5h 1 . 2 . 599 . 1 1 9 LYS O O -2.722 -9.231 0.872 . . . 1.0 . . . . . . . . . . . . A . 9 LYS O . . . . . . . . . c30496_6e5h 1 . 2 . 600 . 1 1 10 ARG C C -3.338 -7.330 3.185 . . . 1.0 . . . . . . . . . . . . A . 10 ARG C . . . . . . . . . c30496_6e5h 1 . 2 . 601 . 1 1 10 ARG CA C -1.887 -7.791 3.091 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CA . . . . . . . . . c30496_6e5h 1 . 2 . 602 . 1 1 10 ARG CB C -1.024 -6.990 4.066 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CB . . . . . . . . . c30496_6e5h 1 . 2 . 603 . 1 1 10 ARG CD C -0.513 -6.390 6.450 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CD . . . . . . . . . c30496_6e5h 1 . 2 . 604 . 1 1 10 ARG CG C -1.407 -7.191 5.520 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CG . . . . . . . . . c30496_6e5h 1 . 2 . 605 . 1 1 10 ARG CZ C 1.778 -6.706 7.318 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CZ . . . . . . . . . c30496_6e5h 1 . 2 . 606 . 1 1 10 ARG H H -0.666 -6.989 1.556 . . . 1.0 . . . . . . . . . . . . A . 10 ARG H . . . . . . . . . c30496_6e5h 1 . 2 . 607 . 1 1 10 ARG HA H -1.834 -8.838 3.350 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HA . . . . . . . . . c30496_6e5h 1 . 2 . 608 . 1 1 10 ARG HB2 H 0.007 -7.281 3.942 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HB2 . . . . . . . . . c30496_6e5h 1 . 2 . 609 . 1 1 10 ARG HB3 H -1.125 -5.941 3.834 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HB3 . . . . . . . . . c30496_6e5h 1 . 2 . 610 . 1 1 10 ARG HD2 H -0.628 -5.340 6.222 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HD2 . . . . . . . . . c30496_6e5h 1 . 2 . 611 . 1 1 10 ARG HD3 H -0.825 -6.570 7.469 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HD3 . . . . . . . . . c30496_6e5h 1 . 2 . 612 . 1 1 10 ARG HE H 1.210 -7.047 5.426 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HE . . . . . . . . . c30496_6e5h 1 . 2 . 613 . 1 1 10 ARG HG2 H -2.430 -6.869 5.658 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HG2 . . . . . . . . . c30496_6e5h 1 . 2 . 614 . 1 1 10 ARG HG3 H -1.320 -8.241 5.764 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HG3 . . . . . . . . . c30496_6e5h 1 . 2 . 615 . 1 1 10 ARG HH11 H 2.052 -6.296 9.281 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HH11 . . . . . . . . . c30496_6e5h 1 . 2 . 616 . 1 1 10 ARG HH12 H 0.432 -6.090 8.700 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HH12 . . . . . . . . . c30496_6e5h 1 . 2 . 617 . 1 1 10 ARG HH21 H 3.351 -7.320 6.199 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HH21 . . . . . . . . . c30496_6e5h 1 . 2 . 618 . 1 1 10 ARG HH22 H 3.706 -6.999 7.866 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HH22 . . . . . . . . . c30496_6e5h 1 . 2 . 619 . 1 1 10 ARG N N -1.383 -7.639 1.733 . . . 1.0 . . . . . . . . . . . . A . 10 ARG N . . . . . . . . . c30496_6e5h 1 . 2 . 620 . 1 1 10 ARG NE N 0.900 -6.755 6.316 . . . 1.0 . . . . . . . . . . . . A . 10 ARG NE . . . . . . . . . c30496_6e5h 1 . 2 . 621 . 1 1 10 ARG NH1 N 1.390 -6.333 8.529 . . . 1.0 . . . . . . . . . . . . A . 10 ARG NH1 . . . . . . . . . c30496_6e5h 1 . 2 . 622 . 1 1 10 ARG NH2 N 3.045 -7.034 7.109 . . . 1.0 . . . . . . . . . . . . A . 10 ARG NH2 . . . . . . . . . c30496_6e5h 1 . 2 . 623 . 1 1 10 ARG O O -4.170 -7.973 3.824 . . . 1.0 . . . . . . . . . . . . A . 10 ARG O . . . . . . . . . c30496_6e5h 1 . 2 . 624 . 1 1 11 TYR C C -5.767 -6.053 1.321 . . . 1.0 . . . . . . . . . . . . A . 11 TYR C . . . . . . . . . c30496_6e5h 1 . 2 . 625 . 1 1 11 TYR CA C -4.965 -5.635 2.550 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CA . . . . . . . . . c30496_6e5h 1 . 2 . 626 . 1 1 11 TYR CB C -4.869 -4.112 2.608 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CB . . . . . . . . . c30496_6e5h 1 . 2 . 627 . 1 1 11 TYR CD1 C -5.178 -3.481 5.036 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CD1 . . . . . . . . . c30496_6e5h 1 . 2 . 628 . 1 1 11 TYR CD2 C -3.029 -3.198 4.054 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CD2 . . . . . . . . . c30496_6e5h 1 . 2 . 629 . 1 1 11 TYR CE1 C -4.696 -3.006 6.238 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CE1 . . . . . . . . . c30496_6e5h 1 . 2 . 630 . 1 1 11 TYR CE2 C -2.541 -2.722 5.251 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CE2 . . . . . . . . . c30496_6e5h 1 . 2 . 631 . 1 1 11 TYR CG C -4.352 -3.585 3.924 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CG . . . . . . . . . c30496_6e5h 1 . 2 . 632 . 1 1 11 TYR CZ C -3.424 -2.603 6.350 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CZ . . . . . . . . . c30496_6e5h 1 . 2 . 633 . 1 1 11 TYR H H -2.924 -5.761 2.023 . . . 1.0 . . . . . . . . . . . . A . 11 TYR H . . . . . . . . . c30496_6e5h 1 . 2 . 634 . 1 1 11 TYR HA H -5.470 -5.987 3.435 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HA . . . . . . . . . c30496_6e5h 1 . 2 . 635 . 1 1 11 TYR HB2 H -4.203 -3.771 1.831 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HB2 . . . . . . . . . c30496_6e5h 1 . 2 . 636 . 1 1 11 TYR HB3 H -5.849 -3.694 2.443 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HB3 . . . . . . . . . c30496_6e5h 1 . 2 . 637 . 1 1 11 TYR HD1 H -6.215 -3.777 4.952 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HD1 . . . . . . . . . c30496_6e5h 1 . 2 . 638 . 1 1 11 TYR HD2 H -2.375 -3.271 3.199 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HD2 . . . . . . . . . c30496_6e5h 1 . 2 . 639 . 1 1 11 TYR HE1 H -5.352 -2.933 7.091 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HE1 . . . . . . . . . c30496_6e5h 1 . 2 . 640 . 1 1 11 TYR HE2 H -1.509 -2.426 5.329 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HE2 . . . . . . . . . c30496_6e5h 1 . 2 . 641 . 1 1 11 TYR HH H -3.162 -2.758 8.246 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HH . . . . . . . . . c30496_6e5h 1 . 2 . 642 . 1 1 11 TYR N N -3.632 -6.215 2.532 . . . 1.0 . . . . . . . . . . . . A . 11 TYR N . . . . . . . . . c30496_6e5h 1 . 2 . 643 . 1 1 11 TYR O O -6.435 -5.225 0.699 . . . 1.0 . . . . . . . . . . . . A . 11 TYR O . . . . . . . . . c30496_6e5h 1 . 2 . 644 . 1 1 11 TYR OH O -2.889 -2.158 7.539 . . . 1.0 . . . . . . . . . . . . A . 11 TYR OH . . . . . . . . . c30496_6e5h 1 . 2 . 645 . 1 1 12 ABA C C -7.930 -7.515 -0.032 . . . 1.0 . . . . . . . . . . . . A . 12 AIB C . . . . . . . . . c30496_6e5h 1 . 2 . 646 . 1 1 12 ABA CA C -6.446 -7.904 -0.153 . . . 1.0 . . . . . . . . . . . . A . 12 AIB CA . . . . . . . . . c30496_6e5h 1 . 2 . 647 . 1 1 12 ABA H H -5.132 -7.934 1.521 . . . 1.0 . . . . . . . . . . . . A . 12 AIB H . . . . . . . . . c30496_6e5h 1 . 2 . 648 . 1 1 12 ABA N N -5.700 -7.342 0.985 . . . 1.0 . . . . . . . . . . . . A . 12 AIB N . . . . . . . . . c30496_6e5h 1 . 2 . 649 . 1 1 12 ABA O O -8.591 -7.847 0.958 . . . 1.0 . . . . . . . . . . . . A . 12 AIB O . . . . . . . . . c30496_6e5h 1 . 2 . 650 . 1 1 13 GLY C C -9.890 -4.837 -0.915 . . . 1.0 . . . . . . . . . . . . A . 13 GLY C . . . . . . . . . c30496_6e5h 1 . 2 . 651 . 1 1 13 GLY CA C -9.816 -6.345 -0.983 . . . 1.0 . . . . . . . . . . . . A . 13 GLY CA . . . . . . . . . c30496_6e5h 1 . 2 . 652 . 1 1 13 GLY H H -7.894 -6.601 -1.811 . . . 1.0 . . . . . . . . . . . . A . 13 GLY H . . . . . . . . . c30496_6e5h 1 . 2 . 653 . 1 1 13 GLY HA2 H -10.332 -6.684 -1.867 . . . 1.0 . . . . . . . . . . . . A . 13 GLY HA2 . . . . . . . . . c30496_6e5h 1 . 2 . 654 . 1 1 13 GLY HA3 H -10.296 -6.759 -0.112 . . . 1.0 . . . . . . . . . . . . A . 13 GLY HA3 . . . . . . . . . c30496_6e5h 1 . 2 . 655 . 1 1 13 GLY N N -8.447 -6.809 -1.030 . . . 1.0 . . . . . . . . . . . . A . 13 GLY N . . . . . . . . . c30496_6e5h 1 . 2 . 656 . 1 1 13 GLY O O -10.865 -4.230 -1.356 . . . 1.0 . . . . . . . . . . . . A . 13 GLY O . . . . . . . . . c30496_6e5h 1 . 2 . 657 . 1 1 14 CYS C C -7.699 -2.269 -1.211 . . . 1.0 . . . . . . . . . . . . A . 14 CYS C . . . . . . . . . c30496_6e5h 1 . 2 . 658 . 1 1 14 CYS CA C -8.771 -2.789 -0.268 . . . 1.0 . . . . . . . . . . . . A . 14 CYS CA . . . . . . . . . c30496_6e5h 1 . 2 . 659 . 1 1 14 CYS CB C -8.441 -2.370 1.162 . . . 1.0 . . . . . . . . . . . . A . 14 CYS CB . . . . . . . . . c30496_6e5h 1 . 2 . 660 . 1 1 14 CYS H H -8.111 -4.772 -0.016 . . . 1.0 . . . . . . . . . . . . A . 14 CYS H . . . . . . . . . c30496_6e5h 1 . 2 . 661 . 1 1 14 CYS HA H -9.724 -2.375 -0.552 . . . 1.0 . . . . . . . . . . . . A . 14 CYS HA . . . . . . . . . c30496_6e5h 1 . 2 . 662 . 1 1 14 CYS HB2 H -7.449 -2.713 1.407 . . . 1.0 . . . . . . . . . . . . A . 14 CYS HB2 . . . . . . . . . c30496_6e5h 1 . 2 . 663 . 1 1 14 CYS HB3 H -8.468 -1.292 1.225 . . . 1.0 . . . . . . . . . . . . A . 14 CYS HB3 . . . . . . . . . c30496_6e5h 1 . 2 . 664 . 1 1 14 CYS N N -8.853 -4.232 -0.365 . . . 1.0 . . . . . . . . . . . . A . 14 CYS N . . . . . . . . . c30496_6e5h 1 . 2 . 665 . 1 1 14 CYS O O -6.797 -3.010 -1.615 . . . 1.0 . . . . . . . . . . . . A . 14 CYS O . . . . . . . . . c30496_6e5h 1 . 2 . 666 . 1 1 14 CYS SG S -9.585 -3.029 2.421 . . . 1.0 . . . . . . . . . . . . A . 14 CYS SG . . . . . . . . . c30496_6e5h 1 . 2 . 667 . 1 1 15 GLU C C -5.844 0.427 -1.579 . . . 1.0 . . . . . . . . . . . . A . 15 GLU C . . . . . . . . . c30496_6e5h 1 . 2 . 668 . 1 1 15 GLU CA C -6.817 -0.374 -2.420 . . . 1.0 . . . . . . . . . . . . A . 15 GLU CA . . . . . . . . . c30496_6e5h 1 . 2 . 669 . 1 1 15 GLU CB C -7.503 0.519 -3.447 . . . 1.0 . . . . . . . . . . . . A . 15 GLU CB . . . . . . . . . c30496_6e5h 1 . 2 . 670 . 1 1 15 GLU CD C -7.688 -1.271 -5.225 . . . 1.0 . . . . . . . . . . . . A . 15 GLU CD . . . . . . . . . c30496_6e5h 1 . 2 . 671 . 1 1 15 GLU CG C -8.424 -0.243 -4.388 . . . 1.0 . . . . . . . . . . . . A . 15 GLU CG . . . . . . . . . c30496_6e5h 1 . 2 . 672 . 1 1 15 GLU H H -8.545 -0.463 -1.211 . . . 1.0 . . . . . . . . . . . . A . 15 GLU H . . . . . . . . . c30496_6e5h 1 . 2 . 673 . 1 1 15 GLU HA H -6.276 -1.155 -2.933 . . . 1.0 . . . . . . . . . . . . A . 15 GLU HA . . . . . . . . . c30496_6e5h 1 . 2 . 674 . 1 1 15 GLU HB2 H -8.087 1.263 -2.925 . . . 1.0 . . . . . . . . . . . . A . 15 GLU HB2 . . . . . . . . . c30496_6e5h 1 . 2 . 675 . 1 1 15 GLU HB3 H -6.746 1.014 -4.038 . . . 1.0 . . . . . . . . . . . . A . 15 GLU HB3 . . . . . . . . . c30496_6e5h 1 . 2 . 676 . 1 1 15 GLU HG2 H -9.175 -0.752 -3.803 . . . 1.0 . . . . . . . . . . . . A . 15 GLU HG2 . . . . . . . . . c30496_6e5h 1 . 2 . 677 . 1 1 15 GLU HG3 H -8.903 0.462 -5.050 . . . 1.0 . . . . . . . . . . . . A . 15 GLU HG3 . . . . . . . . . c30496_6e5h 1 . 2 . 678 . 1 1 15 GLU N N -7.798 -1.002 -1.558 . . . 1.0 . . . . . . . . . . . . A . 15 GLU N . . . . . . . . . c30496_6e5h 1 . 2 . 679 . 1 1 15 GLU O O -6.249 1.286 -0.796 . . . 1.0 . . . . . . . . . . . . A . 15 GLU O . . . . . . . . . c30496_6e5h 1 . 2 . 680 . 1 1 15 GLU OE1 O -7.623 -2.445 -4.806 . . . 1.0 . . . . . . . . . . . . A . 15 GLU OE1 . . . . . . . . . c30496_6e5h 1 . 2 . 681 . 1 1 15 GLU OE2 O -7.169 -0.915 -6.303 . . . 1.0 . . . . . . . . . . . . A . 15 GLU OE2 . . . . . . . . . c30496_6e5h 1 . 2 . 682 . 1 1 16 VAL C C -2.812 1.820 -1.722 . . . 1.0 . . . . . . . . . . . . A . 16 VAL C . . . . . . . . . c30496_6e5h 1 . 2 . 683 . 1 1 16 VAL CA C -3.549 0.767 -0.915 . . . 1.0 . . . . . . . . . . . . A . 16 VAL CA . . . . . . . . . c30496_6e5h 1 . 2 . 684 . 1 1 16 VAL CB C -2.543 -0.260 -0.358 . . . 1.0 . . . . . . . . . . . . A . 16 VAL CB . . . . . . . . . c30496_6e5h 1 . 2 . 685 . 1 1 16 VAL CG1 C -1.480 0.429 0.485 . . . 1.0 . . . . . . . . . . . . A . 16 VAL CG1 . . . . . . . . . c30496_6e5h 1 . 2 . 686 . 1 1 16 VAL CG2 C -3.270 -1.321 0.456 . . . 1.0 . . . . . . . . . . . . A . 16 VAL CG2 . . . . . . . . . c30496_6e5h 1 . 2 . 687 . 1 1 16 VAL H H -4.302 -0.521 -2.407 . . . 1.0 . . . . . . . . . . . . A . 16 VAL H . . . . . . . . . c30496_6e5h 1 . 2 . 688 . 1 1 16 VAL HA H -4.039 1.247 -0.081 . . . 1.0 . . . . . . . . . . . . A . 16 VAL HA . . . . . . . . . c30496_6e5h 1 . 2 . 689 . 1 1 16 VAL HB H -2.056 -0.747 -1.192 . . . 1.0 . . . . . . . . . . . . A . 16 VAL HB . . . . . . . . . c30496_6e5h 1 . 2 . 690 . 1 1 16 VAL HG11 H -1.954 0.931 1.316 . . . 1.0 . . . . . . . . . . . . A . 16 VAL HG11 . . . . . . . . . c30496_6e5h 1 . 2 . 691 . 1 1 16 VAL HG12 H -0.953 1.152 -0.122 . . . 1.0 . . . . . . . . . . . . A . 16 VAL HG12 . . . . . . . . . c30496_6e5h 1 . 2 . 692 . 1 1 16 VAL HG13 H -0.782 -0.306 0.857 . . . 1.0 . . . . . . . . . . . . A . 16 VAL HG13 . . . . . . . . . c30496_6e5h 1 . 2 . 693 . 1 1 16 VAL HG21 H -3.828 -0.844 1.248 . . . 1.0 . . . . . . . . . . . . A . 16 VAL HG21 . . . . . . . . . c30496_6e5h 1 . 2 . 694 . 1 1 16 VAL HG22 H -2.552 -2.003 0.884 . . . 1.0 . . . . . . . . . . . . A . 16 VAL HG22 . . . . . . . . . c30496_6e5h 1 . 2 . 695 . 1 1 16 VAL HG23 H -3.949 -1.866 -0.183 . . . 1.0 . . . . . . . . . . . . A . 16 VAL HG23 . . . . . . . . . c30496_6e5h 1 . 2 . 696 . 1 1 16 VAL N N -4.568 0.130 -1.724 . . . 1.0 . . . . . . . . . . . . A . 16 VAL N . . . . . . . . . c30496_6e5h 1 . 2 . 697 . 1 1 16 VAL O O -2.215 1.525 -2.758 . . . 1.0 . . . . . . . . . . . . A . 16 VAL O . . . . . . . . . c30496_6e5h 1 . 2 . 698 . 1 1 17 ARG C C -0.898 4.459 -1.255 . . . 1.0 . . . . . . . . . . . . A . 17 ARG C . . . . . . . . . c30496_6e5h 1 . 2 . 699 . 1 1 17 ARG CA C -2.239 4.167 -1.909 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CA . . . . . . . . . c30496_6e5h 1 . 2 . 700 . 1 1 17 ARG CB C -3.143 5.401 -1.854 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CB . . . . . . . . . c30496_6e5h 1 . 2 . 701 . 1 1 17 ARG CD C -2.265 6.384 -4.000 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CD . . . . . . . . . c30496_6e5h 1 . 2 . 702 . 1 1 17 ARG CG C -2.552 6.630 -2.528 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CG . . . . . . . . . c30496_6e5h 1 . 2 . 703 . 1 1 17 ARG CZ C -0.575 7.545 -5.382 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CZ . . . . . . . . . c30496_6e5h 1 . 2 . 704 . 1 1 17 ARG H H -3.364 3.207 -0.407 . . . 1.0 . . . . . . . . . . . . A . 17 ARG H . . . . . . . . . c30496_6e5h 1 . 2 . 705 . 1 1 17 ARG HA H -2.074 3.895 -2.937 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HA . . . . . . . . . c30496_6e5h 1 . 2 . 706 . 1 1 17 ARG HB2 H -4.079 5.168 -2.337 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HB2 . . . . . . . . . c30496_6e5h 1 . 2 . 707 . 1 1 17 ARG HB3 H -3.334 5.643 -0.820 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HB3 . . . . . . . . . c30496_6e5h 1 . 2 . 708 . 1 1 17 ARG HD2 H -1.570 5.564 -4.083 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HD2 . . . . . . . . . c30496_6e5h 1 . 2 . 709 . 1 1 17 ARG HD3 H -3.188 6.124 -4.496 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HD3 . . . . . . . . . c30496_6e5h 1 . 2 . 710 . 1 1 17 ARG HE H -2.166 8.419 -4.536 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HE . . . . . . . . . c30496_6e5h 1 . 2 . 711 . 1 1 17 ARG HG2 H -3.251 7.448 -2.440 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HG2 . . . . . . . . . c30496_6e5h 1 . 2 . 712 . 1 1 17 ARG HG3 H -1.630 6.888 -2.030 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HG3 . . . . . . . . . c30496_6e5h 1 . 2 . 713 . 1 1 17 ARG HH11 H -0.228 5.561 -5.142 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH11 . . . . . . . . . c30496_6e5h 1 . 2 . 714 . 1 1 17 ARG HH12 H 0.940 6.407 -6.100 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH12 . . . . . . . . . c30496_6e5h 1 . 2 . 715 . 1 1 17 ARG HH21 H -0.645 9.522 -5.818 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH21 . . . . . . . . . c30496_6e5h 1 . 2 . 716 . 1 1 17 ARG HH22 H 0.699 8.657 -6.496 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH22 . . . . . . . . . c30496_6e5h 1 . 2 . 717 . 1 1 17 ARG N N -2.878 3.049 -1.247 . . . 1.0 . . . . . . . . . . . . A . 17 ARG N . . . . . . . . . c30496_6e5h 1 . 2 . 718 . 1 1 17 ARG NE N -1.689 7.563 -4.649 . . . 1.0 . . . . . . . . . . . . A . 17 ARG NE . . . . . . . . . c30496_6e5h 1 . 2 . 719 . 1 1 17 ARG NH1 N 0.097 6.413 -5.558 . . . 1.0 . . . . . . . . . . . . A . 17 ARG NH1 . . . . . . . . . c30496_6e5h 1 . 2 . 720 . 1 1 17 ARG NH2 N -0.137 8.663 -5.943 . . . 1.0 . . . . . . . . . . . . A . 17 ARG NH2 . . . . . . . . . c30496_6e5h 1 . 2 . 721 . 1 1 17 ARG O O -0.835 4.867 -0.094 . . . 1.0 . . . . . . . . . . . . A . 17 ARG O . . . . . . . . . c30496_6e5h 1 . 2 . 722 . 1 1 18 CYS C C 2.001 5.840 -1.939 . . . 1.0 . . . . . . . . . . . . A . 18 CYS C . . . . . . . . . c30496_6e5h 1 . 2 . 723 . 1 1 18 CYS CA C 1.502 4.474 -1.492 . . . 1.0 . . . . . . . . . . . . A . 18 CYS CA . . . . . . . . . c30496_6e5h 1 . 2 . 724 . 1 1 18 CYS CB C 2.457 3.376 -1.949 . . . 1.0 . . . . . . . . . . . . A . 18 CYS CB . . . . . . . . . c30496_6e5h 1 . 2 . 725 . 1 1 18 CYS H H 0.062 3.852 -2.894 . . . 1.0 . . . . . . . . . . . . A . 18 CYS H . . . . . . . . . c30496_6e5h 1 . 2 . 726 . 1 1 18 CYS HA H 1.451 4.461 -0.415 . . . 1.0 . . . . . . . . . . . . A . 18 CYS HA . . . . . . . . . c30496_6e5h 1 . 2 . 727 . 1 1 18 CYS HB2 H 3.469 3.744 -1.886 . . . 1.0 . . . . . . . . . . . . A . 18 CYS HB2 . . . . . . . . . c30496_6e5h 1 . 2 . 728 . 1 1 18 CYS HB3 H 2.348 2.523 -1.298 . . . 1.0 . . . . . . . . . . . . A . 18 CYS HB3 . . . . . . . . . c30496_6e5h 1 . 2 . 729 . 1 1 18 CYS N N 0.169 4.217 -1.991 . . . 1.0 . . . . . . . . . . . . A . 18 CYS N . . . . . . . . . c30496_6e5h 1 . 2 . 730 . 1 1 18 CYS O O 2.039 6.145 -3.130 . . . 1.0 . . . . . . . . . . . . A . 18 CYS O . . . . . . . . . c30496_6e5h 1 . 2 . 731 . 1 1 18 CYS SG S 2.185 2.808 -3.658 . . . 1.0 . . . . . . . . . . . . A . 18 CYS SG . . . . . . . . . c30496_6e5h 1 . 2 . 732 . 1 1 19 ASP C C 4.207 8.166 -0.474 . . . 1.0 . . . . . . . . . . . . A . 19 ASP C . . . . . . . . . c30496_6e5h 1 . 2 . 733 . 1 1 19 ASP CA C 2.893 7.987 -1.226 . . . 1.0 . . . . . . . . . . . . A . 19 ASP CA . . . . . . . . . c30496_6e5h 1 . 2 . 734 . 1 1 19 ASP CB C 1.880 9.045 -0.783 . . . 1.0 . . . . . . . . . . . . A . 19 ASP CB . . . . . . . . . c30496_6e5h 1 . 2 . 735 . 1 1 19 ASP CG C 2.347 10.457 -1.071 . . . 1.0 . . . . . . . . . . . . A . 19 ASP CG . . . . . . . . . c30496_6e5h 1 . 2 . 736 . 1 1 19 ASP H H 2.311 6.351 -0.036 . . . 1.0 . . . . . . . . . . . . A . 19 ASP H . . . . . . . . . c30496_6e5h 1 . 2 . 737 . 1 1 19 ASP HA H 3.072 8.083 -2.285 . . . 1.0 . . . . . . . . . . . . A . 19 ASP HA . . . . . . . . . c30496_6e5h 1 . 2 . 738 . 1 1 19 ASP HB2 H 0.949 8.882 -1.303 . . . 1.0 . . . . . . . . . . . . A . 19 ASP HB2 . . . . . . . . . c30496_6e5h 1 . 2 . 739 . 1 1 19 ASP HB3 H 1.714 8.951 0.279 . . . 1.0 . . . . . . . . . . . . A . 19 ASP HB3 . . . . . . . . . c30496_6e5h 1 . 2 . 740 . 1 1 19 ASP N N 2.374 6.656 -0.968 . . . 1.0 . . . . . . . . . . . . A . 19 ASP N . . . . . . . . . c30496_6e5h 1 . 2 . 741 . 1 1 19 ASP O O 4.228 8.666 0.652 . . . 1.0 . . . . . . . . . . . . A . 19 ASP O . . . . . . . . . c30496_6e5h 1 . 2 . 742 . 1 1 19 ASP OD1 O 2.931 11.091 -0.171 . . . 1.0 . . . . . . . . . . . . A . 19 ASP OD1 . . . . . . . . . c30496_6e5h 1 . 2 . 743 . 1 1 19 ASP OD2 O 2.143 10.941 -2.201 . . . 1.0 . . . . . . . . . . . . A . 19 ASP OD2 . . . . . . . . . c30496_6e5h 1 . 2 . 744 . 1 1 20 DPR C C 6.634 6.903 0.846 . . . 1.0 . . . . . . . . . . . . A . 20 DPR C . . . . . . . . . c30496_6e5h 1 . 2 . 745 . 1 1 20 DPR CA C 6.628 7.761 -0.414 . . . 1.0 . . . . . . . . . . . . A . 20 DPR CA . . . . . . . . . c30496_6e5h 1 . 2 . 746 . 1 1 20 DPR CB C 7.595 7.197 -1.456 . . . 1.0 . . . . . . . . . . . . A . 20 DPR CB . . . . . . . . . c30496_6e5h 1 . 2 . 747 . 1 1 20 DPR CD C 5.408 7.165 -2.428 . . . 1.0 . . . . . . . . . . . . A . 20 DPR CD . . . . . . . . . c30496_6e5h 1 . 2 . 748 . 1 1 20 DPR CG C 6.869 7.286 -2.754 . . . 1.0 . . . . . . . . . . . . A . 20 DPR CG . . . . . . . . . c30496_6e5h 1 . 2 . 749 . 1 1 20 DPR HA H 6.921 8.767 -0.166 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HA . . . . . . . . . c30496_6e5h 1 . 2 . 750 . 1 1 20 DPR HB2 H 8.494 7.795 -1.467 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HB2 . . . . . . . . . c30496_6e5h 1 . 2 . 751 . 1 1 20 DPR HB3 H 7.838 6.175 -1.209 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HB3 . . . . . . . . . c30496_6e5h 1 . 2 . 752 . 1 1 20 DPR HD2 H 4.819 7.742 -3.124 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HD2 . . . . . . . . . c30496_6e5h 1 . 2 . 753 . 1 1 20 DPR HD3 H 5.100 6.132 -2.436 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HD3 . . . . . . . . . c30496_6e5h 1 . 2 . 754 . 1 1 20 DPR HG2 H 7.070 8.237 -3.220 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HG2 . . . . . . . . . c30496_6e5h 1 . 2 . 755 . 1 1 20 DPR HG3 H 7.176 6.478 -3.403 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HG3 . . . . . . . . . c30496_6e5h 1 . 2 . 756 . 1 1 20 DPR N N 5.324 7.727 -1.073 . . . 1.0 . . . . . . . . . . . . A . 20 DPR N . . . . . . . . . c30496_6e5h 1 . 2 . 757 . 1 1 20 DPR O O 6.333 5.708 0.797 . . . 1.0 . . . . . . . . . . . . A . 20 DPR O . . . . . . . . . c30496_6e5h 1 . 2 . 758 . 1 1 21 PRO C C 5.558 6.820 3.912 . . . 1.0 . . . . . . . . . . . . A . 21 PRO C . . . . . . . . . c30496_6e5h 1 . 2 . 759 . 1 1 21 PRO CA C 6.951 6.818 3.284 . . . 1.0 . . . . . . . . . . . . A . 21 PRO CA . . . . . . . . . c30496_6e5h 1 . 2 . 760 . 1 1 21 PRO CB C 7.916 7.651 4.119 . . . 1.0 . . . . . . . . . . . . A . 21 PRO CB . . . . . . . . . c30496_6e5h 1 . 2 . 761 . 1 1 21 PRO CD C 7.457 8.892 2.117 . . . 1.0 . . . . . . . . . . . . A . 21 PRO CD . . . . . . . . . c30496_6e5h 1 . 2 . 762 . 1 1 21 PRO CG C 7.761 9.035 3.589 . . . 1.0 . . . . . . . . . . . . A . 21 PRO CG . . . . . . . . . c30496_6e5h 1 . 2 . 763 . 1 1 21 PRO HA H 7.313 5.803 3.208 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HA . . . . . . . . . c30496_6e5h 1 . 2 . 764 . 1 1 21 PRO HB2 H 7.640 7.590 5.161 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HB2 . . . . . . . . . c30496_6e5h 1 . 2 . 765 . 1 1 21 PRO HB3 H 8.923 7.288 3.983 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HB3 . . . . . . . . . c30496_6e5h 1 . 2 . 766 . 1 1 21 PRO HD2 H 6.691 9.591 1.819 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HD2 . . . . . . . . . c30496_6e5h 1 . 2 . 767 . 1 1 21 PRO HD3 H 8.353 9.041 1.534 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HD3 . . . . . . . . . c30496_6e5h 1 . 2 . 768 . 1 1 21 PRO HG2 H 6.944 9.530 4.091 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HG2 . . . . . . . . . c30496_6e5h 1 . 2 . 769 . 1 1 21 PRO HG3 H 8.678 9.588 3.730 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HG3 . . . . . . . . . c30496_6e5h 1 . 2 . 770 . 1 1 21 PRO N N 6.978 7.501 1.993 . . . 1.0 . . . . . . . . . . . . A . 21 PRO N . . . . . . . . . c30496_6e5h 1 . 2 . 771 . 1 1 21 PRO O O 5.367 6.344 5.034 . . . 1.0 . . . . . . . . . . . . A . 21 PRO O . . . . . . . . . c30496_6e5h 1 . 2 . 772 . 1 1 22 ARG C C 2.350 6.426 2.944 . . . 1.0 . . . . . . . . . . . . A . 22 ARG C . . . . . . . . . c30496_6e5h 1 . 2 . 773 . 1 1 22 ARG CA C 3.221 7.431 3.680 . . . 1.0 . . . . . . . . . . . . A . 22 ARG CA . . . . . . . . . c30496_6e5h 1 . 2 . 774 . 1 1 22 ARG CB C 2.654 8.839 3.502 . . . 1.0 . . . . . . . . . . . . A . 22 ARG CB . . . . . . . . . c30496_6e5h 1 . 2 . 775 . 1 1 22 ARG CD C 2.827 11.288 4.065 . . . 1.0 . . . . . . . . . . . . A . 22 ARG CD . . . . . . . . . c30496_6e5h 1 . 2 . 776 . 1 1 22 ARG CG C 3.493 9.923 4.160 . . . 1.0 . . . . . . . . . . . . A . 22 ARG CG . . . . . . . . . c30496_6e5h 1 . 2 . 777 . 1 1 22 ARG CZ C 1.879 12.795 2.354 . . . 1.0 . . . . . . . . . . . . A . 22 ARG CZ . . . . . . . . . c30496_6e5h 1 . 2 . 778 . 1 1 22 ARG H H 4.792 7.714 2.290 . . . 1.0 . . . . . . . . . . . . A . 22 ARG H . . . . . . . . . c30496_6e5h 1 . 2 . 779 . 1 1 22 ARG HA H 3.232 7.183 4.730 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HA . . . . . . . . . c30496_6e5h 1 . 2 . 780 . 1 1 22 ARG HB2 H 2.587 9.053 2.446 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HB2 . . . . . . . . . c30496_6e5h 1 . 2 . 781 . 1 1 22 ARG HB3 H 1.662 8.871 3.931 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HB3 . . . . . . . . . c30496_6e5h 1 . 2 . 782 . 1 1 22 ARG HD2 H 1.890 11.250 4.598 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HD2 . . . . . . . . . c30496_6e5h 1 . 2 . 783 . 1 1 22 ARG HD3 H 3.472 12.018 4.531 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HD3 . . . . . . . . . c30496_6e5h 1 . 2 . 784 . 1 1 22 ARG HE H 2.908 11.124 1.959 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HE . . . . . . . . . c30496_6e5h 1 . 2 . 785 . 1 1 22 ARG HG2 H 3.629 9.674 5.202 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HG2 . . . . . . . . . c30496_6e5h 1 . 2 . 786 . 1 1 22 ARG HG3 H 4.457 9.966 3.673 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HG3 . . . . . . . . . c30496_6e5h 1 . 2 . 787 . 1 1 22 ARG HH11 H 1.573 13.399 4.265 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HH11 . . . . . . . . . c30496_6e5h 1 . 2 . 788 . 1 1 22 ARG HH12 H 0.896 14.427 3.042 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HH12 . . . . . . . . . c30496_6e5h 1 . 2 . 789 . 1 1 22 ARG HH21 H 1.153 13.904 0.825 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HH21 . . . . . . . . . c30496_6e5h 1 . 2 . 790 . 1 1 22 ARG HH22 H 2.027 12.468 0.359 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HH22 . . . . . . . . . c30496_6e5h 1 . 2 . 791 . 1 1 22 ARG N N 4.587 7.363 3.189 . . . 1.0 . . . . . . . . . . . . A . 22 ARG N . . . . . . . . . c30496_6e5h 1 . 2 . 792 . 1 1 22 ARG NE N 2.563 11.700 2.683 . . . 1.0 . . . . . . . . . . . . A . 22 ARG NE . . . . . . . . . c30496_6e5h 1 . 2 . 793 . 1 1 22 ARG NH1 N 1.414 13.604 3.296 . . . 1.0 . . . . . . . . . . . . A . 22 ARG NH1 . . . . . . . . . c30496_6e5h 1 . 2 . 794 . 1 1 22 ARG NH2 N 1.668 13.082 1.079 . . . 1.0 . . . . . . . . . . . . A . 22 ARG NH2 . . . . . . . . . c30496_6e5h 1 . 2 . 795 . 1 1 22 ARG O O 2.548 6.176 1.758 . . . 1.0 . . . . . . . . . . . . A . 22 ARG O . . . . . . . . . c30496_6e5h 1 . 2 . 796 . 1 1 23 TYR C C -0.918 5.081 3.509 . . . 1.0 . . . . . . . . . . . . A . 23 TYR C . . . . . . . . . c30496_6e5h 1 . 2 . 797 . 1 1 23 TYR CA C 0.514 4.854 3.056 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CA . . . . . . . . . c30496_6e5h 1 . 2 . 798 . 1 1 23 TYR CB C 0.963 3.441 3.427 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CB . . . . . . . . . c30496_6e5h 1 . 2 . 799 . 1 1 23 TYR CD1 C 3.450 3.205 3.759 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CD1 . . . . . . . . . c30496_6e5h 1 . 2 . 800 . 1 1 23 TYR CD2 C 2.545 2.660 1.623 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CD2 . . . . . . . . . c30496_6e5h 1 . 2 . 801 . 1 1 23 TYR CE1 C 4.714 2.890 3.307 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CE1 . . . . . . . . . c30496_6e5h 1 . 2 . 802 . 1 1 23 TYR CE2 C 3.808 2.342 1.164 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CE2 . . . . . . . . . c30496_6e5h 1 . 2 . 803 . 1 1 23 TYR CG C 2.345 3.094 2.927 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CG . . . . . . . . . c30496_6e5h 1 . 2 . 804 . 1 1 23 TYR CZ C 4.884 2.455 2.001 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CZ . . . . . . . . . c30496_6e5h 1 . 2 . 805 . 1 1 23 TYR H H 1.290 6.073 4.596 . . . 1.0 . . . . . . . . . . . . A . 23 TYR H . . . . . . . . . c30496_6e5h 1 . 2 . 806 . 1 1 23 TYR HA H 0.564 4.968 1.985 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HA . . . . . . . . . c30496_6e5h 1 . 2 . 807 . 1 1 23 TYR HB2 H 0.966 3.343 4.500 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HB2 . . . . . . . . . c30496_6e5h 1 . 2 . 808 . 1 1 23 TYR HB3 H 0.270 2.730 3.007 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HB3 . . . . . . . . . c30496_6e5h 1 . 2 . 809 . 1 1 23 TYR HD1 H 3.309 3.540 4.776 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HD1 . . . . . . . . . c30496_6e5h 1 . 2 . 810 . 1 1 23 TYR HD2 H 1.695 2.568 0.965 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HD2 . . . . . . . . . c30496_6e5h 1 . 2 . 811 . 1 1 23 TYR HE1 H 5.559 2.983 3.969 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HE1 . . . . . . . . . c30496_6e5h 1 . 2 . 812 . 1 1 23 TYR HE2 H 3.941 2.003 0.149 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HE2 . . . . . . . . . c30496_6e5h 1 . 2 . 813 . 1 1 23 TYR HH H 6.551 1.499 2.154 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HH . . . . . . . . . c30496_6e5h 1 . 2 . 814 . 1 1 23 TYR N N 1.401 5.839 3.651 . . . 1.0 . . . . . . . . . . . . A . 23 TYR N . . . . . . . . . c30496_6e5h 1 . 2 . 815 . 1 1 23 TYR O O -1.168 5.395 4.676 . . . 1.0 . . . . . . . . . . . . A . 23 TYR O . . . . . . . . . c30496_6e5h 1 . 2 . 816 . 1 1 23 TYR OH O 6.151 2.146 1.560 . . . 1.0 . . . . . . . . . . . . A . 23 TYR OH . . . . . . . . . c30496_6e5h 1 . 2 . 817 . 1 1 24 GLU C C -4.020 3.850 2.426 . . . 1.0 . . . . . . . . . . . . A . 24 GLU C . . . . . . . . . c30496_6e5h 1 . 2 . 818 . 1 1 24 GLU CA C -3.265 5.088 2.884 . . . 1.0 . . . . . . . . . . . . A . 24 GLU CA . . . . . . . . . c30496_6e5h 1 . 2 . 819 . 1 1 24 GLU CB C -3.840 6.335 2.201 . . . 1.0 . . . . . . . . . . . . A . 24 GLU CB . . . . . . . . . c30496_6e5h 1 . 2 . 820 . 1 1 24 GLU CD C -3.767 8.846 1.941 . . . 1.0 . . . . . . . . . . . . A . 24 GLU CD . . . . . . . . . c30496_6e5h 1 . 2 . 821 . 1 1 24 GLU CG C -3.124 7.627 2.568 . . . 1.0 . . . . . . . . . . . . A . 24 GLU CG . . . . . . . . . c30496_6e5h 1 . 2 . 822 . 1 1 24 GLU H H -1.578 4.724 1.659 . . . 1.0 . . . . . . . . . . . . A . 24 GLU H . . . . . . . . . c30496_6e5h 1 . 2 . 823 . 1 1 24 GLU HA H -3.369 5.185 3.955 . . . 1.0 . . . . . . . . . . . . A . 24 GLU HA . . . . . . . . . c30496_6e5h 1 . 2 . 824 . 1 1 24 GLU HB2 H -3.775 6.205 1.132 . . . 1.0 . . . . . . . . . . . . A . 24 GLU HB2 . . . . . . . . . c30496_6e5h 1 . 2 . 825 . 1 1 24 GLU HB3 H -4.879 6.432 2.478 . . . 1.0 . . . . . . . . . . . . A . 24 GLU HB3 . . . . . . . . . c30496_6e5h 1 . 2 . 826 . 1 1 24 GLU HG2 H -3.142 7.743 3.641 . . . 1.0 . . . . . . . . . . . . A . 24 GLU HG2 . . . . . . . . . c30496_6e5h 1 . 2 . 827 . 1 1 24 GLU HG3 H -2.099 7.565 2.231 . . . 1.0 . . . . . . . . . . . . A . 24 GLU HG3 . . . . . . . . . c30496_6e5h 1 . 2 . 828 . 1 1 24 GLU N N -1.849 4.940 2.581 . . . 1.0 . . . . . . . . . . . . A . 24 GLU N . . . . . . . . . c30496_6e5h 1 . 2 . 829 . 1 1 24 GLU O O -3.746 3.313 1.357 . . . 1.0 . . . . . . . . . . . . A . 24 GLU O . . . . . . . . . c30496_6e5h 1 . 2 . 830 . 1 1 24 GLU OE1 O -3.469 9.139 0.764 . . . 1.0 . . . . . . . . . . . . A . 24 GLU OE1 . . . . . . . . . c30496_6e5h 1 . 2 . 831 . 1 1 24 GLU OE2 O -4.577 9.515 2.614 . . . 1.0 . . . . . . . . . . . . A . 24 GLU OE2 . . . . . . . . . c30496_6e5h 1 . 2 . 832 . 1 1 25 VAL C C -7.180 2.554 2.663 . . . 1.0 . . . . . . . . . . . . A . 25 VAL C . . . . . . . . . c30496_6e5h 1 . 2 . 833 . 1 1 25 VAL CA C -5.719 2.200 2.899 . . . 1.0 . . . . . . . . . . . . A . 25 VAL CA . . . . . . . . . c30496_6e5h 1 . 2 . 834 . 1 1 25 VAL CB C -5.615 1.131 4.006 . . . 1.0 . . . . . . . . . . . . A . 25 VAL CB . . . . . . . . . c30496_6e5h 1 . 2 . 835 . 1 1 25 VAL CG1 C -6.459 -0.088 3.663 . . . 1.0 . . . . . . . . . . . . A . 25 VAL CG1 . . . . . . . . . c30496_6e5h 1 . 2 . 836 . 1 1 25 VAL CG2 C -4.163 0.730 4.225 . . . 1.0 . . . . . . . . . . . . A . 25 VAL CG2 . . . . . . . . . c30496_6e5h 1 . 2 . 837 . 1 1 25 VAL H H -5.147 3.864 4.071 . . . 1.0 . . . . . . . . . . . . A . 25 VAL H . . . . . . . . . c30496_6e5h 1 . 2 . 838 . 1 1 25 VAL HA H -5.307 1.787 1.987 . . . 1.0 . . . . . . . . . . . . A . 25 VAL HA . . . . . . . . . c30496_6e5h 1 . 2 . 839 . 1 1 25 VAL HB H -5.992 1.556 4.924 . . . 1.0 . . . . . . . . . . . . A . 25 VAL HB . . . . . . . . . c30496_6e5h 1 . 2 . 840 . 1 1 25 VAL HG11 H -6.102 -0.523 2.741 . . . 1.0 . . . . . . . . . . . . A . 25 VAL HG11 . . . . . . . . . c30496_6e5h 1 . 2 . 841 . 1 1 25 VAL HG12 H -7.491 0.210 3.543 . . . 1.0 . . . . . . . . . . . . A . 25 VAL HG12 . . . . . . . . . c30496_6e5h 1 . 2 . 842 . 1 1 25 VAL HG13 H -6.384 -0.816 4.457 . . . 1.0 . . . . . . . . . . . . A . 25 VAL HG13 . . . . . . . . . c30496_6e5h 1 . 2 . 843 . 1 1 25 VAL HG21 H -3.750 0.357 3.301 . . . 1.0 . . . . . . . . . . . . A . 25 VAL HG21 . . . . . . . . . c30496_6e5h 1 . 2 . 844 . 1 1 25 VAL HG22 H -4.110 -0.041 4.980 . . . 1.0 . . . . . . . . . . . . A . 25 VAL HG22 . . . . . . . . . c30496_6e5h 1 . 2 . 845 . 1 1 25 VAL HG23 H -3.597 1.591 4.549 . . . 1.0 . . . . . . . . . . . . A . 25 VAL HG23 . . . . . . . . . c30496_6e5h 1 . 2 . 846 . 1 1 25 VAL N N -4.955 3.389 3.234 . . . 1.0 . . . . . . . . . . . . A . 25 VAL N . . . . . . . . . c30496_6e5h 1 . 2 . 847 . 1 1 25 VAL O O -7.875 3.001 3.576 . . . 1.0 . . . . . . . . . . . . A . 25 VAL O . . . . . . . . . c30496_6e5h 1 . 2 . 848 . 1 1 26 HIS C C -9.808 1.436 0.792 . . . 1.0 . . . . . . . . . . . . A . 26 HIS C . . . . . . . . . c30496_6e5h 1 . 2 . 849 . 1 1 26 HIS CA C -9.006 2.698 1.078 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CA . . . . . . . . . c30496_6e5h 1 . 2 . 850 . 1 1 26 HIS CB C -9.017 3.624 -0.143 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CB . . . . . . . . . c30496_6e5h 1 . 2 . 851 . 1 1 26 HIS CD2 C -11.079 5.186 0.136 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CD2 . . . . . . . . . c30496_6e5h 1 . 2 . 852 . 1 1 26 HIS CE1 C -12.251 4.471 -1.568 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CE1 . . . . . . . . . c30496_6e5h 1 . 2 . 853 . 1 1 26 HIS CG C -10.366 4.200 -0.464 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CG . . . . . . . . . c30496_6e5h 1 . 2 . 854 . 1 1 26 HIS H H -7.046 1.970 0.755 . . . 1.0 . . . . . . . . . . . . A . 26 HIS H . . . . . . . . . c30496_6e5h 1 . 2 . 855 . 1 1 26 HIS HA H -9.449 3.210 1.914 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HA . . . . . . . . . c30496_6e5h 1 . 2 . 856 . 1 1 26 HIS HB2 H -8.338 4.444 0.029 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HB2 . . . . . . . . . c30496_6e5h 1 . 2 . 857 . 1 1 26 HIS HB3 H -8.684 3.065 -1.004 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HB3 . . . . . . . . . c30496_6e5h 1 . 2 . 858 . 1 1 26 HIS HD1 H -10.885 3.073 -2.167 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HD1 . . . . . . . . . c30496_6e5h 1 . 2 . 859 . 1 1 26 HIS HD2 H -10.781 5.757 1.003 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HD2 . . . . . . . . . c30496_6e5h 1 . 2 . 860 . 1 1 26 HIS HE1 H -13.037 4.355 -2.298 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HE1 . . . . . . . . . c30496_6e5h 1 . 2 . 861 . 1 1 26 HIS HE2 H -12.911 6.040 -0.432 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HE2 . . . . . . . . . c30496_6e5h 1 . 2 . 862 . 1 1 26 HIS N N -7.640 2.358 1.437 . . . 1.0 . . . . . . . . . . . . A . 26 HIS N . . . . . . . . . c30496_6e5h 1 . 2 . 863 . 1 1 26 HIS ND1 N -11.132 3.775 -1.527 . . . 1.0 . . . . . . . . . . . . A . 26 HIS ND1 . . . . . . . . . c30496_6e5h 1 . 2 . 864 . 1 1 26 HIS NE2 N -12.245 5.331 -0.571 . . . 1.0 . . . . . . . . . . . . A . 26 HIS NE2 . . . . . . . . . c30496_6e5h 1 . 2 . 865 . 1 1 26 HIS O O -9.629 0.791 -0.244 . . . 1.0 . . . . . . . . . . . . A . 26 HIS O . . . . . . . . . c30496_6e5h 1 . 2 . 866 . 1 1 27 CYS C C -12.912 0.358 1.088 . . . 1.0 . . . . . . . . . . . . A . 27 CYS C . . . . . . . . . c30496_6e5h 1 . 2 . 867 . 1 1 27 CYS CA C -11.533 -0.079 1.560 . . . 1.0 . . . . . . . . . . . . A . 27 CYS CA . . . . . . . . . c30496_6e5h 1 . 2 . 868 . 1 1 27 CYS CB C -11.647 -0.845 2.876 . . . 1.0 . . . . . . . . . . . . A . 27 CYS CB . . . . . . . . . c30496_6e5h 1 . 2 . 869 . 1 1 27 CYS H H -10.731 1.598 2.552 . . . 1.0 . . . . . . . . . . . . A . 27 CYS H . . . . . . . . . c30496_6e5h 1 . 2 . 870 . 1 1 27 CYS HA H -11.095 -0.721 0.813 . . . 1.0 . . . . . . . . . . . . A . 27 CYS HA . . . . . . . . . c30496_6e5h 1 . 2 . 871 . 1 1 27 CYS HB2 H -12.107 -0.208 3.615 . . . 1.0 . . . . . . . . . . . . A . 27 CYS HB2 . . . . . . . . . c30496_6e5h 1 . 2 . 872 . 1 1 27 CYS HB3 H -12.266 -1.714 2.722 . . . 1.0 . . . . . . . . . . . . A . 27 CYS HB3 . . . . . . . . . c30496_6e5h 1 . 2 . 873 . 1 1 27 CYS N N -10.672 1.075 1.723 . . . 1.0 . . . . . . . . . . . . A . 27 CYS N . . . . . . . . . c30496_6e5h 1 . 2 . 874 . 1 1 27 CYS O O -13.763 0.742 1.888 . . . 1.0 . . . . . . . . . . . . A . 27 CYS O . . . . . . . . . c30496_6e5h 1 . 2 . 875 . 1 1 27 CYS SG S -10.048 -1.407 3.550 . . . 1.0 . . . . . . . . . . . . A . 27 CYS SG . . . . . . . . . c30496_6e5h 1 . 2 . 876 . 1 1 28 NH2 HN1 H -12.394 0.015 -0.796 . . . 1.0 . . . . . . . . . . . . A . 28 NH2 HN1 . . . . . . . . . c30496_6e5h 1 . 2 . 877 . 1 1 28 NH2 HN2 H -13.992 0.631 -0.550 . . . 1.0 . . . . . . . . . . . . A . 28 NH2 HN2 . . . . . . . . . c30496_6e5h 1 . 2 . 878 . 1 1 28 NH2 N N -13.120 0.333 -0.215 . . . 1.0 . . . . . . . . . . . . A . 28 NH2 N . . . . . . . . . c30496_6e5h 1 . 3 . 879 . 1 1 1 ASN C C 9.832 -4.729 2.211 . . . 1.0 . . . . . . . . . . . . A . 1 ASN C . . . . . . . . . c30496_6e5h 1 . 3 . 880 . 1 1 1 ASN CA C 10.537 -5.715 3.134 . . . 1.0 . . . . . . . . . . . . A . 1 ASN CA . . . . . . . . . c30496_6e5h 1 . 3 . 881 . 1 1 1 ASN CB C 12.040 -5.703 2.847 . . . 1.0 . . . . . . . . . . . . A . 1 ASN CB . . . . . . . . . c30496_6e5h 1 . 3 . 882 . 1 1 1 ASN CG C 12.821 -6.583 3.800 . . . 1.0 . . . . . . . . . . . . A . 1 ASN CG . . . . . . . . . c30496_6e5h 1 . 3 . 883 . 1 1 1 ASN H1 H 10.232 -7.455 2.029 . . . 1.0 . . . . . . . . . . . . A . 1 ASN H1 . . . . . . . . . c30496_6e5h 1 . 3 . 884 . 1 1 1 ASN H2 H 8.948 -7.065 3.055 . . . 1.0 . . . . . . . . . . . . A . 1 ASN H2 . . . . . . . . . c30496_6e5h 1 . 3 . 885 . 1 1 1 ASN H3 H 10.373 -7.719 3.693 . . . 1.0 . . . . . . . . . . . . A . 1 ASN H3 . . . . . . . . . c30496_6e5h 1 . 3 . 886 . 1 1 1 ASN HA H 10.371 -5.409 4.157 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HA . . . . . . . . . c30496_6e5h 1 . 3 . 887 . 1 1 1 ASN HB2 H 12.210 -6.057 1.842 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HB2 . . . . . . . . . c30496_6e5h 1 . 3 . 888 . 1 1 1 ASN HB3 H 12.409 -4.693 2.935 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HB3 . . . . . . . . . c30496_6e5h 1 . 3 . 889 . 1 1 1 ASN HD21 H 13.240 -5.019 4.954 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HD21 . . . . . . . . . c30496_6e5h 1 . 3 . 890 . 1 1 1 ASN HD22 H 13.885 -6.538 5.470 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HD22 . . . . . . . . . c30496_6e5h 1 . 3 . 891 . 1 1 1 ASN N N 9.989 -7.083 2.967 . . . 1.0 . . . . . . . . . . . . A . 1 ASN N . . . . . . . . . c30496_6e5h 1 . 3 . 892 . 1 1 1 ASN ND2 N 13.367 -5.989 4.846 . . . 1.0 . . . . . . . . . . . . A . 1 ASN ND2 . . . . . . . . . c30496_6e5h 1 . 3 . 893 . 1 1 1 ASN O O 9.831 -3.524 2.465 . . . 1.0 . . . . . . . . . . . . A . 1 ASN O . . . . . . . . . c30496_6e5h 1 . 3 . 894 . 1 1 1 ASN OD1 O 12.944 -7.787 3.588 . . . 1.0 . . . . . . . . . . . . A . 1 ASN OD1 . . . . . . . . . c30496_6e5h 1 . 3 . 895 . 1 1 2 ASP C C 7.160 -3.985 0.864 . . . 1.0 . . . . . . . . . . . . A . 2 ASP C . . . . . . . . . c30496_6e5h 1 . 3 . 896 . 1 1 2 ASP CA C 8.467 -4.408 0.215 . . . 1.0 . . . . . . . . . . . . A . 2 ASP CA . . . . . . . . . c30496_6e5h 1 . 3 . 897 . 1 1 2 ASP CB C 8.173 -5.151 -1.092 . . . 1.0 . . . . . . . . . . . . A . 2 ASP CB . . . . . . . . . c30496_6e5h 1 . 3 . 898 . 1 1 2 ASP CG C 9.380 -5.264 -1.995 . . . 1.0 . . . . . . . . . . . . A . 2 ASP CG . . . . . . . . . c30496_6e5h 1 . 3 . 899 . 1 1 2 ASP H H 9.332 -6.196 0.946 . . . 1.0 . . . . . . . . . . . . A . 2 ASP H . . . . . . . . . c30496_6e5h 1 . 3 . 900 . 1 1 2 ASP HA H 9.049 -3.525 -0.006 . . . 1.0 . . . . . . . . . . . . A . 2 ASP HA . . . . . . . . . c30496_6e5h 1 . 3 . 901 . 1 1 2 ASP HB2 H 7.823 -6.144 -0.864 . . . 1.0 . . . . . . . . . . . . A . 2 ASP HB2 . . . . . . . . . c30496_6e5h 1 . 3 . 902 . 1 1 2 ASP HB3 H 7.399 -4.620 -1.626 . . . 1.0 . . . . . . . . . . . . A . 2 ASP HB3 . . . . . . . . . c30496_6e5h 1 . 3 . 903 . 1 1 2 ASP N N 9.242 -5.240 1.133 . . . 1.0 . . . . . . . . . . . . A . 2 ASP N . . . . . . . . . c30496_6e5h 1 . 3 . 904 . 1 1 2 ASP O O 6.156 -4.688 0.777 . . . 1.0 . . . . . . . . . . . . A . 2 ASP O . . . . . . . . . c30496_6e5h 1 . 3 . 905 . 1 1 2 ASP OD1 O 10.175 -6.213 -1.826 . . . 1.0 . . . . . . . . . . . . A . 2 ASP OD1 . . . . . . . . . c30496_6e5h 1 . 3 . 906 . 1 1 2 ASP OD2 O 9.534 -4.406 -2.892 . . . 1.0 . . . . . . . . . . . . A . 2 ASP OD2 . . . . . . . . . c30496_6e5h 1 . 3 . 907 . 1 1 3 LYS C C 4.821 -2.148 1.359 . . . 1.0 . . . . . . . . . . . . A . 3 LYS C . . . . . . . . . c30496_6e5h 1 . 3 . 908 . 1 1 3 LYS CA C 6.037 -2.330 2.254 . . . 1.0 . . . . . . . . . . . . A . 3 LYS CA . . . . . . . . . c30496_6e5h 1 . 3 . 909 . 1 1 3 LYS CB C 6.369 -1.005 2.951 . . . 1.0 . . . . . . . . . . . . A . 3 LYS CB . . . . . . . . . c30496_6e5h 1 . 3 . 910 . 1 1 3 LYS CD C 7.570 0.204 4.794 . . . 1.0 . . . . . . . . . . . . A . 3 LYS CD . . . . . . . . . c30496_6e5h 1 . 3 . 911 . 1 1 3 LYS CE C 8.471 0.076 6.014 . . . 1.0 . . . . . . . . . . . . A . 3 LYS CE . . . . . . . . . c30496_6e5h 1 . 3 . 912 . 1 1 3 LYS CG C 7.347 -1.136 4.110 . . . 1.0 . . . . . . . . . . . . A . 3 LYS CG . . . . . . . . . c30496_6e5h 1 . 3 . 913 . 1 1 3 LYS H H 7.991 -2.271 1.445 . . . 1.0 . . . . . . . . . . . . A . 3 LYS H . . . . . . . . . c30496_6e5h 1 . 3 . 914 . 1 1 3 LYS HA H 5.802 -3.067 3.005 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HA . . . . . . . . . c30496_6e5h 1 . 3 . 915 . 1 1 3 LYS HB2 H 6.797 -0.329 2.227 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HB2 . . . . . . . . . c30496_6e5h 1 . 3 . 916 . 1 1 3 LYS HB3 H 5.454 -0.576 3.331 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HB3 . . . . . . . . . c30496_6e5h 1 . 3 . 917 . 1 1 3 LYS HD2 H 8.031 0.883 4.092 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HD2 . . . . . . . . . c30496_6e5h 1 . 3 . 918 . 1 1 3 LYS HD3 H 6.614 0.601 5.104 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HD3 . . . . . . . . . c30496_6e5h 1 . 3 . 919 . 1 1 3 LYS HE2 H 8.539 1.039 6.498 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HE2 . . . . . . . . . c30496_6e5h 1 . 3 . 920 . 1 1 3 LYS HE3 H 8.031 -0.638 6.695 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HE3 . . . . . . . . . c30496_6e5h 1 . 3 . 921 . 1 1 3 LYS HG2 H 6.949 -1.836 4.828 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HG2 . . . . . . . . . c30496_6e5h 1 . 3 . 922 . 1 1 3 LYS HG3 H 8.292 -1.501 3.737 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HG3 . . . . . . . . . c30496_6e5h 1 . 3 . 923 . 1 1 3 LYS HZ1 H 10.256 0.259 4.946 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HZ1 . . . . . . . . . c30496_6e5h 1 . 3 . 924 . 1 1 3 LYS HZ2 H 9.812 -1.339 5.264 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HZ2 . . . . . . . . . c30496_6e5h 1 . 3 . 925 . 1 1 3 LYS HZ3 H 10.449 -0.379 6.499 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HZ3 . . . . . . . . . c30496_6e5h 1 . 3 . 926 . 1 1 3 LYS N N 7.183 -2.821 1.499 . . . 1.0 . . . . . . . . . . . . A . 3 LYS N . . . . . . . . . c30496_6e5h 1 . 3 . 927 . 1 1 3 LYS NZ N 9.840 -0.378 5.655 . . . 1.0 . . . . . . . . . . . . A . 3 LYS NZ . . . . . . . . . c30496_6e5h 1 . 3 . 928 . 1 1 3 LYS O O 3.743 -2.650 1.664 . . . 1.0 . . . . . . . . . . . . A . 3 LYS O . . . . . . . . . c30496_6e5h 1 . 3 . 929 . 1 1 4 CYS C C 3.310 -2.444 -1.225 . . . 1.0 . . . . . . . . . . . . A . 4 CYS C . . . . . . . . . c30496_6e5h 1 . 3 . 930 . 1 1 4 CYS CA C 3.903 -1.160 -0.658 . . . 1.0 . . . . . . . . . . . . A . 4 CYS CA . . . . . . . . . c30496_6e5h 1 . 3 . 931 . 1 1 4 CYS CB C 4.372 -0.247 -1.797 . . . 1.0 . . . . . . . . . . . . A . 4 CYS CB . . . . . . . . . c30496_6e5h 1 . 3 . 932 . 1 1 4 CYS H H 5.909 -1.156 0.011 . . . 1.0 . . . . . . . . . . . . A . 4 CYS H . . . . . . . . . c30496_6e5h 1 . 3 . 933 . 1 1 4 CYS HA H 3.141 -0.650 -0.090 . . . 1.0 . . . . . . . . . . . . A . 4 CYS HA . . . . . . . . . c30496_6e5h 1 . 3 . 934 . 1 1 4 CYS HB2 H 4.742 0.676 -1.378 . . . 1.0 . . . . . . . . . . . . A . 4 CYS HB2 . . . . . . . . . c30496_6e5h 1 . 3 . 935 . 1 1 4 CYS HB3 H 5.170 -0.738 -2.331 . . . 1.0 . . . . . . . . . . . . A . 4 CYS HB3 . . . . . . . . . c30496_6e5h 1 . 3 . 936 . 1 1 4 CYS N N 5.006 -1.458 0.243 . . . 1.0 . . . . . . . . . . . . A . 4 CYS N . . . . . . . . . c30496_6e5h 1 . 3 . 937 . 1 1 4 CYS O O 2.094 -2.618 -1.252 . . . 1.0 . . . . . . . . . . . . A . 4 CYS O . . . . . . . . . c30496_6e5h 1 . 3 . 938 . 1 1 4 CYS SG S 3.073 0.176 -3.006 . . . 1.0 . . . . . . . . . . . . A . 4 CYS SG . . . . . . . . . c30496_6e5h 1 . 3 . 939 . 1 1 5 LYS C C 3.023 -5.491 -1.257 . . . 1.0 . . . . . . . . . . . . A . 5 LYS C . . . . . . . . . c30496_6e5h 1 . 3 . 940 . 1 1 5 LYS CA C 3.735 -4.596 -2.263 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CA . . . . . . . . . c30496_6e5h 1 . 3 . 941 . 1 1 5 LYS CB C 4.924 -5.332 -2.883 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CB . . . . . . . . . c30496_6e5h 1 . 3 . 942 . 1 1 5 LYS CD C 4.811 -4.205 -5.137 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CD . . . . . . . . . c30496_6e5h 1 . 3 . 943 . 1 1 5 LYS CE C 5.575 -3.398 -6.175 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CE . . . . . . . . . c30496_6e5h 1 . 3 . 944 . 1 1 5 LYS CG C 5.674 -4.511 -3.922 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CG . . . . . . . . . c30496_6e5h 1 . 3 . 945 . 1 1 5 LYS H H 5.135 -3.203 -1.505 . . . 1.0 . . . . . . . . . . . . A . 5 LYS H . . . . . . . . . c30496_6e5h 1 . 3 . 946 . 1 1 5 LYS HA H 3.039 -4.336 -3.043 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HA . . . . . . . . . c30496_6e5h 1 . 3 . 947 . 1 1 5 LYS HB2 H 5.615 -5.597 -2.097 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HB2 . . . . . . . . . c30496_6e5h 1 . 3 . 948 . 1 1 5 LYS HB3 H 4.566 -6.234 -3.357 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HB3 . . . . . . . . . c30496_6e5h 1 . 3 . 949 . 1 1 5 LYS HD2 H 4.492 -5.134 -5.583 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HD2 . . . . . . . . . c30496_6e5h 1 . 3 . 950 . 1 1 5 LYS HD3 H 3.948 -3.639 -4.821 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HD3 . . . . . . . . . c30496_6e5h 1 . 3 . 951 . 1 1 5 LYS HE2 H 4.915 -3.183 -7.002 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HE2 . . . . . . . . . c30496_6e5h 1 . 3 . 952 . 1 1 5 LYS HE3 H 5.899 -2.472 -5.724 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HE3 . . . . . . . . . c30496_6e5h 1 . 3 . 953 . 1 1 5 LYS HG2 H 5.984 -3.580 -3.472 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HG2 . . . . . . . . . c30496_6e5h 1 . 3 . 954 . 1 1 5 LYS HG3 H 6.544 -5.064 -4.239 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HG3 . . . . . . . . . c30496_6e5h 1 . 3 . 955 . 1 1 5 LYS HZ1 H 6.468 -5.010 -7.155 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HZ1 . . . . . . . . . c30496_6e5h 1 . 3 . 956 . 1 1 5 LYS HZ2 H 7.405 -4.368 -5.903 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HZ2 . . . . . . . . . c30496_6e5h 1 . 3 . 957 . 1 1 5 LYS HZ3 H 7.279 -3.542 -7.373 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HZ3 . . . . . . . . . c30496_6e5h 1 . 3 . 958 . 1 1 5 LYS N N 4.177 -3.358 -1.637 . . . 1.0 . . . . . . . . . . . . A . 5 LYS N . . . . . . . . . c30496_6e5h 1 . 3 . 959 . 1 1 5 LYS NZ N 6.764 -4.130 -6.685 . . . 1.0 . . . . . . . . . . . . A . 5 LYS NZ . . . . . . . . . c30496_6e5h 1 . 3 . 960 . 1 1 5 LYS O O 1.968 -6.052 -1.554 . . . 1.0 . . . . . . . . . . . . A . 5 LYS O . . . . . . . . . c30496_6e5h 1 . 3 . 961 . 1 1 6 GLU C C 1.671 -5.880 1.440 . . . 1.0 . . . . . . . . . . . . A . 6 GLU C . . . . . . . . . c30496_6e5h 1 . 3 . 962 . 1 1 6 GLU CA C 3.011 -6.436 0.980 . . . 1.0 . . . . . . . . . . . . A . 6 GLU CA . . . . . . . . . c30496_6e5h 1 . 3 . 963 . 1 1 6 GLU CB C 3.973 -6.563 2.163 . . . 1.0 . . . . . . . . . . . . A . 6 GLU CB . . . . . . . . . c30496_6e5h 1 . 3 . 964 . 1 1 6 GLU CD C 6.189 -7.450 2.994 . . . 1.0 . . . . . . . . . . . . A . 6 GLU CD . . . . . . . . . c30496_6e5h 1 . 3 . 965 . 1 1 6 GLU CG C 5.167 -7.464 1.879 . . . 1.0 . . . . . . . . . . . . A . 6 GLU CG . . . . . . . . . c30496_6e5h 1 . 3 . 966 . 1 1 6 GLU H H 4.414 -5.104 0.123 . . . 1.0 . . . . . . . . . . . . A . 6 GLU H . . . . . . . . . c30496_6e5h 1 . 3 . 967 . 1 1 6 GLU HA H 2.846 -7.416 0.557 . . . 1.0 . . . . . . . . . . . . A . 6 GLU HA . . . . . . . . . c30496_6e5h 1 . 3 . 968 . 1 1 6 GLU HB2 H 4.342 -5.581 2.419 . . . 1.0 . . . . . . . . . . . . A . 6 GLU HB2 . . . . . . . . . c30496_6e5h 1 . 3 . 969 . 1 1 6 GLU HB3 H 3.436 -6.968 3.006 . . . 1.0 . . . . . . . . . . . . A . 6 GLU HB3 . . . . . . . . . c30496_6e5h 1 . 3 . 970 . 1 1 6 GLU HG2 H 4.815 -8.476 1.749 . . . 1.0 . . . . . . . . . . . . A . 6 GLU HG2 . . . . . . . . . c30496_6e5h 1 . 3 . 971 . 1 1 6 GLU HG3 H 5.645 -7.133 0.968 . . . 1.0 . . . . . . . . . . . . A . 6 GLU HG3 . . . . . . . . . c30496_6e5h 1 . 3 . 972 . 1 1 6 GLU N N 3.588 -5.602 -0.064 . . . 1.0 . . . . . . . . . . . . A . 6 GLU N . . . . . . . . . c30496_6e5h 1 . 3 . 973 . 1 1 6 GLU O O 0.730 -6.635 1.671 . . . 1.0 . . . . . . . . . . . . A . 6 GLU O . . . . . . . . . c30496_6e5h 1 . 3 . 974 . 1 1 6 GLU OE1 O 5.799 -7.634 4.167 . . . 1.0 . . . . . . . . . . . . A . 6 GLU OE1 . . . . . . . . . c30496_6e5h 1 . 3 . 975 . 1 1 6 GLU OE2 O 7.389 -7.264 2.709 . . . 1.0 . . . . . . . . . . . . A . 6 GLU OE2 . . . . . . . . . c30496_6e5h 1 . 3 . 976 . 1 1 7 LEU C C -0.713 -4.131 0.818 . . . 1.0 . . . . . . . . . . . . A . 7 LEU C . . . . . . . . . c30496_6e5h 1 . 3 . 977 . 1 1 7 LEU CA C 0.322 -3.921 1.917 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CA . . . . . . . . . c30496_6e5h 1 . 3 . 978 . 1 1 7 LEU CB C 0.526 -2.426 2.170 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CB . . . . . . . . . c30496_6e5h 1 . 3 . 979 . 1 1 7 LEU CD1 C 1.656 -0.576 3.438 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CD1 . . . . . . . . . c30496_6e5h 1 . 3 . 980 . 1 1 7 LEU CD2 C 0.717 -2.524 4.677 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CD2 . . . . . . . . . c30496_6e5h 1 . 3 . 981 . 1 1 7 LEU CG C 1.389 -2.073 3.389 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CG . . . . . . . . . c30496_6e5h 1 . 3 . 982 . 1 1 7 LEU H H 2.375 -4.001 1.392 . . . 1.0 . . . . . . . . . . . . A . 7 LEU H . . . . . . . . . c30496_6e5h 1 . 3 . 983 . 1 1 7 LEU HA H -0.035 -4.386 2.822 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HA . . . . . . . . . c30496_6e5h 1 . 3 . 984 . 1 1 7 LEU HB2 H 0.990 -1.998 1.292 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HB2 . . . . . . . . . c30496_6e5h 1 . 3 . 985 . 1 1 7 LEU HB3 H -0.443 -1.974 2.299 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HB3 . . . . . . . . . c30496_6e5h 1 . 3 . 986 . 1 1 7 LEU HD11 H 2.175 -0.270 2.541 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD11 . . . . . . . . . c30496_6e5h 1 . 3 . 987 . 1 1 7 LEU HD12 H 2.266 -0.347 4.300 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD12 . . . . . . . . . c30496_6e5h 1 . 3 . 988 . 1 1 7 LEU HD13 H 0.719 -0.044 3.512 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD13 . . . . . . . . . c30496_6e5h 1 . 3 . 989 . 1 1 7 LEU HD21 H 1.345 -2.270 5.519 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD21 . . . . . . . . . c30496_6e5h 1 . 3 . 990 . 1 1 7 LEU HD22 H 0.565 -3.592 4.653 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD22 . . . . . . . . . c30496_6e5h 1 . 3 . 991 . 1 1 7 LEU HD23 H -0.236 -2.025 4.778 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD23 . . . . . . . . . c30496_6e5h 1 . 3 . 992 . 1 1 7 LEU HG H 2.340 -2.582 3.310 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HG . . . . . . . . . c30496_6e5h 1 . 3 . 993 . 1 1 7 LEU N N 1.578 -4.560 1.554 . . . 1.0 . . . . . . . . . . . . A . 7 LEU N . . . . . . . . . c30496_6e5h 1 . 3 . 994 . 1 1 7 LEU O O -1.872 -4.447 1.092 . . . 1.0 . . . . . . . . . . . . A . 7 LEU O . . . . . . . . . c30496_6e5h 1 . 3 . 995 . 1 1 8 LYS C C -1.699 -5.566 -1.658 . . . 1.0 . . . . . . . . . . . . A . 8 LYS C . . . . . . . . . c30496_6e5h 1 . 3 . 996 . 1 1 8 LYS CA C -1.150 -4.148 -1.583 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CA . . . . . . . . . c30496_6e5h 1 . 3 . 997 . 1 1 8 LYS CB C -0.402 -3.811 -2.876 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CB . . . . . . . . . c30496_6e5h 1 . 3 . 998 . 1 1 8 LYS CD C -1.620 -1.781 -3.744 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CD . . . . . . . . . c30496_6e5h 1 . 3 . 999 . 1 1 8 LYS CE C -1.870 -2.297 -5.151 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CE . . . . . . . . . c30496_6e5h 1 . 3 . 1000 . 1 1 8 LYS CG C -0.317 -2.320 -3.174 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CG . . . . . . . . . c30496_6e5h 1 . 3 . 1001 . 1 1 8 LYS H H 0.664 -3.727 -0.573 . . . 1.0 . . . . . . . . . . . . A . 8 LYS H . . . . . . . . . c30496_6e5h 1 . 3 . 1002 . 1 1 8 LYS HA H -1.978 -3.467 -1.471 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HA . . . . . . . . . c30496_6e5h 1 . 3 . 1003 . 1 1 8 LYS HB2 H 0.603 -4.197 -2.804 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HB2 . . . . . . . . . c30496_6e5h 1 . 3 . 1004 . 1 1 8 LYS HB3 H -0.901 -4.293 -3.702 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HB3 . . . . . . . . . c30496_6e5h 1 . 3 . 1005 . 1 1 8 LYS HD2 H -2.434 -2.092 -3.111 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HD2 . . . . . . . . . c30496_6e5h 1 . 3 . 1006 . 1 1 8 LYS HD3 H -1.572 -0.703 -3.769 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HD3 . . . . . . . . . c30496_6e5h 1 . 3 . 1007 . 1 1 8 LYS HE2 H -1.085 -1.936 -5.797 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HE2 . . . . . . . . . c30496_6e5h 1 . 3 . 1008 . 1 1 8 LYS HE3 H -1.852 -3.376 -5.135 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HE3 . . . . . . . . . c30496_6e5h 1 . 3 . 1009 . 1 1 8 LYS HG2 H -0.094 -1.793 -2.258 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HG2 . . . . . . . . . c30496_6e5h 1 . 3 . 1010 . 1 1 8 LYS HG3 H 0.475 -2.151 -3.889 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HG3 . . . . . . . . . c30496_6e5h 1 . 3 . 1011 . 1 1 8 LYS HZ1 H -3.953 -2.217 -5.097 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ1 . . . . . . . . . c30496_6e5h 1 . 3 . 1012 . 1 1 8 LYS HZ2 H -3.306 -2.182 -6.658 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ2 . . . . . . . . . c30496_6e5h 1 . 3 . 1013 . 1 1 8 LYS HZ3 H -3.228 -0.807 -5.679 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ3 . . . . . . . . . c30496_6e5h 1 . 3 . 1014 . 1 1 8 LYS N N -0.277 -3.974 -0.426 . . . 1.0 . . . . . . . . . . . . A . 8 LYS N . . . . . . . . . c30496_6e5h 1 . 3 . 1015 . 1 1 8 LYS NZ N -3.177 -1.844 -5.683 . . . 1.0 . . . . . . . . . . . . A . 8 LYS NZ . . . . . . . . . c30496_6e5h 1 . 3 . 1016 . 1 1 8 LYS O O -2.864 -5.765 -1.990 . . . 1.0 . . . . . . . . . . . . A . 8 LYS O . . . . . . . . . c30496_6e5h 1 . 3 . 1017 . 1 1 9 LYS C C -2.115 -8.304 -0.179 . . . 1.0 . . . . . . . . . . . . A . 9 LYS C . . . . . . . . . c30496_6e5h 1 . 3 . 1018 . 1 1 9 LYS CA C -1.272 -7.945 -1.398 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CA . . . . . . . . . c30496_6e5h 1 . 3 . 1019 . 1 1 9 LYS CB C -0.044 -8.855 -1.479 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CB . . . . . . . . . c30496_6e5h 1 . 3 . 1020 . 1 1 9 LYS CD C 2.062 -9.444 -2.715 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CD . . . . . . . . . c30496_6e5h 1 . 3 . 1021 . 1 1 9 LYS CE C 2.921 -9.127 -3.926 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CE . . . . . . . . . c30496_6e5h 1 . 3 . 1022 . 1 1 9 LYS CG C 0.775 -8.643 -2.739 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CG . . . . . . . . . c30496_6e5h 1 . 3 . 1023 . 1 1 9 LYS H H 0.071 -6.325 -1.116 . . . 1.0 . . . . . . . . . . . . A . 9 LYS H . . . . . . . . . c30496_6e5h 1 . 3 . 1024 . 1 1 9 LYS HA H -1.871 -8.086 -2.284 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HA . . . . . . . . . c30496_6e5h 1 . 3 . 1025 . 1 1 9 LYS HB2 H 0.591 -8.665 -0.624 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HB2 . . . . . . . . . c30496_6e5h 1 . 3 . 1026 . 1 1 9 LYS HB3 H -0.368 -9.885 -1.455 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HB3 . . . . . . . . . c30496_6e5h 1 . 3 . 1027 . 1 1 9 LYS HD2 H 2.612 -9.199 -1.818 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HD2 . . . . . . . . . c30496_6e5h 1 . 3 . 1028 . 1 1 9 LYS HD3 H 1.821 -10.496 -2.718 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HD3 . . . . . . . . . c30496_6e5h 1 . 3 . 1029 . 1 1 9 LYS HE2 H 2.362 -9.362 -4.819 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HE2 . . . . . . . . . c30496_6e5h 1 . 3 . 1030 . 1 1 9 LYS HE3 H 3.156 -8.074 -3.917 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HE3 . . . . . . . . . c30496_6e5h 1 . 3 . 1031 . 1 1 9 LYS HG2 H 0.190 -8.951 -3.592 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HG2 . . . . . . . . . c30496_6e5h 1 . 3 . 1032 . 1 1 9 LYS HG3 H 1.017 -7.593 -2.828 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HG3 . . . . . . . . . c30496_6e5h 1 . 3 . 1033 . 1 1 9 LYS HZ1 H 3.984 -10.920 -4.014 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HZ1 . . . . . . . . . c30496_6e5h 1 . 3 . 1034 . 1 1 9 LYS HZ2 H 4.714 -9.738 -3.054 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HZ2 . . . . . . . . . c30496_6e5h 1 . 3 . 1035 . 1 1 9 LYS HZ3 H 4.777 -9.615 -4.737 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HZ3 . . . . . . . . . c30496_6e5h 1 . 3 . 1036 . 1 1 9 LYS N N -0.859 -6.546 -1.358 . . . 1.0 . . . . . . . . . . . . A . 9 LYS N . . . . . . . . . c30496_6e5h 1 . 3 . 1037 . 1 1 9 LYS NZ N 4.186 -9.904 -3.933 . . . 1.0 . . . . . . . . . . . . A . 9 LYS NZ . . . . . . . . . c30496_6e5h 1 . 3 . 1038 . 1 1 9 LYS O O -3.050 -9.099 -0.270 . . . 1.0 . . . . . . . . . . . . A . 9 LYS O . . . . . . . . . c30496_6e5h 1 . 3 . 1039 . 1 1 10 ARG C C -3.920 -7.469 2.121 . . . 1.0 . . . . . . . . . . . . A . 10 ARG C . . . . . . . . . c30496_6e5h 1 . 3 . 1040 . 1 1 10 ARG CA C -2.486 -7.972 2.202 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CA . . . . . . . . . c30496_6e5h 1 . 3 . 1041 . 1 1 10 ARG CB C -1.766 -7.285 3.360 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CB . . . . . . . . . c30496_6e5h 1 . 3 . 1042 . 1 1 10 ARG CD C -1.482 -6.987 5.827 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CD . . . . . . . . . c30496_6e5h 1 . 3 . 1043 . 1 1 10 ARG CG C -2.237 -7.725 4.735 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CG . . . . . . . . . c30496_6e5h 1 . 3 . 1044 . 1 1 10 ARG CZ C 0.785 -6.042 6.079 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CZ . . . . . . . . . c30496_6e5h 1 . 3 . 1045 . 1 1 10 ARG H H -1.018 -7.086 0.961 . . . 1.0 . . . . . . . . . . . . A . 10 ARG H . . . . . . . . . c30496_6e5h 1 . 3 . 1046 . 1 1 10 ARG HA H -2.493 -9.037 2.371 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HA . . . . . . . . . c30496_6e5h 1 . 3 . 1047 . 1 1 10 ARG HB2 H -0.712 -7.493 3.283 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HB2 . . . . . . . . . c30496_6e5h 1 . 3 . 1048 . 1 1 10 ARG HB3 H -1.919 -6.220 3.278 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HB3 . . . . . . . . . c30496_6e5h 1 . 3 . 1049 . 1 1 10 ARG HD2 H -1.859 -5.976 5.891 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HD2 . . . . . . . . . c30496_6e5h 1 . 3 . 1050 . 1 1 10 ARG HD3 H -1.647 -7.492 6.767 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HD3 . . . . . . . . . c30496_6e5h 1 . 3 . 1051 . 1 1 10 ARG HE H 0.318 -7.608 4.926 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HE . . . . . . . . . c30496_6e5h 1 . 3 . 1052 . 1 1 10 ARG HG2 H -3.293 -7.510 4.830 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HG2 . . . . . . . . . c30496_6e5h 1 . 3 . 1053 . 1 1 10 ARG HG3 H -2.069 -8.787 4.842 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HG3 . . . . . . . . . c30496_6e5h 1 . 3 . 1054 . 1 1 10 ARG HH11 H 0.976 -4.487 7.367 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HH11 . . . . . . . . . c30496_6e5h 1 . 3 . 1055 . 1 1 10 ARG HH12 H -0.605 -5.194 7.286 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HH12 . . . . . . . . . c30496_6e5h 1 . 3 . 1056 . 1 1 10 ARG HH21 H 2.398 -6.701 5.049 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HH21 . . . . . . . . . c30496_6e5h 1 . 3 . 1057 . 1 1 10 ARG HH22 H 2.694 -5.358 6.107 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HH22 . . . . . . . . . c30496_6e5h 1 . 3 . 1058 . 1 1 10 ARG N N -1.776 -7.713 0.957 . . . 1.0 . . . . . . . . . . . . A . 10 ARG N . . . . . . . . . c30496_6e5h 1 . 3 . 1059 . 1 1 10 ARG NE N -0.045 -6.942 5.558 . . . 1.0 . . . . . . . . . . . . A . 10 ARG NE . . . . . . . . . c30496_6e5h 1 . 3 . 1060 . 1 1 10 ARG NH1 N 0.348 -5.167 6.977 . . . 1.0 . . . . . . . . . . . . A . 10 ARG NH1 . . . . . . . . . c30496_6e5h 1 . 3 . 1061 . 1 1 10 ARG NH2 N 2.059 -6.033 5.716 . . . 1.0 . . . . . . . . . . . . A . 10 ARG NH2 . . . . . . . . . c30496_6e5h 1 . 3 . 1062 . 1 1 10 ARG O O -4.858 -8.168 2.505 . . . 1.0 . . . . . . . . . . . . A . 10 ARG O . . . . . . . . . c30496_6e5h 1 . 3 . 1063 . 1 1 11 TYR C C -5.944 -5.706 0.109 . . . 1.0 . . . . . . . . . . . . A . 11 TYR C . . . . . . . . . c30496_6e5h 1 . 3 . 1064 . 1 1 11 TYR CA C -5.390 -5.630 1.531 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CA . . . . . . . . . c30496_6e5h 1 . 3 . 1065 . 1 1 11 TYR CB C -5.306 -4.173 1.978 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CB . . . . . . . . . c30496_6e5h 1 . 3 . 1066 . 1 1 11 TYR CD1 C -5.623 -4.115 4.481 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CD1 . . . . . . . . . c30496_6e5h 1 . 3 . 1067 . 1 1 11 TYR CD2 C -3.447 -3.683 3.614 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CD2 . . . . . . . . . c30496_6e5h 1 . 3 . 1068 . 1 1 11 TYR CE1 C -5.151 -3.953 5.766 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CE1 . . . . . . . . . c30496_6e5h 1 . 3 . 1069 . 1 1 11 TYR CE2 C -2.965 -3.518 4.900 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CE2 . . . . . . . . . c30496_6e5h 1 . 3 . 1070 . 1 1 11 TYR CG C -4.783 -3.984 3.383 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CG . . . . . . . . . c30496_6e5h 1 . 3 . 1071 . 1 1 11 TYR CZ C -3.820 -3.617 5.967 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CZ . . . . . . . . . c30496_6e5h 1 . 3 . 1072 . 1 1 11 TYR H H -3.292 -5.762 1.289 . . . 1.0 . . . . . . . . . . . . A . 11 TYR H . . . . . . . . . c30496_6e5h 1 . 3 . 1073 . 1 1 11 TYR HA H -6.056 -6.160 2.195 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HA . . . . . . . . . c30496_6e5h 1 . 3 . 1074 . 1 1 11 TYR HB2 H -4.651 -3.639 1.308 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HB2 . . . . . . . . . c30496_6e5h 1 . 3 . 1075 . 1 1 11 TYR HB3 H -6.290 -3.739 1.930 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HB3 . . . . . . . . . c30496_6e5h 1 . 3 . 1076 . 1 1 11 TYR HD1 H -6.666 -4.347 4.319 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HD1 . . . . . . . . . c30496_6e5h 1 . 3 . 1077 . 1 1 11 TYR HD2 H -2.782 -3.576 2.771 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HD2 . . . . . . . . . c30496_6e5h 1 . 3 . 1078 . 1 1 11 TYR HE1 H -5.822 -4.060 6.602 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HE1 . . . . . . . . . c30496_6e5h 1 . 3 . 1079 . 1 1 11 TYR HE2 H -1.923 -3.285 5.058 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HE2 . . . . . . . . . c30496_6e5h 1 . 3 . 1080 . 1 1 11 TYR HH H -3.752 -4.163 7.832 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HH . . . . . . . . . c30496_6e5h 1 . 3 . 1081 . 1 1 11 TYR N N -4.080 -6.256 1.616 . . . 1.0 . . . . . . . . . . . . A . 11 TYR N . . . . . . . . . c30496_6e5h 1 . 3 . 1082 . 1 1 11 TYR O O -6.287 -4.683 -0.485 . . . 1.0 . . . . . . . . . . . . A . 11 TYR O . . . . . . . . . c30496_6e5h 1 . 3 . 1083 . 1 1 11 TYR OH O -3.350 -3.495 7.257 . . . 1.0 . . . . . . . . . . . . A . 11 TYR OH . . . . . . . . . c30496_6e5h 1 . 3 . 1084 . 1 1 12 ABA C C -8.000 -6.665 -1.876 . . . 1.0 . . . . . . . . . . . . A . 12 AIB C . . . . . . . . . c30496_6e5h 1 . 3 . 1085 . 1 1 12 ABA CA C -6.562 -7.179 -1.772 . . . 1.0 . . . . . . . . . . . . A . 12 AIB CA . . . . . . . . . c30496_6e5h 1 . 3 . 1086 . 1 1 12 ABA H H -5.745 -7.692 0.122 . . . 1.0 . . . . . . . . . . . . A . 12 AIB H . . . . . . . . . c30496_6e5h 1 . 3 . 1087 . 1 1 12 ABA N N -6.036 -6.927 -0.419 . . . 1.0 . . . . . . . . . . . . A . 12 AIB N . . . . . . . . . c30496_6e5h 1 . 3 . 1088 . 1 1 12 ABA O O -8.441 -6.229 -2.940 . . . 1.0 . . . . . . . . . . . . A . 12 AIB O . . . . . . . . . c30496_6e5h 1 . 3 . 1089 . 1 1 13 GLY C C -10.219 -4.776 -0.477 . . . 1.0 . . . . . . . . . . . . A . 13 GLY C . . . . . . . . . c30496_6e5h 1 . 3 . 1090 . 1 1 13 GLY CA C -10.096 -6.261 -0.756 . . . 1.0 . . . . . . . . . . . . A . 13 GLY CA . . . . . . . . . c30496_6e5h 1 . 3 . 1091 . 1 1 13 GLY H H -8.314 -7.060 0.056 . . . 1.0 . . . . . . . . . . . . A . 13 GLY H . . . . . . . . . c30496_6e5h 1 . 3 . 1092 . 1 1 13 GLY HA2 H -10.536 -6.472 -1.717 . . . 1.0 . . . . . . . . . . . . A . 13 GLY HA2 . . . . . . . . . c30496_6e5h 1 . 3 . 1093 . 1 1 13 GLY HA3 H -10.636 -6.804 0.003 . . . 1.0 . . . . . . . . . . . . A . 13 GLY HA3 . . . . . . . . . c30496_6e5h 1 . 3 . 1094 . 1 1 13 GLY N N -8.720 -6.712 -0.765 . . . 1.0 . . . . . . . . . . . . A . 13 GLY N . . . . . . . . . c30496_6e5h 1 . 3 . 1095 . 1 1 13 GLY O O -11.319 -4.269 -0.258 . . . 1.0 . . . . . . . . . . . . A . 13 GLY O . . . . . . . . . c30496_6e5h 1 . 3 . 1096 . 1 1 14 CYS C C -8.186 -1.977 -1.279 . . . 1.0 . . . . . . . . . . . . A . 14 CYS C . . . . . . . . . c30496_6e5h 1 . 3 . 1097 . 1 1 14 CYS CA C -9.068 -2.650 -0.233 . . . 1.0 . . . . . . . . . . . . A . 14 CYS CA . . . . . . . . . c30496_6e5h 1 . 3 . 1098 . 1 1 14 CYS CB C -8.517 -2.361 1.164 . . . 1.0 . . . . . . . . . . . . A . 14 CYS CB . . . . . . . . . c30496_6e5h 1 . 3 . 1099 . 1 1 14 CYS H H -8.241 -4.547 -0.642 . . . 1.0 . . . . . . . . . . . . A . 14 CYS H . . . . . . . . . c30496_6e5h 1 . 3 . 1100 . 1 1 14 CYS HA H -10.074 -2.271 -0.312 . . . 1.0 . . . . . . . . . . . . A . 14 CYS HA . . . . . . . . . c30496_6e5h 1 . 3 . 1101 . 1 1 14 CYS HB2 H -7.440 -2.389 1.125 . . . 1.0 . . . . . . . . . . . . A . 14 CYS HB2 . . . . . . . . . c30496_6e5h 1 . 3 . 1102 . 1 1 14 CYS HB3 H -8.830 -1.373 1.467 . . . 1.0 . . . . . . . . . . . . A . 14 CYS HB3 . . . . . . . . . c30496_6e5h 1 . 3 . 1103 . 1 1 14 CYS N N -9.091 -4.083 -0.473 . . . 1.0 . . . . . . . . . . . . A . 14 CYS N . . . . . . . . . c30496_6e5h 1 . 3 . 1104 . 1 1 14 CYS O O -7.569 -2.653 -2.104 . . . 1.0 . . . . . . . . . . . . A . 14 CYS O . . . . . . . . . c30496_6e5h 1 . 3 . 1105 . 1 1 14 CYS SG S -9.059 -3.541 2.452 . . . 1.0 . . . . . . . . . . . . A . 14 CYS SG . . . . . . . . . c30496_6e5h 1 . 3 . 1106 . 1 1 15 GLU C C -6.119 0.725 -1.394 . . . 1.0 . . . . . . . . . . . . A . 15 GLU C . . . . . . . . . c30496_6e5h 1 . 3 . 1107 . 1 1 15 GLU CA C -7.263 0.083 -2.161 . . . 1.0 . . . . . . . . . . . . A . 15 GLU CA . . . . . . . . . c30496_6e5h 1 . 3 . 1108 . 1 1 15 GLU CB C -8.047 1.168 -2.898 . . . 1.0 . . . . . . . . . . . . A . 15 GLU CB . . . . . . . . . c30496_6e5h 1 . 3 . 1109 . 1 1 15 GLU CD C -9.953 1.770 -4.425 . . . 1.0 . . . . . . . . . . . . A . 15 GLU CD . . . . . . . . . c30496_6e5h 1 . 3 . 1110 . 1 1 15 GLU CG C -9.187 0.648 -3.757 . . . 1.0 . . . . . . . . . . . . A . 15 GLU CG . . . . . . . . . c30496_6e5h 1 . 3 . 1111 . 1 1 15 GLU H H -8.675 -0.161 -0.601 . . . 1.0 . . . . . . . . . . . . A . 15 GLU H . . . . . . . . . c30496_6e5h 1 . 3 . 1112 . 1 1 15 GLU HA H -6.856 -0.613 -2.877 . . . 1.0 . . . . . . . . . . . . A . 15 GLU HA . . . . . . . . . c30496_6e5h 1 . 3 . 1113 . 1 1 15 GLU HB2 H -8.458 1.851 -2.171 . . . 1.0 . . . . . . . . . . . . A . 15 GLU HB2 . . . . . . . . . c30496_6e5h 1 . 3 . 1114 . 1 1 15 GLU HB3 H -7.364 1.710 -3.536 . . . 1.0 . . . . . . . . . . . . A . 15 GLU HB3 . . . . . . . . . c30496_6e5h 1 . 3 . 1115 . 1 1 15 GLU HG2 H -8.786 0.002 -4.524 . . . 1.0 . . . . . . . . . . . . A . 15 GLU HG2 . . . . . . . . . c30496_6e5h 1 . 3 . 1116 . 1 1 15 GLU HG3 H -9.867 0.088 -3.132 . . . 1.0 . . . . . . . . . . . . A . 15 GLU HG3 . . . . . . . . . c30496_6e5h 1 . 3 . 1117 . 1 1 15 GLU N N -8.126 -0.655 -1.251 . . . 1.0 . . . . . . . . . . . . A . 15 GLU N . . . . . . . . . c30496_6e5h 1 . 3 . 1118 . 1 1 15 GLU O O -6.322 1.680 -0.647 . . . 1.0 . . . . . . . . . . . . A . 15 GLU O . . . . . . . . . c30496_6e5h 1 . 3 . 1119 . 1 1 15 GLU OE1 O -9.566 2.181 -5.538 . . . 1.0 . . . . . . . . . . . . A . 15 GLU OE1 . . . . . . . . . c30496_6e5h 1 . 3 . 1120 . 1 1 15 GLU OE2 O -10.958 2.242 -3.846 . . . 1.0 . . . . . . . . . . . . A . 15 GLU OE2 . . . . . . . . . c30496_6e5h 1 . 3 . 1121 . 1 1 16 VAL C C -3.055 1.769 -1.751 . . . 1.0 . . . . . . . . . . . . A . 16 VAL C . . . . . . . . . c30496_6e5h 1 . 3 . 1122 . 1 1 16 VAL CA C -3.755 0.733 -0.887 . . . 1.0 . . . . . . . . . . . . A . 16 VAL CA . . . . . . . . . c30496_6e5h 1 . 3 . 1123 . 1 1 16 VAL CB C -2.744 -0.369 -0.515 . . . 1.0 . . . . . . . . . . . . A . 16 VAL CB . . . . . . . . . c30496_6e5h 1 . 3 . 1124 . 1 1 16 VAL CG1 C -1.545 0.229 0.211 . . . 1.0 . . . . . . . . . . . . A . 16 VAL CG1 . . . . . . . . . c30496_6e5h 1 . 3 . 1125 . 1 1 16 VAL CG2 C -3.404 -1.439 0.337 . . . 1.0 . . . . . . . . . . . . A . 16 VAL CG2 . . . . . . . . . c30496_6e5h 1 . 3 . 1126 . 1 1 16 VAL H H -4.816 -0.561 -2.184 . . . 1.0 . . . . . . . . . . . . A . 16 VAL H . . . . . . . . . c30496_6e5h 1 . 3 . 1127 . 1 1 16 VAL HA H -4.092 1.206 0.023 . . . 1.0 . . . . . . . . . . . . A . 16 VAL HA . . . . . . . . . c30496_6e5h 1 . 3 . 1128 . 1 1 16 VAL HB H -2.394 -0.827 -1.428 . . . 1.0 . . . . . . . . . . . . A . 16 VAL HB . . . . . . . . . c30496_6e5h 1 . 3 . 1129 . 1 1 16 VAL HG11 H -1.079 0.975 -0.417 . . . 1.0 . . . . . . . . . . . . A . 16 VAL HG11 . . . . . . . . . c30496_6e5h 1 . 3 . 1130 . 1 1 16 VAL HG12 H -0.834 -0.551 0.433 . . . 1.0 . . . . . . . . . . . . A . 16 VAL HG12 . . . . . . . . . c30496_6e5h 1 . 3 . 1131 . 1 1 16 VAL HG13 H -1.875 0.689 1.132 . . . 1.0 . . . . . . . . . . . . A . 16 VAL HG13 . . . . . . . . . c30496_6e5h 1 . 3 . 1132 . 1 1 16 VAL HG21 H -3.794 -0.991 1.238 . . . 1.0 . . . . . . . . . . . . A . 16 VAL HG21 . . . . . . . . . c30496_6e5h 1 . 3 . 1133 . 1 1 16 VAL HG22 H -2.673 -2.192 0.598 . . . 1.0 . . . . . . . . . . . . A . 16 VAL HG22 . . . . . . . . . c30496_6e5h 1 . 3 . 1134 . 1 1 16 VAL HG23 H -4.211 -1.896 -0.216 . . . 1.0 . . . . . . . . . . . . A . 16 VAL HG23 . . . . . . . . . c30496_6e5h 1 . 3 . 1135 . 1 1 16 VAL N N -4.921 0.198 -1.571 . . . 1.0 . . . . . . . . . . . . A . 16 VAL N . . . . . . . . . c30496_6e5h 1 . 3 . 1136 . 1 1 16 VAL O O -2.622 1.477 -2.867 . . . 1.0 . . . . . . . . . . . . A . 16 VAL O . . . . . . . . . c30496_6e5h 1 . 3 . 1137 . 1 1 17 ARG C C -0.866 4.232 -1.366 . . . 1.0 . . . . . . . . . . . . A . 17 ARG C . . . . . . . . . c30496_6e5h 1 . 3 . 1138 . 1 1 17 ARG CA C -2.266 4.048 -1.930 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CA . . . . . . . . . c30496_6e5h 1 . 3 . 1139 . 1 1 17 ARG CB C -3.054 5.349 -1.811 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CB . . . . . . . . . c30496_6e5h 1 . 3 . 1140 . 1 1 17 ARG CD C -3.221 7.792 -2.345 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CD . . . . . . . . . c30496_6e5h 1 . 3 . 1141 . 1 1 17 ARG CG C -2.429 6.513 -2.562 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CG . . . . . . . . . c30496_6e5h 1 . 3 . 1142 . 1 1 17 ARG CZ C -5.655 8.147 -2.134 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CZ . . . . . . . . . c30496_6e5h 1 . 3 . 1143 . 1 1 17 ARG H H -3.348 3.154 -0.348 . . . 1.0 . . . . . . . . . . . . A . 17 ARG H . . . . . . . . . c30496_6e5h 1 . 3 . 1144 . 1 1 17 ARG HA H -2.192 3.774 -2.969 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HA . . . . . . . . . c30496_6e5h 1 . 3 . 1145 . 1 1 17 ARG HB2 H -4.048 5.191 -2.199 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HB2 . . . . . . . . . c30496_6e5h 1 . 3 . 1146 . 1 1 17 ARG HB3 H -3.123 5.618 -0.771 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HB3 . . . . . . . . . c30496_6e5h 1 . 3 . 1147 . 1 1 17 ARG HD2 H -3.212 8.030 -1.291 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HD2 . . . . . . . . . c30496_6e5h 1 . 3 . 1148 . 1 1 17 ARG HD3 H -2.752 8.592 -2.899 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HD3 . . . . . . . . . c30496_6e5h 1 . 3 . 1149 . 1 1 17 ARG HE H -4.762 7.154 -3.625 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HE . . . . . . . . . c30496_6e5h 1 . 3 . 1150 . 1 1 17 ARG HG2 H -1.419 6.658 -2.209 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HG2 . . . . . . . . . c30496_6e5h 1 . 3 . 1151 . 1 1 17 ARG HG3 H -2.414 6.282 -3.618 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HG3 . . . . . . . . . c30496_6e5h 1 . 3 . 1152 . 1 1 17 ARG HH11 H -4.556 8.948 -0.617 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH11 . . . . . . . . . c30496_6e5h 1 . 3 . 1153 . 1 1 17 ARG HH12 H -6.276 9.184 -0.506 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH12 . . . . . . . . . c30496_6e5h 1 . 3 . 1154 . 1 1 17 ARG HH21 H -7.013 7.461 -3.471 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH21 . . . . . . . . . c30496_6e5h 1 . 3 . 1155 . 1 1 17 ARG HH22 H -7.672 8.337 -2.127 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH22 . . . . . . . . . c30496_6e5h 1 . 3 . 1156 . 1 1 17 ARG N N -2.952 2.977 -1.232 . . . 1.0 . . . . . . . . . . . . A . 17 ARG N . . . . . . . . . c30496_6e5h 1 . 3 . 1157 . 1 1 17 ARG NE N -4.607 7.652 -2.789 . . . 1.0 . . . . . . . . . . . . A . 17 ARG NE . . . . . . . . . c30496_6e5h 1 . 3 . 1158 . 1 1 17 ARG NH1 N -5.484 8.813 -0.996 . . . 1.0 . . . . . . . . . . . . A . 17 ARG NH1 . . . . . . . . . c30496_6e5h 1 . 3 . 1159 . 1 1 17 ARG NH2 N -6.878 7.968 -2.615 . . . 1.0 . . . . . . . . . . . . A . 17 ARG NH2 . . . . . . . . . c30496_6e5h 1 . 3 . 1160 . 1 1 17 ARG O O -0.698 4.543 -0.187 . . . 1.0 . . . . . . . . . . . . A . 17 ARG O . . . . . . . . . c30496_6e5h 1 . 3 . 1161 . 1 1 18 CYS C C 2.028 5.553 -2.261 . . . 1.0 . . . . . . . . . . . . A . 18 CYS C . . . . . . . . . c30496_6e5h 1 . 3 . 1162 . 1 1 18 CYS CA C 1.515 4.189 -1.812 . . . 1.0 . . . . . . . . . . . . A . 18 CYS CA . . . . . . . . . c30496_6e5h 1 . 3 . 1163 . 1 1 18 CYS CB C 2.366 3.074 -2.419 . . . 1.0 . . . . . . . . . . . . A . 18 CYS CB . . . . . . . . . c30496_6e5h 1 . 3 . 1164 . 1 1 18 CYS H H -0.072 3.765 -3.130 . . . 1.0 . . . . . . . . . . . . A . 18 CYS H . . . . . . . . . c30496_6e5h 1 . 3 . 1165 . 1 1 18 CYS HA H 1.563 4.128 -0.736 . . . 1.0 . . . . . . . . . . . . A . 18 CYS HA . . . . . . . . . c30496_6e5h 1 . 3 . 1166 . 1 1 18 CYS HB2 H 2.336 3.154 -3.496 . . . 1.0 . . . . . . . . . . . . A . 18 CYS HB2 . . . . . . . . . c30496_6e5h 1 . 3 . 1167 . 1 1 18 CYS HB3 H 3.384 3.185 -2.083 . . . 1.0 . . . . . . . . . . . . A . 18 CYS HB3 . . . . . . . . . c30496_6e5h 1 . 3 . 1168 . 1 1 18 CYS N N 0.128 4.027 -2.209 . . . 1.0 . . . . . . . . . . . . A . 18 CYS N . . . . . . . . . c30496_6e5h 1 . 3 . 1169 . 1 1 18 CYS O O 2.210 5.797 -3.457 . . . 1.0 . . . . . . . . . . . . A . 18 CYS O . . . . . . . . . c30496_6e5h 1 . 3 . 1170 . 1 1 18 CYS SG S 1.817 1.392 -1.975 . . . 1.0 . . . . . . . . . . . . A . 18 CYS SG . . . . . . . . . c30496_6e5h 1 . 3 . 1171 . 1 1 19 ASP C C 3.950 8.128 -0.820 . . . 1.0 . . . . . . . . . . . . A . 19 ASP C . . . . . . . . . c30496_6e5h 1 . 3 . 1172 . 1 1 19 ASP CA C 2.686 7.798 -1.607 . . . 1.0 . . . . . . . . . . . . A . 19 ASP CA . . . . . . . . . c30496_6e5h 1 . 3 . 1173 . 1 1 19 ASP CB C 1.578 8.808 -1.282 . . . 1.0 . . . . . . . . . . . . A . 19 ASP CB . . . . . . . . . c30496_6e5h 1 . 3 . 1174 . 1 1 19 ASP CG C 1.986 10.238 -1.581 . . . 1.0 . . . . . . . . . . . . A . 19 ASP CG . . . . . . . . . c30496_6e5h 1 . 3 . 1175 . 1 1 19 ASP H H 2.127 6.181 -0.365 . . . 1.0 . . . . . . . . . . . . A . 19 ASP H . . . . . . . . . c30496_6e5h 1 . 3 . 1176 . 1 1 19 ASP HA H 2.908 7.848 -2.661 . . . 1.0 . . . . . . . . . . . . A . 19 ASP HA . . . . . . . . . c30496_6e5h 1 . 3 . 1177 . 1 1 19 ASP HB2 H 0.704 8.572 -1.871 . . . 1.0 . . . . . . . . . . . . A . 19 ASP HB2 . . . . . . . . . c30496_6e5h 1 . 3 . 1178 . 1 1 19 ASP HB3 H 1.331 8.734 -0.234 . . . 1.0 . . . . . . . . . . . . A . 19 ASP HB3 . . . . . . . . . c30496_6e5h 1 . 3 . 1179 . 1 1 19 ASP N N 2.245 6.445 -1.306 . . . 1.0 . . . . . . . . . . . . A . 19 ASP N . . . . . . . . . c30496_6e5h 1 . 3 . 1180 . 1 1 19 ASP O O 3.887 8.715 0.262 . . . 1.0 . . . . . . . . . . . . A . 19 ASP O . . . . . . . . . c30496_6e5h 1 . 3 . 1181 . 1 1 19 ASP OD1 O 2.202 11.012 -0.627 . . . 1.0 . . . . . . . . . . . . A . 19 ASP OD1 . . . . . . . . . c30496_6e5h 1 . 3 . 1182 . 1 1 19 ASP OD2 O 2.098 10.597 -2.772 . . . 1.0 . . . . . . . . . . . . A . 19 ASP OD2 . . . . . . . . . c30496_6e5h 1 . 3 . 1183 . 1 1 20 DPR C C 6.426 7.322 0.712 . . . 1.0 . . . . . . . . . . . . A . 20 DPR C . . . . . . . . . c30496_6e5h 1 . 3 . 1184 . 1 1 20 DPR CA C 6.403 7.955 -0.677 . . . 1.0 . . . . . . . . . . . . A . 20 DPR CA . . . . . . . . . c30496_6e5h 1 . 3 . 1185 . 1 1 20 DPR CB C 7.421 7.278 -1.591 . . . 1.0 . . . . . . . . . . . . A . 20 DPR CB . . . . . . . . . c30496_6e5h 1 . 3 . 1186 . 1 1 20 DPR CD C 5.290 7.081 -2.658 . . . 1.0 . . . . . . . . . . . . A . 20 DPR CD . . . . . . . . . c30496_6e5h 1 . 3 . 1187 . 1 1 20 DPR CG C 6.763 7.214 -2.925 . . . 1.0 . . . . . . . . . . . . A . 20 DPR CG . . . . . . . . . c30496_6e5h 1 . 3 . 1188 . 1 1 20 DPR HA H 6.640 9.002 -0.599 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HA . . . . . . . . . c30496_6e5h 1 . 3 . 1189 . 1 1 20 DPR HB2 H 8.322 7.871 -1.625 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HB2 . . . . . . . . . c30496_6e5h 1 . 3 . 1190 . 1 1 20 DPR HB3 H 7.645 6.292 -1.215 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HB3 . . . . . . . . . c30496_6e5h 1 . 3 . 1191 . 1 1 20 DPR HD2 H 4.722 7.586 -3.424 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HD2 . . . . . . . . . c30496_6e5h 1 . 3 . 1192 . 1 1 20 DPR HD3 H 5.006 6.040 -2.600 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HD3 . . . . . . . . . c30496_6e5h 1 . 3 . 1193 . 1 1 20 DPR HG2 H 6.965 8.121 -3.476 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HG2 . . . . . . . . . c30496_6e5h 1 . 3 . 1194 . 1 1 20 DPR HG3 H 7.124 6.355 -3.472 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HG3 . . . . . . . . . c30496_6e5h 1 . 3 . 1195 . 1 1 20 DPR N N 5.120 7.744 -1.352 . . . 1.0 . . . . . . . . . . . . A . 20 DPR N . . . . . . . . . c30496_6e5h 1 . 3 . 1196 . 1 1 20 DPR O O 6.256 6.110 0.856 . . . 1.0 . . . . . . . . . . . . A . 20 DPR O . . . . . . . . . c30496_6e5h 1 . 3 . 1197 . 1 1 21 PRO C C 5.262 7.459 3.716 . . . 1.0 . . . . . . . . . . . . A . 21 PRO C . . . . . . . . . c30496_6e5h 1 . 3 . 1198 . 1 1 21 PRO CA C 6.657 7.667 3.135 . . . 1.0 . . . . . . . . . . . . A . 21 PRO CA . . . . . . . . . c30496_6e5h 1 . 3 . 1199 . 1 1 21 PRO CB C 7.369 8.805 3.860 . . . 1.0 . . . . . . . . . . . . A . 21 PRO CB . . . . . . . . . c30496_6e5h 1 . 3 . 1200 . 1 1 21 PRO CD C 6.867 9.592 1.656 . . . 1.0 . . . . . . . . . . . . A . 21 PRO CD . . . . . . . . . c30496_6e5h 1 . 3 . 1201 . 1 1 21 PRO CG C 6.990 10.025 3.094 . . . 1.0 . . . . . . . . . . . . A . 21 PRO CG . . . . . . . . . c30496_6e5h 1 . 3 . 1202 . 1 1 21 PRO HA H 7.228 6.756 3.235 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HA . . . . . . . . . c30496_6e5h 1 . 3 . 1203 . 1 1 21 PRO HB2 H 7.027 8.852 4.883 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HB2 . . . . . . . . . c30496_6e5h 1 . 3 . 1204 . 1 1 21 PRO HB3 H 8.435 8.639 3.836 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HB3 . . . . . . . . . c30496_6e5h 1 . 3 . 1205 . 1 1 21 PRO HD2 H 6.034 10.089 1.181 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HD2 . . . . . . . . . c30496_6e5h 1 . 3 . 1206 . 1 1 21 PRO HD3 H 7.783 9.795 1.123 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HD3 . . . . . . . . . c30496_6e5h 1 . 3 . 1207 . 1 1 21 PRO HG2 H 6.045 10.405 3.452 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HG2 . . . . . . . . . c30496_6e5h 1 . 3 . 1208 . 1 1 21 PRO HG3 H 7.759 10.776 3.195 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HG3 . . . . . . . . . c30496_6e5h 1 . 3 . 1209 . 1 1 21 PRO N N 6.628 8.139 1.751 . . . 1.0 . . . . . . . . . . . . A . 21 PRO N . . . . . . . . . c30496_6e5h 1 . 3 . 1210 . 1 1 21 PRO O O 5.113 7.024 4.858 . . . 1.0 . . . . . . . . . . . . A . 21 PRO O . . . . . . . . . c30496_6e5h 1 . 3 . 1211 . 1 1 22 ARG C C 2.146 6.531 2.693 . . . 1.0 . . . . . . . . . . . . A . 22 ARG C . . . . . . . . . c30496_6e5h 1 . 3 . 1212 . 1 1 22 ARG CA C 2.871 7.666 3.391 . . . 1.0 . . . . . . . . . . . . A . 22 ARG CA . . . . . . . . . c30496_6e5h 1 . 3 . 1213 . 1 1 22 ARG CB C 2.119 8.973 3.144 . . . 1.0 . . . . . . . . . . . . A . 22 ARG CB . . . . . . . . . c30496_6e5h 1 . 3 . 1214 . 1 1 22 ARG CD C 1.889 11.429 3.642 . . . 1.0 . . . . . . . . . . . . A . 22 ARG CD . . . . . . . . . c30496_6e5h 1 . 3 . 1215 . 1 1 22 ARG CG C 2.703 10.166 3.883 . . . 1.0 . . . . . . . . . . . . A . 22 ARG CG . . . . . . . . . c30496_6e5h 1 . 3 . 1216 . 1 1 22 ARG CZ C 1.743 13.095 1.825 . . . 1.0 . . . . . . . . . . . . A . 22 ARG CZ . . . . . . . . . c30496_6e5h 1 . 3 . 1217 . 1 1 22 ARG H H 4.418 8.057 2.004 . . . 1.0 . . . . . . . . . . . . A . 22 ARG H . . . . . . . . . c30496_6e5h 1 . 3 . 1218 . 1 1 22 ARG HA H 2.891 7.467 4.451 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HA . . . . . . . . . c30496_6e5h 1 . 3 . 1219 . 1 1 22 ARG HB2 H 2.137 9.186 2.087 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HB2 . . . . . . . . . c30496_6e5h 1 . 3 . 1220 . 1 1 22 ARG HB3 H 1.092 8.846 3.460 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HB3 . . . . . . . . . c30496_6e5h 1 . 3 . 1221 . 1 1 22 ARG HD2 H 0.872 11.251 3.955 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HD2 . . . . . . . . . c30496_6e5h 1 . 3 . 1222 . 1 1 22 ARG HD3 H 2.310 12.227 4.235 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HD3 . . . . . . . . . c30496_6e5h 1 . 3 . 1223 . 1 1 22 ARG HE H 1.990 11.130 1.554 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HE . . . . . . . . . c30496_6e5h 1 . 3 . 1224 . 1 1 22 ARG HG2 H 2.710 9.952 4.942 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HG2 . . . . . . . . . c30496_6e5h 1 . 3 . 1225 . 1 1 22 ARG HG3 H 3.715 10.328 3.541 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HG3 . . . . . . . . . c30496_6e5h 1 . 3 . 1226 . 1 1 22 ARG HH11 H 1.647 13.882 3.688 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HH11 . . . . . . . . . c30496_6e5h 1 . 3 . 1227 . 1 1 22 ARG HH12 H 1.515 15.027 2.393 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HH12 . . . . . . . . . c30496_6e5h 1 . 3 . 1228 . 1 1 22 ARG HH21 H 1.623 14.311 0.209 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HH21 . . . . . . . . . c30496_6e5h 1 . 3 . 1229 . 1 1 22 ARG HH22 H 1.833 12.616 -0.144 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HH22 . . . . . . . . . c30496_6e5h 1 . 3 . 1230 . 1 1 22 ARG N N 4.244 7.769 2.929 . . . 1.0 . . . . . . . . . . . . A . 22 ARG N . . . . . . . . . c30496_6e5h 1 . 3 . 1231 . 1 1 22 ARG NE N 1.888 11.836 2.234 . . . 1.0 . . . . . . . . . . . . A . 22 ARG NE . . . . . . . . . c30496_6e5h 1 . 3 . 1232 . 1 1 22 ARG NH1 N 1.628 14.080 2.706 . . . 1.0 . . . . . . . . . . . . A . 22 ARG NH1 . . . . . . . . . c30496_6e5h 1 . 3 . 1233 . 1 1 22 ARG NH2 N 1.730 13.366 0.528 . . . 1.0 . . . . . . . . . . . . A . 22 ARG NH2 . . . . . . . . . c30496_6e5h 1 . 3 . 1234 . 1 1 22 ARG O O 2.318 6.306 1.496 . . . 1.0 . . . . . . . . . . . . A . 22 ARG O . . . . . . . . . c30496_6e5h 1 . 3 . 1235 . 1 1 23 TYR C C -0.922 4.967 3.347 . . . 1.0 . . . . . . . . . . . . A . 23 TYR C . . . . . . . . . c30496_6e5h 1 . 3 . 1236 . 1 1 23 TYR CA C 0.513 4.758 2.904 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CA . . . . . . . . . c30496_6e5h 1 . 3 . 1237 . 1 1 23 TYR CB C 1.004 3.384 3.360 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CB . . . . . . . . . c30496_6e5h 1 . 3 . 1238 . 1 1 23 TYR CD1 C 3.465 3.468 3.893 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CD1 . . . . . . . . . c30496_6e5h 1 . 3 . 1239 . 1 1 23 TYR CD2 C 2.793 2.492 1.828 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CD2 . . . . . . . . . c30496_6e5h 1 . 3 . 1240 . 1 1 23 TYR CE1 C 4.786 3.217 3.589 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CE1 . . . . . . . . . c30496_6e5h 1 . 3 . 1241 . 1 1 23 TYR CE2 C 4.114 2.237 1.516 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CE2 . . . . . . . . . c30496_6e5h 1 . 3 . 1242 . 1 1 23 TYR CG C 2.448 3.110 3.020 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CG . . . . . . . . . c30496_6e5h 1 . 3 . 1243 . 1 1 23 TYR CZ C 5.107 2.602 2.400 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CZ . . . . . . . . . c30496_6e5h 1 . 3 . 1244 . 1 1 23 TYR H H 1.290 6.011 4.409 . . . 1.0 . . . . . . . . . . . . A . 23 TYR H . . . . . . . . . c30496_6e5h 1 . 3 . 1245 . 1 1 23 TYR HA H 0.562 4.815 1.829 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HA . . . . . . . . . c30496_6e5h 1 . 3 . 1246 . 1 1 23 TYR HB2 H 0.893 3.305 4.428 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HB2 . . . . . . . . . c30496_6e5h 1 . 3 . 1247 . 1 1 23 TYR HB3 H 0.402 2.625 2.883 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HB3 . . . . . . . . . c30496_6e5h 1 . 3 . 1248 . 1 1 23 TYR HD1 H 3.209 3.952 4.826 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HD1 . . . . . . . . . c30496_6e5h 1 . 3 . 1249 . 1 1 23 TYR HD2 H 2.011 2.213 1.135 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HD2 . . . . . . . . . c30496_6e5h 1 . 3 . 1250 . 1 1 23 TYR HE1 H 5.561 3.505 4.282 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HE1 . . . . . . . . . c30496_6e5h 1 . 3 . 1251 . 1 1 23 TYR HE2 H 4.361 1.757 0.585 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HE2 . . . . . . . . . c30496_6e5h 1 . 3 . 1252 . 1 1 23 TYR HH H 6.570 2.475 1.151 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HH . . . . . . . . . c30496_6e5h 1 . 3 . 1253 . 1 1 23 TYR N N 1.340 5.816 3.450 . . . 1.0 . . . . . . . . . . . . A . 23 TYR N . . . . . . . . . c30496_6e5h 1 . 3 . 1254 . 1 1 23 TYR O O -1.189 5.202 4.528 . . . 1.0 . . . . . . . . . . . . A . 23 TYR O . . . . . . . . . c30496_6e5h 1 . 3 . 1255 . 1 1 23 TYR OH O 6.427 2.348 2.099 . . . 1.0 . . . . . . . . . . . . A . 23 TYR OH . . . . . . . . . c30496_6e5h 1 . 3 . 1256 . 1 1 24 GLU C C -4.067 3.917 2.307 . . . 1.0 . . . . . . . . . . . . A . 24 GLU C . . . . . . . . . c30496_6e5h 1 . 3 . 1257 . 1 1 24 GLU CA C -3.243 5.127 2.709 . . . 1.0 . . . . . . . . . . . . A . 24 GLU CA . . . . . . . . . c30496_6e5h 1 . 3 . 1258 . 1 1 24 GLU CB C -3.768 6.373 1.994 . . . 1.0 . . . . . . . . . . . . A . 24 GLU CB . . . . . . . . . c30496_6e5h 1 . 3 . 1259 . 1 1 24 GLU CD C -3.578 8.853 1.614 . . . 1.0 . . . . . . . . . . . . A . 24 GLU CD . . . . . . . . . c30496_6e5h 1 . 3 . 1260 . 1 1 24 GLU CG C -3.013 7.648 2.332 . . . 1.0 . . . . . . . . . . . . A . 24 GLU CG . . . . . . . . . c30496_6e5h 1 . 3 . 1261 . 1 1 24 GLU H H -1.569 4.706 1.478 . . . 1.0 . . . . . . . . . . . . A . 24 GLU H . . . . . . . . . c30496_6e5h 1 . 3 . 1262 . 1 1 24 GLU HA H -3.331 5.268 3.775 . . . 1.0 . . . . . . . . . . . . A . 24 GLU HA . . . . . . . . . c30496_6e5h 1 . 3 . 1263 . 1 1 24 GLU HB2 H -3.703 6.216 0.930 . . . 1.0 . . . . . . . . . . . . A . 24 GLU HB2 . . . . . . . . . c30496_6e5h 1 . 3 . 1264 . 1 1 24 GLU HB3 H -4.804 6.515 2.261 . . . 1.0 . . . . . . . . . . . . A . 24 GLU HB3 . . . . . . . . . c30496_6e5h 1 . 3 . 1265 . 1 1 24 GLU HG2 H -3.076 7.820 3.396 . . . 1.0 . . . . . . . . . . . . A . 24 GLU HG2 . . . . . . . . . c30496_6e5h 1 . 3 . 1266 . 1 1 24 GLU HG3 H -1.979 7.527 2.047 . . . 1.0 . . . . . . . . . . . . A . 24 GLU HG3 . . . . . . . . . c30496_6e5h 1 . 3 . 1267 . 1 1 24 GLU N N -1.840 4.909 2.405 . . . 1.0 . . . . . . . . . . . . A . 24 GLU N . . . . . . . . . c30496_6e5h 1 . 3 . 1268 . 1 1 24 GLU O O -4.396 3.736 1.134 . . . 1.0 . . . . . . . . . . . . A . 24 GLU O . . . . . . . . . c30496_6e5h 1 . 3 . 1269 . 1 1 24 GLU OE1 O -3.145 9.130 0.477 . . . 1.0 . . . . . . . . . . . . A . 24 GLU OE1 . . . . . . . . . c30496_6e5h 1 . 3 . 1270 . 1 1 24 GLU OE2 O -4.449 9.540 2.186 . . . 1.0 . . . . . . . . . . . . A . 24 GLU OE2 . . . . . . . . . c30496_6e5h 1 . 3 . 1271 . 1 1 25 VAL C C -6.676 2.335 3.047 . . . 1.0 . . . . . . . . . . . . A . 25 VAL C . . . . . . . . . c30496_6e5h 1 . 3 . 1272 . 1 1 25 VAL CA C -5.213 1.920 3.045 . . . 1.0 . . . . . . . . . . . . A . 25 VAL CA . . . . . . . . . c30496_6e5h 1 . 3 . 1273 . 1 1 25 VAL CB C -4.988 0.824 4.109 . . . 1.0 . . . . . . . . . . . . A . 25 VAL CB . . . . . . . . . c30496_6e5h 1 . 3 . 1274 . 1 1 25 VAL CG1 C -5.913 -0.360 3.865 . . . 1.0 . . . . . . . . . . . . A . 25 VAL CG1 . . . . . . . . . c30496_6e5h 1 . 3 . 1275 . 1 1 25 VAL CG2 C -3.533 0.375 4.118 . . . 1.0 . . . . . . . . . . . . A . 25 VAL CG2 . . . . . . . . . c30496_6e5h 1 . 3 . 1276 . 1 1 25 VAL H H -4.044 3.255 4.188 . . . 1.0 . . . . . . . . . . . . A . 25 VAL H . . . . . . . . . c30496_6e5h 1 . 3 . 1277 . 1 1 25 VAL HA H -4.962 1.517 2.073 . . . 1.0 . . . . . . . . . . . . A . 25 VAL HA . . . . . . . . . c30496_6e5h 1 . 3 . 1278 . 1 1 25 VAL HB H -5.221 1.241 5.078 . . . 1.0 . . . . . . . . . . . . A . 25 VAL HB . . . . . . . . . c30496_6e5h 1 . 3 . 1279 . 1 1 25 VAL HG11 H -5.712 -0.777 2.890 . . . 1.0 . . . . . . . . . . . . A . 25 VAL HG11 . . . . . . . . . c30496_6e5h 1 . 3 . 1280 . 1 1 25 VAL HG12 H -6.940 -0.028 3.908 . . . 1.0 . . . . . . . . . . . . A . 25 VAL HG12 . . . . . . . . . c30496_6e5h 1 . 3 . 1281 . 1 1 25 VAL HG13 H -5.743 -1.112 4.621 . . . 1.0 . . . . . . . . . . . . A . 25 VAL HG13 . . . . . . . . . c30496_6e5h 1 . 3 . 1282 . 1 1 25 VAL HG21 H -2.897 1.213 4.362 . . . 1.0 . . . . . . . . . . . . A . 25 VAL HG21 . . . . . . . . . c30496_6e5h 1 . 3 . 1283 . 1 1 25 VAL HG22 H -3.268 -0.004 3.145 . . . 1.0 . . . . . . . . . . . . A . 25 VAL HG22 . . . . . . . . . c30496_6e5h 1 . 3 . 1284 . 1 1 25 VAL HG23 H -3.400 -0.404 4.855 . . . 1.0 . . . . . . . . . . . . A . 25 VAL HG23 . . . . . . . . . c30496_6e5h 1 . 3 . 1285 . 1 1 25 VAL N N -4.378 3.082 3.281 . . . 1.0 . . . . . . . . . . . . A . 25 VAL N . . . . . . . . . c30496_6e5h 1 . 3 . 1286 . 1 1 25 VAL O O -7.250 2.624 4.097 . . . 1.0 . . . . . . . . . . . . A . 25 VAL O . . . . . . . . . c30496_6e5h 1 . 3 . 1287 . 1 1 26 HIS C C -9.522 1.543 1.765 . . . 1.0 . . . . . . . . . . . . A . 26 HIS C . . . . . . . . . c30496_6e5h 1 . 3 . 1288 . 1 1 26 HIS CA C -8.655 2.787 1.739 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CA . . . . . . . . . c30496_6e5h 1 . 3 . 1289 . 1 1 26 HIS CB C -8.878 3.565 0.439 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CB . . . . . . . . . c30496_6e5h 1 . 3 . 1290 . 1 1 26 HIS CD2 C -11.362 4.310 0.592 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CD2 . . . . . . . . . c30496_6e5h 1 . 3 . 1291 . 1 1 26 HIS CE1 C -11.054 6.474 0.481 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CE1 . . . . . . . . . c30496_6e5h 1 . 3 . 1292 . 1 1 26 HIS CG C -10.030 4.525 0.494 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CG . . . . . . . . . c30496_6e5h 1 . 3 . 1293 . 1 1 26 HIS H H -6.757 2.149 1.062 . . . 1.0 . . . . . . . . . . . . A . 26 HIS H . . . . . . . . . c30496_6e5h 1 . 3 . 1294 . 1 1 26 HIS HA H -8.908 3.414 2.578 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HA . . . . . . . . . c30496_6e5h 1 . 3 . 1295 . 1 1 26 HIS HB2 H -7.989 4.126 0.205 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HB2 . . . . . . . . . c30496_6e5h 1 . 3 . 1296 . 1 1 26 HIS HB3 H -9.071 2.864 -0.354 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HB3 . . . . . . . . . c30496_6e5h 1 . 3 . 1297 . 1 1 26 HIS HD1 H -9.015 6.373 0.351 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HD1 . . . . . . . . . c30496_6e5h 1 . 3 . 1298 . 1 1 26 HIS HD2 H -11.852 3.351 0.666 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HD2 . . . . . . . . . c30496_6e5h 1 . 3 . 1299 . 1 1 26 HIS HE1 H -11.237 7.538 0.443 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HE1 . . . . . . . . . c30496_6e5h 1 . 3 . 1300 . 1 1 26 HIS HE2 H -12.940 5.687 0.467 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HE2 . . . . . . . . . c30496_6e5h 1 . 3 . 1301 . 1 1 26 HIS N N -7.265 2.394 1.868 . . . 1.0 . . . . . . . . . . . . A . 26 HIS N . . . . . . . . . c30496_6e5h 1 . 3 . 1302 . 1 1 26 HIS ND1 N -9.872 5.895 0.427 . . . 1.0 . . . . . . . . . . . . A . 26 HIS ND1 . . . . . . . . . c30496_6e5h 1 . 3 . 1303 . 1 1 26 HIS NE2 N -11.975 5.538 0.581 . . . 1.0 . . . . . . . . . . . . A . 26 HIS NE2 . . . . . . . . . c30496_6e5h 1 . 3 . 1304 . 1 1 26 HIS O O -9.573 0.790 0.791 . . . 1.0 . . . . . . . . . . . . A . 26 HIS O . . . . . . . . . c30496_6e5h 1 . 3 . 1305 . 1 1 27 CYS C C -12.185 0.426 3.924 . . . 1.0 . . . . . . . . . . . . A . 27 CYS C . . . . . . . . . c30496_6e5h 1 . 3 . 1306 . 1 1 27 CYS CA C -10.969 0.117 3.061 . . . 1.0 . . . . . . . . . . . . A . 27 CYS CA . . . . . . . . . c30496_6e5h 1 . 3 . 1307 . 1 1 27 CYS CB C -10.131 -0.993 3.694 . . . 1.0 . . . . . . . . . . . . A . 27 CYS CB . . . . . . . . . c30496_6e5h 1 . 3 . 1308 . 1 1 27 CYS H H -10.094 1.947 3.631 . . . 1.0 . . . . . . . . . . . . A . 27 CYS H . . . . . . . . . c30496_6e5h 1 . 3 . 1309 . 1 1 27 CYS HA H -11.300 -0.203 2.086 . . . 1.0 . . . . . . . . . . . . A . 27 CYS HA . . . . . . . . . c30496_6e5h 1 . 3 . 1310 . 1 1 27 CYS HB2 H -9.111 -0.898 3.358 . . . 1.0 . . . . . . . . . . . . A . 27 CYS HB2 . . . . . . . . . c30496_6e5h 1 . 3 . 1311 . 1 1 27 CYS HB3 H -10.162 -0.885 4.768 . . . 1.0 . . . . . . . . . . . . A . 27 CYS HB3 . . . . . . . . . c30496_6e5h 1 . 3 . 1312 . 1 1 27 CYS N N -10.165 1.307 2.892 . . . 1.0 . . . . . . . . . . . . A . 27 CYS N . . . . . . . . . c30496_6e5h 1 . 3 . 1313 . 1 1 27 CYS O O -13.323 0.336 3.473 . . . 1.0 . . . . . . . . . . . . A . 27 CYS O . . . . . . . . . c30496_6e5h 1 . 3 . 1314 . 1 1 27 CYS SG S -10.695 -2.675 3.290 . . . 1.0 . . . . . . . . . . . . A . 27 CYS SG . . . . . . . . . c30496_6e5h 1 . 3 . 1315 . 1 1 28 NH2 HN1 H -11.004 0.844 5.465 . . . 1.0 . . . . . . . . . . . . A . 28 NH2 HN1 . . . . . . . . . c30496_6e5h 1 . 3 . 1316 . 1 1 28 NH2 HN2 H -12.702 1.000 5.751 . . . 1.0 . . . . . . . . . . . . A . 28 NH2 HN2 . . . . . . . . . c30496_6e5h 1 . 3 . 1317 . 1 1 28 NH2 N N -11.939 0.793 5.170 . . . 1.0 . . . . . . . . . . . . A . 28 NH2 N . . . . . . . . . c30496_6e5h 1 . 4 . 1318 . 1 1 1 ASN C C 9.831 -4.371 0.444 . . . 1.0 . . . . . . . . . . . . A . 1 ASN C . . . . . . . . . c30496_6e5h 1 . 4 . 1319 . 1 1 1 ASN CA C 10.544 -5.577 1.035 . . . 1.0 . . . . . . . . . . . . A . 1 ASN CA . . . . . . . . . c30496_6e5h 1 . 4 . 1320 . 1 1 1 ASN CB C 11.643 -6.059 0.080 . . . 1.0 . . . . . . . . . . . . A . 1 ASN CB . . . . . . . . . c30496_6e5h 1 . 4 . 1321 . 1 1 1 ASN CG C 12.463 -7.196 0.657 . . . 1.0 . . . . . . . . . . . . A . 1 ASN CG . . . . . . . . . c30496_6e5h 1 . 4 . 1322 . 1 1 1 ASN H1 H 8.828 -6.320 1.961 . . . 1.0 . . . . . . . . . . . . A . 1 ASN H1 . . . . . . . . . c30496_6e5h 1 . 4 . 1323 . 1 1 1 ASN H2 H 10.056 -7.472 1.750 . . . 1.0 . . . . . . . . . . . . A . 1 ASN H2 . . . . . . . . . c30496_6e5h 1 . 4 . 1324 . 1 1 1 ASN H3 H 9.126 -6.979 0.429 . . . 1.0 . . . . . . . . . . . . A . 1 ASN H3 . . . . . . . . . c30496_6e5h 1 . 4 . 1325 . 1 1 1 ASN HA H 10.993 -5.285 1.970 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HA . . . . . . . . . c30496_6e5h 1 . 4 . 1326 . 1 1 1 ASN HB2 H 11.190 -6.400 -0.838 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HB2 . . . . . . . . . c30496_6e5h 1 . 4 . 1327 . 1 1 1 ASN HB3 H 12.307 -5.236 -0.135 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HB3 . . . . . . . . . c30496_6e5h 1 . 4 . 1328 . 1 1 1 ASN HD21 H 14.059 -6.606 -0.370 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HD21 . . . . . . . . . c30496_6e5h 1 . 4 . 1329 . 1 1 1 ASN HD22 H 14.277 -8.001 0.630 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HD22 . . . . . . . . . c30496_6e5h 1 . 4 . 1330 . 1 1 1 ASN N N 9.573 -6.662 1.310 . . . 1.0 . . . . . . . . . . . . A . 1 ASN N . . . . . . . . . c30496_6e5h 1 . 4 . 1331 . 1 1 1 ASN ND2 N 13.725 -7.276 0.265 . . . 1.0 . . . . . . . . . . . . A . 1 ASN ND2 . . . . . . . . . c30496_6e5h 1 . 4 . 1332 . 1 1 1 ASN O O 9.972 -3.249 0.934 . . . 1.0 . . . . . . . . . . . . A . 1 ASN O . . . . . . . . . c30496_6e5h 1 . 4 . 1333 . 1 1 1 ASN OD1 O 11.965 -8.000 1.441 . . . 1.0 . . . . . . . . . . . . A . 1 ASN OD1 . . . . . . . . . c30496_6e5h 1 . 4 . 1334 . 1 1 2 ASP C C 7.002 -3.345 -0.402 . . . 1.0 . . . . . . . . . . . . A . 2 ASP C . . . . . . . . . c30496_6e5h 1 . 4 . 1335 . 1 1 2 ASP CA C 8.256 -3.567 -1.226 . . . 1.0 . . . . . . . . . . . . A . 2 ASP CA . . . . . . . . . c30496_6e5h 1 . 4 . 1336 . 1 1 2 ASP CB C 7.865 -3.950 -2.654 . . . 1.0 . . . . . . . . . . . . A . 2 ASP CB . . . . . . . . . c30496_6e5h 1 . 4 . 1337 . 1 1 2 ASP CG C 9.053 -4.077 -3.581 . . . 1.0 . . . . . . . . . . . . A . 2 ASP CG . . . . . . . . . c30496_6e5h 1 . 4 . 1338 . 1 1 2 ASP H H 9.023 -5.517 -0.978 . . . 1.0 . . . . . . . . . . . . A . 2 ASP H . . . . . . . . . c30496_6e5h 1 . 4 . 1339 . 1 1 2 ASP HA H 8.837 -2.658 -1.245 . . . 1.0 . . . . . . . . . . . . A . 2 ASP HA . . . . . . . . . c30496_6e5h 1 . 4 . 1340 . 1 1 2 ASP HB2 H 7.347 -4.896 -2.637 . . . 1.0 . . . . . . . . . . . . A . 2 ASP HB2 . . . . . . . . . c30496_6e5h 1 . 4 . 1341 . 1 1 2 ASP HB3 H 7.204 -3.194 -3.049 . . . 1.0 . . . . . . . . . . . . A . 2 ASP HB3 . . . . . . . . . c30496_6e5h 1 . 4 . 1342 . 1 1 2 ASP N N 9.060 -4.611 -0.609 . . . 1.0 . . . . . . . . . . . . A . 2 ASP N . . . . . . . . . c30496_6e5h 1 . 4 . 1343 . 1 1 2 ASP O O 6.111 -4.195 -0.367 . . . 1.0 . . . . . . . . . . . . A . 2 ASP O . . . . . . . . . c30496_6e5h 1 . 4 . 1344 . 1 1 2 ASP OD1 O 9.609 -5.188 -3.688 . . . 1.0 . . . . . . . . . . . . A . 2 ASP OD1 . . . . . . . . . c30496_6e5h 1 . 4 . 1345 . 1 1 2 ASP OD2 O 9.454 -3.063 -4.192 . . . 1.0 . . . . . . . . . . . . A . 2 ASP OD2 . . . . . . . . . c30496_6e5h 1 . 4 . 1346 . 1 1 3 LYS C C 4.531 -1.840 0.451 . . . 1.0 . . . . . . . . . . . . A . 3 LYS C . . . . . . . . . c30496_6e5h 1 . 4 . 1347 . 1 1 3 LYS CA C 5.861 -1.896 1.178 . . . 1.0 . . . . . . . . . . . . A . 3 LYS CA . . . . . . . . . c30496_6e5h 1 . 4 . 1348 . 1 1 3 LYS CB C 6.103 -0.571 1.916 . . . 1.0 . . . . . . . . . . . . A . 3 LYS CB . . . . . . . . . c30496_6e5h 1 . 4 . 1349 . 1 1 3 LYS CD C 8.609 -0.258 1.905 . . . 1.0 . . . . . . . . . . . . A . 3 LYS CD . . . . . . . . . c30496_6e5h 1 . 4 . 1350 . 1 1 3 LYS CE C 9.873 -0.240 2.743 . . . 1.0 . . . . . . . . . . . . A . 3 LYS CE . . . . . . . . . c30496_6e5h 1 . 4 . 1351 . 1 1 3 LYS CG C 7.375 -0.531 2.753 . . . 1.0 . . . . . . . . . . . . A . 3 LYS CG . . . . . . . . . c30496_6e5h 1 . 4 . 1352 . 1 1 3 LYS H H 7.607 -1.504 0.059 . . . 1.0 . . . . . . . . . . . . A . 3 LYS H . . . . . . . . . c30496_6e5h 1 . 4 . 1353 . 1 1 3 LYS HA H 5.827 -2.698 1.899 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HA . . . . . . . . . c30496_6e5h 1 . 4 . 1354 . 1 1 3 LYS HB2 H 6.159 0.222 1.186 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HB2 . . . . . . . . . c30496_6e5h 1 . 4 . 1355 . 1 1 3 LYS HB3 H 5.263 -0.383 2.568 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HB3 . . . . . . . . . c30496_6e5h 1 . 4 . 1356 . 1 1 3 LYS HD2 H 8.699 -1.032 1.160 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HD2 . . . . . . . . . c30496_6e5h 1 . 4 . 1357 . 1 1 3 LYS HD3 H 8.495 0.700 1.420 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HD3 . . . . . . . . . c30496_6e5h 1 . 4 . 1358 . 1 1 3 LYS HE2 H 10.697 0.080 2.124 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HE2 . . . . . . . . . c30496_6e5h 1 . 4 . 1359 . 1 1 3 LYS HE3 H 9.743 0.460 3.555 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HE3 . . . . . . . . . c30496_6e5h 1 . 4 . 1360 . 1 1 3 LYS HG2 H 7.279 0.252 3.490 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HG2 . . . . . . . . . c30496_6e5h 1 . 4 . 1361 . 1 1 3 LYS HG3 H 7.494 -1.480 3.252 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HG3 . . . . . . . . . c30496_6e5h 1 . 4 . 1362 . 1 1 3 LYS HZ1 H 9.452 -1.866 3.986 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HZ1 . . . . . . . . . c30496_6e5h 1 . 4 . 1363 . 1 1 3 LYS HZ2 H 11.103 -1.563 3.791 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HZ2 . . . . . . . . . c30496_6e5h 1 . 4 . 1364 . 1 1 3 LYS HZ3 H 10.224 -2.290 2.542 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HZ3 . . . . . . . . . c30496_6e5h 1 . 4 . 1365 . 1 1 3 LYS N N 6.933 -2.189 0.241 . . . 1.0 . . . . . . . . . . . . A . 3 LYS N . . . . . . . . . c30496_6e5h 1 . 4 . 1366 . 1 1 3 LYS NZ N 10.185 -1.581 3.305 . . . 1.0 . . . . . . . . . . . . A . 3 LYS NZ . . . . . . . . . c30496_6e5h 1 . 4 . 1367 . 1 1 3 LYS O O 3.528 -2.342 0.945 . . . 1.0 . . . . . . . . . . . . A . 3 LYS O . . . . . . . . . c30496_6e5h 1 . 4 . 1368 . 1 1 4 CYS C C 2.819 -2.539 -1.905 . . . 1.0 . . . . . . . . . . . . A . 4 CYS C . . . . . . . . . c30496_6e5h 1 . 4 . 1369 . 1 1 4 CYS CA C 3.335 -1.150 -1.541 . . . 1.0 . . . . . . . . . . . . A . 4 CYS CA . . . . . . . . . c30496_6e5h 1 . 4 . 1370 . 1 1 4 CYS CB C 3.609 -0.335 -2.804 . . . 1.0 . . . . . . . . . . . . A . 4 CYS CB . . . . . . . . . c30496_6e5h 1 . 4 . 1371 . 1 1 4 CYS H H 5.374 -0.855 -1.066 . . . 1.0 . . . . . . . . . . . . A . 4 CYS H . . . . . . . . . c30496_6e5h 1 . 4 . 1372 . 1 1 4 CYS HA H 2.584 -0.644 -0.955 . . . 1.0 . . . . . . . . . . . . A . 4 CYS HA . . . . . . . . . c30496_6e5h 1 . 4 . 1373 . 1 1 4 CYS HB2 H 4.468 -0.751 -3.309 . . . 1.0 . . . . . . . . . . . . A . 4 CYS HB2 . . . . . . . . . c30496_6e5h 1 . 4 . 1374 . 1 1 4 CYS HB3 H 2.750 -0.392 -3.456 . . . 1.0 . . . . . . . . . . . . A . 4 CYS HB3 . . . . . . . . . c30496_6e5h 1 . 4 . 1375 . 1 1 4 CYS N N 4.537 -1.244 -0.730 . . . 1.0 . . . . . . . . . . . . A . 4 CYS N . . . . . . . . . c30496_6e5h 1 . 4 . 1376 . 1 1 4 CYS O O 1.622 -2.806 -1.819 . . . 1.0 . . . . . . . . . . . . A . 4 CYS O . . . . . . . . . c30496_6e5h 1 . 4 . 1377 . 1 1 4 CYS SG S 3.956 1.425 -2.493 . . . 1.0 . . . . . . . . . . . . A . 4 CYS SG . . . . . . . . . c30496_6e5h 1 . 4 . 1378 . 1 1 5 LYS C C 2.814 -5.554 -1.459 . . . 1.0 . . . . . . . . . . . . A . 5 LYS C . . . . . . . . . c30496_6e5h 1 . 4 . 1379 . 1 1 5 LYS CA C 3.370 -4.791 -2.652 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CA . . . . . . . . . c30496_6e5h 1 . 4 . 1380 . 1 1 5 LYS CB C 4.582 -5.535 -3.218 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CB . . . . . . . . . c30496_6e5h 1 . 4 . 1381 . 1 1 5 LYS CD C 4.178 -5.171 -5.678 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CD . . . . . . . . . c30496_6e5h 1 . 4 . 1382 . 1 1 5 LYS CE C 4.804 -4.733 -6.994 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CE . . . . . . . . . c30496_6e5h 1 . 4 . 1383 . 1 1 5 LYS CG C 5.126 -4.950 -4.511 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CG . . . . . . . . . c30496_6e5h 1 . 4 . 1384 . 1 1 5 LYS H H 4.676 -3.173 -2.267 . . . 1.0 . . . . . . . . . . . . A . 5 LYS H . . . . . . . . . c30496_6e5h 1 . 4 . 1385 . 1 1 5 LYS HA H 2.607 -4.729 -3.411 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HA . . . . . . . . . c30496_6e5h 1 . 4 . 1386 . 1 1 5 LYS HB2 H 5.372 -5.518 -2.483 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HB2 . . . . . . . . . c30496_6e5h 1 . 4 . 1387 . 1 1 5 LYS HB3 H 4.302 -6.562 -3.404 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HB3 . . . . . . . . . c30496_6e5h 1 . 4 . 1388 . 1 1 5 LYS HD2 H 3.937 -6.221 -5.738 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HD2 . . . . . . . . . c30496_6e5h 1 . 4 . 1389 . 1 1 5 LYS HD3 H 3.277 -4.601 -5.512 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HD3 . . . . . . . . . c30496_6e5h 1 . 4 . 1390 . 1 1 5 LYS HE2 H 4.088 -4.886 -7.787 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HE2 . . . . . . . . . c30496_6e5h 1 . 4 . 1391 . 1 1 5 LYS HE3 H 5.048 -3.684 -6.930 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HE3 . . . . . . . . . c30496_6e5h 1 . 4 . 1392 . 1 1 5 LYS HG2 H 5.272 -3.887 -4.380 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HG2 . . . . . . . . . c30496_6e5h 1 . 4 . 1393 . 1 1 5 LYS HG3 H 6.071 -5.417 -4.734 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HG3 . . . . . . . . . c30496_6e5h 1 . 4 . 1394 . 1 1 5 LYS HZ1 H 5.859 -6.519 -7.235 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HZ1 . . . . . . . . . c30496_6e5h 1 . 4 . 1395 . 1 1 5 LYS HZ2 H 6.801 -5.246 -6.645 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HZ2 . . . . . . . . . c30496_6e5h 1 . 4 . 1396 . 1 1 5 LYS HZ3 H 6.360 -5.286 -8.275 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HZ3 . . . . . . . . . c30496_6e5h 1 . 4 . 1397 . 1 1 5 LYS N N 3.733 -3.432 -2.269 . . . 1.0 . . . . . . . . . . . . A . 5 LYS N . . . . . . . . . c30496_6e5h 1 . 4 . 1398 . 1 1 5 LYS NZ N 6.041 -5.498 -7.307 . . . 1.0 . . . . . . . . . . . . A . 5 LYS NZ . . . . . . . . . c30496_6e5h 1 . 4 . 1399 . 1 1 5 LYS O O 1.793 -6.235 -1.569 . . . 1.0 . . . . . . . . . . . . A . 5 LYS O . . . . . . . . . c30496_6e5h 1 . 4 . 1400 . 1 1 6 GLU C C 1.740 -5.617 1.397 . . . 1.0 . . . . . . . . . . . . A . 6 GLU C . . . . . . . . . c30496_6e5h 1 . 4 . 1401 . 1 1 6 GLU CA C 3.084 -6.124 0.892 . . . 1.0 . . . . . . . . . . . . A . 6 GLU CA . . . . . . . . . c30496_6e5h 1 . 4 . 1402 . 1 1 6 GLU CB C 4.145 -5.959 1.982 . . . 1.0 . . . . . . . . . . . . A . 6 GLU CB . . . . . . . . . c30496_6e5h 1 . 4 . 1403 . 1 1 6 GLU CD C 6.481 -6.485 2.778 . . . 1.0 . . . . . . . . . . . . A . 6 GLU CD . . . . . . . . . c30496_6e5h 1 . 4 . 1404 . 1 1 6 GLU CG C 5.464 -6.651 1.669 . . . 1.0 . . . . . . . . . . . . A . 6 GLU CG . . . . . . . . . c30496_6e5h 1 . 4 . 1405 . 1 1 6 GLU H H 4.272 -4.837 -0.298 . . . 1.0 . . . . . . . . . . . . A . 6 GLU H . . . . . . . . . c30496_6e5h 1 . 4 . 1406 . 1 1 6 GLU HA H 2.988 -7.171 0.650 . . . 1.0 . . . . . . . . . . . . A . 6 GLU HA . . . . . . . . . c30496_6e5h 1 . 4 . 1407 . 1 1 6 GLU HB2 H 4.341 -4.905 2.120 . . . 1.0 . . . . . . . . . . . . A . 6 GLU HB2 . . . . . . . . . c30496_6e5h 1 . 4 . 1408 . 1 1 6 GLU HB3 H 3.760 -6.366 2.905 . . . 1.0 . . . . . . . . . . . . A . 6 GLU HB3 . . . . . . . . . c30496_6e5h 1 . 4 . 1409 . 1 1 6 GLU HG2 H 5.280 -7.706 1.527 . . . 1.0 . . . . . . . . . . . . A . 6 GLU HG2 . . . . . . . . . c30496_6e5h 1 . 4 . 1410 . 1 1 6 GLU HG3 H 5.873 -6.234 0.760 . . . 1.0 . . . . . . . . . . . . A . 6 GLU HG3 . . . . . . . . . c30496_6e5h 1 . 4 . 1411 . 1 1 6 GLU N N 3.484 -5.424 -0.322 . . . 1.0 . . . . . . . . . . . . A . 6 GLU N . . . . . . . . . c30496_6e5h 1 . 4 . 1412 . 1 1 6 GLU O O 0.902 -6.397 1.843 . . . 1.0 . . . . . . . . . . . . A . 6 GLU O . . . . . . . . . c30496_6e5h 1 . 4 . 1413 . 1 1 6 GLU OE1 O 6.309 -7.105 3.848 . . . 1.0 . . . . . . . . . . . . A . 6 GLU OE1 . . . . . . . . . c30496_6e5h 1 . 4 . 1414 . 1 1 6 GLU OE2 O 7.469 -5.748 2.581 . . . 1.0 . . . . . . . . . . . . A . 6 GLU OE2 . . . . . . . . . c30496_6e5h 1 . 4 . 1415 . 1 1 7 LEU C C -0.856 -4.090 0.826 . . . 1.0 . . . . . . . . . . . . A . 7 LEU C . . . . . . . . . c30496_6e5h 1 . 4 . 1416 . 1 1 7 LEU CA C 0.290 -3.705 1.754 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CA . . . . . . . . . c30496_6e5h 1 . 4 . 1417 . 1 1 7 LEU CB C 0.437 -2.186 1.819 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CB . . . . . . . . . c30496_6e5h 1 . 4 . 1418 . 1 1 7 LEU CD1 C 1.698 -0.207 2.706 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CD1 . . . . . . . . . c30496_6e5h 1 . 4 . 1419 . 1 1 7 LEU CD2 C 0.697 -1.845 4.294 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CD2 . . . . . . . . . c30496_6e5h 1 . 4 . 1420 . 1 1 7 LEU CG C 1.354 -1.671 2.932 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CG . . . . . . . . . c30496_6e5h 1 . 4 . 1421 . 1 1 7 LEU H H 2.249 -3.734 0.958 . . . 1.0 . . . . . . . . . . . . A . 7 LEU H . . . . . . . . . c30496_6e5h 1 . 4 . 1422 . 1 1 7 LEU HA H 0.077 -4.077 2.744 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HA . . . . . . . . . c30496_6e5h 1 . 4 . 1423 . 1 1 7 LEU HB2 H 0.827 -1.845 0.871 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HB2 . . . . . . . . . c30496_6e5h 1 . 4 . 1424 . 1 1 7 LEU HB3 H -0.542 -1.759 1.962 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HB3 . . . . . . . . . c30496_6e5h 1 . 4 . 1425 . 1 1 7 LEU HD11 H 2.328 0.145 3.509 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD11 . . . . . . . . . c30496_6e5h 1 . 4 . 1426 . 1 1 7 LEU HD12 H 0.790 0.376 2.682 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD12 . . . . . . . . . c30496_6e5h 1 . 4 . 1427 . 1 1 7 LEU HD13 H 2.221 -0.098 1.766 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD13 . . . . . . . . . c30496_6e5h 1 . 4 . 1428 . 1 1 7 LEU HD21 H 1.359 -1.479 5.063 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD21 . . . . . . . . . c30496_6e5h 1 . 4 . 1429 . 1 1 7 LEU HD22 H 0.491 -2.891 4.465 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD22 . . . . . . . . . c30496_6e5h 1 . 4 . 1430 . 1 1 7 LEU HD23 H -0.228 -1.286 4.319 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD23 . . . . . . . . . c30496_6e5h 1 . 4 . 1431 . 1 1 7 LEU HG H 2.272 -2.240 2.926 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HG . . . . . . . . . c30496_6e5h 1 . 4 . 1432 . 1 1 7 LEU N N 1.536 -4.311 1.317 . . . 1.0 . . . . . . . . . . . . A . 7 LEU N . . . . . . . . . c30496_6e5h 1 . 4 . 1433 . 1 1 7 LEU O O -1.954 -4.404 1.284 . . . 1.0 . . . . . . . . . . . . A . 7 LEU O . . . . . . . . . c30496_6e5h 1 . 4 . 1434 . 1 1 8 LYS C C -1.939 -5.939 -1.364 . . . 1.0 . . . . . . . . . . . . A . 8 LYS C . . . . . . . . . c30496_6e5h 1 . 4 . 1435 . 1 1 8 LYS CA C -1.602 -4.455 -1.462 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CA . . . . . . . . . c30496_6e5h 1 . 4 . 1436 . 1 1 8 LYS CB C -1.131 -4.123 -2.881 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CB . . . . . . . . . c30496_6e5h 1 . 4 . 1437 . 1 1 8 LYS CD C -0.571 -2.369 -4.587 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CD . . . . . . . . . c30496_6e5h 1 . 4 . 1438 . 1 1 8 LYS CE C -0.580 -0.886 -4.907 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CE . . . . . . . . . c30496_6e5h 1 . 4 . 1439 . 1 1 8 LYS CG C -1.113 -2.636 -3.193 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CG . . . . . . . . . c30496_6e5h 1 . 4 . 1440 . 1 1 8 LYS H H 0.309 -3.819 -0.782 . . . 1.0 . . . . . . . . . . . . A . 8 LYS H . . . . . . . . . c30496_6e5h 1 . 4 . 1441 . 1 1 8 LYS HA H -2.492 -3.885 -1.247 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HA . . . . . . . . . c30496_6e5h 1 . 4 . 1442 . 1 1 8 LYS HB2 H -0.131 -4.507 -3.011 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HB2 . . . . . . . . . c30496_6e5h 1 . 4 . 1443 . 1 1 8 LYS HB3 H -1.788 -4.610 -3.587 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HB3 . . . . . . . . . c30496_6e5h 1 . 4 . 1444 . 1 1 8 LYS HD2 H 0.443 -2.734 -4.643 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HD2 . . . . . . . . . c30496_6e5h 1 . 4 . 1445 . 1 1 8 LYS HD3 H -1.185 -2.890 -5.307 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HD3 . . . . . . . . . c30496_6e5h 1 . 4 . 1446 . 1 1 8 LYS HE2 H -1.591 -0.518 -4.818 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HE2 . . . . . . . . . c30496_6e5h 1 . 4 . 1447 . 1 1 8 LYS HE3 H 0.051 -0.375 -4.194 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HE3 . . . . . . . . . c30496_6e5h 1 . 4 . 1448 . 1 1 8 LYS HG2 H -2.120 -2.251 -3.130 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HG2 . . . . . . . . . c30496_6e5h 1 . 4 . 1449 . 1 1 8 LYS HG3 H -0.488 -2.133 -2.472 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HG3 . . . . . . . . . c30496_6e5h 1 . 4 . 1450 . 1 1 8 LYS HZ1 H -0.613 -1.173 -6.976 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ1 . . . . . . . . . c30496_6e5h 1 . 4 . 1451 . 1 1 8 LYS HZ2 H 0.925 -0.846 -6.356 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ2 . . . . . . . . . c30496_6e5h 1 . 4 . 1452 . 1 1 8 LYS HZ3 H -0.207 0.399 -6.508 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ3 . . . . . . . . . c30496_6e5h 1 . 4 . 1453 . 1 1 8 LYS N N -0.590 -4.083 -0.476 . . . 1.0 . . . . . . . . . . . . A . 8 LYS N . . . . . . . . . c30496_6e5h 1 . 4 . 1454 . 1 1 8 LYS NZ N -0.084 -0.608 -6.281 . . . 1.0 . . . . . . . . . . . . A . 8 LYS NZ . . . . . . . . . c30496_6e5h 1 . 4 . 1455 . 1 1 8 LYS O O -3.072 -6.349 -1.623 . . . 1.0 . . . . . . . . . . . . A . 8 LYS O . . . . . . . . . c30496_6e5h 1 . 4 . 1456 . 1 1 9 LYS C C -1.904 -8.449 0.469 . . . 1.0 . . . . . . . . . . . . A . 9 LYS C . . . . . . . . . c30496_6e5h 1 . 4 . 1457 . 1 1 9 LYS CA C -1.129 -8.165 -0.815 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CA . . . . . . . . . c30496_6e5h 1 . 4 . 1458 . 1 1 9 LYS CB C 0.235 -8.859 -0.779 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CB . . . . . . . . . c30496_6e5h 1 . 4 . 1459 . 1 1 9 LYS CD C 1.562 -10.950 -0.454 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CD . . . . . . . . . c30496_6e5h 1 . 4 . 1460 . 1 1 9 LYS CE C 1.524 -12.432 -0.125 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CE . . . . . . . . . c30496_6e5h 1 . 4 . 1461 . 1 1 9 LYS CG C 0.169 -10.356 -0.539 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CG . . . . . . . . . c30496_6e5h 1 . 4 . 1462 . 1 1 9 LYS H H -0.050 -6.350 -0.863 . . . 1.0 . . . . . . . . . . . . A . 9 LYS H . . . . . . . . . c30496_6e5h 1 . 4 . 1463 . 1 1 9 LYS HA H -1.694 -8.538 -1.655 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HA . . . . . . . . . c30496_6e5h 1 . 4 . 1464 . 1 1 9 LYS HB2 H 0.734 -8.692 -1.722 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HB2 . . . . . . . . . c30496_6e5h 1 . 4 . 1465 . 1 1 9 LYS HB3 H 0.826 -8.417 0.010 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HB3 . . . . . . . . . c30496_6e5h 1 . 4 . 1466 . 1 1 9 LYS HD2 H 2.057 -10.816 -1.404 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HD2 . . . . . . . . . c30496_6e5h 1 . 4 . 1467 . 1 1 9 LYS HD3 H 2.114 -10.433 0.316 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HD3 . . . . . . . . . c30496_6e5h 1 . 4 . 1468 . 1 1 9 LYS HE2 H 0.991 -12.568 0.805 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HE2 . . . . . . . . . c30496_6e5h 1 . 4 . 1469 . 1 1 9 LYS HE3 H 1.004 -12.950 -0.916 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HE3 . . . . . . . . . c30496_6e5h 1 . 4 . 1470 . 1 1 9 LYS HG2 H -0.353 -10.544 0.387 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HG2 . . . . . . . . . c30496_6e5h 1 . 4 . 1471 . 1 1 9 LYS HG3 H -0.362 -10.821 -1.357 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HG3 . . . . . . . . . c30496_6e5h 1 . 4 . 1472 . 1 1 9 LYS HZ1 H 3.404 -12.916 -0.889 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HZ1 . . . . . . . . . c30496_6e5h 1 . 4 . 1473 . 1 1 9 LYS HZ2 H 2.835 -14.005 0.273 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HZ2 . . . . . . . . . c30496_6e5h 1 . 4 . 1474 . 1 1 9 LYS HZ3 H 3.418 -12.491 0.748 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HZ3 . . . . . . . . . c30496_6e5h 1 . 4 . 1475 . 1 1 9 LYS N N -0.944 -6.735 -0.999 . . . 1.0 . . . . . . . . . . . . A . 9 LYS N . . . . . . . . . c30496_6e5h 1 . 4 . 1476 . 1 1 9 LYS NZ N 2.890 -13.001 0.011 . . . 1.0 . . . . . . . . . . . . A . 9 LYS NZ . . . . . . . . . c30496_6e5h 1 . 4 . 1477 . 1 1 9 LYS O O -2.845 -9.242 0.475 . . . 1.0 . . . . . . . . . . . . A . 9 LYS O . . . . . . . . . c30496_6e5h 1 . 4 . 1478 . 1 1 10 ARG C C -3.579 -7.526 2.839 . . . 1.0 . . . . . . . . . . . . A . 10 ARG C . . . . . . . . . c30496_6e5h 1 . 4 . 1479 . 1 1 10 ARG CA C -2.131 -7.995 2.848 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CA . . . . . . . . . c30496_6e5h 1 . 4 . 1480 . 1 1 10 ARG CB C -1.354 -7.251 3.936 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CB . . . . . . . . . c30496_6e5h 1 . 4 . 1481 . 1 1 10 ARG CD C -1.161 -6.630 6.360 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CD . . . . . . . . . c30496_6e5h 1 . 4 . 1482 . 1 1 10 ARG CG C -1.938 -7.429 5.326 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CG . . . . . . . . . c30496_6e5h 1 . 4 . 1483 . 1 1 10 ARG CZ C -1.444 -5.971 8.722 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CZ . . . . . . . . . c30496_6e5h 1 . 4 . 1484 . 1 1 10 ARG H H -0.761 -7.155 1.472 . . . 1.0 . . . . . . . . . . . . A . 10 ARG H . . . . . . . . . c30496_6e5h 1 . 4 . 1485 . 1 1 10 ARG HA H -2.109 -9.051 3.064 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HA . . . . . . . . . c30496_6e5h 1 . 4 . 1486 . 1 1 10 ARG HB2 H -0.338 -7.613 3.947 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HB2 . . . . . . . . . c30496_6e5h 1 . 4 . 1487 . 1 1 10 ARG HB3 H -1.351 -6.197 3.703 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HB3 . . . . . . . . . c30496_6e5h 1 . 4 . 1488 . 1 1 10 ARG HD2 H -0.134 -6.964 6.357 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HD2 . . . . . . . . . c30496_6e5h 1 . 4 . 1489 . 1 1 10 ARG HD3 H -1.200 -5.585 6.089 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HD3 . . . . . . . . . c30496_6e5h 1 . 4 . 1490 . 1 1 10 ARG HE H -2.309 -7.560 7.866 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HE . . . . . . . . . c30496_6e5h 1 . 4 . 1491 . 1 1 10 ARG HG2 H -2.965 -7.090 5.319 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HG2 . . . . . . . . . c30496_6e5h 1 . 4 . 1492 . 1 1 10 ARG HG3 H -1.902 -8.478 5.588 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HG3 . . . . . . . . . c30496_6e5h 1 . 4 . 1493 . 1 1 10 ARG HH11 H -0.448 -4.305 9.309 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HH11 . . . . . . . . . c30496_6e5h 1 . 4 . 1494 . 1 1 10 ARG HH12 H -0.240 -4.746 7.647 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HH12 . . . . . . . . . c30496_6e5h 1 . 4 . 1495 . 1 1 10 ARG HH21 H -2.582 -6.987 10.061 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HH21 . . . . . . . . . c30496_6e5h 1 . 4 . 1496 . 1 1 10 ARG HH22 H -1.774 -5.582 10.685 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HH22 . . . . . . . . . c30496_6e5h 1 . 4 . 1497 . 1 1 10 ARG N N -1.505 -7.792 1.549 . . . 1.0 . . . . . . . . . . . . A . 10 ARG N . . . . . . . . . c30496_6e5h 1 . 4 . 1498 . 1 1 10 ARG NE N -1.710 -6.791 7.709 . . . 1.0 . . . . . . . . . . . . A . 10 ARG NE . . . . . . . . . c30496_6e5h 1 . 4 . 1499 . 1 1 10 ARG NH1 N -0.647 -4.924 8.544 . . . 1.0 . . . . . . . . . . . . A . 10 ARG NH1 . . . . . . . . . c30496_6e5h 1 . 4 . 1500 . 1 1 10 ARG NH2 N -1.978 -6.198 9.917 . . . 1.0 . . . . . . . . . . . . A . 10 ARG NH2 . . . . . . . . . c30496_6e5h 1 . 4 . 1501 . 1 1 10 ARG O O -4.484 -8.266 3.223 . . . 1.0 . . . . . . . . . . . . A . 10 ARG O . . . . . . . . . c30496_6e5h 1 . 4 . 1502 . 1 1 11 TYR C C -5.885 -6.022 1.119 . . . 1.0 . . . . . . . . . . . . A . 11 TYR C . . . . . . . . . c30496_6e5h 1 . 4 . 1503 . 1 1 11 TYR CA C -5.123 -5.713 2.402 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CA . . . . . . . . . c30496_6e5h 1 . 4 . 1504 . 1 1 11 TYR CB C -5.026 -4.207 2.614 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CB . . . . . . . . . c30496_6e5h 1 . 4 . 1505 . 1 1 11 TYR CD1 C -5.176 -3.947 5.112 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CD1 . . . . . . . . . c30496_6e5h 1 . 4 . 1506 . 1 1 11 TYR CD2 C -3.132 -3.355 4.050 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CD2 . . . . . . . . . c30496_6e5h 1 . 4 . 1507 . 1 1 11 TYR CE1 C -4.645 -3.601 6.338 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CE1 . . . . . . . . . c30496_6e5h 1 . 4 . 1508 . 1 1 11 TYR CE2 C -2.591 -3.009 5.273 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CE2 . . . . . . . . . c30496_6e5h 1 . 4 . 1509 . 1 1 11 TYR CG C -4.431 -3.830 3.950 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CG . . . . . . . . . c30496_6e5h 1 . 4 . 1510 . 1 1 11 TYR CZ C -3.353 -3.132 6.414 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CZ . . . . . . . . . c30496_6e5h 1 . 4 . 1511 . 1 1 11 TYR H H -3.048 -5.785 2.009 . . . 1.0 . . . . . . . . . . . . A . 11 TYR H . . . . . . . . . c30496_6e5h 1 . 4 . 1512 . 1 1 11 TYR HA H -5.659 -6.145 3.233 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HA . . . . . . . . . c30496_6e5h 1 . 4 . 1513 . 1 1 11 TYR HB2 H -4.407 -3.778 1.841 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HB2 . . . . . . . . . c30496_6e5h 1 . 4 . 1514 . 1 1 11 TYR HB3 H -6.014 -3.781 2.557 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HB3 . . . . . . . . . c30496_6e5h 1 . 4 . 1515 . 1 1 11 TYR HD1 H -6.189 -4.316 5.050 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HD1 . . . . . . . . . c30496_6e5h 1 . 4 . 1516 . 1 1 11 TYR HD2 H -2.537 -3.259 3.153 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HD2 . . . . . . . . . c30496_6e5h 1 . 4 . 1517 . 1 1 11 TYR HE1 H -5.243 -3.700 7.230 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HE1 . . . . . . . . . c30496_6e5h 1 . 4 . 1518 . 1 1 11 TYR HE2 H -1.580 -2.644 5.329 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HE2 . . . . . . . . . c30496_6e5h 1 . 4 . 1519 . 1 1 11 TYR HH H -2.358 -1.940 7.553 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HH . . . . . . . . . c30496_6e5h 1 . 4 . 1520 . 1 1 11 TYR N N -3.798 -6.305 2.379 . . . 1.0 . . . . . . . . . . . . A . 11 TYR N . . . . . . . . . c30496_6e5h 1 . 4 . 1521 . 1 1 11 TYR O O -6.360 -5.112 0.430 . . . 1.0 . . . . . . . . . . . . A . 11 TYR O . . . . . . . . . c30496_6e5h 1 . 4 . 1522 . 1 1 11 TYR OH O -2.820 -2.785 7.635 . . . 1.0 . . . . . . . . . . . . A . 11 TYR OH . . . . . . . . . c30496_6e5h 1 . 4 . 1523 . 1 1 12 ABA C C -8.208 -7.304 -0.190 . . . 1.0 . . . . . . . . . . . . A . 12 AIB C . . . . . . . . . c30496_6e5h 1 . 4 . 1524 . 1 1 12 ABA CA C -6.760 -7.787 -0.344 . . . 1.0 . . . . . . . . . . . . A . 12 AIB CA . . . . . . . . . c30496_6e5h 1 . 4 . 1525 . 1 1 12 ABA H H -5.525 -7.970 1.373 . . . 1.0 . . . . . . . . . . . . A . 12 AIB H . . . . . . . . . c30496_6e5h 1 . 4 . 1526 . 1 1 12 ABA N N -5.985 -7.313 0.806 . . . 1.0 . . . . . . . . . . . . A . 12 AIB N . . . . . . . . . c30496_6e5h 1 . 4 . 1527 . 1 1 12 ABA O O -8.867 -7.621 0.800 . . . 1.0 . . . . . . . . . . . . A . 12 AIB O . . . . . . . . . c30496_6e5h 1 . 4 . 1528 . 1 1 13 GLY C C -10.021 -4.503 -0.747 . . . 1.0 . . . . . . . . . . . . A . 13 GLY C . . . . . . . . . c30496_6e5h 1 . 4 . 1529 . 1 1 13 GLY CA C -10.031 -5.987 -1.055 . . . 1.0 . . . . . . . . . . . . A . 13 GLY CA . . . . . . . . . c30496_6e5h 1 . 4 . 1530 . 1 1 13 GLY H H -8.151 -6.347 -1.947 . . . 1.0 . . . . . . . . . . . . A . 13 GLY H . . . . . . . . . c30496_6e5h 1 . 4 . 1531 . 1 1 13 GLY HA2 H -10.545 -6.146 -1.990 . . . 1.0 . . . . . . . . . . . . A . 13 GLY HA2 . . . . . . . . . c30496_6e5h 1 . 4 . 1532 . 1 1 13 GLY HA3 H -10.561 -6.503 -0.271 . . . 1.0 . . . . . . . . . . . . A . 13 GLY HA3 . . . . . . . . . c30496_6e5h 1 . 4 . 1533 . 1 1 13 GLY N N -8.695 -6.534 -1.154 . . . 1.0 . . . . . . . . . . . . A . 13 GLY N . . . . . . . . . c30496_6e5h 1 . 4 . 1534 . 1 1 13 GLY O O -11.049 -3.833 -0.843 . . . 1.0 . . . . . . . . . . . . A . 13 GLY O . . . . . . . . . c30496_6e5h 1 . 4 . 1535 . 1 1 14 CYS C C -7.813 -1.932 -1.141 . . . 1.0 . . . . . . . . . . . . A . 14 CYS C . . . . . . . . . c30496_6e5h 1 . 4 . 1536 . 1 1 14 CYS CA C -8.715 -2.567 -0.096 . . . 1.0 . . . . . . . . . . . . A . 14 CYS CA . . . . . . . . . c30496_6e5h 1 . 4 . 1537 . 1 1 14 CYS CB C -8.118 -2.345 1.290 . . . 1.0 . . . . . . . . . . . . A . 14 CYS CB . . . . . . . . . c30496_6e5h 1 . 4 . 1538 . 1 1 14 CYS H H -8.088 -4.576 -0.245 . . . 1.0 . . . . . . . . . . . . A . 14 CYS H . . . . . . . . . c30496_6e5h 1 . 4 . 1539 . 1 1 14 CYS HA H -9.690 -2.109 -0.141 . . . 1.0 . . . . . . . . . . . . A . 14 CYS HA . . . . . . . . . c30496_6e5h 1 . 4 . 1540 . 1 1 14 CYS HB2 H -7.100 -2.695 1.290 . . . 1.0 . . . . . . . . . . . . A . 14 CYS HB2 . . . . . . . . . c30496_6e5h 1 . 4 . 1541 . 1 1 14 CYS HB3 H -8.130 -1.288 1.512 . . . 1.0 . . . . . . . . . . . . A . 14 CYS HB3 . . . . . . . . . c30496_6e5h 1 . 4 . 1542 . 1 1 14 CYS N N -8.865 -3.987 -0.362 . . . 1.0 . . . . . . . . . . . . A . 14 CYS N . . . . . . . . . c30496_6e5h 1 . 4 . 1543 . 1 1 14 CYS O O -6.923 -2.587 -1.689 . . . 1.0 . . . . . . . . . . . . A . 14 CYS O . . . . . . . . . c30496_6e5h 1 . 4 . 1544 . 1 1 14 CYS SG S -9.003 -3.203 2.633 . . . 1.0 . . . . . . . . . . . . A . 14 CYS SG . . . . . . . . . c30496_6e5h 1 . 4 . 1545 . 1 1 15 GLU C C -6.095 0.764 -1.609 . . . 1.0 . . . . . . . . . . . . A . 15 GLU C . . . . . . . . . c30496_6e5h 1 . 4 . 1546 . 1 1 15 GLU CA C -7.224 0.077 -2.357 . . . 1.0 . . . . . . . . . . . . A . 15 GLU CA . . . . . . . . . c30496_6e5h 1 . 4 . 1547 . 1 1 15 GLU CB C -8.053 1.113 -3.115 . . . 1.0 . . . . . . . . . . . . A . 15 GLU CB . . . . . . . . . c30496_6e5h 1 . 4 . 1548 . 1 1 15 GLU CD C -9.878 1.569 -4.790 . . . 1.0 . . . . . . . . . . . . A . 15 GLU CD . . . . . . . . . c30496_6e5h 1 . 4 . 1549 . 1 1 15 GLU CG C -9.162 0.519 -3.968 . . . 1.0 . . . . . . . . . . . . A . 15 GLU CG . . . . . . . . . c30496_6e5h 1 . 4 . 1550 . 1 1 15 GLU H H -8.793 -0.203 -0.967 . . . 1.0 . . . . . . . . . . . . A . 15 GLU H . . . . . . . . . c30496_6e5h 1 . 4 . 1551 . 1 1 15 GLU HA H -6.801 -0.625 -3.059 . . . 1.0 . . . . . . . . . . . . A . 15 GLU HA . . . . . . . . . c30496_6e5h 1 . 4 . 1552 . 1 1 15 GLU HB2 H -8.503 1.785 -2.401 . . . 1.0 . . . . . . . . . . . . A . 15 GLU HB2 . . . . . . . . . c30496_6e5h 1 . 4 . 1553 . 1 1 15 GLU HB3 H -7.397 1.677 -3.758 . . . 1.0 . . . . . . . . . . . . A . 15 GLU HB3 . . . . . . . . . c30496_6e5h 1 . 4 . 1554 . 1 1 15 GLU HG2 H -8.736 -0.212 -4.641 . . . 1.0 . . . . . . . . . . . . A . 15 GLU HG2 . . . . . . . . . c30496_6e5h 1 . 4 . 1555 . 1 1 15 GLU HG3 H -9.879 0.038 -3.321 . . . 1.0 . . . . . . . . . . . . A . 15 GLU HG3 . . . . . . . . . c30496_6e5h 1 . 4 . 1556 . 1 1 15 GLU N N -8.049 -0.663 -1.420 . . . 1.0 . . . . . . . . . . . . A . 15 GLU N . . . . . . . . . c30496_6e5h 1 . 4 . 1557 . 1 1 15 GLU O O -6.333 1.661 -0.802 . . . 1.0 . . . . . . . . . . . . A . 15 GLU O . . . . . . . . . c30496_6e5h 1 . 4 . 1558 . 1 1 15 GLU OE1 O -9.292 2.053 -5.778 . . . 1.0 . . . . . . . . . . . . A . 15 GLU OE1 . . . . . . . . . c30496_6e5h 1 . 4 . 1559 . 1 1 15 GLU OE2 O -11.027 1.919 -4.455 . . . 1.0 . . . . . . . . . . . . A . 15 GLU OE2 . . . . . . . . . c30496_6e5h 1 . 4 . 1560 . 1 1 16 VAL C C -3.020 1.912 -2.043 . . . 1.0 . . . . . . . . . . . . A . 16 VAL C . . . . . . . . . c30496_6e5h 1 . 4 . 1561 . 1 1 16 VAL CA C -3.722 0.881 -1.170 . . . 1.0 . . . . . . . . . . . . A . 16 VAL CA . . . . . . . . . c30496_6e5h 1 . 4 . 1562 . 1 1 16 VAL CB C -2.715 -0.214 -0.765 . . . 1.0 . . . . . . . . . . . . A . 16 VAL CB . . . . . . . . . c30496_6e5h 1 . 4 . 1563 . 1 1 16 VAL CG1 C -1.528 0.393 -0.028 . . . 1.0 . . . . . . . . . . . . A . 16 VAL CG1 . . . . . . . . . c30496_6e5h 1 . 4 . 1564 . 1 1 16 VAL CG2 C -3.393 -1.278 0.090 . . . 1.0 . . . . . . . . . . . . A . 16 VAL CG2 . . . . . . . . . c30496_6e5h 1 . 4 . 1565 . 1 1 16 VAL H H -4.743 -0.379 -2.525 . . . 1.0 . . . . . . . . . . . . A . 16 VAL H . . . . . . . . . c30496_6e5h 1 . 4 . 1566 . 1 1 16 VAL HA H -4.075 1.367 -0.270 . . . 1.0 . . . . . . . . . . . . A . 16 VAL HA . . . . . . . . . c30496_6e5h 1 . 4 . 1567 . 1 1 16 VAL HB H -2.349 -0.686 -1.665 . . . 1.0 . . . . . . . . . . . . A . 16 VAL HB . . . . . . . . . c30496_6e5h 1 . 4 . 1568 . 1 1 16 VAL HG11 H -1.862 0.812 0.910 . . . 1.0 . . . . . . . . . . . . A . 16 VAL HG11 . . . . . . . . . c30496_6e5h 1 . 4 . 1569 . 1 1 16 VAL HG12 H -1.092 1.175 -0.633 . . . 1.0 . . . . . . . . . . . . A . 16 VAL HG12 . . . . . . . . . c30496_6e5h 1 . 4 . 1570 . 1 1 16 VAL HG13 H -0.790 -0.370 0.159 . . . 1.0 . . . . . . . . . . . . A . 16 VAL HG13 . . . . . . . . . c30496_6e5h 1 . 4 . 1571 . 1 1 16 VAL HG21 H -2.668 -2.023 0.381 . . . 1.0 . . . . . . . . . . . . A . 16 VAL HG21 . . . . . . . . . c30496_6e5h 1 . 4 . 1572 . 1 1 16 VAL HG22 H -4.183 -1.747 -0.476 . . . 1.0 . . . . . . . . . . . . A . 16 VAL HG22 . . . . . . . . . c30496_6e5h 1 . 4 . 1573 . 1 1 16 VAL HG23 H -3.807 -0.817 0.974 . . . 1.0 . . . . . . . . . . . . A . 16 VAL HG23 . . . . . . . . . c30496_6e5h 1 . 4 . 1574 . 1 1 16 VAL N N -4.874 0.327 -1.856 . . . 1.0 . . . . . . . . . . . . A . 16 VAL N . . . . . . . . . c30496_6e5h 1 . 4 . 1575 . 1 1 16 VAL O O -2.621 1.622 -3.173 . . . 1.0 . . . . . . . . . . . . A . 16 VAL O . . . . . . . . . c30496_6e5h 1 . 4 . 1576 . 1 1 17 ARG C C -0.840 4.436 -1.582 . . . 1.0 . . . . . . . . . . . . A . 17 ARG C . . . . . . . . . c30496_6e5h 1 . 4 . 1577 . 1 1 17 ARG CA C -2.194 4.184 -2.216 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CA . . . . . . . . . c30496_6e5h 1 . 4 . 1578 . 1 1 17 ARG CB C -3.018 5.468 -2.192 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CB . . . . . . . . . c30496_6e5h 1 . 4 . 1579 . 1 1 17 ARG CD C -5.129 6.657 -2.832 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CD . . . . . . . . . c30496_6e5h 1 . 4 . 1580 . 1 1 17 ARG CG C -4.394 5.327 -2.814 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CG . . . . . . . . . c30496_6e5h 1 . 4 . 1581 . 1 1 17 ARG CZ C -4.872 8.899 -3.827 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CZ . . . . . . . . . c30496_6e5h 1 . 4 . 1582 . 1 1 17 ARG H H -3.242 3.285 -0.614 . . . 1.0 . . . . . . . . . . . . A . 17 ARG H . . . . . . . . . c30496_6e5h 1 . 4 . 1583 . 1 1 17 ARG HA H -2.050 3.873 -3.238 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HA . . . . . . . . . c30496_6e5h 1 . 4 . 1584 . 1 1 17 ARG HB2 H -3.140 5.781 -1.170 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HB2 . . . . . . . . . c30496_6e5h 1 . 4 . 1585 . 1 1 17 ARG HB3 H -2.480 6.233 -2.730 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HB3 . . . . . . . . . c30496_6e5h 1 . 4 . 1586 . 1 1 17 ARG HD2 H -6.123 6.499 -3.222 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HD2 . . . . . . . . . c30496_6e5h 1 . 4 . 1587 . 1 1 17 ARG HD3 H -5.196 7.029 -1.820 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HD3 . . . . . . . . . c30496_6e5h 1 . 4 . 1588 . 1 1 17 ARG HE H -3.623 7.366 -4.123 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HE . . . . . . . . . c30496_6e5h 1 . 4 . 1589 . 1 1 17 ARG HG2 H -4.287 4.972 -3.828 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HG2 . . . . . . . . . c30496_6e5h 1 . 4 . 1590 . 1 1 17 ARG HG3 H -4.967 4.615 -2.240 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HG3 . . . . . . . . . c30496_6e5h 1 . 4 . 1591 . 1 1 17 ARG HH11 H -6.490 8.685 -2.629 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH11 . . . . . . . . . c30496_6e5h 1 . 4 . 1592 . 1 1 17 ARG HH12 H -6.298 10.253 -3.341 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH12 . . . . . . . . . c30496_6e5h 1 . 4 . 1593 . 1 1 17 ARG HH21 H -3.361 9.416 -5.073 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH21 . . . . . . . . . c30496_6e5h 1 . 4 . 1594 . 1 1 17 ARG HH22 H -4.507 10.673 -4.735 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH22 . . . . . . . . . c30496_6e5h 1 . 4 . 1595 . 1 1 17 ARG N N -2.880 3.114 -1.514 . . . 1.0 . . . . . . . . . . . . A . 17 ARG N . . . . . . . . . c30496_6e5h 1 . 4 . 1596 . 1 1 17 ARG NE N -4.446 7.651 -3.661 . . . 1.0 . . . . . . . . . . . . A . 17 ARG NE . . . . . . . . . c30496_6e5h 1 . 4 . 1597 . 1 1 17 ARG NH1 N -5.975 9.313 -3.218 . . . 1.0 . . . . . . . . . . . . A . 17 ARG NH1 . . . . . . . . . c30496_6e5h 1 . 4 . 1598 . 1 1 17 ARG NH2 N -4.195 9.729 -4.607 . . . 1.0 . . . . . . . . . . . . A . 17 ARG NH2 . . . . . . . . . c30496_6e5h 1 . 4 . 1599 . 1 1 17 ARG O O -0.694 4.356 -0.359 . . . 1.0 . . . . . . . . . . . . A . 17 ARG O . . . . . . . . . c30496_6e5h 1 . 4 . 1600 . 1 1 18 CYS C C 1.892 6.433 -2.111 . . . 1.0 . . . . . . . . . . . . A . 18 CYS C . . . . . . . . . c30496_6e5h 1 . 4 . 1601 . 1 1 18 CYS CA C 1.491 4.973 -1.932 . . . 1.0 . . . . . . . . . . . . A . 18 CYS CA . . . . . . . . . c30496_6e5h 1 . 4 . 1602 . 1 1 18 CYS CB C 2.469 4.067 -2.678 . . . 1.0 . . . . . . . . . . . . A . 18 CYS CB . . . . . . . . . c30496_6e5h 1 . 4 . 1603 . 1 1 18 CYS H H -0.047 4.827 -3.367 . . . 1.0 . . . . . . . . . . . . A . 18 CYS H . . . . . . . . . c30496_6e5h 1 . 4 . 1604 . 1 1 18 CYS HA H 1.515 4.727 -0.883 . . . 1.0 . . . . . . . . . . . . A . 18 CYS HA . . . . . . . . . c30496_6e5h 1 . 4 . 1605 . 1 1 18 CYS HB2 H 2.434 4.304 -3.730 . . . 1.0 . . . . . . . . . . . . A . 18 CYS HB2 . . . . . . . . . c30496_6e5h 1 . 4 . 1606 . 1 1 18 CYS HB3 H 3.466 4.244 -2.307 . . . 1.0 . . . . . . . . . . . . A . 18 CYS HB3 . . . . . . . . . c30496_6e5h 1 . 4 . 1607 . 1 1 18 CYS N N 0.142 4.745 -2.408 . . . 1.0 . . . . . . . . . . . . A . 18 CYS N . . . . . . . . . c30496_6e5h 1 . 4 . 1608 . 1 1 18 CYS O O 1.636 7.037 -3.152 . . . 1.0 . . . . . . . . . . . . A . 18 CYS O . . . . . . . . . c30496_6e5h 1 . 4 . 1609 . 1 1 18 CYS SG S 2.117 2.287 -2.500 . . . 1.0 . . . . . . . . . . . . A . 18 CYS SG . . . . . . . . . c30496_6e5h 1 . 4 . 1610 . 1 1 19 ASP C C 4.332 8.409 -0.348 . . . 1.0 . . . . . . . . . . . . A . 19 ASP C . . . . . . . . . c30496_6e5h 1 . 4 . 1611 . 1 1 19 ASP CA C 3.026 8.354 -1.134 . . . 1.0 . . . . . . . . . . . . A . 19 ASP CA . . . . . . . . . c30496_6e5h 1 . 4 . 1612 . 1 1 19 ASP CB C 2.010 9.349 -0.559 . . . 1.0 . . . . . . . . . . . . A . 19 ASP CB . . . . . . . . . c30496_6e5h 1 . 4 . 1613 . 1 1 19 ASP CG C 2.453 10.798 -0.680 . . . 1.0 . . . . . . . . . . . . A . 19 ASP CG . . . . . . . . . c30496_6e5h 1 . 4 . 1614 . 1 1 19 ASP H H 2.603 6.484 -0.245 . . . 1.0 . . . . . . . . . . . . A . 19 ASP H . . . . . . . . . c30496_6e5h 1 . 4 . 1615 . 1 1 19 ASP HA H 3.224 8.599 -2.165 . . . 1.0 . . . . . . . . . . . . A . 19 ASP HA . . . . . . . . . c30496_6e5h 1 . 4 . 1616 . 1 1 19 ASP HB2 H 1.074 9.236 -1.083 . . . 1.0 . . . . . . . . . . . . A . 19 ASP HB2 . . . . . . . . . c30496_6e5h 1 . 4 . 1617 . 1 1 19 ASP HB3 H 1.857 9.126 0.485 . . . 1.0 . . . . . . . . . . . . A . 19 ASP HB3 . . . . . . . . . c30496_6e5h 1 . 4 . 1618 . 1 1 19 ASP N N 2.500 6.997 -1.082 . . . 1.0 . . . . . . . . . . . . A . 19 ASP N . . . . . . . . . c30496_6e5h 1 . 4 . 1619 . 1 1 19 ASP O O 4.369 8.888 0.785 . . . 1.0 . . . . . . . . . . . . A . 19 ASP O . . . . . . . . . c30496_6e5h 1 . 4 . 1620 . 1 1 19 ASP OD1 O 3.012 11.345 0.297 . . . 1.0 . . . . . . . . . . . . A . 19 ASP OD1 . . . . . . . . . c30496_6e5h 1 . 4 . 1621 . 1 1 19 ASP OD2 O 2.224 11.408 -1.745 . . . 1.0 . . . . . . . . . . . . A . 19 ASP OD2 . . . . . . . . . c30496_6e5h 1 . 4 . 1622 . 1 1 20 DPR C C 6.596 6.946 1.031 . . . 1.0 . . . . . . . . . . . . A . 20 DPR C . . . . . . . . . c30496_6e5h 1 . 4 . 1623 . 1 1 20 DPR CA C 6.711 7.784 -0.241 . . . 1.0 . . . . . . . . . . . . A . 20 DPR CA . . . . . . . . . c30496_6e5h 1 . 4 . 1624 . 1 1 20 DPR CB C 7.624 7.100 -1.256 . . . 1.0 . . . . . . . . . . . . A . 20 DPR CB . . . . . . . . . c30496_6e5h 1 . 4 . 1625 . 1 1 20 DPR CD C 5.501 7.380 -2.312 . . . 1.0 . . . . . . . . . . . . A . 20 DPR CD . . . . . . . . . c30496_6e5h 1 . 4 . 1626 . 1 1 20 DPR CG C 6.980 7.339 -2.576 . . . 1.0 . . . . . . . . . . . . A . 20 DPR CG . . . . . . . . . c30496_6e5h 1 . 4 . 1627 . 1 1 20 DPR HA H 7.112 8.754 0.001 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HA . . . . . . . . . c30496_6e5h 1 . 4 . 1628 . 1 1 20 DPR HB2 H 8.608 7.544 -1.210 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HB2 . . . . . . . . . c30496_6e5h 1 . 4 . 1629 . 1 1 20 DPR HB3 H 7.688 6.046 -1.033 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HB3 . . . . . . . . . c30496_6e5h 1 . 4 . 1630 . 1 1 20 DPR HD2 H 5.013 8.051 -3.001 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HD2 . . . . . . . . . c30496_6e5h 1 . 4 . 1631 . 1 1 20 DPR HD3 H 5.076 6.390 -2.381 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HD3 . . . . . . . . . c30496_6e5h 1 . 4 . 1632 . 1 1 20 DPR HG2 H 7.314 8.283 -2.979 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HG2 . . . . . . . . . c30496_6e5h 1 . 4 . 1633 . 1 1 20 DPR HG3 H 7.220 6.534 -3.254 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HG3 . . . . . . . . . c30496_6e5h 1 . 4 . 1634 . 1 1 20 DPR N N 5.423 7.890 -0.933 . . . 1.0 . . . . . . . . . . . . A . 20 DPR N . . . . . . . . . c30496_6e5h 1 . 4 . 1635 . 1 1 20 DPR O O 6.215 5.776 0.982 . . . 1.0 . . . . . . . . . . . . A . 20 DPR O . . . . . . . . . c30496_6e5h 1 . 4 . 1636 . 1 1 21 PRO C C 5.358 6.839 3.993 . . . 1.0 . . . . . . . . . . . . A . 21 PRO C . . . . . . . . . c30496_6e5h 1 . 4 . 1637 . 1 1 21 PRO CA C 6.799 6.885 3.487 . . . 1.0 . . . . . . . . . . . . A . 21 PRO CA . . . . . . . . . c30496_6e5h 1 . 4 . 1638 . 1 1 21 PRO CB C 7.652 7.771 4.393 . . . 1.0 . . . . . . . . . . . . A . 21 PRO CB . . . . . . . . . c30496_6e5h 1 . 4 . 1639 . 1 1 21 PRO CD C 7.422 8.928 2.312 . . . 1.0 . . . . . . . . . . . . A . 21 PRO CD . . . . . . . . . c30496_6e5h 1 . 4 . 1640 . 1 1 21 PRO CG C 7.538 9.131 3.799 . . . 1.0 . . . . . . . . . . . . A . 21 PRO CG . . . . . . . . . c30496_6e5h 1 . 4 . 1641 . 1 1 21 PRO HA H 7.207 5.887 3.462 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HA . . . . . . . . . c30496_6e5h 1 . 4 . 1642 . 1 1 21 PRO HB2 H 7.262 7.742 5.400 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HB2 . . . . . . . . . c30496_6e5h 1 . 4 . 1643 . 1 1 21 PRO HB3 H 8.674 7.422 4.386 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HB3 . . . . . . . . . c30496_6e5h 1 . 4 . 1644 . 1 1 21 PRO HD2 H 6.725 9.636 1.888 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HD2 . . . . . . . . . c30496_6e5h 1 . 4 . 1645 . 1 1 21 PRO HD3 H 8.389 9.024 1.843 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HD3 . . . . . . . . . c30496_6e5h 1 . 4 . 1646 . 1 1 21 PRO HG2 H 6.657 9.624 4.179 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HG2 . . . . . . . . . c30496_6e5h 1 . 4 . 1647 . 1 1 21 PRO HG3 H 8.421 9.709 4.030 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HG3 . . . . . . . . . c30496_6e5h 1 . 4 . 1648 . 1 1 21 PRO N N 6.911 7.548 2.186 . . . 1.0 . . . . . . . . . . . . A . 21 PRO N . . . . . . . . . c30496_6e5h 1 . 4 . 1649 . 1 1 21 PRO O O 5.077 6.300 5.064 . . . 1.0 . . . . . . . . . . . . A . 21 PRO O . . . . . . . . . c30496_6e5h 1 . 4 . 1650 . 1 1 22 ARG C C 2.238 6.491 2.764 . . . 1.0 . . . . . . . . . . . . A . 22 ARG C . . . . . . . . . c30496_6e5h 1 . 4 . 1651 . 1 1 22 ARG CA C 3.047 7.475 3.591 . . . 1.0 . . . . . . . . . . . . A . 22 ARG CA . . . . . . . . . c30496_6e5h 1 . 4 . 1652 . 1 1 22 ARG CB C 2.511 8.886 3.378 . . . 1.0 . . . . . . . . . . . . A . 22 ARG CB . . . . . . . . . c30496_6e5h 1 . 4 . 1653 . 1 1 22 ARG CD C 2.757 11.343 3.790 . . . 1.0 . . . . . . . . . . . . A . 22 ARG CD . . . . . . . . . c30496_6e5h 1 . 4 . 1654 . 1 1 22 ARG CG C 3.264 9.956 4.149 . . . 1.0 . . . . . . . . . . . . A . 22 ARG CG . . . . . . . . . c30496_6e5h 1 . 4 . 1655 . 1 1 22 ARG CZ C 0.423 11.713 3.058 . . . 1.0 . . . . . . . . . . . . A . 22 ARG CZ . . . . . . . . . c30496_6e5h 1 . 4 . 1656 . 1 1 22 ARG H H 4.730 7.793 2.352 . . . 1.0 . . . . . . . . . . . . A . 22 ARG H . . . . . . . . . c30496_6e5h 1 . 4 . 1657 . 1 1 22 ARG HA H 2.963 7.212 4.633 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HA . . . . . . . . . c30496_6e5h 1 . 4 . 1658 . 1 1 22 ARG HB2 H 2.572 9.123 2.328 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HB2 . . . . . . . . . c30496_6e5h 1 . 4 . 1659 . 1 1 22 ARG HB3 H 1.476 8.913 3.684 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HB3 . . . . . . . . . c30496_6e5h 1 . 4 . 1660 . 1 1 22 ARG HD2 H 3.278 12.070 4.398 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HD2 . . . . . . . . . c30496_6e5h 1 . 4 . 1661 . 1 1 22 ARG HD3 H 2.968 11.530 2.748 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HD3 . . . . . . . . . c30496_6e5h 1 . 4 . 1662 . 1 1 22 ARG HE H 1.000 11.387 4.948 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HE . . . . . . . . . c30496_6e5h 1 . 4 . 1663 . 1 1 22 ARG HG2 H 3.127 9.792 5.208 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HG2 . . . . . . . . . c30496_6e5h 1 . 4 . 1664 . 1 1 22 ARG HG3 H 4.313 9.891 3.905 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HG3 . . . . . . . . . c30496_6e5h 1 . 4 . 1665 . 1 1 22 ARG HH11 H 1.779 11.722 1.542 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HH11 . . . . . . . . . c30496_6e5h 1 . 4 . 1666 . 1 1 22 ARG HH12 H 0.129 11.999 1.076 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HH12 . . . . . . . . . c30496_6e5h 1 . 4 . 1667 . 1 1 22 ARG HH21 H -1.537 12.003 2.639 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HH21 . . . . . . . . . c30496_6e5h 1 . 4 . 1668 . 1 1 22 ARG HH22 H -1.168 11.729 4.312 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HH22 . . . . . . . . . c30496_6e5h 1 . 4 . 1669 . 1 1 22 ARG N N 4.450 7.411 3.216 . . . 1.0 . . . . . . . . . . . . A . 22 ARG N . . . . . . . . . c30496_6e5h 1 . 4 . 1670 . 1 1 22 ARG NE N 1.317 11.477 4.019 . . . 1.0 . . . . . . . . . . . . A . 22 ARG NE . . . . . . . . . c30496_6e5h 1 . 4 . 1671 . 1 1 22 ARG NH1 N 0.807 11.820 1.793 . . . 1.0 . . . . . . . . . . . . A . 22 ARG NH1 . . . . . . . . . c30496_6e5h 1 . 4 . 1672 . 1 1 22 ARG NH2 N -0.863 11.825 3.361 . . . 1.0 . . . . . . . . . . . . A . 22 ARG NH2 . . . . . . . . . c30496_6e5h 1 . 4 . 1673 . 1 1 22 ARG O O 2.530 6.275 1.589 . . . 1.0 . . . . . . . . . . . . A . 22 ARG O . . . . . . . . . c30496_6e5h 1 . 4 . 1674 . 1 1 23 TYR C C -1.055 5.069 3.121 . . . 1.0 . . . . . . . . . . . . A . 23 TYR C . . . . . . . . . c30496_6e5h 1 . 4 . 1675 . 1 1 23 TYR CA C 0.393 4.924 2.686 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CA . . . . . . . . . c30496_6e5h 1 . 4 . 1676 . 1 1 23 TYR CB C 0.871 3.494 2.944 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CB . . . . . . . . . c30496_6e5h 1 . 4 . 1677 . 1 1 23 TYR CD1 C 3.350 3.368 3.383 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CD1 . . . . . . . . . c30496_6e5h 1 . 4 . 1678 . 1 1 23 TYR CD2 C 2.568 2.882 1.187 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CD2 . . . . . . . . . c30496_6e5h 1 . 4 . 1679 . 1 1 23 TYR CE1 C 4.648 3.147 2.977 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CE1 . . . . . . . . . c30496_6e5h 1 . 4 . 1680 . 1 1 23 TYR CE2 C 3.864 2.655 0.772 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CE2 . . . . . . . . . c30496_6e5h 1 . 4 . 1681 . 1 1 23 TYR CG C 2.290 3.240 2.496 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CG . . . . . . . . . c30496_6e5h 1 . 4 . 1682 . 1 1 23 TYR CZ C 4.901 2.790 1.670 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CZ . . . . . . . . . c30496_6e5h 1 . 4 . 1683 . 1 1 23 TYR H H 1.041 6.106 4.313 . . . 1.0 . . . . . . . . . . . . A . 23 TYR H . . . . . . . . . c30496_6e5h 1 . 4 . 1684 . 1 1 23 TYR HA H 0.459 5.128 1.628 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HA . . . . . . . . . c30496_6e5h 1 . 4 . 1685 . 1 1 23 TYR HB2 H 0.813 3.284 4.000 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HB2 . . . . . . . . . c30496_6e5h 1 . 4 . 1686 . 1 1 23 TYR HB3 H 0.229 2.811 2.410 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HB3 . . . . . . . . . c30496_6e5h 1 . 4 . 1687 . 1 1 23 TYR HD1 H 3.146 3.650 4.406 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HD1 . . . . . . . . . c30496_6e5h 1 . 4 . 1688 . 1 1 23 TYR HD2 H 1.753 2.779 0.486 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HD2 . . . . . . . . . c30496_6e5h 1 . 4 . 1689 . 1 1 23 TYR HE1 H 5.457 3.251 3.681 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HE1 . . . . . . . . . c30496_6e5h 1 . 4 . 1690 . 1 1 23 TYR HE2 H 4.060 2.372 -0.249 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HE2 . . . . . . . . . c30496_6e5h 1 . 4 . 1691 . 1 1 23 TYR HH H 6.336 2.987 0.401 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HH . . . . . . . . . c30496_6e5h 1 . 4 . 1692 . 1 1 23 TYR N N 1.233 5.889 3.377 . . . 1.0 . . . . . . . . . . . . A . 23 TYR N . . . . . . . . . c30496_6e5h 1 . 4 . 1693 . 1 1 23 TYR O O -1.348 5.231 4.307 . . . 1.0 . . . . . . . . . . . . A . 23 TYR O . . . . . . . . . c30496_6e5h 1 . 4 . 1694 . 1 1 23 TYR OH O 6.196 2.569 1.260 . . . 1.0 . . . . . . . . . . . . A . 23 TYR OH . . . . . . . . . c30496_6e5h 1 . 4 . 1695 . 1 1 24 GLU C C -4.108 3.861 2.098 . . . 1.0 . . . . . . . . . . . . A . 24 GLU C . . . . . . . . . c30496_6e5h 1 . 4 . 1696 . 1 1 24 GLU CA C -3.375 5.154 2.429 . . . 1.0 . . . . . . . . . . . . A . 24 GLU CA . . . . . . . . . c30496_6e5h 1 . 4 . 1697 . 1 1 24 GLU CB C -3.962 6.308 1.611 . . . 1.0 . . . . . . . . . . . . A . 24 GLU CB . . . . . . . . . c30496_6e5h 1 . 4 . 1698 . 1 1 24 GLU CD C -3.544 8.173 3.266 . . . 1.0 . . . . . . . . . . . . A . 24 GLU CD . . . . . . . . . c30496_6e5h 1 . 4 . 1699 . 1 1 24 GLU CG C -3.298 7.654 1.867 . . . 1.0 . . . . . . . . . . . . A . 24 GLU CG . . . . . . . . . c30496_6e5h 1 . 4 . 1700 . 1 1 24 GLU H H -1.656 4.839 1.232 . . . 1.0 . . . . . . . . . . . . A . 24 GLU H . . . . . . . . . c30496_6e5h 1 . 4 . 1701 . 1 1 24 GLU HA H -3.494 5.367 3.480 . . . 1.0 . . . . . . . . . . . . A . 24 GLU HA . . . . . . . . . c30496_6e5h 1 . 4 . 1702 . 1 1 24 GLU HB2 H -3.860 6.076 0.563 . . . 1.0 . . . . . . . . . . . . A . 24 GLU HB2 . . . . . . . . . c30496_6e5h 1 . 4 . 1703 . 1 1 24 GLU HB3 H -5.011 6.400 1.846 . . . 1.0 . . . . . . . . . . . . A . 24 GLU HB3 . . . . . . . . . c30496_6e5h 1 . 4 . 1704 . 1 1 24 GLU HG2 H -2.234 7.548 1.723 . . . 1.0 . . . . . . . . . . . . A . 24 GLU HG2 . . . . . . . . . c30496_6e5h 1 . 4 . 1705 . 1 1 24 GLU HG3 H -3.687 8.371 1.158 . . . 1.0 . . . . . . . . . . . . A . 24 GLU HG3 . . . . . . . . . c30496_6e5h 1 . 4 . 1706 . 1 1 24 GLU N N -1.955 5.006 2.157 . . . 1.0 . . . . . . . . . . . . A . 24 GLU N . . . . . . . . . c30496_6e5h 1 . 4 . 1707 . 1 1 24 GLU O O -4.208 3.477 0.934 . . . 1.0 . . . . . . . . . . . . A . 24 GLU O . . . . . . . . . c30496_6e5h 1 . 4 . 1708 . 1 1 24 GLU OE1 O -2.581 8.239 4.057 . . . 1.0 . . . . . . . . . . . . A . 24 GLU OE1 . . . . . . . . . c30496_6e5h 1 . 4 . 1709 . 1 1 24 GLU OE2 O -4.703 8.506 3.593 . . . 1.0 . . . . . . . . . . . . A . 24 GLU OE2 . . . . . . . . . c30496_6e5h 1 . 4 . 1710 . 1 1 25 VAL C C -6.830 2.206 2.922 . . . 1.0 . . . . . . . . . . . . A . 25 VAL C . . . . . . . . . c30496_6e5h 1 . 4 . 1711 . 1 1 25 VAL CA C -5.332 1.942 2.921 . . . 1.0 . . . . . . . . . . . . A . 25 VAL CA . . . . . . . . . c30496_6e5h 1 . 4 . 1712 . 1 1 25 VAL CB C -4.984 0.900 4.004 . . . 1.0 . . . . . . . . . . . . A . 25 VAL CB . . . . . . . . . c30496_6e5h 1 . 4 . 1713 . 1 1 25 VAL CG1 C -5.786 -0.377 3.800 . . . 1.0 . . . . . . . . . . . . A . 25 VAL CG1 . . . . . . . . . c30496_6e5h 1 . 4 . 1714 . 1 1 25 VAL CG2 C -3.491 0.602 3.994 . . . 1.0 . . . . . . . . . . . . A . 25 VAL CG2 . . . . . . . . . c30496_6e5h 1 . 4 . 1715 . 1 1 25 VAL H H -4.497 3.538 4.026 . . . 1.0 . . . . . . . . . . . . A . 25 VAL H . . . . . . . . . c30496_6e5h 1 . 4 . 1716 . 1 1 25 VAL HA H -5.047 1.541 1.957 . . . 1.0 . . . . . . . . . . . . A . 25 VAL HA . . . . . . . . . c30496_6e5h 1 . 4 . 1717 . 1 1 25 VAL HB H -5.242 1.312 4.968 . . . 1.0 . . . . . . . . . . . . A . 25 VAL HB . . . . . . . . . c30496_6e5h 1 . 4 . 1718 . 1 1 25 VAL HG11 H -5.535 -1.091 4.573 . . . 1.0 . . . . . . . . . . . . A . 25 VAL HG11 . . . . . . . . . c30496_6e5h 1 . 4 . 1719 . 1 1 25 VAL HG12 H -5.554 -0.796 2.833 . . . 1.0 . . . . . . . . . . . . A . 25 VAL HG12 . . . . . . . . . c30496_6e5h 1 . 4 . 1720 . 1 1 25 VAL HG13 H -6.842 -0.152 3.849 . . . 1.0 . . . . . . . . . . . . A . 25 VAL HG13 . . . . . . . . . c30496_6e5h 1 . 4 . 1721 . 1 1 25 VAL HG21 H -3.267 -0.147 4.741 . . . 1.0 . . . . . . . . . . . . A . 25 VAL HG21 . . . . . . . . . c30496_6e5h 1 . 4 . 1722 . 1 1 25 VAL HG22 H -2.941 1.505 4.212 . . . 1.0 . . . . . . . . . . . . A . 25 VAL HG22 . . . . . . . . . c30496_6e5h 1 . 4 . 1723 . 1 1 25 VAL HG23 H -3.206 0.233 3.020 . . . 1.0 . . . . . . . . . . . . A . 25 VAL HG23 . . . . . . . . . c30496_6e5h 1 . 4 . 1724 . 1 1 25 VAL N N -4.606 3.185 3.118 . . . 1.0 . . . . . . . . . . . . A . 25 VAL N . . . . . . . . . c30496_6e5h 1 . 4 . 1725 . 1 1 25 VAL O O -7.436 2.436 3.969 . . . 1.0 . . . . . . . . . . . . A . 25 VAL O . . . . . . . . . c30496_6e5h 1 . 4 . 1726 . 1 1 26 HIS C C -9.668 1.247 1.455 . . . 1.0 . . . . . . . . . . . . A . 26 HIS C . . . . . . . . . c30496_6e5h 1 . 4 . 1727 . 1 1 26 HIS CA C -8.825 2.513 1.580 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CA . . . . . . . . . c30496_6e5h 1 . 4 . 1728 . 1 1 26 HIS CB C -9.008 3.409 0.351 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CB . . . . . . . . . c30496_6e5h 1 . 4 . 1729 . 1 1 26 HIS CD2 C -11.449 3.575 -0.500 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CD2 . . . . . . . . . c30496_6e5h 1 . 4 . 1730 . 1 1 26 HIS CE1 C -12.038 5.395 0.562 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CE1 . . . . . . . . . c30496_6e5h 1 . 4 . 1731 . 1 1 26 HIS CG C -10.381 3.988 0.218 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CG . . . . . . . . . c30496_6e5h 1 . 4 . 1732 . 1 1 26 HIS H H -6.895 1.926 0.946 . . . 1.0 . . . . . . . . . . . . A . 26 HIS H . . . . . . . . . c30496_6e5h 1 . 4 . 1733 . 1 1 26 HIS HA H -9.139 3.053 2.459 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HA . . . . . . . . . c30496_6e5h 1 . 4 . 1734 . 1 1 26 HIS HB2 H -8.308 4.227 0.403 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HB2 . . . . . . . . . c30496_6e5h 1 . 4 . 1735 . 1 1 26 HIS HB3 H -8.806 2.830 -0.534 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HB3 . . . . . . . . . c30496_6e5h 1 . 4 . 1736 . 1 1 26 HIS HD1 H -10.231 5.669 1.480 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HD1 . . . . . . . . . c30496_6e5h 1 . 4 . 1737 . 1 1 26 HIS HD2 H -11.490 2.709 -1.141 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HD2 . . . . . . . . . c30496_6e5h 1 . 4 . 1738 . 1 1 26 HIS HE1 H -12.616 6.228 0.927 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HE1 . . . . . . . . . c30496_6e5h 1 . 4 . 1739 . 1 1 26 HIS HE2 H -13.332 4.474 -0.731 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HE2 . . . . . . . . . c30496_6e5h 1 . 4 . 1740 . 1 1 26 HIS N N -7.420 2.180 1.740 . . . 1.0 . . . . . . . . . . . . A . 26 HIS N . . . . . . . . . c30496_6e5h 1 . 4 . 1741 . 1 1 26 HIS ND1 N -10.782 5.133 0.871 . . . 1.0 . . . . . . . . . . . . A . 26 HIS ND1 . . . . . . . . . c30496_6e5h 1 . 4 . 1742 . 1 1 26 HIS NE2 N -12.464 4.465 -0.268 . . . 1.0 . . . . . . . . . . . . A . 26 HIS NE2 . . . . . . . . . c30496_6e5h 1 . 4 . 1743 . 1 1 26 HIS O O -9.787 0.669 0.374 . . . 1.0 . . . . . . . . . . . . A . 26 HIS O . . . . . . . . . c30496_6e5h 1 . 4 . 1744 . 1 1 27 CYS C C -12.553 0.047 2.451 . . . 1.0 . . . . . . . . . . . . A . 27 CYS C . . . . . . . . . c30496_6e5h 1 . 4 . 1745 . 1 1 27 CYS CA C -11.090 -0.359 2.583 . . . 1.0 . . . . . . . . . . . . A . 27 CYS CA . . . . . . . . . c30496_6e5h 1 . 4 . 1746 . 1 1 27 CYS CB C -10.875 -1.161 3.866 . . . 1.0 . . . . . . . . . . . . A . 27 CYS CB . . . . . . . . . c30496_6e5h 1 . 4 . 1747 . 1 1 27 CYS H H -10.069 1.293 3.408 . . . 1.0 . . . . . . . . . . . . A . 27 CYS H . . . . . . . . . c30496_6e5h 1 . 4 . 1748 . 1 1 27 CYS HA H -10.823 -0.971 1.736 . . . 1.0 . . . . . . . . . . . . A . 27 CYS HA . . . . . . . . . c30496_6e5h 1 . 4 . 1749 . 1 1 27 CYS HB2 H -11.100 -0.536 4.715 . . . 1.0 . . . . . . . . . . . . A . 27 CYS HB2 . . . . . . . . . c30496_6e5h 1 . 4 . 1750 . 1 1 27 CYS HB3 H -11.541 -2.010 3.864 . . . 1.0 . . . . . . . . . . . . A . 27 CYS HB3 . . . . . . . . . c30496_6e5h 1 . 4 . 1751 . 1 1 27 CYS N N -10.233 0.813 2.568 . . . 1.0 . . . . . . . . . . . . A . 27 CYS N . . . . . . . . . c30496_6e5h 1 . 4 . 1752 . 1 1 27 CYS O O -13.187 -0.194 1.427 . . . 1.0 . . . . . . . . . . . . A . 27 CYS O . . . . . . . . . c30496_6e5h 1 . 4 . 1753 . 1 1 27 CYS SG S -9.177 -1.787 4.075 . . . 1.0 . . . . . . . . . . . . A . 27 CYS SG . . . . . . . . . c30496_6e5h 1 . 4 . 1754 . 1 1 28 NH2 HN1 H -12.529 0.824 4.279 . . . 1.0 . . . . . . . . . . . . A . 28 NH2 HN1 . . . . . . . . . c30496_6e5h 1 . 4 . 1755 . 1 1 28 NH2 HN2 H -14.033 0.922 3.433 . . . 1.0 . . . . . . . . . . . . A . 28 NH2 HN2 . . . . . . . . . c30496_6e5h 1 . 4 . 1756 . 1 1 28 NH2 N N -13.091 0.660 3.490 . . . 1.0 . . . . . . . . . . . . A . 28 NH2 N . . . . . . . . . c30496_6e5h 1 . 5 . 1757 . 1 1 1 ASN C C 10.212 -2.106 -0.097 . . . 1.0 . . . . . . . . . . . . A . 1 ASN C . . . . . . . . . c30496_6e5h 1 . 5 . 1758 . 1 1 1 ASN CA C 11.549 -2.133 0.639 . . . 1.0 . . . . . . . . . . . . A . 1 ASN CA . . . . . . . . . c30496_6e5h 1 . 5 . 1759 . 1 1 1 ASN CB C 12.064 -0.707 0.871 . . . 1.0 . . . . . . . . . . . . A . 1 ASN CB . . . . . . . . . c30496_6e5h 1 . 5 . 1760 . 1 1 1 ASN CG C 11.243 0.047 1.901 . . . 1.0 . . . . . . . . . . . . A . 1 ASN CG . . . . . . . . . c30496_6e5h 1 . 5 . 1761 . 1 1 1 ASN H1 H 12.218 -3.893 -0.242 . . . 1.0 . . . . . . . . . . . . A . 1 ASN H1 . . . . . . . . . c30496_6e5h 1 . 5 . 1762 . 1 1 1 ASN H2 H 13.456 -2.908 0.342 . . . 1.0 . . . . . . . . . . . . A . 1 ASN H2 . . . . . . . . . c30496_6e5h 1 . 5 . 1763 . 1 1 1 ASN H3 H 12.654 -2.498 -1.088 . . . 1.0 . . . . . . . . . . . . A . 1 ASN H3 . . . . . . . . . c30496_6e5h 1 . 5 . 1764 . 1 1 1 ASN HA H 11.410 -2.619 1.594 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HA . . . . . . . . . c30496_6e5h 1 . 5 . 1765 . 1 1 1 ASN HB2 H 13.085 -0.751 1.215 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HB2 . . . . . . . . . c30496_6e5h 1 . 5 . 1766 . 1 1 1 ASN HB3 H 12.025 -0.162 -0.062 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HB3 . . . . . . . . . c30496_6e5h 1 . 5 . 1767 . 1 1 1 ASN HD21 H 11.683 1.776 1.030 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HD21 . . . . . . . . . c30496_6e5h 1 . 5 . 1768 . 1 1 1 ASN HD22 H 10.674 1.871 2.432 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HD22 . . . . . . . . . c30496_6e5h 1 . 5 . 1769 . 1 1 1 ASN N N 12.538 -2.910 -0.140 . . . 1.0 . . . . . . . . . . . . A . 1 ASN N . . . . . . . . . c30496_6e5h 1 . 5 . 1770 . 1 1 1 ASN ND2 N 11.194 1.363 1.775 . . . 1.0 . . . . . . . . . . . . A . 1 ASN ND2 . . . . . . . . . c30496_6e5h 1 . 5 . 1771 . 1 1 1 ASN O O 9.649 -1.043 -0.375 . . . 1.0 . . . . . . . . . . . . A . 1 ASN O . . . . . . . . . c30496_6e5h 1 . 5 . 1772 . 1 1 1 ASN OD1 O 10.664 -0.548 2.806 . . . 1.0 . . . . . . . . . . . . A . 1 ASN OD1 . . . . . . . . . c30496_6e5h 1 . 5 . 1773 . 1 1 2 ASP C C 7.241 -3.340 -0.276 . . . 1.0 . . . . . . . . . . . . A . 2 ASP C . . . . . . . . . c30496_6e5h 1 . 5 . 1774 . 1 1 2 ASP CA C 8.469 -3.426 -1.180 . . . 1.0 . . . . . . . . . . . . A . 2 ASP CA . . . . . . . . . c30496_6e5h 1 . 5 . 1775 . 1 1 2 ASP CB C 8.470 -4.745 -1.974 . . . 1.0 . . . . . . . . . . . . A . 2 ASP CB . . . . . . . . . c30496_6e5h 1 . 5 . 1776 . 1 1 2 ASP CG C 8.562 -5.986 -1.097 . . . 1.0 . . . . . . . . . . . . A . 2 ASP CG . . . . . . . . . c30496_6e5h 1 . 5 . 1777 . 1 1 2 ASP H H 10.157 -4.103 -0.098 . . . 1.0 . . . . . . . . . . . . A . 2 ASP H . . . . . . . . . c30496_6e5h 1 . 5 . 1778 . 1 1 2 ASP HA H 8.438 -2.602 -1.877 . . . 1.0 . . . . . . . . . . . . A . 2 ASP HA . . . . . . . . . c30496_6e5h 1 . 5 . 1779 . 1 1 2 ASP HB2 H 7.559 -4.807 -2.545 . . . 1.0 . . . . . . . . . . . . A . 2 ASP HB2 . . . . . . . . . c30496_6e5h 1 . 5 . 1780 . 1 1 2 ASP HB3 H 9.311 -4.745 -2.653 . . . 1.0 . . . . . . . . . . . . A . 2 ASP HB3 . . . . . . . . . c30496_6e5h 1 . 5 . 1781 . 1 1 2 ASP N N 9.699 -3.290 -0.406 . . . 1.0 . . . . . . . . . . . . A . 2 ASP N . . . . . . . . . c30496_6e5h 1 . 5 . 1782 . 1 1 2 ASP O O 6.354 -4.194 -0.313 . . . 1.0 . . . . . . . . . . . . A . 2 ASP O . . . . . . . . . c30496_6e5h 1 . 5 . 1783 . 1 1 2 ASP OD1 O 9.453 -6.044 -0.220 . . . 1.0 . . . . . . . . . . . . A . 2 ASP OD1 . . . . . . . . . c30496_6e5h 1 . 5 . 1784 . 1 1 2 ASP OD2 O 7.768 -6.926 -1.305 . . . 1.0 . . . . . . . . . . . . A . 2 ASP OD2 . . . . . . . . . c30496_6e5h 1 . 5 . 1785 . 1 1 3 LYS C C 4.773 -1.861 0.760 . . . 1.0 . . . . . . . . . . . . A . 3 LYS C . . . . . . . . . c30496_6e5h 1 . 5 . 1786 . 1 1 3 LYS CA C 6.100 -2.088 1.467 . . . 1.0 . . . . . . . . . . . . A . 3 LYS CA . . . . . . . . . c30496_6e5h 1 . 5 . 1787 . 1 1 3 LYS CB C 6.406 -0.920 2.401 . . . 1.0 . . . . . . . . . . . . A . 3 LYS CB . . . . . . . . . c30496_6e5h 1 . 5 . 1788 . 1 1 3 LYS CD C 7.706 -0.060 4.365 . . . 1.0 . . . . . . . . . . . . A . 3 LYS CD . . . . . . . . . c30496_6e5h 1 . 5 . 1789 . 1 1 3 LYS CE C 8.500 -0.447 5.602 . . . 1.0 . . . . . . . . . . . . A . 3 LYS CE . . . . . . . . . c30496_6e5h 1 . 5 . 1790 . 1 1 3 LYS CG C 7.404 -1.264 3.493 . . . 1.0 . . . . . . . . . . . . A . 3 LYS CG . . . . . . . . . c30496_6e5h 1 . 5 . 1791 . 1 1 3 LYS H H 7.889 -1.601 0.449 . . . 1.0 . . . . . . . . . . . . A . 3 LYS H . . . . . . . . . c30496_6e5h 1 . 5 . 1792 . 1 1 3 LYS HA H 6.021 -2.988 2.054 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HA . . . . . . . . . c30496_6e5h 1 . 5 . 1793 . 1 1 3 LYS HB2 H 6.809 -0.104 1.818 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HB2 . . . . . . . . . c30496_6e5h 1 . 5 . 1794 . 1 1 3 LYS HB3 H 5.488 -0.598 2.868 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HB3 . . . . . . . . . c30496_6e5h 1 . 5 . 1795 . 1 1 3 LYS HD2 H 8.280 0.652 3.791 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HD2 . . . . . . . . . c30496_6e5h 1 . 5 . 1796 . 1 1 3 LYS HD3 H 6.774 0.392 4.673 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HD3 . . . . . . . . . c30496_6e5h 1 . 5 . 1797 . 1 1 3 LYS HE2 H 8.716 0.446 6.166 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HE2 . . . . . . . . . c30496_6e5h 1 . 5 . 1798 . 1 1 3 LYS HE3 H 7.900 -1.113 6.202 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HE3 . . . . . . . . . c30496_6e5h 1 . 5 . 1799 . 1 1 3 LYS HG2 H 6.991 -2.048 4.109 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HG2 . . . . . . . . . c30496_6e5h 1 . 5 . 1800 . 1 1 3 LYS HG3 H 8.320 -1.607 3.037 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HG3 . . . . . . . . . c30496_6e5h 1 . 5 . 1801 . 1 1 3 LYS HZ1 H 10.282 -0.595 4.520 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HZ1 . . . . . . . . . c30496_6e5h 1 . 5 . 1802 . 1 1 3 LYS HZ2 H 9.597 -2.088 4.926 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HZ2 . . . . . . . . . c30496_6e5h 1 . 5 . 1803 . 1 1 3 LYS HZ3 H 10.389 -1.176 6.106 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HZ3 . . . . . . . . . c30496_6e5h 1 . 5 . 1804 . 1 1 3 LYS N N 7.184 -2.280 0.516 . . . 1.0 . . . . . . . . . . . . A . 3 LYS N . . . . . . . . . c30496_6e5h 1 . 5 . 1805 . 1 1 3 LYS NZ N 9.779 -1.124 5.263 . . . 1.0 . . . . . . . . . . . . A . 3 LYS NZ . . . . . . . . . c30496_6e5h 1 . 5 . 1806 . 1 1 3 LYS O O 3.739 -2.333 1.218 . . . 1.0 . . . . . . . . . . . . A . 3 LYS O . . . . . . . . . c30496_6e5h 1 . 5 . 1807 . 1 1 4 CYS C C 2.999 -2.222 -1.618 . . . 1.0 . . . . . . . . . . . . A . 4 CYS C . . . . . . . . . c30496_6e5h 1 . 5 . 1808 . 1 1 4 CYS CA C 3.581 -0.905 -1.123 . . . 1.0 . . . . . . . . . . . . A . 4 CYS CA . . . . . . . . . c30496_6e5h 1 . 5 . 1809 . 1 1 4 CYS CB C 3.849 0.030 -2.306 . . . 1.0 . . . . . . . . . . . . A . 4 CYS CB . . . . . . . . . c30496_6e5h 1 . 5 . 1810 . 1 1 4 CYS H H 5.655 -0.791 -0.684 . . . 1.0 . . . . . . . . . . . . A . 4 CYS H . . . . . . . . . c30496_6e5h 1 . 5 . 1811 . 1 1 4 CYS HA H 2.869 -0.440 -0.461 . . . 1.0 . . . . . . . . . . . . A . 4 CYS HA . . . . . . . . . c30496_6e5h 1 . 5 . 1812 . 1 1 4 CYS HB2 H 4.245 0.963 -1.937 . . . 1.0 . . . . . . . . . . . . A . 4 CYS HB2 . . . . . . . . . c30496_6e5h 1 . 5 . 1813 . 1 1 4 CYS HB3 H 4.575 -0.427 -2.959 . . . 1.0 . . . . . . . . . . . . A . 4 CYS HB3 . . . . . . . . . c30496_6e5h 1 . 5 . 1814 . 1 1 4 CYS N N 4.801 -1.151 -0.361 . . . 1.0 . . . . . . . . . . . . A . 4 CYS N . . . . . . . . . c30496_6e5h 1 . 5 . 1815 . 1 1 4 CYS O O 1.795 -2.463 -1.515 . . . 1.0 . . . . . . . . . . . . A . 4 CYS O . . . . . . . . . c30496_6e5h 1 . 5 . 1816 . 1 1 4 CYS SG S 2.370 0.412 -3.306 . . . 1.0 . . . . . . . . . . . . A . 4 CYS SG . . . . . . . . . c30496_6e5h 1 . 5 . 1817 . 1 1 5 LYS C C 2.968 -5.278 -1.505 . . . 1.0 . . . . . . . . . . . . A . 5 LYS C . . . . . . . . . c30496_6e5h 1 . 5 . 1818 . 1 1 5 LYS CA C 3.449 -4.380 -2.635 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CA . . . . . . . . . c30496_6e5h 1 . 5 . 1819 . 1 1 5 LYS CB C 4.595 -5.053 -3.392 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CB . . . . . . . . . c30496_6e5h 1 . 5 . 1820 . 1 1 5 LYS CD C 6.144 -5.017 -5.369 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CD . . . . . . . . . c30496_6e5h 1 . 5 . 1821 . 1 1 5 LYS CE C 6.522 -4.297 -6.654 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CE . . . . . . . . . c30496_6e5h 1 . 5 . 1822 . 1 1 5 LYS CG C 5.009 -4.310 -4.652 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CG . . . . . . . . . c30496_6e5h 1 . 5 . 1823 . 1 1 5 LYS H H 4.821 -2.853 -2.127 . . . 1.0 . . . . . . . . . . . . A . 5 LYS H . . . . . . . . . c30496_6e5h 1 . 5 . 1824 . 1 1 5 LYS HA H 2.629 -4.212 -3.315 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HA . . . . . . . . . c30496_6e5h 1 . 5 . 1825 . 1 1 5 LYS HB2 H 5.453 -5.118 -2.739 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HB2 . . . . . . . . . c30496_6e5h 1 . 5 . 1826 . 1 1 5 LYS HB3 H 4.290 -6.051 -3.671 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HB3 . . . . . . . . . c30496_6e5h 1 . 5 . 1827 . 1 1 5 LYS HD2 H 7.006 -5.047 -4.719 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HD2 . . . . . . . . . c30496_6e5h 1 . 5 . 1828 . 1 1 5 LYS HD3 H 5.835 -6.023 -5.608 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HD3 . . . . . . . . . c30496_6e5h 1 . 5 . 1829 . 1 1 5 LYS HE2 H 6.858 -3.302 -6.408 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HE2 . . . . . . . . . c30496_6e5h 1 . 5 . 1830 . 1 1 5 LYS HE3 H 7.325 -4.839 -7.131 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HE3 . . . . . . . . . c30496_6e5h 1 . 5 . 1831 . 1 1 5 LYS HG2 H 4.163 -4.253 -5.317 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HG2 . . . . . . . . . c30496_6e5h 1 . 5 . 1832 . 1 1 5 LYS HG3 H 5.328 -3.314 -4.387 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HG3 . . . . . . . . . c30496_6e5h 1 . 5 . 1833 . 1 1 5 LYS HZ1 H 4.599 -3.661 -7.164 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HZ1 . . . . . . . . . c30496_6e5h 1 . 5 . 1834 . 1 1 5 LYS HZ2 H 5.027 -5.149 -7.843 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HZ2 . . . . . . . . . c30496_6e5h 1 . 5 . 1835 . 1 1 5 LYS HZ3 H 5.670 -3.717 -8.472 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HZ3 . . . . . . . . . c30496_6e5h 1 . 5 . 1836 . 1 1 5 LYS N N 3.868 -3.087 -2.118 . . . 1.0 . . . . . . . . . . . . A . 5 LYS N . . . . . . . . . c30496_6e5h 1 . 5 . 1837 . 1 1 5 LYS NZ N 5.376 -4.200 -7.598 . . . 1.0 . . . . . . . . . . . . A . 5 LYS NZ . . . . . . . . . c30496_6e5h 1 . 5 . 1838 . 1 1 5 LYS O O 1.983 -6.005 -1.652 . . . 1.0 . . . . . . . . . . . . A . 5 LYS O . . . . . . . . . c30496_6e5h 1 . 5 . 1839 . 1 1 6 GLU C C 1.922 -5.572 1.307 . . . 1.0 . . . . . . . . . . . . A . 6 GLU C . . . . . . . . . c30496_6e5h 1 . 5 . 1840 . 1 1 6 GLU CA C 3.298 -5.986 0.799 . . . 1.0 . . . . . . . . . . . . A . 6 GLU CA . . . . . . . . . c30496_6e5h 1 . 5 . 1841 . 1 1 6 GLU CB C 4.341 -5.800 1.903 . . . 1.0 . . . . . . . . . . . . A . 6 GLU CB . . . . . . . . . c30496_6e5h 1 . 5 . 1842 . 1 1 6 GLU CD C 4.449 -8.170 2.771 . . . 1.0 . . . . . . . . . . . . A . 6 GLU CD . . . . . . . . . c30496_6e5h 1 . 5 . 1843 . 1 1 6 GLU CG C 4.139 -6.723 3.096 . . . 1.0 . . . . . . . . . . . . A . 6 GLU CG . . . . . . . . . c30496_6e5h 1 . 5 . 1844 . 1 1 6 GLU H H 4.446 -4.617 -0.334 . . . 1.0 . . . . . . . . . . . . A . 6 GLU H . . . . . . . . . c30496_6e5h 1 . 5 . 1845 . 1 1 6 GLU HA H 3.265 -7.026 0.513 . . . 1.0 . . . . . . . . . . . . A . 6 GLU HA . . . . . . . . . c30496_6e5h 1 . 5 . 1846 . 1 1 6 GLU HB2 H 5.322 -5.988 1.491 . . . 1.0 . . . . . . . . . . . . A . 6 GLU HB2 . . . . . . . . . c30496_6e5h 1 . 5 . 1847 . 1 1 6 GLU HB3 H 4.298 -4.778 2.253 . . . 1.0 . . . . . . . . . . . . A . 6 GLU HB3 . . . . . . . . . c30496_6e5h 1 . 5 . 1848 . 1 1 6 GLU HG2 H 4.787 -6.403 3.898 . . . 1.0 . . . . . . . . . . . . A . 6 GLU HG2 . . . . . . . . . c30496_6e5h 1 . 5 . 1849 . 1 1 6 GLU HG3 H 3.110 -6.654 3.416 . . . 1.0 . . . . . . . . . . . . A . 6 GLU HG3 . . . . . . . . . c30496_6e5h 1 . 5 . 1850 . 1 1 6 GLU N N 3.660 -5.207 -0.376 . . . 1.0 . . . . . . . . . . . . A . 6 GLU N . . . . . . . . . c30496_6e5h 1 . 5 . 1851 . 1 1 6 GLU O O 1.085 -6.416 1.619 . . . 1.0 . . . . . . . . . . . . A . 6 GLU O . . . . . . . . . c30496_6e5h 1 . 5 . 1852 . 1 1 6 GLU OE1 O 3.689 -8.794 2.001 . . . 1.0 . . . . . . . . . . . . A . 6 GLU OE1 . . . . . . . . . c30496_6e5h 1 . 5 . 1853 . 1 1 6 GLU OE2 O 5.458 -8.694 3.291 . . . 1.0 . . . . . . . . . . . . A . 6 GLU OE2 . . . . . . . . . c30496_6e5h 1 . 5 . 1854 . 1 1 7 LEU C C -0.706 -4.039 0.868 . . . 1.0 . . . . . . . . . . . . A . 7 LEU C . . . . . . . . . c30496_6e5h 1 . 5 . 1855 . 1 1 7 LEU CA C 0.419 -3.745 1.851 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CA . . . . . . . . . c30496_6e5h 1 . 5 . 1856 . 1 1 7 LEU CB C 0.525 -2.243 2.109 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CB . . . . . . . . . c30496_6e5h 1 . 5 . 1857 . 1 1 7 LEU CD1 C 1.594 -0.329 3.323 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CD1 . . . . . . . . . c30496_6e5h 1 . 5 . 1858 . 1 1 7 LEU CD2 C 1.178 -2.468 4.530 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CD2 . . . . . . . . . c30496_6e5h 1 . 5 . 1859 . 1 1 7 LEU CG C 1.533 -1.839 3.191 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CG . . . . . . . . . c30496_6e5h 1 . 5 . 1860 . 1 1 7 LEU H H 2.385 -3.639 1.076 . . . 1.0 . . . . . . . . . . . . A . 7 LEU H . . . . . . . . . c30496_6e5h 1 . 5 . 1861 . 1 1 7 LEU HA H 0.197 -4.242 2.781 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HA . . . . . . . . . c30496_6e5h 1 . 5 . 1862 . 1 1 7 LEU HB2 H 0.807 -1.763 1.184 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HB2 . . . . . . . . . c30496_6e5h 1 . 5 . 1863 . 1 1 7 LEU HB3 H -0.448 -1.881 2.400 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HB3 . . . . . . . . . c30496_6e5h 1 . 5 . 1864 . 1 1 7 LEU HD11 H 2.302 -0.062 4.094 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD11 . . . . . . . . . c30496_6e5h 1 . 5 . 1865 . 1 1 7 LEU HD12 H 0.617 0.050 3.586 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD12 . . . . . . . . . c30496_6e5h 1 . 5 . 1866 . 1 1 7 LEU HD13 H 1.907 0.102 2.383 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD13 . . . . . . . . . c30496_6e5h 1 . 5 . 1867 . 1 1 7 LEU HD21 H 1.898 -2.161 5.274 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD21 . . . . . . . . . c30496_6e5h 1 . 5 . 1868 . 1 1 7 LEU HD22 H 1.193 -3.543 4.440 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD22 . . . . . . . . . c30496_6e5h 1 . 5 . 1869 . 1 1 7 LEU HD23 H 0.195 -2.145 4.829 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD23 . . . . . . . . . c30496_6e5h 1 . 5 . 1870 . 1 1 7 LEU HG H 2.515 -2.188 2.906 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HG . . . . . . . . . c30496_6e5h 1 . 5 . 1871 . 1 1 7 LEU N N 1.685 -4.269 1.364 . . . 1.0 . . . . . . . . . . . . A . 7 LEU N . . . . . . . . . c30496_6e5h 1 . 5 . 1872 . 1 1 7 LEU O O -1.823 -4.342 1.273 . . . 1.0 . . . . . . . . . . . . A . 7 LEU O . . . . . . . . . c30496_6e5h 1 . 5 . 1873 . 1 1 8 LYS C C -1.677 -5.768 -1.514 . . . 1.0 . . . . . . . . . . . . A . 8 LYS C . . . . . . . . . c30496_6e5h 1 . 5 . 1874 . 1 1 8 LYS CA C -1.404 -4.269 -1.446 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CA . . . . . . . . . c30496_6e5h 1 . 5 . 1875 . 1 1 8 LYS CB C -0.970 -3.744 -2.818 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CB . . . . . . . . . c30496_6e5h 1 . 5 . 1876 . 1 1 8 LYS CD C -0.639 -1.721 -4.315 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CD . . . . . . . . . c30496_6e5h 1 . 5 . 1877 . 1 1 8 LYS CE C -1.736 -1.856 -5.368 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CE . . . . . . . . . c30496_6e5h 1 . 5 . 1878 . 1 1 8 LYS CG C -1.079 -2.231 -2.947 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CG . . . . . . . . . c30496_6e5h 1 . 5 . 1879 . 1 1 8 LYS H H 0.496 -3.682 -0.694 . . . 1.0 . . . . . . . . . . . . A . 8 LYS H . . . . . . . . . c30496_6e5h 1 . 5 . 1880 . 1 1 8 LYS HA H -2.319 -3.773 -1.159 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HA . . . . . . . . . c30496_6e5h 1 . 5 . 1881 . 1 1 8 LYS HB2 H 0.057 -4.026 -2.991 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HB2 . . . . . . . . . c30496_6e5h 1 . 5 . 1882 . 1 1 8 LYS HB3 H -1.592 -4.195 -3.575 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HB3 . . . . . . . . . c30496_6e5h 1 . 5 . 1883 . 1 1 8 LYS HD2 H -0.371 -0.680 -4.225 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HD2 . . . . . . . . . c30496_6e5h 1 . 5 . 1884 . 1 1 8 LYS HD3 H 0.225 -2.288 -4.634 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HD3 . . . . . . . . . c30496_6e5h 1 . 5 . 1885 . 1 1 8 LYS HE2 H -2.660 -1.489 -4.948 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HE2 . . . . . . . . . c30496_6e5h 1 . 5 . 1886 . 1 1 8 LYS HE3 H -1.470 -1.251 -6.223 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HE3 . . . . . . . . . c30496_6e5h 1 . 5 . 1887 . 1 1 8 LYS HG2 H -2.109 -1.947 -2.795 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HG2 . . . . . . . . . c30496_6e5h 1 . 5 . 1888 . 1 1 8 LYS HG3 H -0.464 -1.771 -2.188 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HG3 . . . . . . . . . c30496_6e5h 1 . 5 . 1889 . 1 1 8 LYS HZ1 H -2.637 -3.286 -6.590 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ1 . . . . . . . . . c30496_6e5h 1 . 5 . 1890 . 1 1 8 LYS HZ2 H -2.296 -3.841 -5.034 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ2 . . . . . . . . . c30496_6e5h 1 . 5 . 1891 . 1 1 8 LYS HZ3 H -1.047 -3.662 -6.158 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ3 . . . . . . . . . c30496_6e5h 1 . 5 . 1892 . 1 1 8 LYS N N -0.408 -3.963 -0.423 . . . 1.0 . . . . . . . . . . . . A . 8 LYS N . . . . . . . . . c30496_6e5h 1 . 5 . 1893 . 1 1 8 LYS NZ N -1.942 -3.259 -5.816 . . . 1.0 . . . . . . . . . . . . A . 8 LYS NZ . . . . . . . . . c30496_6e5h 1 . 5 . 1894 . 1 1 8 LYS O O -2.723 -6.192 -1.991 . . . 1.0 . . . . . . . . . . . . A . 8 LYS O . . . . . . . . . c30496_6e5h 1 . 5 . 1895 . 1 1 9 LYS C C -1.740 -8.352 0.275 . . . 1.0 . . . . . . . . . . . . A . 9 LYS C . . . . . . . . . c30496_6e5h 1 . 5 . 1896 . 1 1 9 LYS CA C -0.917 -8.009 -0.964 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CA . . . . . . . . . c30496_6e5h 1 . 5 . 1897 . 1 1 9 LYS CB C 0.442 -8.716 -0.916 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CB . . . . . . . . . c30496_6e5h 1 . 5 . 1898 . 1 1 9 LYS CD C 1.734 -10.859 -0.782 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CD . . . . . . . . . c30496_6e5h 1 . 5 . 1899 . 1 1 9 LYS CE C 1.667 -12.370 -0.635 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CE . . . . . . . . . c30496_6e5h 1 . 5 . 1900 . 1 1 9 LYS CG C 0.353 -10.229 -0.812 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CG . . . . . . . . . c30496_6e5h 1 . 5 . 1901 . 1 1 9 LYS H H 0.141 -6.183 -0.792 . . . 1.0 . . . . . . . . . . . . A . 9 LYS H . . . . . . . . . c30496_6e5h 1 . 5 . 1902 . 1 1 9 LYS HA H -1.457 -8.331 -1.841 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HA . . . . . . . . . c30496_6e5h 1 . 5 . 1903 . 1 1 9 LYS HB2 H 0.990 -8.474 -1.814 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HB2 . . . . . . . . . c30496_6e5h 1 . 5 . 1904 . 1 1 9 LYS HB3 H 0.994 -8.351 -0.062 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HB3 . . . . . . . . . c30496_6e5h 1 . 5 . 1905 . 1 1 9 LYS HD2 H 2.246 -10.620 -1.702 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HD2 . . . . . . . . . c30496_6e5h 1 . 5 . 1906 . 1 1 9 LYS HD3 H 2.285 -10.451 0.052 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HD3 . . . . . . . . . c30496_6e5h 1 . 5 . 1907 . 1 1 9 LYS HE2 H 2.671 -12.753 -0.535 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HE2 . . . . . . . . . c30496_6e5h 1 . 5 . 1908 . 1 1 9 LYS HE3 H 1.106 -12.605 0.256 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HE3 . . . . . . . . . c30496_6e5h 1 . 5 . 1909 . 1 1 9 LYS HG2 H -0.171 -10.489 0.096 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HG2 . . . . . . . . . c30496_6e5h 1 . 5 . 1910 . 1 1 9 LYS HG3 H -0.188 -10.607 -1.664 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HG3 . . . . . . . . . c30496_6e5h 1 . 5 . 1911 . 1 1 9 LYS HZ1 H 0.060 -12.647 -1.945 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HZ1 . . . . . . . . . c30496_6e5h 1 . 5 . 1912 . 1 1 9 LYS HZ2 H 0.949 -14.051 -1.642 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HZ2 . . . . . . . . . c30496_6e5h 1 . 5 . 1913 . 1 1 9 LYS HZ3 H 1.574 -12.864 -2.665 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HZ3 . . . . . . . . . c30496_6e5h 1 . 5 . 1914 . 1 1 9 LYS N N -0.724 -6.569 -1.056 . . . 1.0 . . . . . . . . . . . . A . 9 LYS N . . . . . . . . . c30496_6e5h 1 . 5 . 1915 . 1 1 9 LYS NZ N 1.017 -13.026 -1.803 . . . 1.0 . . . . . . . . . . . . A . 9 LYS NZ . . . . . . . . . c30496_6e5h 1 . 5 . 1916 . 1 1 9 LYS O O -2.648 -9.182 0.226 . . . 1.0 . . . . . . . . . . . . A . 9 LYS O . . . . . . . . . c30496_6e5h 1 . 5 . 1917 . 1 1 10 ARG C C -3.539 -7.451 2.577 . . . 1.0 . . . . . . . . . . . . A . 10 ARG C . . . . . . . . . c30496_6e5h 1 . 5 . 1918 . 1 1 10 ARG CA C -2.087 -7.907 2.649 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CA . . . . . . . . . c30496_6e5h 1 . 5 . 1919 . 1 1 10 ARG CB C -1.352 -7.139 3.749 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CB . . . . . . . . . c30496_6e5h 1 . 5 . 1920 . 1 1 10 ARG CD C -1.175 -6.472 6.149 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CD . . . . . . . . . c30496_6e5h 1 . 5 . 1921 . 1 1 10 ARG CG C -1.951 -7.298 5.134 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CG . . . . . . . . . c30496_6e5h 1 . 5 . 1922 . 1 1 10 ARG CZ C -1.055 -6.195 8.593 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CZ . . . . . . . . . c30496_6e5h 1 . 5 . 1923 . 1 1 10 ARG H H -0.673 -7.047 1.336 . . . 1.0 . . . . . . . . . . . . A . 10 ARG H . . . . . . . . . c30496_6e5h 1 . 5 . 1924 . 1 1 10 ARG HA H -2.058 -8.961 2.875 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HA . . . . . . . . . c30496_6e5h 1 . 5 . 1925 . 1 1 10 ARG HB2 H -0.329 -7.479 3.784 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HB2 . . . . . . . . . c30496_6e5h 1 . 5 . 1926 . 1 1 10 ARG HB3 H -1.360 -6.089 3.500 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HB3 . . . . . . . . . c30496_6e5h 1 . 5 . 1927 . 1 1 10 ARG HD2 H -0.153 -6.818 6.163 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HD2 . . . . . . . . . c30496_6e5h 1 . 5 . 1928 . 1 1 10 ARG HD3 H -1.195 -5.437 5.839 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HD3 . . . . . . . . . c30496_6e5h 1 . 5 . 1929 . 1 1 10 ARG HE H -2.636 -6.930 7.605 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HE . . . . . . . . . c30496_6e5h 1 . 5 . 1930 . 1 1 10 ARG HG2 H -2.979 -6.963 5.113 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HG2 . . . . . . . . . c30496_6e5h 1 . 5 . 1931 . 1 1 10 ARG HG3 H -1.908 -8.341 5.418 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HG3 . . . . . . . . . c30496_6e5h 1 . 5 . 1932 . 1 1 10 ARG HH11 H 0.674 -5.412 9.306 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HH11 . . . . . . . . . c30496_6e5h 1 . 5 . 1933 . 1 1 10 ARG HH12 H 0.600 -5.590 7.584 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HH12 . . . . . . . . . c30496_6e5h 1 . 5 . 1934 . 1 1 10 ARG HH21 H -2.552 -6.688 9.864 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HH21 . . . . . . . . . c30496_6e5h 1 . 5 . 1935 . 1 1 10 ARG HH22 H -1.123 -6.049 10.614 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HH22 . . . . . . . . . c30496_6e5h 1 . 5 . 1936 . 1 1 10 ARG N N -1.410 -7.696 1.377 . . . 1.0 . . . . . . . . . . . . A . 10 ARG N . . . . . . . . . c30496_6e5h 1 . 5 . 1937 . 1 1 10 ARG NE N -1.721 -6.569 7.503 . . . 1.0 . . . . . . . . . . . . A . 10 ARG NE . . . . . . . . . c30496_6e5h 1 . 5 . 1938 . 1 1 10 ARG NH1 N 0.171 -5.693 8.487 . . . 1.0 . . . . . . . . . . . . A . 10 ARG NH1 . . . . . . . . . c30496_6e5h 1 . 5 . 1939 . 1 1 10 ARG NH2 N -1.622 -6.317 9.786 . . . 1.0 . . . . . . . . . . . . A . 10 ARG NH2 . . . . . . . . . c30496_6e5h 1 . 5 . 1940 . 1 1 10 ARG O O -4.455 -8.215 2.868 . . . 1.0 . . . . . . . . . . . . A . 10 ARG O . . . . . . . . . c30496_6e5h 1 . 5 . 1941 . 1 1 11 TYR C C -5.757 -5.932 0.790 . . . 1.0 . . . . . . . . . . . . A . 11 TYR C . . . . . . . . . c30496_6e5h 1 . 5 . 1942 . 1 1 11 TYR CA C -5.073 -5.624 2.117 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CA . . . . . . . . . c30496_6e5h 1 . 5 . 1943 . 1 1 11 TYR CB C -4.998 -4.112 2.305 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CB . . . . . . . . . c30496_6e5h 1 . 5 . 1944 . 1 1 11 TYR CD1 C -5.381 -3.657 4.756 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CD1 . . . . . . . . . c30496_6e5h 1 . 5 . 1945 . 1 1 11 TYR CD2 C -3.202 -3.289 3.868 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CD2 . . . . . . . . . c30496_6e5h 1 . 5 . 1946 . 1 1 11 TYR CE1 C -4.941 -3.277 6.005 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CE1 . . . . . . . . . c30496_6e5h 1 . 5 . 1947 . 1 1 11 TYR CE2 C -2.756 -2.902 5.116 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CE2 . . . . . . . . . c30496_6e5h 1 . 5 . 1948 . 1 1 11 TYR CG C -4.520 -3.672 3.668 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CG . . . . . . . . . c30496_6e5h 1 . 5 . 1949 . 1 1 11 TYR CZ C -3.650 -2.827 6.166 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CZ . . . . . . . . . c30496_6e5h 1 . 5 . 1950 . 1 1 11 TYR H H -2.972 -5.665 1.889 . . . 1.0 . . . . . . . . . . . . A . 11 TYR H . . . . . . . . . c30496_6e5h 1 . 5 . 1951 . 1 1 11 TYR HA H -5.655 -6.048 2.920 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HA . . . . . . . . . c30496_6e5h 1 . 5 . 1952 . 1 1 11 TYR HB2 H -4.323 -3.702 1.572 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HB2 . . . . . . . . . c30496_6e5h 1 . 5 . 1953 . 1 1 11 TYR HB3 H -5.980 -3.697 2.150 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HB3 . . . . . . . . . c30496_6e5h 1 . 5 . 1954 . 1 1 11 TYR HD1 H -6.411 -3.952 4.615 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HD1 . . . . . . . . . c30496_6e5h 1 . 5 . 1955 . 1 1 11 TYR HD2 H -2.522 -3.292 3.029 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HD2 . . . . . . . . . c30496_6e5h 1 . 5 . 1956 . 1 1 11 TYR HE1 H -5.625 -3.272 6.837 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HE1 . . . . . . . . . c30496_6e5h 1 . 5 . 1957 . 1 1 11 TYR HE2 H -1.726 -2.607 5.252 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HE2 . . . . . . . . . c30496_6e5h 1 . 5 . 1958 . 1 1 11 TYR HH H -2.699 -1.696 7.360 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HH . . . . . . . . . c30496_6e5h 1 . 5 . 1959 . 1 1 11 TYR N N -3.741 -6.207 2.171 . . . 1.0 . . . . . . . . . . . . A . 11 TYR N . . . . . . . . . c30496_6e5h 1 . 5 . 1960 . 1 1 11 TYR O O -6.337 -5.039 0.170 . . . 1.0 . . . . . . . . . . . . A . 11 TYR O . . . . . . . . . c30496_6e5h 1 . 5 . 1961 . 1 1 11 TYR OH O -3.188 -2.525 7.430 . . . 1.0 . . . . . . . . . . . . A . 11 TYR OH . . . . . . . . . c30496_6e5h 1 . 5 . 1962 . 1 1 12 ABA C C -7.839 -7.363 -0.782 . . . 1.0 . . . . . . . . . . . . A . 12 AIB C . . . . . . . . . c30496_6e5h 1 . 5 . 1963 . 1 1 12 ABA CA C -6.332 -7.650 -0.867 . . . 1.0 . . . . . . . . . . . . A . 12 AIB CA . . . . . . . . . c30496_6e5h 1 . 5 . 1964 . 1 1 12 ABA H H -5.197 -7.842 0.920 . . . 1.0 . . . . . . . . . . . . A . 12 AIB H . . . . . . . . . c30496_6e5h 1 . 5 . 1965 . 1 1 12 ABA N N -5.689 -7.193 0.371 . . . 1.0 . . . . . . . . . . . . A . 12 AIB N . . . . . . . . . c30496_6e5h 1 . 5 . 1966 . 1 1 12 ABA O O -8.569 -8.063 -0.082 . . . 1.0 . . . . . . . . . . . . A . 12 AIB O . . . . . . . . . c30496_6e5h 1 . 5 . 1967 . 1 1 13 GLY C C -9.861 -4.484 -1.089 . . . 1.0 . . . . . . . . . . . . A . 13 GLY C . . . . . . . . . c30496_6e5h 1 . 5 . 1968 . 1 1 13 GLY CA C -9.689 -5.952 -1.425 . . . 1.0 . . . . . . . . . . . . A . 13 GLY CA . . . . . . . . . c30496_6e5h 1 . 5 . 1969 . 1 1 13 GLY H H -7.681 -5.832 -2.056 . . . 1.0 . . . . . . . . . . . . A . 13 GLY H . . . . . . . . . c30496_6e5h 1 . 5 . 1970 . 1 1 13 GLY HA2 H -10.148 -6.148 -2.380 . . . 1.0 . . . . . . . . . . . . A . 13 GLY HA2 . . . . . . . . . c30496_6e5h 1 . 5 . 1971 . 1 1 13 GLY HA3 H -10.180 -6.543 -0.671 . . . 1.0 . . . . . . . . . . . . A . 13 GLY HA3 . . . . . . . . . c30496_6e5h 1 . 5 . 1972 . 1 1 13 GLY N N -8.295 -6.334 -1.486 . . . 1.0 . . . . . . . . . . . . A . 13 GLY N . . . . . . . . . c30496_6e5h 1 . 5 . 1973 . 1 1 13 GLY O O -10.911 -3.897 -1.344 . . . 1.0 . . . . . . . . . . . . A . 13 GLY O . . . . . . . . . c30496_6e5h 1 . 5 . 1974 . 1 1 14 CYS C C -8.029 -1.689 -1.181 . . . 1.0 . . . . . . . . . . . . A . 14 CYS C . . . . . . . . . c30496_6e5h 1 . 5 . 1975 . 1 1 14 CYS CA C -8.838 -2.483 -0.168 . . . 1.0 . . . . . . . . . . . . A . 14 CYS CA . . . . . . . . . c30496_6e5h 1 . 5 . 1976 . 1 1 14 CYS CB C -8.240 -2.271 1.221 . . . 1.0 . . . . . . . . . . . . A . 14 CYS CB . . . . . . . . . c30496_6e5h 1 . 5 . 1977 . 1 1 14 CYS H H -8.024 -4.425 -0.314 . . . 1.0 . . . . . . . . . . . . A . 14 CYS H . . . . . . . . . c30496_6e5h 1 . 5 . 1978 . 1 1 14 CYS HA H -9.860 -2.138 -0.176 . . . 1.0 . . . . . . . . . . . . A . 14 CYS HA . . . . . . . . . c30496_6e5h 1 . 5 . 1979 . 1 1 14 CYS HB2 H -7.192 -2.513 1.187 . . . 1.0 . . . . . . . . . . . . A . 14 CYS HB2 . . . . . . . . . c30496_6e5h 1 . 5 . 1980 . 1 1 14 CYS HB3 H -8.353 -1.232 1.495 . . . 1.0 . . . . . . . . . . . . A . 14 CYS HB3 . . . . . . . . . c30496_6e5h 1 . 5 . 1981 . 1 1 14 CYS N N -8.826 -3.895 -0.513 . . . 1.0 . . . . . . . . . . . . A . 14 CYS N . . . . . . . . . c30496_6e5h 1 . 5 . 1982 . 1 1 14 CYS O O -7.194 -2.246 -1.893 . . . 1.0 . . . . . . . . . . . . A . 14 CYS O . . . . . . . . . c30496_6e5h 1 . 5 . 1983 . 1 1 14 CYS SG S -8.998 -3.276 2.538 . . . 1.0 . . . . . . . . . . . . A . 14 CYS SG . . . . . . . . . c30496_6e5h 1 . 5 . 1984 . 1 1 15 GLU C C -6.306 1.033 -1.350 . . . 1.0 . . . . . . . . . . . . A . 15 GLU C . . . . . . . . . c30496_6e5h 1 . 5 . 1985 . 1 1 15 GLU CA C -7.513 0.491 -2.102 . . . 1.0 . . . . . . . . . . . . A . 15 GLU CA . . . . . . . . . c30496_6e5h 1 . 5 . 1986 . 1 1 15 GLU CB C -8.386 1.651 -2.592 . . . 1.0 . . . . . . . . . . . . A . 15 GLU CB . . . . . . . . . c30496_6e5h 1 . 5 . 1987 . 1 1 15 GLU CD C -8.499 3.832 -3.862 . . . 1.0 . . . . . . . . . . . . A . 15 GLU CD . . . . . . . . . c30496_6e5h 1 . 5 . 1988 . 1 1 15 GLU CG C -7.650 2.635 -3.491 . . . 1.0 . . . . . . . . . . . . A . 15 GLU CG . . . . . . . . . c30496_6e5h 1 . 5 . 1989 . 1 1 15 GLU H H -8.985 -0.013 -0.673 . . . 1.0 . . . . . . . . . . . . A . 15 GLU H . . . . . . . . . c30496_6e5h 1 . 5 . 1990 . 1 1 15 GLU HA H -7.171 -0.084 -2.950 . . . 1.0 . . . . . . . . . . . . A . 15 GLU HA . . . . . . . . . c30496_6e5h 1 . 5 . 1991 . 1 1 15 GLU HB2 H -9.221 1.247 -3.147 . . . 1.0 . . . . . . . . . . . . A . 15 GLU HB2 . . . . . . . . . c30496_6e5h 1 . 5 . 1992 . 1 1 15 GLU HB3 H -8.762 2.189 -1.736 . . . 1.0 . . . . . . . . . . . . A . 15 GLU HB3 . . . . . . . . . c30496_6e5h 1 . 5 . 1993 . 1 1 15 GLU HG2 H -6.769 2.986 -2.974 . . . 1.0 . . . . . . . . . . . . A . 15 GLU HG2 . . . . . . . . . c30496_6e5h 1 . 5 . 1994 . 1 1 15 GLU HG3 H -7.355 2.127 -4.397 . . . 1.0 . . . . . . . . . . . . A . 15 GLU HG3 . . . . . . . . . c30496_6e5h 1 . 5 . 1995 . 1 1 15 GLU N N -8.273 -0.391 -1.236 . . . 1.0 . . . . . . . . . . . . A . 15 GLU N . . . . . . . . . c30496_6e5h 1 . 5 . 1996 . 1 1 15 GLU O O -6.446 1.899 -0.484 . . . 1.0 . . . . . . . . . . . . A . 15 GLU O . . . . . . . . . c30496_6e5h 1 . 5 . 1997 . 1 1 15 GLU OE1 O -8.141 4.963 -3.472 . . . 1.0 . . . . . . . . . . . . A . 15 GLU OE1 . . . . . . . . . c30496_6e5h 1 . 5 . 1998 . 1 1 15 GLU OE2 O -9.535 3.648 -4.540 . . . 1.0 . . . . . . . . . . . . A . 15 GLU OE2 . . . . . . . . . c30496_6e5h 1 . 5 . 1999 . 1 1 16 VAL C C -3.135 1.864 -1.974 . . . 1.0 . . . . . . . . . . . . A . 16 VAL C . . . . . . . . . c30496_6e5h 1 . 5 . 2000 . 1 1 16 VAL CA C -3.907 0.961 -1.027 . . . 1.0 . . . . . . . . . . . . A . 16 VAL CA . . . . . . . . . c30496_6e5h 1 . 5 . 2001 . 1 1 16 VAL CB C -2.991 -0.206 -0.607 . . . 1.0 . . . . . . . . . . . . A . 16 VAL CB . . . . . . . . . c30496_6e5h 1 . 5 . 2002 . 1 1 16 VAL CG1 C -1.761 0.312 0.126 . . . 1.0 . . . . . . . . . . . . A . 16 VAL CG1 . . . . . . . . . c30496_6e5h 1 . 5 . 2003 . 1 1 16 VAL CG2 C -3.744 -1.208 0.250 . . . 1.0 . . . . . . . . . . . . A . 16 VAL CG2 . . . . . . . . . c30496_6e5h 1 . 5 . 2004 . 1 1 16 VAL H H -5.093 -0.217 -2.324 . . . 1.0 . . . . . . . . . . . . A . 16 VAL H . . . . . . . . . c30496_6e5h 1 . 5 . 2005 . 1 1 16 VAL HA H -4.173 1.522 -0.143 . . . 1.0 . . . . . . . . . . . . A . 16 VAL HA . . . . . . . . . c30496_6e5h 1 . 5 . 2006 . 1 1 16 VAL HB H -2.661 -0.710 -1.501 . . . 1.0 . . . . . . . . . . . . A . 16 VAL HB . . . . . . . . . c30496_6e5h 1 . 5 . 2007 . 1 1 16 VAL HG11 H -1.197 0.962 -0.531 . . . 1.0 . . . . . . . . . . . . A . 16 VAL HG11 . . . . . . . . . c30496_6e5h 1 . 5 . 2008 . 1 1 16 VAL HG12 H -1.142 -0.520 0.426 . . . 1.0 . . . . . . . . . . . . A . 16 VAL HG12 . . . . . . . . . c30496_6e5h 1 . 5 . 2009 . 1 1 16 VAL HG13 H -2.068 0.866 1.000 . . . 1.0 . . . . . . . . . . . . A . 16 VAL HG13 . . . . . . . . . c30496_6e5h 1 . 5 . 2010 . 1 1 16 VAL HG21 H -4.538 -1.654 -0.329 . . . 1.0 . . . . . . . . . . . . A . 16 VAL HG21 . . . . . . . . . c30496_6e5h 1 . 5 . 2011 . 1 1 16 VAL HG22 H -4.163 -0.705 1.107 . . . 1.0 . . . . . . . . . . . . A . 16 VAL HG22 . . . . . . . . . c30496_6e5h 1 . 5 . 2012 . 1 1 16 VAL HG23 H -3.062 -1.978 0.581 . . . 1.0 . . . . . . . . . . . . A . 16 VAL HG23 . . . . . . . . . c30496_6e5h 1 . 5 . 2013 . 1 1 16 VAL N N -5.134 0.500 -1.656 . . . 1.0 . . . . . . . . . . . . A . 16 VAL N . . . . . . . . . c30496_6e5h 1 . 5 . 2014 . 1 1 16 VAL O O -2.783 1.463 -3.084 . . . 1.0 . . . . . . . . . . . . A . 16 VAL O . . . . . . . . . c30496_6e5h 1 . 5 . 2015 . 1 1 17 ARG C C -0.813 4.356 -1.605 . . . 1.0 . . . . . . . . . . . . A . 17 ARG C . . . . . . . . . c30496_6e5h 1 . 5 . 2016 . 1 1 17 ARG CA C -2.115 4.030 -2.319 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CA . . . . . . . . . c30496_6e5h 1 . 5 . 2017 . 1 1 17 ARG CB C -2.910 5.313 -2.560 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CB . . . . . . . . . c30496_6e5h 1 . 5 . 2018 . 1 1 17 ARG CD C -4.972 6.379 -3.533 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CD . . . . . . . . . c30496_6e5h 1 . 5 . 2019 . 1 1 17 ARG CG C -4.290 5.075 -3.150 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CG . . . . . . . . . c30496_6e5h 1 . 5 . 2020 . 1 1 17 ARG CZ C -6.142 7.745 -1.836 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CZ . . . . . . . . . c30496_6e5h 1 . 5 . 2021 . 1 1 17 ARG H H -3.225 3.352 -0.652 . . . 1.0 . . . . . . . . . . . . A . 17 ARG H . . . . . . . . . c30496_6e5h 1 . 5 . 2022 . 1 1 17 ARG HA H -1.889 3.570 -3.266 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HA . . . . . . . . . c30496_6e5h 1 . 5 . 2023 . 1 1 17 ARG HB2 H -3.028 5.830 -1.621 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HB2 . . . . . . . . . c30496_6e5h 1 . 5 . 2024 . 1 1 17 ARG HB3 H -2.354 5.943 -3.239 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HB3 . . . . . . . . . c30496_6e5h 1 . 5 . 2025 . 1 1 17 ARG HD2 H -4.433 6.825 -4.356 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HD2 . . . . . . . . . c30496_6e5h 1 . 5 . 2026 . 1 1 17 ARG HD3 H -5.983 6.160 -3.846 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HD3 . . . . . . . . . c30496_6e5h 1 . 5 . 2027 . 1 1 17 ARG HE H -4.158 7.719 -2.125 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HE . . . . . . . . . c30496_6e5h 1 . 5 . 2028 . 1 1 17 ARG HG2 H -4.192 4.460 -4.031 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HG2 . . . . . . . . . c30496_6e5h 1 . 5 . 2029 . 1 1 17 ARG HG3 H -4.898 4.562 -2.419 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HG3 . . . . . . . . . c30496_6e5h 1 . 5 . 2030 . 1 1 17 ARG HH11 H -7.346 6.442 -2.834 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH11 . . . . . . . . . c30496_6e5h 1 . 5 . 2031 . 1 1 17 ARG HH12 H -8.152 7.506 -1.721 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH12 . . . . . . . . . c30496_6e5h 1 . 5 . 2032 . 1 1 17 ARG HH21 H -5.223 9.111 -0.646 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH21 . . . . . . . . . c30496_6e5h 1 . 5 . 2033 . 1 1 17 ARG HH22 H -6.947 9.011 -0.470 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH22 . . . . . . . . . c30496_6e5h 1 . 5 . 2034 . 1 1 17 ARG N N -2.885 3.083 -1.534 . . . 1.0 . . . . . . . . . . . . A . 17 ARG N . . . . . . . . . c30496_6e5h 1 . 5 . 2035 . 1 1 17 ARG NE N -5.016 7.334 -2.422 . . . 1.0 . . . . . . . . . . . . A . 17 ARG NE . . . . . . . . . c30496_6e5h 1 . 5 . 2036 . 1 1 17 ARG NH1 N -7.304 7.186 -2.152 . . . 1.0 . . . . . . . . . . . . A . 17 ARG NH1 . . . . . . . . . c30496_6e5h 1 . 5 . 2037 . 1 1 17 ARG NH2 N -6.101 8.696 -0.910 . . . 1.0 . . . . . . . . . . . . A . 17 ARG NH2 . . . . . . . . . c30496_6e5h 1 . 5 . 2038 . 1 1 17 ARG O O -0.821 4.886 -0.496 . . . 1.0 . . . . . . . . . . . . A . 17 ARG O . . . . . . . . . c30496_6e5h 1 . 5 . 2039 . 1 1 18 CYS C C 2.226 5.543 -2.177 . . . 1.0 . . . . . . . . . . . . A . 18 CYS C . . . . . . . . . c30496_6e5h 1 . 5 . 2040 . 1 1 18 CYS CA C 1.598 4.267 -1.638 . . . 1.0 . . . . . . . . . . . . A . 18 CYS CA . . . . . . . . . c30496_6e5h 1 . 5 . 2041 . 1 1 18 CYS CB C 2.523 3.080 -1.886 . . . 1.0 . . . . . . . . . . . . A . 18 CYS CB . . . . . . . . . c30496_6e5h 1 . 5 . 2042 . 1 1 18 CYS H H 0.249 3.610 -3.119 . . . 1.0 . . . . . . . . . . . . A . 18 CYS H . . . . . . . . . c30496_6e5h 1 . 5 . 2043 . 1 1 18 CYS HA H 1.453 4.375 -0.575 . . . 1.0 . . . . . . . . . . . . A . 18 CYS HA . . . . . . . . . c30496_6e5h 1 . 5 . 2044 . 1 1 18 CYS HB2 H 3.540 3.385 -1.690 . . . 1.0 . . . . . . . . . . . . A . 18 CYS HB2 . . . . . . . . . c30496_6e5h 1 . 5 . 2045 . 1 1 18 CYS HB3 H 2.255 2.280 -1.213 . . . 1.0 . . . . . . . . . . . . A . 18 CYS HB3 . . . . . . . . . c30496_6e5h 1 . 5 . 2046 . 1 1 18 CYS N N 0.299 4.026 -2.233 . . . 1.0 . . . . . . . . . . . . A . 18 CYS N . . . . . . . . . c30496_6e5h 1 . 5 . 2047 . 1 1 18 CYS O O 2.420 5.694 -3.387 . . . 1.0 . . . . . . . . . . . . A . 18 CYS O . . . . . . . . . c30496_6e5h 1 . 5 . 2048 . 1 1 18 CYS SG S 2.467 2.421 -3.583 . . . 1.0 . . . . . . . . . . . . A . 18 CYS SG . . . . . . . . . c30496_6e5h 1 . 5 . 2049 . 1 1 19 ASP C C 4.374 7.925 -0.695 . . . 1.0 . . . . . . . . . . . . A . 19 ASP C . . . . . . . . . c30496_6e5h 1 . 5 . 2050 . 1 1 19 ASP CA C 3.204 7.696 -1.637 . . . 1.0 . . . . . . . . . . . . A . 19 ASP CA . . . . . . . . . c30496_6e5h 1 . 5 . 2051 . 1 1 19 ASP CB C 2.235 8.877 -1.580 . . . 1.0 . . . . . . . . . . . . A . 19 ASP CB . . . . . . . . . c30496_6e5h 1 . 5 . 2052 . 1 1 19 ASP CG C 2.851 10.147 -2.133 . . . 1.0 . . . . . . . . . . . . A . 19 ASP CG . . . . . . . . . c30496_6e5h 1 . 5 . 2053 . 1 1 19 ASP H H 2.322 6.294 -0.329 . . . 1.0 . . . . . . . . . . . . A . 19 ASP H . . . . . . . . . c30496_6e5h 1 . 5 . 2054 . 1 1 19 ASP HA H 3.579 7.592 -2.644 . . . 1.0 . . . . . . . . . . . . A . 19 ASP HA . . . . . . . . . c30496_6e5h 1 . 5 . 2055 . 1 1 19 ASP HB2 H 1.355 8.643 -2.159 . . . 1.0 . . . . . . . . . . . . A . 19 ASP HB2 . . . . . . . . . c30496_6e5h 1 . 5 . 2056 . 1 1 19 ASP HB3 H 1.952 9.053 -0.553 . . . 1.0 . . . . . . . . . . . . A . 19 ASP HB3 . . . . . . . . . c30496_6e5h 1 . 5 . 2057 . 1 1 19 ASP N N 2.537 6.458 -1.275 . . . 1.0 . . . . . . . . . . . . A . 19 ASP N . . . . . . . . . c30496_6e5h 1 . 5 . 2058 . 1 1 19 ASP O O 4.212 8.480 0.395 . . . 1.0 . . . . . . . . . . . . A . 19 ASP O . . . . . . . . . c30496_6e5h 1 . 5 . 2059 . 1 1 19 ASP OD1 O 3.343 10.976 -1.340 . . . 1.0 . . . . . . . . . . . . A . 19 ASP OD1 . . . . . . . . . c30496_6e5h 1 . 5 . 2060 . 1 1 19 ASP OD2 O 2.854 10.320 -3.371 . . . 1.0 . . . . . . . . . . . . A . 19 ASP OD2 . . . . . . . . . c30496_6e5h 1 . 5 . 2061 . 1 1 20 DPR C C 6.600 6.779 1.044 . . . 1.0 . . . . . . . . . . . . A . 20 DPR C . . . . . . . . . c30496_6e5h 1 . 5 . 2062 . 1 1 20 DPR CA C 6.758 7.566 -0.253 . . . 1.0 . . . . . . . . . . . . A . 20 DPR CA . . . . . . . . . c30496_6e5h 1 . 5 . 2063 . 1 1 20 DPR CB C 7.877 6.988 -1.119 . . . 1.0 . . . . . . . . . . . . A . 20 DPR CB . . . . . . . . . c30496_6e5h 1 . 5 . 2064 . 1 1 20 DPR CD C 5.840 6.774 -2.360 . . . 1.0 . . . . . . . . . . . . A . 20 DPR CD . . . . . . . . . c30496_6e5h 1 . 5 . 2065 . 1 1 20 DPR CG C 7.187 6.143 -2.133 . . . 1.0 . . . . . . . . . . . . A . 20 DPR CG . . . . . . . . . c30496_6e5h 1 . 5 . 2066 . 1 1 20 DPR HA H 6.985 8.593 -0.022 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HA . . . . . . . . . c30496_6e5h 1 . 5 . 2067 . 1 1 20 DPR HB2 H 8.426 7.795 -1.581 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HB2 . . . . . . . . . c30496_6e5h 1 . 5 . 2068 . 1 1 20 DPR HB3 H 8.541 6.400 -0.504 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HB3 . . . . . . . . . c30496_6e5h 1 . 5 . 2069 . 1 1 20 DPR HD2 H 5.884 7.482 -3.174 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HD2 . . . . . . . . . c30496_6e5h 1 . 5 . 2070 . 1 1 20 DPR HD3 H 5.097 6.014 -2.556 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HD3 . . . . . . . . . c30496_6e5h 1 . 5 . 2071 . 1 1 20 DPR HG2 H 7.756 6.132 -3.051 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HG2 . . . . . . . . . c30496_6e5h 1 . 5 . 2072 . 1 1 20 DPR HG3 H 7.070 5.141 -1.753 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HG3 . . . . . . . . . c30496_6e5h 1 . 5 . 2073 . 1 1 20 DPR N N 5.565 7.456 -1.085 . . . 1.0 . . . . . . . . . . . . A . 20 DPR N . . . . . . . . . c30496_6e5h 1 . 5 . 2074 . 1 1 20 DPR O O 6.348 5.569 1.026 . . . 1.0 . . . . . . . . . . . . A . 20 DPR O . . . . . . . . . c30496_6e5h 1 . 5 . 2075 . 1 1 21 PRO C C 5.086 6.785 3.911 . . . 1.0 . . . . . . . . . . . . A . 21 PRO C . . . . . . . . . c30496_6e5h 1 . 5 . 2076 . 1 1 21 PRO CA C 6.554 6.848 3.494 . . . 1.0 . . . . . . . . . . . . A . 21 PRO CA . . . . . . . . . c30496_6e5h 1 . 5 . 2077 . 1 1 21 PRO CB C 7.329 7.788 4.412 . . . 1.0 . . . . . . . . . . . . A . 21 PRO CB . . . . . . . . . c30496_6e5h 1 . 5 . 2078 . 1 1 21 PRO CD C 7.116 8.885 2.289 . . . 1.0 . . . . . . . . . . . . A . 21 PRO CD . . . . . . . . . c30496_6e5h 1 . 5 . 2079 . 1 1 21 PRO CG C 7.183 9.128 3.776 . . . 1.0 . . . . . . . . . . . . A . 21 PRO CG . . . . . . . . . c30496_6e5h 1 . 5 . 2080 . 1 1 21 PRO HA H 6.985 5.861 3.537 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HA . . . . . . . . . c30496_6e5h 1 . 5 . 2081 . 1 1 21 PRO HB2 H 6.897 7.766 5.401 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HB2 . . . . . . . . . c30496_6e5h 1 . 5 . 2082 . 1 1 21 PRO HB3 H 8.363 7.485 4.456 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HB3 . . . . . . . . . c30496_6e5h 1 . 5 . 2083 . 1 1 21 PRO HD2 H 6.365 9.516 1.836 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HD2 . . . . . . . . . c30496_6e5h 1 . 5 . 2084 . 1 1 21 PRO HD3 H 8.079 9.060 1.836 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HD3 . . . . . . . . . c30496_6e5h 1 . 5 . 2085 . 1 1 21 PRO HG2 H 6.274 9.598 4.120 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HG2 . . . . . . . . . c30496_6e5h 1 . 5 . 2086 . 1 1 21 PRO HG3 H 8.038 9.742 4.018 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HG3 . . . . . . . . . c30496_6e5h 1 . 5 . 2087 . 1 1 21 PRO N N 6.738 7.461 2.185 . . . 1.0 . . . . . . . . . . . . A . 21 PRO N . . . . . . . . . c30496_6e5h 1 . 5 . 2088 . 1 1 21 PRO O O 4.756 6.224 4.957 . . . 1.0 . . . . . . . . . . . . A . 21 PRO O . . . . . . . . . c30496_6e5h 1 . 5 . 2089 . 1 1 22 ARG C C 2.041 6.309 2.670 . . . 1.0 . . . . . . . . . . . . A . 22 ARG C . . . . . . . . . c30496_6e5h 1 . 5 . 2090 . 1 1 22 ARG CA C 2.789 7.396 3.417 . . . 1.0 . . . . . . . . . . . . A . 22 ARG CA . . . . . . . . . c30496_6e5h 1 . 5 . 2091 . 1 1 22 ARG CB C 2.178 8.753 3.075 . . . 1.0 . . . . . . . . . . . . A . 22 ARG CB . . . . . . . . . c30496_6e5h 1 . 5 . 2092 . 1 1 22 ARG CD C 1.881 11.151 3.725 . . . 1.0 . . . . . . . . . . . . A . 22 ARG CD . . . . . . . . . c30496_6e5h 1 . 5 . 2093 . 1 1 22 ARG CG C 2.747 9.911 3.873 . . . 1.0 . . . . . . . . . . . . A . 22 ARG CG . . . . . . . . . c30496_6e5h 1 . 5 . 2094 . 1 1 22 ARG CZ C -0.582 11.388 3.642 . . . 1.0 . . . . . . . . . . . . A . 22 ARG CZ . . . . . . . . . c30496_6e5h 1 . 5 . 2095 . 1 1 22 ARG H H 4.519 7.752 2.246 . . . 1.0 . . . . . . . . . . . . A . 22 ARG H . . . . . . . . . c30496_6e5h 1 . 5 . 2096 . 1 1 22 ARG HA H 2.686 7.221 4.477 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HA . . . . . . . . . c30496_6e5h 1 . 5 . 2097 . 1 1 22 ARG HB2 H 2.346 8.953 2.027 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HB2 . . . . . . . . . c30496_6e5h 1 . 5 . 2098 . 1 1 22 ARG HB3 H 1.114 8.708 3.255 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HB3 . . . . . . . . . c30496_6e5h 1 . 5 . 2099 . 1 1 22 ARG HD2 H 2.336 11.962 4.276 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HD2 . . . . . . . . . c30496_6e5h 1 . 5 . 2100 . 1 1 22 ARG HD3 H 1.827 11.414 2.679 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HD3 . . . . . . . . . c30496_6e5h 1 . 5 . 2101 . 1 1 22 ARG HE H 0.432 10.423 5.070 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HE . . . . . . . . . c30496_6e5h 1 . 5 . 2102 . 1 1 22 ARG HG2 H 2.795 9.635 4.916 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HG2 . . . . . . . . . c30496_6e5h 1 . 5 . 2103 . 1 1 22 ARG HG3 H 3.740 10.132 3.511 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HG3 . . . . . . . . . c30496_6e5h 1 . 5 . 2104 . 1 1 22 ARG HH11 H 0.387 12.217 2.061 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HH11 . . . . . . . . . c30496_6e5h 1 . 5 . 2105 . 1 1 22 ARG HH12 H -1.338 12.394 2.051 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HH12 . . . . . . . . . c30496_6e5h 1 . 5 . 2106 . 1 1 22 ARG HH21 H -2.603 11.504 3.750 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HH21 . . . . . . . . . c30496_6e5h 1 . 5 . 2107 . 1 1 22 ARG HH22 H -1.840 10.646 5.052 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HH22 . . . . . . . . . c30496_6e5h 1 . 5 . 2108 . 1 1 22 ARG N N 4.208 7.360 3.096 . . . 1.0 . . . . . . . . . . . . A . 22 ARG N . . . . . . . . . c30496_6e5h 1 . 5 . 2109 . 1 1 22 ARG NE N 0.523 10.933 4.233 . . . 1.0 . . . . . . . . . . . . A . 22 ARG NE . . . . . . . . . c30496_6e5h 1 . 5 . 2110 . 1 1 22 ARG NH1 N -0.504 12.053 2.493 . . . 1.0 . . . . . . . . . . . . A . 22 ARG NH1 . . . . . . . . . c30496_6e5h 1 . 5 . 2111 . 1 1 22 ARG NH2 N -1.770 11.162 4.192 . . . 1.0 . . . . . . . . . . . . A . 22 ARG NH2 . . . . . . . . . c30496_6e5h 1 . 5 . 2112 . 1 1 22 ARG O O 2.351 6.005 1.515 . . . 1.0 . . . . . . . . . . . . A . 22 ARG O . . . . . . . . . c30496_6e5h 1 . 5 . 2113 . 1 1 23 TYR C C -1.215 4.889 3.070 . . . 1.0 . . . . . . . . . . . . A . 23 TYR C . . . . . . . . . c30496_6e5h 1 . 5 . 2114 . 1 1 23 TYR CA C 0.249 4.686 2.724 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CA . . . . . . . . . c30496_6e5h 1 . 5 . 2115 . 1 1 23 TYR CB C 0.708 3.303 3.179 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CB . . . . . . . . . c30496_6e5h 1 . 5 . 2116 . 1 1 23 TYR CD1 C 3.140 3.199 3.847 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CD1 . . . . . . . . . c30496_6e5h 1 . 5 . 2117 . 1 1 23 TYR CD2 C 2.553 2.595 1.619 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CD2 . . . . . . . . . c30496_6e5h 1 . 5 . 2118 . 1 1 23 TYR CE1 C 4.468 2.953 3.567 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CE1 . . . . . . . . . c30496_6e5h 1 . 5 . 2119 . 1 1 23 TYR CE2 C 3.879 2.343 1.333 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CE2 . . . . . . . . . c30496_6e5h 1 . 5 . 2120 . 1 1 23 TYR CG C 2.161 3.025 2.877 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CG . . . . . . . . . c30496_6e5h 1 . 5 . 2121 . 1 1 23 TYR CZ C 4.832 2.525 2.309 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CZ . . . . . . . . . c30496_6e5h 1 . 5 . 2122 . 1 1 23 TYR H H 0.877 5.990 4.258 . . . 1.0 . . . . . . . . . . . . A . 23 TYR H . . . . . . . . . c30496_6e5h 1 . 5 . 2123 . 1 1 23 TYR HA H 0.367 4.760 1.655 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HA . . . . . . . . . c30496_6e5h 1 . 5 . 2124 . 1 1 23 TYR HB2 H 0.566 3.214 4.243 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HB2 . . . . . . . . . c30496_6e5h 1 . 5 . 2125 . 1 1 23 TYR HB3 H 0.114 2.556 2.674 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HB3 . . . . . . . . . c30496_6e5h 1 . 5 . 2126 . 1 1 23 TYR HD1 H 2.850 3.536 4.831 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HD1 . . . . . . . . . c30496_6e5h 1 . 5 . 2127 . 1 1 23 TYR HD2 H 1.800 2.456 0.855 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HD2 . . . . . . . . . c30496_6e5h 1 . 5 . 2128 . 1 1 23 TYR HE1 H 5.213 3.092 4.334 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HE1 . . . . . . . . . c30496_6e5h 1 . 5 . 2129 . 1 1 23 TYR HE2 H 4.163 2.007 0.349 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HE2 . . . . . . . . . c30496_6e5h 1 . 5 . 2130 . 1 1 23 TYR HH H 6.369 2.646 1.157 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HH . . . . . . . . . c30496_6e5h 1 . 5 . 2131 . 1 1 23 TYR N N 1.061 5.721 3.332 . . . 1.0 . . . . . . . . . . . . A . 23 TYR N . . . . . . . . . c30496_6e5h 1 . 5 . 2132 . 1 1 23 TYR O O -1.596 4.895 4.241 . . . 1.0 . . . . . . . . . . . . A . 23 TYR O . . . . . . . . . c30496_6e5h 1 . 5 . 2133 . 1 1 23 TYR OH O 6.156 2.281 2.024 . . . 1.0 . . . . . . . . . . . . A . 23 TYR OH . . . . . . . . . c30496_6e5h 1 . 5 . 2134 . 1 1 24 GLU C C -4.212 3.969 1.982 . . . 1.0 . . . . . . . . . . . . A . 24 GLU C . . . . . . . . . c30496_6e5h 1 . 5 . 2135 . 1 1 24 GLU CA C -3.453 5.262 2.221 . . . 1.0 . . . . . . . . . . . . A . 24 GLU CA . . . . . . . . . c30496_6e5h 1 . 5 . 2136 . 1 1 24 GLU CB C -3.961 6.357 1.282 . . . 1.0 . . . . . . . . . . . . A . 24 GLU CB . . . . . . . . . c30496_6e5h 1 . 5 . 2137 . 1 1 24 GLU CD C -4.606 8.012 3.057 . . . 1.0 . . . . . . . . . . . . A . 24 GLU CD . . . . . . . . . c30496_6e5h 1 . 5 . 2138 . 1 1 24 GLU CG C -3.759 7.759 1.829 . . . 1.0 . . . . . . . . . . . . A . 24 GLU CG . . . . . . . . . c30496_6e5h 1 . 5 . 2139 . 1 1 24 GLU H H -1.653 5.043 1.135 . . . 1.0 . . . . . . . . . . . . A . 24 GLU H . . . . . . . . . c30496_6e5h 1 . 5 . 2140 . 1 1 24 GLU HA H -3.616 5.574 3.242 . . . 1.0 . . . . . . . . . . . . A . 24 GLU HA . . . . . . . . . c30496_6e5h 1 . 5 . 2141 . 1 1 24 GLU HB2 H -3.439 6.282 0.341 . . . 1.0 . . . . . . . . . . . . A . 24 GLU HB2 . . . . . . . . . c30496_6e5h 1 . 5 . 2142 . 1 1 24 GLU HB3 H -5.016 6.210 1.113 . . . 1.0 . . . . . . . . . . . . A . 24 GLU HB3 . . . . . . . . . c30496_6e5h 1 . 5 . 2143 . 1 1 24 GLU HG2 H -2.719 7.886 2.091 . . . 1.0 . . . . . . . . . . . . A . 24 GLU HG2 . . . . . . . . . c30496_6e5h 1 . 5 . 2144 . 1 1 24 GLU HG3 H -4.031 8.474 1.066 . . . 1.0 . . . . . . . . . . . . A . 24 GLU HG3 . . . . . . . . . c30496_6e5h 1 . 5 . 2145 . 1 1 24 GLU N N -2.026 5.062 2.045 . . . 1.0 . . . . . . . . . . . . A . 24 GLU N . . . . . . . . . c30496_6e5h 1 . 5 . 2146 . 1 1 24 GLU O O -4.343 3.516 0.847 . . . 1.0 . . . . . . . . . . . . A . 24 GLU O . . . . . . . . . c30496_6e5h 1 . 5 . 2147 . 1 1 24 GLU OE1 O -5.796 8.350 2.898 . . . 1.0 . . . . . . . . . . . . A . 24 GLU OE1 . . . . . . . . . c30496_6e5h 1 . 5 . 2148 . 1 1 24 GLU OE2 O -4.095 7.858 4.187 . . . 1.0 . . . . . . . . . . . . A . 24 GLU OE2 . . . . . . . . . c30496_6e5h 1 . 5 . 2149 . 1 1 25 VAL C C -6.941 2.431 3.134 . . . 1.0 . . . . . . . . . . . . A . 25 VAL C . . . . . . . . . c30496_6e5h 1 . 5 . 2150 . 1 1 25 VAL CA C -5.456 2.142 2.975 . . . 1.0 . . . . . . . . . . . . A . 25 VAL CA . . . . . . . . . c30496_6e5h 1 . 5 . 2151 . 1 1 25 VAL CB C -5.016 1.128 4.051 . . . 1.0 . . . . . . . . . . . . A . 25 VAL CB . . . . . . . . . c30496_6e5h 1 . 5 . 2152 . 1 1 25 VAL CG1 C -5.858 -0.138 3.973 . . . 1.0 . . . . . . . . . . . . A . 25 VAL CG1 . . . . . . . . . c30496_6e5h 1 . 5 . 2153 . 1 1 25 VAL CG2 C -3.538 0.799 3.908 . . . 1.0 . . . . . . . . . . . . A . 25 VAL CG2 . . . . . . . . . c30496_6e5h 1 . 5 . 2154 . 1 1 25 VAL H H -4.560 3.793 3.933 . . . 1.0 . . . . . . . . . . . . A . 25 VAL H . . . . . . . . . c30496_6e5h 1 . 5 . 2155 . 1 1 25 VAL HA H -5.283 1.709 2.000 . . . 1.0 . . . . . . . . . . . . A . 25 VAL HA . . . . . . . . . c30496_6e5h 1 . 5 . 2156 . 1 1 25 VAL HB H -5.170 1.577 5.020 . . . 1.0 . . . . . . . . . . . . A . 25 VAL HB . . . . . . . . . c30496_6e5h 1 . 5 . 2157 . 1 1 25 VAL HG11 H -5.540 -0.829 4.740 . . . 1.0 . . . . . . . . . . . . A . 25 VAL HG11 . . . . . . . . . c30496_6e5h 1 . 5 . 2158 . 1 1 25 VAL HG12 H -5.733 -0.595 3.004 . . . 1.0 . . . . . . . . . . . . A . 25 VAL HG12 . . . . . . . . . c30496_6e5h 1 . 5 . 2159 . 1 1 25 VAL HG13 H -6.898 0.111 4.122 . . . 1.0 . . . . . . . . . . . . A . 25 VAL HG13 . . . . . . . . . c30496_6e5h 1 . 5 . 2160 . 1 1 25 VAL HG21 H -3.360 0.361 2.937 . . . 1.0 . . . . . . . . . . . . A . 25 VAL HG21 . . . . . . . . . c30496_6e5h 1 . 5 . 2161 . 1 1 25 VAL HG22 H -3.248 0.098 4.677 . . . 1.0 . . . . . . . . . . . . A . 25 VAL HG22 . . . . . . . . . c30496_6e5h 1 . 5 . 2162 . 1 1 25 VAL HG23 H -2.956 1.704 4.006 . . . 1.0 . . . . . . . . . . . . A . 25 VAL HG23 . . . . . . . . . c30496_6e5h 1 . 5 . 2163 . 1 1 25 VAL N N -4.700 3.378 3.057 . . . 1.0 . . . . . . . . . . . . A . 25 VAL N . . . . . . . . . c30496_6e5h 1 . 5 . 2164 . 1 1 25 VAL O O -7.408 2.757 4.225 . . . 1.0 . . . . . . . . . . . . A . 25 VAL O . . . . . . . . . c30496_6e5h 1 . 5 . 2165 . 1 1 26 HIS C C -9.894 1.349 1.743 . . . 1.0 . . . . . . . . . . . . A . 26 HIS C . . . . . . . . . c30496_6e5h 1 . 5 . 2166 . 1 1 26 HIS CA C -9.098 2.610 2.052 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CA . . . . . . . . . c30496_6e5h 1 . 5 . 2167 . 1 1 26 HIS CB C -9.431 3.718 1.048 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CB . . . . . . . . . c30496_6e5h 1 . 5 . 2168 . 1 1 26 HIS CD2 C -7.700 5.606 1.472 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CD2 . . . . . . . . . c30496_6e5h 1 . 5 . 2169 . 1 1 26 HIS CE1 C -9.066 7.137 2.230 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CE1 . . . . . . . . . c30496_6e5h 1 . 5 . 2170 . 1 1 26 HIS CG C -8.946 5.076 1.465 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CG . . . . . . . . . c30496_6e5h 1 . 5 . 2171 . 1 1 26 HIS H H -7.243 2.050 1.200 . . . 1.0 . . . . . . . . . . . . A . 26 HIS H . . . . . . . . . c30496_6e5h 1 . 5 . 2172 . 1 1 26 HIS HA H -9.357 2.948 3.042 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HA . . . . . . . . . c30496_6e5h 1 . 5 . 2173 . 1 1 26 HIS HB2 H -8.972 3.482 0.102 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HB2 . . . . . . . . . c30496_6e5h 1 . 5 . 2174 . 1 1 26 HIS HB3 H -10.499 3.769 0.918 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HB3 . . . . . . . . . c30496_6e5h 1 . 5 . 2175 . 1 1 26 HIS HD1 H -10.751 5.984 2.067 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HD1 . . . . . . . . . c30496_6e5h 1 . 5 . 2176 . 1 1 26 HIS HD2 H -6.795 5.110 1.158 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HD2 . . . . . . . . . c30496_6e5h 1 . 5 . 2177 . 1 1 26 HIS HE1 H -9.454 8.063 2.625 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HE1 . . . . . . . . . c30496_6e5h 1 . 5 . 2178 . 1 1 26 HIS HE2 H -7.039 7.438 2.274 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HE2 . . . . . . . . . c30496_6e5h 1 . 5 . 2179 . 1 1 26 HIS N N -7.672 2.329 2.042 . . . 1.0 . . . . . . . . . . . . A . 26 HIS N . . . . . . . . . c30496_6e5h 1 . 5 . 2180 . 1 1 26 HIS ND1 N -9.778 6.062 1.946 . . . 1.0 . . . . . . . . . . . . A . 26 HIS ND1 . . . . . . . . . c30496_6e5h 1 . 5 . 2181 . 1 1 26 HIS NE2 N -7.802 6.888 1.954 . . . 1.0 . . . . . . . . . . . . A . 26 HIS NE2 . . . . . . . . . c30496_6e5h 1 . 5 . 2182 . 1 1 26 HIS O O -9.996 0.932 0.591 . . . 1.0 . . . . . . . . . . . . A . 26 HIS O . . . . . . . . . c30496_6e5h 1 . 5 . 2183 . 1 1 27 CYS C C -12.693 -0.148 2.481 . . . 1.0 . . . . . . . . . . . . A . 27 CYS C . . . . . . . . . c30496_6e5h 1 . 5 . 2184 . 1 1 27 CYS CA C -11.217 -0.483 2.630 . . . 1.0 . . . . . . . . . . . . A . 27 CYS CA . . . . . . . . . c30496_6e5h 1 . 5 . 2185 . 1 1 27 CYS CB C -11.005 -1.405 3.828 . . . 1.0 . . . . . . . . . . . . A . 27 CYS CB . . . . . . . . . c30496_6e5h 1 . 5 . 2186 . 1 1 27 CYS H H -10.295 1.097 3.681 . . . 1.0 . . . . . . . . . . . . A . 27 CYS H . . . . . . . . . c30496_6e5h 1 . 5 . 2187 . 1 1 27 CYS HA H -10.883 -0.984 1.737 . . . 1.0 . . . . . . . . . . . . A . 27 CYS HA . . . . . . . . . c30496_6e5h 1 . 5 . 2188 . 1 1 27 CYS HB2 H -11.303 -0.888 4.727 . . . 1.0 . . . . . . . . . . . . A . 27 CYS HB2 . . . . . . . . . c30496_6e5h 1 . 5 . 2189 . 1 1 27 CYS HB3 H -11.617 -2.286 3.706 . . . 1.0 . . . . . . . . . . . . A . 27 CYS HB3 . . . . . . . . . c30496_6e5h 1 . 5 . 2190 . 1 1 27 CYS N N -10.430 0.729 2.784 . . . 1.0 . . . . . . . . . . . . A . 27 CYS N . . . . . . . . . c30496_6e5h 1 . 5 . 2191 . 1 1 27 CYS O O -13.425 -0.038 3.463 . . . 1.0 . . . . . . . . . . . . A . 27 CYS O . . . . . . . . . c30496_6e5h 1 . 5 . 2192 . 1 1 27 CYS SG S -9.280 -1.952 4.050 . . . 1.0 . . . . . . . . . . . . A . 27 CYS SG . . . . . . . . . c30496_6e5h 1 . 5 . 2193 . 1 1 28 NH2 HN1 H -12.481 -0.068 0.514 . . . 1.0 . . . . . . . . . . . . A . 28 NH2 HN1 . . . . . . . . . c30496_6e5h 1 . 5 . 2194 . 1 1 28 NH2 HN2 H -14.064 0.272 1.117 . . . 1.0 . . . . . . . . . . . . A . 28 NH2 HN2 . . . . . . . . . c30496_6e5h 1 . 5 . 2195 . 1 1 28 NH2 N N -13.124 0.037 1.249 . . . 1.0 . . . . . . . . . . . . A . 28 NH2 N . . . . . . . . . c30496_6e5h 1 . 6 . 2196 . 1 1 1 ASN C C 8.196 -2.016 -1.870 . . . 1.0 . . . . . . . . . . . . A . 1 ASN C . . . . . . . . . c30496_6e5h 1 . 6 . 2197 . 1 1 1 ASN CA C 8.859 -0.813 -2.529 . . . 1.0 . . . . . . . . . . . . A . 1 ASN CA . . . . . . . . . c30496_6e5h 1 . 6 . 2198 . 1 1 1 ASN CB C 8.815 -0.977 -4.052 . . . 1.0 . . . . . . . . . . . . A . 1 ASN CB . . . . . . . . . c30496_6e5h 1 . 6 . 2199 . 1 1 1 ASN CG C 9.262 0.267 -4.793 . . . 1.0 . . . . . . . . . . . . A . 1 ASN CG . . . . . . . . . c30496_6e5h 1 . 6 . 2200 . 1 1 1 ASN H1 H 10.809 -1.513 -2.292 . . . 1.0 . . . . . . . . . . . . A . 1 ASN H1 . . . . . . . . . c30496_6e5h 1 . 6 . 2201 . 1 1 1 ASN H2 H 10.278 -0.514 -1.032 . . . 1.0 . . . . . . . . . . . . A . 1 ASN H2 . . . . . . . . . c30496_6e5h 1 . 6 . 2202 . 1 1 1 ASN H3 H 10.701 0.160 -2.521 . . . 1.0 . . . . . . . . . . . . A . 1 ASN H3 . . . . . . . . . c30496_6e5h 1 . 6 . 2203 . 1 1 1 ASN HA H 8.315 0.076 -2.254 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HA . . . . . . . . . c30496_6e5h 1 . 6 . 2204 . 1 1 1 ASN HB2 H 9.463 -1.792 -4.337 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HB2 . . . . . . . . . c30496_6e5h 1 . 6 . 2205 . 1 1 1 ASN HB3 H 7.804 -1.209 -4.352 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HB3 . . . . . . . . . c30496_6e5h 1 . 6 . 2206 . 1 1 1 ASN HD21 H 8.081 -0.188 -6.325 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HD21 . . . . . . . . . c30496_6e5h 1 . 6 . 2207 . 1 1 1 ASN HD22 H 9.000 1.269 -6.489 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HD22 . . . . . . . . . c30496_6e5h 1 . 6 . 2208 . 1 1 1 ASN N N 10.257 -0.662 -2.061 . . . 1.0 . . . . . . . . . . . . A . 1 ASN N . . . . . . . . . c30496_6e5h 1 . 6 . 2209 . 1 1 1 ASN ND2 N 8.728 0.469 -5.988 . . . 1.0 . . . . . . . . . . . . A . 1 ASN ND2 . . . . . . . . . c30496_6e5h 1 . 6 . 2210 . 1 1 1 ASN O O 7.070 -2.385 -2.217 . . . 1.0 . . . . . . . . . . . . A . 1 ASN O . . . . . . . . . c30496_6e5h 1 . 6 . 2211 . 1 1 1 ASN OD1 O 10.085 1.040 -4.299 . . . 1.0 . . . . . . . . . . . . A . 1 ASN OD1 . . . . . . . . . c30496_6e5h 1 . 6 . 2212 . 1 1 2 ASP C C 7.128 -3.505 0.563 . . . 1.0 . . . . . . . . . . . . A . 2 ASP C . . . . . . . . . c30496_6e5h 1 . 6 . 2213 . 1 1 2 ASP CA C 8.386 -3.818 -0.239 . . . 1.0 . . . . . . . . . . . . A . 2 ASP CA . . . . . . . . . c30496_6e5h 1 . 6 . 2214 . 1 1 2 ASP CB C 9.456 -4.421 0.678 . . . 1.0 . . . . . . . . . . . . A . 2 ASP CB . . . . . . . . . c30496_6e5h 1 . 6 . 2215 . 1 1 2 ASP CG C 8.967 -5.650 1.426 . . . 1.0 . . . . . . . . . . . . A . 2 ASP CG . . . . . . . . . c30496_6e5h 1 . 6 . 2216 . 1 1 2 ASP H H 9.765 -2.261 -0.652 . . . 1.0 . . . . . . . . . . . . A . 2 ASP H . . . . . . . . . c30496_6e5h 1 . 6 . 2217 . 1 1 2 ASP HA H 8.135 -4.538 -1.001 . . . 1.0 . . . . . . . . . . . . A . 2 ASP HA . . . . . . . . . c30496_6e5h 1 . 6 . 2218 . 1 1 2 ASP HB2 H 10.314 -4.705 0.086 . . . 1.0 . . . . . . . . . . . . A . 2 ASP HB2 . . . . . . . . . c30496_6e5h 1 . 6 . 2219 . 1 1 2 ASP HB3 H 9.756 -3.681 1.403 . . . 1.0 . . . . . . . . . . . . A . 2 ASP HB3 . . . . . . . . . c30496_6e5h 1 . 6 . 2220 . 1 1 2 ASP N N 8.892 -2.623 -0.914 . . . 1.0 . . . . . . . . . . . . A . 2 ASP N . . . . . . . . . c30496_6e5h 1 . 6 . 2221 . 1 1 2 ASP O O 6.220 -4.330 0.646 . . . 1.0 . . . . . . . . . . . . A . 2 ASP O . . . . . . . . . c30496_6e5h 1 . 6 . 2222 . 1 1 2 ASP OD1 O 8.926 -6.742 0.820 . . . 1.0 . . . . . . . . . . . . A . 2 ASP OD1 . . . . . . . . . c30496_6e5h 1 . 6 . 2223 . 1 1 2 ASP OD2 O 8.614 -5.527 2.619 . . . 1.0 . . . . . . . . . . . . A . 2 ASP OD2 . . . . . . . . . c30496_6e5h 1 . 6 . 2224 . 1 1 3 LYS C C 4.659 -1.809 1.131 . . . 1.0 . . . . . . . . . . . . A . 3 LYS C . . . . . . . . . c30496_6e5h 1 . 6 . 2225 . 1 1 3 LYS CA C 5.936 -1.908 1.954 . . . 1.0 . . . . . . . . . . . . A . 3 LYS CA . . . . . . . . . c30496_6e5h 1 . 6 . 2226 . 1 1 3 LYS CB C 6.216 -0.580 2.660 . . . 1.0 . . . . . . . . . . . . A . 3 LYS CB . . . . . . . . . c30496_6e5h 1 . 6 . 2227 . 1 1 3 LYS CD C 7.536 0.668 4.397 . . . 1.0 . . . . . . . . . . . . A . 3 LYS CD . . . . . . . . . c30496_6e5h 1 . 6 . 2228 . 1 1 3 LYS CE C 8.619 0.565 5.456 . . . 1.0 . . . . . . . . . . . . A . 3 LYS CE . . . . . . . . . c30496_6e5h 1 . 6 . 2229 . 1 1 3 LYS CG C 7.325 -0.663 3.696 . . . 1.0 . . . . . . . . . . . . A . 3 LYS CG . . . . . . . . . c30496_6e5h 1 . 6 . 2230 . 1 1 3 LYS H H 7.785 -1.657 0.955 . . . 1.0 . . . . . . . . . . . . A . 3 LYS H . . . . . . . . . c30496_6e5h 1 . 6 . 2231 . 1 1 3 LYS HA H 5.801 -2.675 2.699 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HA . . . . . . . . . c30496_6e5h 1 . 6 . 2232 . 1 1 3 LYS HB2 H 6.498 0.155 1.922 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HB2 . . . . . . . . . c30496_6e5h 1 . 6 . 2233 . 1 1 3 LYS HB3 H 5.314 -0.251 3.156 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HB3 . . . . . . . . . c30496_6e5h 1 . 6 . 2234 . 1 1 3 LYS HD2 H 7.828 1.407 3.666 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HD2 . . . . . . . . . c30496_6e5h 1 . 6 . 2235 . 1 1 3 LYS HD3 H 6.612 0.968 4.867 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HD3 . . . . . . . . . c30496_6e5h 1 . 6 . 2236 . 1 1 3 LYS HE2 H 8.356 -0.225 6.142 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HE2 . . . . . . . . . c30496_6e5h 1 . 6 . 2237 . 1 1 3 LYS HE3 H 9.554 0.322 4.972 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HE3 . . . . . . . . . c30496_6e5h 1 . 6 . 2238 . 1 1 3 LYS HG2 H 7.061 -1.407 4.433 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HG2 . . . . . . . . . c30496_6e5h 1 . 6 . 2239 . 1 1 3 LYS HG3 H 8.244 -0.950 3.208 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HG3 . . . . . . . . . c30496_6e5h 1 . 6 . 2240 . 1 1 3 LYS HZ1 H 9.141 2.582 5.595 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HZ1 . . . . . . . . . c30496_6e5h 1 . 6 . 2241 . 1 1 3 LYS HZ2 H 9.452 1.693 6.998 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HZ2 . . . . . . . . . c30496_6e5h 1 . 6 . 2242 . 1 1 3 LYS HZ3 H 7.868 2.131 6.612 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HZ3 . . . . . . . . . c30496_6e5h 1 . 6 . 2243 . 1 1 3 LYS N N 7.064 -2.301 1.120 . . . 1.0 . . . . . . . . . . . . A . 3 LYS N . . . . . . . . . c30496_6e5h 1 . 6 . 2244 . 1 1 3 LYS NZ N 8.782 1.831 6.217 . . . 1.0 . . . . . . . . . . . . A . 3 LYS NZ . . . . . . . . . c30496_6e5h 1 . 6 . 2245 . 1 1 3 LYS O O 3.632 -2.365 1.506 . . . 1.0 . . . . . . . . . . . . A . 3 LYS O . . . . . . . . . c30496_6e5h 1 . 6 . 2246 . 1 1 4 CYS C C 3.094 -2.318 -1.366 . . . 1.0 . . . . . . . . . . . . A . 4 CYS C . . . . . . . . . c30496_6e5h 1 . 6 . 2247 . 1 1 4 CYS CA C 3.575 -0.961 -0.874 . . . 1.0 . . . . . . . . . . . . A . 4 CYS CA . . . . . . . . . c30496_6e5h 1 . 6 . 2248 . 1 1 4 CYS CB C 3.918 -0.066 -2.065 . . . 1.0 . . . . . . . . . . . . A . 4 CYS CB . . . . . . . . . c30496_6e5h 1 . 6 . 2249 . 1 1 4 CYS H H 5.592 -0.726 -0.267 . . . 1.0 . . . . . . . . . . . . A . 4 CYS H . . . . . . . . . c30496_6e5h 1 . 6 . 2250 . 1 1 4 CYS HA H 2.789 -0.498 -0.298 . . . 1.0 . . . . . . . . . . . . A . 4 CYS HA . . . . . . . . . c30496_6e5h 1 . 6 . 2251 . 1 1 4 CYS HB2 H 4.266 0.887 -1.701 . . . 1.0 . . . . . . . . . . . . A . 4 CYS HB2 . . . . . . . . . c30496_6e5h 1 . 6 . 2252 . 1 1 4 CYS HB3 H 4.703 -0.534 -2.640 . . . 1.0 . . . . . . . . . . . . A . 4 CYS HB3 . . . . . . . . . c30496_6e5h 1 . 6 . 2253 . 1 1 4 CYS N N 4.735 -1.125 -0.004 . . . 1.0 . . . . . . . . . . . . A . 4 CYS N . . . . . . . . . c30496_6e5h 1 . 6 . 2254 . 1 1 4 CYS O O 1.898 -2.608 -1.370 . . . 1.0 . . . . . . . . . . . . A . 4 CYS O . . . . . . . . . c30496_6e5h 1 . 6 . 2255 . 1 1 4 CYS SG S 2.517 0.247 -3.188 . . . 1.0 . . . . . . . . . . . . A . 4 CYS SG . . . . . . . . . c30496_6e5h 1 . 6 . 2256 . 1 1 5 LYS C C 3.055 -5.306 -1.151 . . . 1.0 . . . . . . . . . . . . A . 5 LYS C . . . . . . . . . c30496_6e5h 1 . 6 . 2257 . 1 1 5 LYS CA C 3.761 -4.493 -2.231 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CA . . . . . . . . . c30496_6e5h 1 . 6 . 2258 . 1 1 5 LYS CB C 5.067 -5.181 -2.633 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CB . . . . . . . . . c30496_6e5h 1 . 6 . 2259 . 1 1 5 LYS CD C 6.259 -7.376 -2.913 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CD . . . . . . . . . c30496_6e5h 1 . 6 . 2260 . 1 1 5 LYS CE C 6.887 -7.262 -1.532 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CE . . . . . . . . . c30496_6e5h 1 . 6 . 2261 . 1 1 5 LYS CG C 4.918 -6.658 -2.963 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CG . . . . . . . . . c30496_6e5h 1 . 6 . 2262 . 1 1 5 LYS H H 4.981 -2.851 -1.715 . . . 1.0 . . . . . . . . . . . . A . 5 LYS H . . . . . . . . . c30496_6e5h 1 . 6 . 2263 . 1 1 5 LYS HA H 3.118 -4.416 -3.094 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HA . . . . . . . . . c30496_6e5h 1 . 6 . 2264 . 1 1 5 LYS HB2 H 5.468 -4.681 -3.502 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HB2 . . . . . . . . . c30496_6e5h 1 . 6 . 2265 . 1 1 5 LYS HB3 H 5.769 -5.082 -1.821 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HB3 . . . . . . . . . c30496_6e5h 1 . 6 . 2266 . 1 1 5 LYS HD2 H 6.109 -8.419 -3.147 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HD2 . . . . . . . . . c30496_6e5h 1 . 6 . 2267 . 1 1 5 LYS HD3 H 6.922 -6.931 -3.641 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HD3 . . . . . . . . . c30496_6e5h 1 . 6 . 2268 . 1 1 5 LYS HE2 H 7.100 -6.226 -1.333 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HE2 . . . . . . . . . c30496_6e5h 1 . 6 . 2269 . 1 1 5 LYS HE3 H 6.182 -7.628 -0.801 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HE3 . . . . . . . . . c30496_6e5h 1 . 6 . 2270 . 1 1 5 LYS HG2 H 4.251 -7.113 -2.246 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HG2 . . . . . . . . . c30496_6e5h 1 . 6 . 2271 . 1 1 5 LYS HG3 H 4.503 -6.756 -3.956 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HG3 . . . . . . . . . c30496_6e5h 1 . 6 . 2272 . 1 1 5 LYS HZ1 H 8.589 -7.847 -0.487 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HZ1 . . . . . . . . . c30496_6e5h 1 . 6 . 2273 . 1 1 5 LYS HZ2 H 8.812 -7.750 -2.163 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HZ2 . . . . . . . . . c30496_6e5h 1 . 6 . 2274 . 1 1 5 LYS HZ3 H 7.957 -9.051 -1.498 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HZ3 . . . . . . . . . c30496_6e5h 1 . 6 . 2275 . 1 1 5 LYS N N 4.049 -3.150 -1.755 . . . 1.0 . . . . . . . . . . . . A . 5 LYS N . . . . . . . . . c30496_6e5h 1 . 6 . 2276 . 1 1 5 LYS NZ N 8.149 -8.032 -1.415 . . . 1.0 . . . . . . . . . . . . A . 5 LYS NZ . . . . . . . . . c30496_6e5h 1 . 6 . 2277 . 1 1 5 LYS O O 2.025 -5.929 -1.405 . . . 1.0 . . . . . . . . . . . . A . 5 LYS O . . . . . . . . . c30496_6e5h 1 . 6 . 2278 . 1 1 6 GLU C C 1.692 -5.553 1.566 . . . 1.0 . . . . . . . . . . . . A . 6 GLU C . . . . . . . . . c30496_6e5h 1 . 6 . 2279 . 1 1 6 GLU CA C 3.073 -6.055 1.164 . . . 1.0 . . . . . . . . . . . . A . 6 GLU CA . . . . . . . . . c30496_6e5h 1 . 6 . 2280 . 1 1 6 GLU CB C 4.022 -5.994 2.363 . . . 1.0 . . . . . . . . . . . . A . 6 GLU CB . . . . . . . . . c30496_6e5h 1 . 6 . 2281 . 1 1 6 GLU CD C 4.485 -6.710 4.735 . . . 1.0 . . . . . . . . . . . . A . 6 GLU CD . . . . . . . . . c30496_6e5h 1 . 6 . 2282 . 1 1 6 GLU CG C 3.590 -6.870 3.528 . . . 1.0 . . . . . . . . . . . . A . 6 GLU CG . . . . . . . . . c30496_6e5h 1 . 6 . 2283 . 1 1 6 GLU H H 4.397 -4.712 0.206 . . . 1.0 . . . . . . . . . . . . A . 6 GLU H . . . . . . . . . c30496_6e5h 1 . 6 . 2284 . 1 1 6 GLU HA H 2.987 -7.079 0.835 . . . 1.0 . . . . . . . . . . . . A . 6 GLU HA . . . . . . . . . c30496_6e5h 1 . 6 . 2285 . 1 1 6 GLU HB2 H 5.004 -6.312 2.045 . . . 1.0 . . . . . . . . . . . . A . 6 GLU HB2 . . . . . . . . . c30496_6e5h 1 . 6 . 2286 . 1 1 6 GLU HB3 H 4.079 -4.972 2.710 . . . 1.0 . . . . . . . . . . . . A . 6 GLU HB3 . . . . . . . . . c30496_6e5h 1 . 6 . 2287 . 1 1 6 GLU HG2 H 2.582 -6.606 3.808 . . . 1.0 . . . . . . . . . . . . A . 6 GLU HG2 . . . . . . . . . c30496_6e5h 1 . 6 . 2288 . 1 1 6 GLU HG3 H 3.616 -7.903 3.213 . . . 1.0 . . . . . . . . . . . . A . 6 GLU HG3 . . . . . . . . . c30496_6e5h 1 . 6 . 2289 . 1 1 6 GLU N N 3.606 -5.276 0.056 . . . 1.0 . . . . . . . . . . . . A . 6 GLU N . . . . . . . . . c30496_6e5h 1 . 6 . 2290 . 1 1 6 GLU O O 0.814 -6.339 1.900 . . . 1.0 . . . . . . . . . . . . A . 6 GLU O . . . . . . . . . c30496_6e5h 1 . 6 . 2291 . 1 1 6 GLU OE1 O 4.097 -5.990 5.676 . . . 1.0 . . . . . . . . . . . . A . 6 GLU OE1 . . . . . . . . . c30496_6e5h 1 . 6 . 2292 . 1 1 6 GLU OE2 O 5.590 -7.292 4.746 . . . 1.0 . . . . . . . . . . . . A . 6 GLU OE2 . . . . . . . . . c30496_6e5h 1 . 6 . 2293 . 1 1 7 LEU C C -0.844 -4.001 0.855 . . . 1.0 . . . . . . . . . . . . A . 7 LEU C . . . . . . . . . c30496_6e5h 1 . 6 . 2294 . 1 1 7 LEU CA C 0.223 -3.651 1.884 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CA . . . . . . . . . c30496_6e5h 1 . 6 . 2295 . 1 1 7 LEU CB C 0.360 -2.137 2.020 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CB . . . . . . . . . c30496_6e5h 1 . 6 . 2296 . 1 1 7 LEU CD1 C 1.491 -0.183 3.119 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CD1 . . . . . . . . . c30496_6e5h 1 . 6 . 2297 . 1 1 7 LEU CD2 C 0.472 -1.972 4.523 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CD2 . . . . . . . . . c30496_6e5h 1 . 6 . 2298 . 1 1 7 LEU CG C 1.194 -1.670 3.217 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CG . . . . . . . . . c30496_6e5h 1 . 6 . 2299 . 1 1 7 LEU H H 2.246 -3.655 1.258 . . . 1.0 . . . . . . . . . . . . A . 7 LEU H . . . . . . . . . c30496_6e5h 1 . 6 . 2300 . 1 1 7 LEU HA H -0.070 -4.061 2.837 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HA . . . . . . . . . c30496_6e5h 1 . 6 . 2301 . 1 1 7 LEU HB2 H 0.814 -1.755 1.116 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HB2 . . . . . . . . . c30496_6e5h 1 . 6 . 2302 . 1 1 7 LEU HB3 H -0.628 -1.717 2.112 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HB3 . . . . . . . . . c30496_6e5h 1 . 6 . 2303 . 1 1 7 LEU HD11 H 0.563 0.367 3.092 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD11 . . . . . . . . . c30496_6e5h 1 . 6 . 2304 . 1 1 7 LEU HD12 H 2.053 0.016 2.220 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD12 . . . . . . . . . c30496_6e5h 1 . 6 . 2305 . 1 1 7 LEU HD13 H 2.067 0.128 3.980 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD13 . . . . . . . . . c30496_6e5h 1 . 6 . 2306 . 1 1 7 LEU HD21 H 0.317 -3.037 4.615 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD21 . . . . . . . . . c30496_6e5h 1 . 6 . 2307 . 1 1 7 LEU HD22 H -0.483 -1.467 4.530 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD22 . . . . . . . . . c30496_6e5h 1 . 6 . 2308 . 1 1 7 LEU HD23 H 1.069 -1.623 5.352 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD23 . . . . . . . . . c30496_6e5h 1 . 6 . 2309 . 1 1 7 LEU HG H 2.134 -2.203 3.223 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HG . . . . . . . . . c30496_6e5h 1 . 6 . 2310 . 1 1 7 LEU N N 1.503 -4.243 1.527 . . . 1.0 . . . . . . . . . . . . A . 7 LEU N . . . . . . . . . c30496_6e5h 1 . 6 . 2311 . 1 1 7 LEU O O -1.958 -4.391 1.212 . . . 1.0 . . . . . . . . . . . . A . 7 LEU O . . . . . . . . . c30496_6e5h 1 . 6 . 2312 . 1 1 8 LYS C C -1.713 -5.702 -1.541 . . . 1.0 . . . . . . . . . . . . A . 8 LYS C . . . . . . . . . c30496_6e5h 1 . 6 . 2313 . 1 1 8 LYS CA C -1.439 -4.203 -1.490 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CA . . . . . . . . . c30496_6e5h 1 . 6 . 2314 . 1 1 8 LYS CB C -0.918 -3.714 -2.844 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CB . . . . . . . . . c30496_6e5h 1 . 6 . 2315 . 1 1 8 LYS CD C -0.345 -1.758 -4.328 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CD . . . . . . . . . c30496_6e5h 1 . 6 . 2316 . 1 1 8 LYS CE C -1.220 -2.177 -5.501 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CE . . . . . . . . . c30496_6e5h 1 . 6 . 2317 . 1 1 8 LYS CG C -0.927 -2.199 -2.993 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CG . . . . . . . . . c30496_6e5h 1 . 6 . 2318 . 1 1 8 LYS H H 0.411 -3.582 -0.648 . . . 1.0 . . . . . . . . . . . . A . 8 LYS H . . . . . . . . . c30496_6e5h 1 . 6 . 2319 . 1 1 8 LYS HA H -2.364 -3.694 -1.269 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HA . . . . . . . . . c30496_6e5h 1 . 6 . 2320 . 1 1 8 LYS HB2 H 0.096 -4.061 -2.973 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HB2 . . . . . . . . . c30496_6e5h 1 . 6 . 2321 . 1 1 8 LYS HB3 H -1.534 -4.135 -3.625 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HB3 . . . . . . . . . c30496_6e5h 1 . 6 . 2322 . 1 1 8 LYS HD2 H -0.254 -0.682 -4.328 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HD2 . . . . . . . . . c30496_6e5h 1 . 6 . 2323 . 1 1 8 LYS HD3 H 0.632 -2.202 -4.442 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HD3 . . . . . . . . . c30496_6e5h 1 . 6 . 2324 . 1 1 8 LYS HE2 H -1.367 -3.246 -5.461 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HE2 . . . . . . . . . c30496_6e5h 1 . 6 . 2325 . 1 1 8 LYS HE3 H -2.174 -1.680 -5.418 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HE3 . . . . . . . . . c30496_6e5h 1 . 6 . 2326 . 1 1 8 LYS HG2 H -1.946 -1.850 -2.928 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HG2 . . . . . . . . . c30496_6e5h 1 . 6 . 2327 . 1 1 8 LYS HG3 H -0.345 -1.764 -2.195 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HG3 . . . . . . . . . c30496_6e5h 1 . 6 . 2328 . 1 1 8 LYS HZ1 H 0.277 -2.361 -6.946 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ1 . . . . . . . . . c30496_6e5h 1 . 6 . 2329 . 1 1 8 LYS HZ2 H -0.386 -0.809 -6.848 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ2 . . . . . . . . . c30496_6e5h 1 . 6 . 2330 . 1 1 8 LYS HZ3 H -1.257 -2.059 -7.587 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ3 . . . . . . . . . c30496_6e5h 1 . 6 . 2331 . 1 1 8 LYS N N -0.499 -3.884 -0.420 . . . 1.0 . . . . . . . . . . . . A . 8 LYS N . . . . . . . . . c30496_6e5h 1 . 6 . 2332 . 1 1 8 LYS NZ N -0.604 -1.827 -6.810 . . . 1.0 . . . . . . . . . . . . A . 8 LYS NZ . . . . . . . . . c30496_6e5h 1 . 6 . 2333 . 1 1 8 LYS O O -2.798 -6.129 -1.931 . . . 1.0 . . . . . . . . . . . . A . 8 LYS O . . . . . . . . . c30496_6e5h 1 . 6 . 2334 . 1 1 9 LYS C C -1.749 -8.331 0.098 . . . 1.0 . . . . . . . . . . . . A . 9 LYS C . . . . . . . . . c30496_6e5h 1 . 6 . 2335 . 1 1 9 LYS CA C -0.867 -7.940 -1.084 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CA . . . . . . . . . c30496_6e5h 1 . 6 . 2336 . 1 1 9 LYS CB C 0.516 -8.585 -0.945 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CB . . . . . . . . . c30496_6e5h 1 . 6 . 2337 . 1 1 9 LYS CD C 1.891 -10.643 -0.608 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CD . . . . . . . . . c30496_6e5h 1 . 6 . 2338 . 1 1 9 LYS CE C 1.925 -12.162 -0.638 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CE . . . . . . . . . c30496_6e5h 1 . 6 . 2339 . 1 1 9 LYS CG C 0.506 -10.102 -0.917 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CG . . . . . . . . . c30496_6e5h 1 . 6 . 2340 . 1 1 9 LYS H H 0.146 -6.091 -0.923 . . . 1.0 . . . . . . . . . . . . A . 9 LYS H . . . . . . . . . c30496_6e5h 1 . 6 . 2341 . 1 1 9 LYS HA H -1.329 -8.278 -1.998 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HA . . . . . . . . . c30496_6e5h 1 . 6 . 2342 . 1 1 9 LYS HB2 H 1.128 -8.270 -1.777 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HB2 . . . . . . . . . c30496_6e5h 1 . 6 . 2343 . 1 1 9 LYS HB3 H 0.968 -8.233 -0.029 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HB3 . . . . . . . . . c30496_6e5h 1 . 6 . 2344 . 1 1 9 LYS HD2 H 2.584 -10.264 -1.343 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HD2 . . . . . . . . . c30496_6e5h 1 . 6 . 2345 . 1 1 9 LYS HD3 H 2.186 -10.303 0.374 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HD3 . . . . . . . . . c30496_6e5h 1 . 6 . 2346 . 1 1 9 LYS HE2 H 2.880 -12.494 -0.260 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HE2 . . . . . . . . . c30496_6e5h 1 . 6 . 2347 . 1 1 9 LYS HE3 H 1.136 -12.539 -0.005 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HE3 . . . . . . . . . c30496_6e5h 1 . 6 . 2348 . 1 1 9 LYS HG2 H -0.182 -10.436 -0.155 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HG2 . . . . . . . . . c30496_6e5h 1 . 6 . 2349 . 1 1 9 LYS HG3 H 0.190 -10.470 -1.881 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HG3 . . . . . . . . . c30496_6e5h 1 . 6 . 2350 . 1 1 9 LYS HZ1 H 1.802 -13.735 -2.002 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HZ1 . . . . . . . . . c30496_6e5h 1 . 6 . 2351 . 1 1 9 LYS HZ2 H 2.477 -12.324 -2.644 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HZ2 . . . . . . . . . c30496_6e5h 1 . 6 . 2352 . 1 1 9 LYS HZ3 H 0.809 -12.420 -2.385 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HZ3 . . . . . . . . . c30496_6e5h 1 . 6 . 2353 . 1 1 9 LYS N N -0.721 -6.492 -1.155 . . . 1.0 . . . . . . . . . . . . A . 9 LYS N . . . . . . . . . c30496_6e5h 1 . 6 . 2354 . 1 1 9 LYS NZ N 1.740 -12.696 -2.012 . . . 1.0 . . . . . . . . . . . . A . 9 LYS NZ . . . . . . . . . c30496_6e5h 1 . 6 . 2355 . 1 1 9 LYS O O -2.629 -9.184 -0.019 . . . 1.0 . . . . . . . . . . . . A . 9 LYS O . . . . . . . . . c30496_6e5h 1 . 6 . 2356 . 1 1 10 ARG C C -3.693 -7.591 2.338 . . . 1.0 . . . . . . . . . . . . A . 10 ARG C . . . . . . . . . c30496_6e5h 1 . 6 . 2357 . 1 1 10 ARG CA C -2.224 -7.981 2.463 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CA . . . . . . . . . c30496_6e5h 1 . 6 . 2358 . 1 1 10 ARG CB C -1.593 -7.223 3.634 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CB . . . . . . . . . c30496_6e5h 1 . 6 . 2359 . 1 1 10 ARG CD C -1.679 -6.706 6.096 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CD . . . . . . . . . c30496_6e5h 1 . 6 . 2360 . 1 1 10 ARG CG C -2.104 -7.665 4.993 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CG . . . . . . . . . c30496_6e5h 1 . 6 . 2361 . 1 1 10 ARG CZ C 0.372 -5.694 7.026 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CZ . . . . . . . . . c30496_6e5h 1 . 6 . 2362 . 1 1 10 ARG H H -0.805 -7.001 1.244 . . . 1.0 . . . . . . . . . . . . A . 10 ARG H . . . . . . . . . c30496_6e5h 1 . 6 . 2363 . 1 1 10 ARG HA H -2.155 -9.040 2.651 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HA . . . . . . . . . c30496_6e5h 1 . 6 . 2364 . 1 1 10 ARG HB2 H -0.525 -7.371 3.608 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HB2 . . . . . . . . . c30496_6e5h 1 . 6 . 2365 . 1 1 10 ARG HB3 H -1.804 -6.170 3.521 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HB3 . . . . . . . . . c30496_6e5h 1 . 6 . 2366 . 1 1 10 ARG HD2 H -2.155 -5.752 5.925 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HD2 . . . . . . . . . c30496_6e5h 1 . 6 . 2367 . 1 1 10 ARG HD3 H -2.012 -7.103 7.045 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HD3 . . . . . . . . . c30496_6e5h 1 . 6 . 2368 . 1 1 10 ARG HE H 0.324 -6.990 5.496 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HE . . . . . . . . . c30496_6e5h 1 . 6 . 2369 . 1 1 10 ARG HG2 H -3.184 -7.705 4.963 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HG2 . . . . . . . . . c30496_6e5h 1 . 6 . 2370 . 1 1 10 ARG HG3 H -1.711 -8.649 5.210 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HG3 . . . . . . . . . c30496_6e5h 1 . 6 . 2371 . 1 1 10 ARG HH11 H 0.107 -4.442 8.597 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HH11 . . . . . . . . . c30496_6e5h 1 . 6 . 2372 . 1 1 10 ARG HH12 H -1.340 -5.172 7.979 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HH12 . . . . . . . . . c30496_6e5h 1 . 6 . 2373 . 1 1 10 ARG HH21 H 2.251 -6.025 6.320 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HH21 . . . . . . . . . c30496_6e5h 1 . 6 . 2374 . 1 1 10 ARG HH22 H 2.135 -4.930 7.663 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HH22 . . . . . . . . . c30496_6e5h 1 . 6 . 2375 . 1 1 10 ARG N N -1.504 -7.691 1.232 . . . 1.0 . . . . . . . . . . . . A . 10 ARG N . . . . . . . . . c30496_6e5h 1 . 6 . 2376 . 1 1 10 ARG NE N -0.229 -6.502 6.150 . . . 1.0 . . . . . . . . . . . . A . 10 ARG NE . . . . . . . . . c30496_6e5h 1 . 6 . 2377 . 1 1 10 ARG NH1 N -0.346 -5.050 7.940 . . . 1.0 . . . . . . . . . . . . A . 10 ARG NH1 . . . . . . . . . c30496_6e5h 1 . 6 . 2378 . 1 1 10 ARG NH2 N 1.690 -5.537 7.000 . . . 1.0 . . . . . . . . . . . . A . 10 ARG NH2 . . . . . . . . . c30496_6e5h 1 . 6 . 2379 . 1 1 10 ARG O O -4.590 -8.401 2.574 . . . 1.0 . . . . . . . . . . . . A . 10 ARG O . . . . . . . . . c30496_6e5h 1 . 6 . 2380 . 1 1 11 TYR C C -5.883 -6.025 0.493 . . . 1.0 . . . . . . . . . . . . A . 11 TYR C . . . . . . . . . c30496_6e5h 1 . 6 . 2381 . 1 1 11 TYR CA C -5.284 -5.820 1.879 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CA . . . . . . . . . c30496_6e5h 1 . 6 . 2382 . 1 1 11 TYR CB C -5.285 -4.340 2.254 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CB . . . . . . . . . c30496_6e5h 1 . 6 . 2383 . 1 1 11 TYR CD1 C -5.508 -4.321 4.762 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CD1 . . . . . . . . . c30496_6e5h 1 . 6 . 2384 . 1 1 11 TYR CD2 C -3.450 -3.592 3.814 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CD2 . . . . . . . . . c30496_6e5h 1 . 6 . 2385 . 1 1 11 TYR CE1 C -5.010 -4.089 6.027 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CE1 . . . . . . . . . c30496_6e5h 1 . 6 . 2386 . 1 1 11 TYR CE2 C -2.947 -3.355 5.075 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CE2 . . . . . . . . . c30496_6e5h 1 . 6 . 2387 . 1 1 11 TYR CG C -4.738 -4.078 3.635 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CG . . . . . . . . . c30496_6e5h 1 . 6 . 2388 . 1 1 11 TYR CZ C -3.731 -3.606 6.179 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CZ . . . . . . . . . c30496_6e5h 1 . 6 . 2389 . 1 1 11 TYR H H -3.178 -5.772 1.689 . . . 1.0 . . . . . . . . . . . . A . 11 TYR H . . . . . . . . . c30496_6e5h 1 . 6 . 2390 . 1 1 11 TYR HA H -5.881 -6.359 2.597 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HA . . . . . . . . . c30496_6e5h 1 . 6 . 2391 . 1 1 11 TYR HB2 H -4.681 -3.794 1.546 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HB2 . . . . . . . . . c30496_6e5h 1 . 6 . 2392 . 1 1 11 TYR HB3 H -6.298 -3.969 2.221 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HB3 . . . . . . . . . c30496_6e5h 1 . 6 . 2393 . 1 1 11 TYR HD1 H -6.513 -4.701 4.639 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HD1 . . . . . . . . . c30496_6e5h 1 . 6 . 2394 . 1 1 11 TYR HD2 H -2.837 -3.397 2.944 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HD2 . . . . . . . . . c30496_6e5h 1 . 6 . 2395 . 1 1 11 TYR HE1 H -5.625 -4.286 6.890 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HE1 . . . . . . . . . c30496_6e5h 1 . 6 . 2396 . 1 1 11 TYR HE2 H -1.944 -2.977 5.192 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HE2 . . . . . . . . . c30496_6e5h 1 . 6 . 2397 . 1 1 11 TYR HH H -2.854 -2.487 7.476 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HH . . . . . . . . . c30496_6e5h 1 . 6 . 2398 . 1 1 11 TYR N N -3.932 -6.349 1.947 . . . 1.0 . . . . . . . . . . . . A . 11 TYR N . . . . . . . . . c30496_6e5h 1 . 6 . 2399 . 1 1 11 TYR O O -6.259 -5.062 -0.183 . . . 1.0 . . . . . . . . . . . . A . 11 TYR O . . . . . . . . . c30496_6e5h 1 . 6 . 2400 . 1 1 11 TYR OH O -3.230 -3.376 7.440 . . . 1.0 . . . . . . . . . . . . A . 11 TYR OH . . . . . . . . . c30496_6e5h 1 . 6 . 2401 . 1 1 12 ABA C C -7.967 -7.112 -1.312 . . . 1.0 . . . . . . . . . . . . A . 12 AIB C . . . . . . . . . c30496_6e5h 1 . 6 . 2402 . 1 1 12 ABA CA C -6.538 -7.669 -1.214 . . . 1.0 . . . . . . . . . . . . A . 12 AIB CA . . . . . . . . . c30496_6e5h 1 . 6 . 2403 . 1 1 12 ABA H H -5.611 -7.995 0.668 . . . 1.0 . . . . . . . . . . . . A . 12 AIB H . . . . . . . . . c30496_6e5h 1 . 6 . 2404 . 1 1 12 ABA N N -5.959 -7.290 0.080 . . . 1.0 . . . . . . . . . . . . A . 12 AIB N . . . . . . . . . c30496_6e5h 1 . 6 . 2405 . 1 1 12 ABA O O -8.831 -7.471 -0.512 . . . 1.0 . . . . . . . . . . . . A . 12 AIB O . . . . . . . . . c30496_6e5h 1 . 6 . 2406 . 1 1 13 GLY C C -9.630 -4.235 -1.965 . . . 1.0 . . . . . . . . . . . . A . 13 GLY C . . . . . . . . . c30496_6e5h 1 . 6 . 2407 . 1 1 13 GLY CA C -9.533 -5.668 -2.446 . . . 1.0 . . . . . . . . . . . . A . 13 GLY CA . . . . . . . . . c30496_6e5h 1 . 6 . 2408 . 1 1 13 GLY H H -7.484 -5.953 -2.870 . . . 1.0 . . . . . . . . . . . . A . 13 GLY H . . . . . . . . . c30496_6e5h 1 . 6 . 2409 . 1 1 13 GLY HA2 H -9.788 -5.701 -3.494 . . . 1.0 . . . . . . . . . . . . A . 13 GLY HA2 . . . . . . . . . c30496_6e5h 1 . 6 . 2410 . 1 1 13 GLY HA3 H -10.238 -6.268 -1.894 . . . 1.0 . . . . . . . . . . . . A . 13 GLY HA3 . . . . . . . . . c30496_6e5h 1 . 6 . 2411 . 1 1 13 GLY N N -8.208 -6.228 -2.271 . . . 1.0 . . . . . . . . . . . . A . 13 GLY N . . . . . . . . . c30496_6e5h 1 . 6 . 2412 . 1 1 13 GLY O O -10.539 -3.504 -2.355 . . . 1.0 . . . . . . . . . . . . A . 13 GLY O . . . . . . . . . c30496_6e5h 1 . 6 . 2413 . 1 1 14 CYS C C -7.811 -1.572 -1.429 . . . 1.0 . . . . . . . . . . . . A . 14 CYS C . . . . . . . . . c30496_6e5h 1 . 6 . 2414 . 1 1 14 CYS CA C -8.697 -2.472 -0.588 . . . 1.0 . . . . . . . . . . . . A . 14 CYS CA . . . . . . . . . c30496_6e5h 1 . 6 . 2415 . 1 1 14 CYS CB C -8.203 -2.460 0.854 . . . 1.0 . . . . . . . . . . . . A . 14 CYS CB . . . . . . . . . c30496_6e5h 1 . 6 . 2416 . 1 1 14 CYS H H -7.982 -4.444 -0.850 . . . 1.0 . . . . . . . . . . . . A . 14 CYS H . . . . . . . . . c30496_6e5h 1 . 6 . 2417 . 1 1 14 CYS HA H -9.709 -2.099 -0.619 . . . 1.0 . . . . . . . . . . . . A . 14 CYS HA . . . . . . . . . c30496_6e5h 1 . 6 . 2418 . 1 1 14 CYS HB2 H -7.175 -2.779 0.872 . . . 1.0 . . . . . . . . . . . . A . 14 CYS HB2 . . . . . . . . . c30496_6e5h 1 . 6 . 2419 . 1 1 14 CYS HB3 H -8.266 -1.451 1.237 . . . 1.0 . . . . . . . . . . . . A . 14 CYS HB3 . . . . . . . . . c30496_6e5h 1 . 6 . 2420 . 1 1 14 CYS N N -8.696 -3.825 -1.119 . . . 1.0 . . . . . . . . . . . . A . 14 CYS N . . . . . . . . . c30496_6e5h 1 . 6 . 2421 . 1 1 14 CYS O O -6.849 -2.034 -2.044 . . . 1.0 . . . . . . . . . . . . A . 14 CYS O . . . . . . . . . c30496_6e5h 1 . 6 . 2422 . 1 1 14 CYS SG S -9.142 -3.541 1.979 . . . 1.0 . . . . . . . . . . . . A . 14 CYS SG . . . . . . . . . c30496_6e5h 1 . 6 . 2423 . 1 1 15 GLU C C -6.204 1.185 -1.355 . . . 1.0 . . . . . . . . . . . . A . 15 GLU C . . . . . . . . . c30496_6e5h 1 . 6 . 2424 . 1 1 15 GLU CA C -7.367 0.685 -2.194 . . . 1.0 . . . . . . . . . . . . A . 15 GLU CA . . . . . . . . . c30496_6e5h 1 . 6 . 2425 . 1 1 15 GLU CB C -8.248 1.864 -2.601 . . . 1.0 . . . . . . . . . . . . A . 15 GLU CB . . . . . . . . . c30496_6e5h 1 . 6 . 2426 . 1 1 15 GLU CD C -9.028 0.836 -4.768 . . . 1.0 . . . . . . . . . . . . A . 15 GLU CD . . . . . . . . . c30496_6e5h 1 . 6 . 2427 . 1 1 15 GLU CG C -9.439 1.469 -3.457 . . . 1.0 . . . . . . . . . . . . A . 15 GLU CG . . . . . . . . . c30496_6e5h 1 . 6 . 2428 . 1 1 15 GLU H H -8.912 0.012 -0.925 . . . 1.0 . . . . . . . . . . . . A . 15 GLU H . . . . . . . . . c30496_6e5h 1 . 6 . 2429 . 1 1 15 GLU HA H -6.983 0.205 -3.080 . . . 1.0 . . . . . . . . . . . . A . 15 GLU HA . . . . . . . . . c30496_6e5h 1 . 6 . 2430 . 1 1 15 GLU HB2 H -8.615 2.347 -1.710 . . . 1.0 . . . . . . . . . . . . A . 15 GLU HB2 . . . . . . . . . c30496_6e5h 1 . 6 . 2431 . 1 1 15 GLU HB3 H -7.650 2.566 -3.160 . . . 1.0 . . . . . . . . . . . . A . 15 GLU HB3 . . . . . . . . . c30496_6e5h 1 . 6 . 2432 . 1 1 15 GLU HG2 H -10.044 0.762 -2.908 . . . 1.0 . . . . . . . . . . . . A . 15 GLU HG2 . . . . . . . . . c30496_6e5h 1 . 6 . 2433 . 1 1 15 GLU HG3 H -10.022 2.352 -3.667 . . . 1.0 . . . . . . . . . . . . A . 15 GLU HG3 . . . . . . . . . c30496_6e5h 1 . 6 . 2434 . 1 1 15 GLU N N -8.135 -0.291 -1.445 . . . 1.0 . . . . . . . . . . . . A . 15 GLU N . . . . . . . . . c30496_6e5h 1 . 6 . 2435 . 1 1 15 GLU O O -6.398 1.934 -0.400 . . . 1.0 . . . . . . . . . . . . A . 15 GLU O . . . . . . . . . c30496_6e5h 1 . 6 . 2436 . 1 1 15 GLU OE1 O -9.176 -0.394 -4.909 . . . 1.0 . . . . . . . . . . . . A . 15 GLU OE1 . . . . . . . . . c30496_6e5h 1 . 6 . 2437 . 1 1 15 GLU OE2 O -8.540 1.563 -5.661 . . . 1.0 . . . . . . . . . . . . A . 15 GLU OE2 . . . . . . . . . c30496_6e5h 1 . 6 . 2438 . 1 1 16 VAL C C -3.077 2.255 -1.706 . . . 1.0 . . . . . . . . . . . . A . 16 VAL C . . . . . . . . . c30496_6e5h 1 . 6 . 2439 . 1 1 16 VAL CA C -3.823 1.159 -0.959 . . . 1.0 . . . . . . . . . . . . A . 16 VAL CA . . . . . . . . . c30496_6e5h 1 . 6 . 2440 . 1 1 16 VAL CB C -2.864 -0.021 -0.708 . . . 1.0 . . . . . . . . . . . . A . 16 VAL CB . . . . . . . . . c30496_6e5h 1 . 6 . 2441 . 1 1 16 VAL CG1 C -1.650 0.437 0.085 . . . 1.0 . . . . . . . . . . . . A . 16 VAL CG1 . . . . . . . . . c30496_6e5h 1 . 6 . 2442 . 1 1 16 VAL CG2 C -3.577 -1.157 0.013 . . . 1.0 . . . . . . . . . . . . A . 16 VAL CG2 . . . . . . . . . c30496_6e5h 1 . 6 . 2443 . 1 1 16 VAL H H -4.913 0.151 -2.463 . . . 1.0 . . . . . . . . . . . . A . 16 VAL H . . . . . . . . . c30496_6e5h 1 . 6 . 2444 . 1 1 16 VAL HA H -4.145 1.546 -0.002 . . . 1.0 . . . . . . . . . . . . A . 16 VAL HA . . . . . . . . . c30496_6e5h 1 . 6 . 2445 . 1 1 16 VAL HB H -2.525 -0.389 -1.665 . . . 1.0 . . . . . . . . . . . . A . 16 VAL HB . . . . . . . . . c30496_6e5h 1 . 6 . 2446 . 1 1 16 VAL HG11 H -0.977 -0.393 0.228 . . . 1.0 . . . . . . . . . . . . A . 16 VAL HG11 . . . . . . . . . c30496_6e5h 1 . 6 . 2447 . 1 1 16 VAL HG12 H -1.970 0.813 1.046 . . . 1.0 . . . . . . . . . . . . A . 16 VAL HG12 . . . . . . . . . c30496_6e5h 1 . 6 . 2448 . 1 1 16 VAL HG13 H -1.141 1.224 -0.457 . . . 1.0 . . . . . . . . . . . . A . 16 VAL HG13 . . . . . . . . . c30496_6e5h 1 . 6 . 2449 . 1 1 16 VAL HG21 H -4.028 -0.779 0.916 . . . 1.0 . . . . . . . . . . . . A . 16 VAL HG21 . . . . . . . . . c30496_6e5h 1 . 6 . 2450 . 1 1 16 VAL HG22 H -2.864 -1.928 0.264 . . . 1.0 . . . . . . . . . . . . A . 16 VAL HG22 . . . . . . . . . c30496_6e5h 1 . 6 . 2451 . 1 1 16 VAL HG23 H -4.342 -1.569 -0.628 . . . 1.0 . . . . . . . . . . . . A . 16 VAL HG23 . . . . . . . . . c30496_6e5h 1 . 6 . 2452 . 1 1 16 VAL N N -5.007 0.752 -1.695 . . . 1.0 . . . . . . . . . . . . A . 16 VAL N . . . . . . . . . c30496_6e5h 1 . 6 . 2453 . 1 1 16 VAL O O -2.530 2.023 -2.786 . . . 1.0 . . . . . . . . . . . . A . 16 VAL O . . . . . . . . . c30496_6e5h 1 . 6 . 2454 . 1 1 17 ARG C C -0.873 4.471 -1.270 . . . 1.0 . . . . . . . . . . . . A . 17 ARG C . . . . . . . . . c30496_6e5h 1 . 6 . 2455 . 1 1 17 ARG CA C -2.327 4.557 -1.700 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CA . . . . . . . . . c30496_6e5h 1 . 6 . 2456 . 1 1 17 ARG CB C -2.900 5.901 -1.252 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CB . . . . . . . . . c30496_6e5h 1 . 6 . 2457 . 1 1 17 ARG CD C -4.791 7.529 -1.201 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CD . . . . . . . . . c30496_6e5h 1 . 6 . 2458 . 1 1 17 ARG CG C -4.329 6.167 -1.692 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CG . . . . . . . . . c30496_6e5h 1 . 6 . 2459 . 1 1 17 ARG CZ C -6.834 8.907 -1.186 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CZ . . . . . . . . . c30496_6e5h 1 . 6 . 2460 . 1 1 17 ARG H H -3.572 3.575 -0.299 . . . 1.0 . . . . . . . . . . . . A . 17 ARG H . . . . . . . . . c30496_6e5h 1 . 6 . 2461 . 1 1 17 ARG HA H -2.381 4.487 -2.775 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HA . . . . . . . . . c30496_6e5h 1 . 6 . 2462 . 1 1 17 ARG HB2 H -2.867 5.948 -0.179 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HB2 . . . . . . . . . c30496_6e5h 1 . 6 . 2463 . 1 1 17 ARG HB3 H -2.276 6.687 -1.652 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HB3 . . . . . . . . . c30496_6e5h 1 . 6 . 2464 . 1 1 17 ARG HD2 H -4.753 7.539 -0.122 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HD2 . . . . . . . . . c30496_6e5h 1 . 6 . 2465 . 1 1 17 ARG HD3 H -4.120 8.281 -1.588 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HD3 . . . . . . . . . c30496_6e5h 1 . 6 . 2466 . 1 1 17 ARG HE H -6.572 7.249 -2.286 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HE . . . . . . . . . c30496_6e5h 1 . 6 . 2467 . 1 1 17 ARG HG2 H -4.379 6.142 -2.769 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HG2 . . . . . . . . . c30496_6e5h 1 . 6 . 2468 . 1 1 17 ARG HG3 H -4.974 5.405 -1.280 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HG3 . . . . . . . . . c30496_6e5h 1 . 6 . 2469 . 1 1 17 ARG HH11 H -5.383 9.528 0.106 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH11 . . . . . . . . . c30496_6e5h 1 . 6 . 2470 . 1 1 17 ARG HH12 H -6.815 10.515 0.061 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH12 . . . . . . . . . c30496_6e5h 1 . 6 . 2471 . 1 1 17 ARG HH21 H -8.461 8.541 -2.340 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH21 . . . . . . . . . c30496_6e5h 1 . 6 . 2472 . 1 1 17 ARG HH22 H -8.568 9.950 -1.333 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH22 . . . . . . . . . c30496_6e5h 1 . 6 . 2473 . 1 1 17 ARG N N -3.071 3.445 -1.134 . . . 1.0 . . . . . . . . . . . . A . 17 ARG N . . . . . . . . . c30496_6e5h 1 . 6 . 2474 . 1 1 17 ARG NE N -6.152 7.849 -1.624 . . . 1.0 . . . . . . . . . . . . A . 17 ARG NE . . . . . . . . . c30496_6e5h 1 . 6 . 2475 . 1 1 17 ARG NH1 N -6.305 9.714 -0.266 . . . 1.0 . . . . . . . . . . . . A . 17 ARG NH1 . . . . . . . . . c30496_6e5h 1 . 6 . 2476 . 1 1 17 ARG NH2 N -8.053 9.152 -1.657 . . . 1.0 . . . . . . . . . . . . A . 17 ARG NH2 . . . . . . . . . c30496_6e5h 1 . 6 . 2477 . 1 1 17 ARG O O -0.578 4.412 -0.072 . . . 1.0 . . . . . . . . . . . . A . 17 ARG O . . . . . . . . . c30496_6e5h 1 . 6 . 2478 . 1 1 18 CYS C C 2.122 5.675 -2.451 . . . 1.0 . . . . . . . . . . . . A . 18 CYS C . . . . . . . . . c30496_6e5h 1 . 6 . 2479 . 1 1 18 CYS CA C 1.446 4.397 -1.978 . . . 1.0 . . . . . . . . . . . . A . 18 CYS CA . . . . . . . . . c30496_6e5h 1 . 6 . 2480 . 1 1 18 CYS CB C 2.072 3.197 -2.680 . . . 1.0 . . . . . . . . . . . . A . 18 CYS CB . . . . . . . . . c30496_6e5h 1 . 6 . 2481 . 1 1 18 CYS H H -0.285 4.489 -3.174 . . . 1.0 . . . . . . . . . . . . A . 18 CYS H . . . . . . . . . c30496_6e5h 1 . 6 . 2482 . 1 1 18 CYS HA H 1.581 4.296 -0.913 . . . 1.0 . . . . . . . . . . . . A . 18 CYS HA . . . . . . . . . c30496_6e5h 1 . 6 . 2483 . 1 1 18 CYS HB2 H 1.925 3.299 -3.745 . . . 1.0 . . . . . . . . . . . . A . 18 CYS HB2 . . . . . . . . . c30496_6e5h 1 . 6 . 2484 . 1 1 18 CYS HB3 H 3.130 3.182 -2.470 . . . 1.0 . . . . . . . . . . . . A . 18 CYS HB3 . . . . . . . . . c30496_6e5h 1 . 6 . 2485 . 1 1 18 CYS N N 0.021 4.455 -2.244 . . . 1.0 . . . . . . . . . . . . A . 18 CYS N . . . . . . . . . c30496_6e5h 1 . 6 . 2486 . 1 1 18 CYS O O 2.261 5.908 -3.652 . . . 1.0 . . . . . . . . . . . . A . 18 CYS O . . . . . . . . . c30496_6e5h 1 . 6 . 2487 . 1 1 18 CYS SG S 1.377 1.588 -2.180 . . . 1.0 . . . . . . . . . . . . A . 18 CYS SG . . . . . . . . . c30496_6e5h 1 . 6 . 2488 . 1 1 19 ASP C C 4.437 7.921 -0.984 . . . 1.0 . . . . . . . . . . . . A . 19 ASP C . . . . . . . . . c30496_6e5h 1 . 6 . 2489 . 1 1 19 ASP CA C 3.184 7.764 -1.828 . . . 1.0 . . . . . . . . . . . . A . 19 ASP CA . . . . . . . . . c30496_6e5h 1 . 6 . 2490 . 1 1 19 ASP CB C 2.235 8.945 -1.599 . . . 1.0 . . . . . . . . . . . . A . 19 ASP CB . . . . . . . . . c30496_6e5h 1 . 6 . 2491 . 1 1 19 ASP CG C 1.095 8.979 -2.597 . . . 1.0 . . . . . . . . . . . . A . 19 ASP CG . . . . . . . . . c30496_6e5h 1 . 6 . 2492 . 1 1 19 ASP H H 2.398 6.263 -0.564 . . . 1.0 . . . . . . . . . . . . A . 19 ASP H . . . . . . . . . c30496_6e5h 1 . 6 . 2493 . 1 1 19 ASP HA H 3.464 7.737 -2.867 . . . 1.0 . . . . . . . . . . . . A . 19 ASP HA . . . . . . . . . c30496_6e5h 1 . 6 . 2494 . 1 1 19 ASP HB2 H 1.817 8.874 -0.606 . . . 1.0 . . . . . . . . . . . . A . 19 ASP HB2 . . . . . . . . . c30496_6e5h 1 . 6 . 2495 . 1 1 19 ASP HB3 H 2.792 9.867 -1.684 . . . 1.0 . . . . . . . . . . . . A . 19 ASP HB3 . . . . . . . . . c30496_6e5h 1 . 6 . 2496 . 1 1 19 ASP N N 2.529 6.505 -1.508 . . . 1.0 . . . . . . . . . . . . A . 19 ASP N . . . . . . . . . c30496_6e5h 1 . 6 . 2497 . 1 1 19 ASP O O 4.426 8.598 0.048 . . . 1.0 . . . . . . . . . . . . A . 19 ASP O . . . . . . . . . c30496_6e5h 1 . 6 . 2498 . 1 1 19 ASP OD1 O 0.123 8.213 -2.430 . . . 1.0 . . . . . . . . . . . . A . 19 ASP OD1 . . . . . . . . . c30496_6e5h 1 . 6 . 2499 . 1 1 19 ASP OD2 O 1.162 9.778 -3.557 . . . 1.0 . . . . . . . . . . . . A . 19 ASP OD2 . . . . . . . . . c30496_6e5h 1 . 6 . 2500 . 1 1 20 DPR C C 6.587 6.559 0.697 . . . 1.0 . . . . . . . . . . . . A . 20 DPR C . . . . . . . . . c30496_6e5h 1 . 6 . 2501 . 1 1 20 DPR CA C 6.779 7.269 -0.635 . . . 1.0 . . . . . . . . . . . . A . 20 DPR CA . . . . . . . . . c30496_6e5h 1 . 6 . 2502 . 1 1 20 DPR CB C 7.768 6.504 -1.517 . . . 1.0 . . . . . . . . . . . . A . 20 DPR CB . . . . . . . . . c30496_6e5h 1 . 6 . 2503 . 1 1 20 DPR CD C 5.665 6.511 -2.649 . . . 1.0 . . . . . . . . . . . . A . 20 DPR CD . . . . . . . . . c30496_6e5h 1 . 6 . 2504 . 1 1 20 DPR CG C 7.148 6.478 -2.871 . . . 1.0 . . . . . . . . . . . . A . 20 DPR CG . . . . . . . . . c30496_6e5h 1 . 6 . 2505 . 1 1 20 DPR HA H 7.150 8.264 -0.464 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HA . . . . . . . . . c30496_6e5h 1 . 6 . 2506 . 1 1 20 DPR HB2 H 8.715 7.023 -1.526 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HB2 . . . . . . . . . c30496_6e5h 1 . 6 . 2507 . 1 1 20 DPR HB3 H 7.902 5.508 -1.127 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HB3 . . . . . . . . . c30496_6e5h 1 . 6 . 2508 . 1 1 20 DPR HD2 H 5.174 7.013 -3.468 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HD2 . . . . . . . . . c30496_6e5h 1 . 6 . 2509 . 1 1 20 DPR HD3 H 5.276 5.511 -2.528 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HD3 . . . . . . . . . c30496_6e5h 1 . 6 . 2510 . 1 1 20 DPR HG2 H 7.462 7.345 -3.432 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HG2 . . . . . . . . . c30496_6e5h 1 . 6 . 2511 . 1 1 20 DPR HG3 H 7.432 5.573 -3.388 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HG3 . . . . . . . . . c30496_6e5h 1 . 6 . 2512 . 1 1 20 DPR N N 5.537 7.278 -1.402 . . . 1.0 . . . . . . . . . . . . A . 20 DPR N . . . . . . . . . c30496_6e5h 1 . 6 . 2513 . 1 1 20 DPR O O 6.235 5.380 0.734 . . . 1.0 . . . . . . . . . . . . A . 20 DPR O . . . . . . . . . c30496_6e5h 1 . 6 . 2514 . 1 1 21 PRO C C 5.123 6.900 3.593 . . . 1.0 . . . . . . . . . . . . A . 21 PRO C . . . . . . . . . c30496_6e5h 1 . 6 . 2515 . 1 1 21 PRO CA C 6.578 6.746 3.147 . . . 1.0 . . . . . . . . . . . . A . 21 PRO CA . . . . . . . . . c30496_6e5h 1 . 6 . 2516 . 1 1 21 PRO CB C 7.490 7.620 4.001 . . . 1.0 . . . . . . . . . . . . A . 21 PRO CB . . . . . . . . . c30496_6e5h 1 . 6 . 2517 . 1 1 21 PRO CD C 7.347 8.648 1.840 . . . 1.0 . . . . . . . . . . . . A . 21 PRO CD . . . . . . . . . c30496_6e5h 1 . 6 . 2518 . 1 1 21 PRO CG C 7.477 8.942 3.314 . . . 1.0 . . . . . . . . . . . . A . 21 PRO CG . . . . . . . . . c30496_6e5h 1 . 6 . 2519 . 1 1 21 PRO HA H 6.878 5.713 3.230 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HA . . . . . . . . . c30496_6e5h 1 . 6 . 2520 . 1 1 21 PRO HB2 H 7.095 7.686 5.004 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HB2 . . . . . . . . . c30496_6e5h 1 . 6 . 2521 . 1 1 21 PRO HB3 H 8.483 7.196 4.024 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HB3 . . . . . . . . . c30496_6e5h 1 . 6 . 2522 . 1 1 21 PRO HD2 H 6.661 9.342 1.377 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HD2 . . . . . . . . . c30496_6e5h 1 . 6 . 2523 . 1 1 21 PRO HD3 H 8.312 8.695 1.361 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HD3 . . . . . . . . . c30496_6e5h 1 . 6 . 2524 . 1 1 21 PRO HG2 H 6.634 9.524 3.655 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HG2 . . . . . . . . . c30496_6e5h 1 . 6 . 2525 . 1 1 21 PRO HG3 H 8.399 9.466 3.510 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HG3 . . . . . . . . . c30496_6e5h 1 . 6 . 2526 . 1 1 21 PRO N N 6.810 7.273 1.805 . . . 1.0 . . . . . . . . . . . . A . 21 PRO N . . . . . . . . . c30496_6e5h 1 . 6 . 2527 . 1 1 21 PRO O O 4.758 6.518 4.705 . . . 1.0 . . . . . . . . . . . . A . 21 PRO O . . . . . . . . . c30496_6e5h 1 . 6 . 2528 . 1 1 22 ARG C C 2.024 6.601 2.448 . . . 1.0 . . . . . . . . . . . . A . 22 ARG C . . . . . . . . . c30496_6e5h 1 . 6 . 2529 . 1 1 22 ARG CA C 2.893 7.693 3.047 . . . 1.0 . . . . . . . . . . . . A . 22 ARG CA . . . . . . . . . c30496_6e5h 1 . 6 . 2530 . 1 1 22 ARG CB C 2.439 9.055 2.529 . . . 1.0 . . . . . . . . . . . . A . 22 ARG CB . . . . . . . . . c30496_6e5h 1 . 6 . 2531 . 1 1 22 ARG CD C 2.822 11.533 2.461 . . . 1.0 . . . . . . . . . . . . A . 22 ARG CD . . . . . . . . . c30496_6e5h 1 . 6 . 2532 . 1 1 22 ARG CG C 3.172 10.229 3.156 . . . 1.0 . . . . . . . . . . . . A . 22 ARG CG . . . . . . . . . c30496_6e5h 1 . 6 . 2533 . 1 1 22 ARG CZ C 2.748 12.334 0.125 . . . 1.0 . . . . . . . . . . . . A . 22 ARG CZ . . . . . . . . . c30496_6e5h 1 . 6 . 2534 . 1 1 22 ARG H H 4.630 7.720 1.832 . . . 1.0 . . . . . . . . . . . . A . 22 ARG H . . . . . . . . . c30496_6e5h 1 . 6 . 2535 . 1 1 22 ARG HA H 2.793 7.670 4.121 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HA . . . . . . . . . c30496_6e5h 1 . 6 . 2536 . 1 1 22 ARG HB2 H 2.598 9.088 1.462 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HB2 . . . . . . . . . c30496_6e5h 1 . 6 . 2537 . 1 1 22 ARG HB3 H 1.384 9.167 2.729 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HB3 . . . . . . . . . c30496_6e5h 1 . 6 . 2538 . 1 1 22 ARG HD2 H 1.751 11.667 2.490 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HD2 . . . . . . . . . c30496_6e5h 1 . 6 . 2539 . 1 1 22 ARG HD3 H 3.300 12.347 2.986 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HD3 . . . . . . . . . c30496_6e5h 1 . 6 . 2540 . 1 1 22 ARG HE H 3.999 10.934 0.820 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HE . . . . . . . . . c30496_6e5h 1 . 6 . 2541 . 1 1 22 ARG HG2 H 2.894 10.302 4.197 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HG2 . . . . . . . . . c30496_6e5h 1 . 6 . 2542 . 1 1 22 ARG HG3 H 4.236 10.062 3.076 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HG3 . . . . . . . . . c30496_6e5h 1 . 6 . 2543 . 1 1 22 ARG HH11 H 1.356 13.170 1.342 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HH11 . . . . . . . . . c30496_6e5h 1 . 6 . 2544 . 1 1 22 ARG HH12 H 1.351 13.744 -0.295 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HH12 . . . . . . . . . c30496_6e5h 1 . 6 . 2545 . 1 1 22 ARG HH21 H 2.855 12.898 -1.823 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HH21 . . . . . . . . . c30496_6e5h 1 . 6 . 2546 . 1 1 22 ARG HH22 H 4.001 11.690 -1.332 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HH22 . . . . . . . . . c30496_6e5h 1 . 6 . 2547 . 1 1 22 ARG N N 4.293 7.463 2.723 . . . 1.0 . . . . . . . . . . . . A . 22 ARG N . . . . . . . . . c30496_6e5h 1 . 6 . 2548 . 1 1 22 ARG NE N 3.264 11.544 1.065 . . . 1.0 . . . . . . . . . . . . A . 22 ARG NE . . . . . . . . . c30496_6e5h 1 . 6 . 2549 . 1 1 22 ARG NH1 N 1.737 13.148 0.414 . . . 1.0 . . . . . . . . . . . . A . 22 ARG NH1 . . . . . . . . . c30496_6e5h 1 . 6 . 2550 . 1 1 22 ARG NH2 N 3.239 12.303 -1.108 . . . 1.0 . . . . . . . . . . . . A . 22 ARG NH2 . . . . . . . . . c30496_6e5h 1 . 6 . 2551 . 1 1 22 ARG O O 2.088 6.334 1.248 . . . 1.0 . . . . . . . . . . . . A . 22 ARG O . . . . . . . . . c30496_6e5h 1 . 6 . 2552 . 1 1 23 TYR C C -1.046 5.055 3.372 . . . 1.0 . . . . . . . . . . . . A . 23 TYR C . . . . . . . . . c30496_6e5h 1 . 6 . 2553 . 1 1 23 TYR CA C 0.360 4.888 2.832 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CA . . . . . . . . . c30496_6e5h 1 . 6 . 2554 . 1 1 23 TYR CB C 0.925 3.542 3.277 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CB . . . . . . . . . c30496_6e5h 1 . 6 . 2555 . 1 1 23 TYR CD1 C 3.408 3.415 3.661 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CD1 . . . . . . . . . c30496_6e5h 1 . 6 . 2556 . 1 1 23 TYR CD2 C 2.580 2.968 1.472 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CD2 . . . . . . . . . c30496_6e5h 1 . 6 . 2557 . 1 1 23 TYR CE1 C 4.697 3.212 3.220 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CE1 . . . . . . . . . c30496_6e5h 1 . 6 . 2558 . 1 1 23 TYR CE2 C 3.864 2.760 1.024 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CE2 . . . . . . . . . c30496_6e5h 1 . 6 . 2559 . 1 1 23 TYR CG C 2.330 3.297 2.795 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CG . . . . . . . . . c30496_6e5h 1 . 6 . 2560 . 1 1 23 TYR CZ C 4.920 2.883 1.901 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CZ . . . . . . . . . c30496_6e5h 1 . 6 . 2561 . 1 1 23 TYR H H 1.180 6.250 4.221 . . . 1.0 . . . . . . . . . . . . A . 23 TYR H . . . . . . . . . c30496_6e5h 1 . 6 . 2562 . 1 1 23 TYR HA H 0.327 4.917 1.755 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HA . . . . . . . . . c30496_6e5h 1 . 6 . 2563 . 1 1 23 TYR HB2 H 0.932 3.498 4.354 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HB2 . . . . . . . . . c30496_6e5h 1 . 6 . 2564 . 1 1 23 TYR HB3 H 0.300 2.754 2.891 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HB3 . . . . . . . . . c30496_6e5h 1 . 6 . 2565 . 1 1 23 TYR HD1 H 3.227 3.674 4.693 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HD1 . . . . . . . . . c30496_6e5h 1 . 6 . 2566 . 1 1 23 TYR HD2 H 1.748 2.873 0.789 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HD2 . . . . . . . . . c30496_6e5h 1 . 6 . 2567 . 1 1 23 TYR HE1 H 5.523 3.305 3.907 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HE1 . . . . . . . . . c30496_6e5h 1 . 6 . 2568 . 1 1 23 TYR HE2 H 4.037 2.502 -0.007 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HE2 . . . . . . . . . c30496_6e5h 1 . 6 . 2569 . 1 1 23 TYR HH H 6.397 3.371 0.774 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HH . . . . . . . . . c30496_6e5h 1 . 6 . 2570 . 1 1 23 TYR N N 1.214 5.973 3.281 . . . 1.0 . . . . . . . . . . . . A . 23 TYR N . . . . . . . . . c30496_6e5h 1 . 6 . 2571 . 1 1 23 TYR O O -1.237 5.321 4.561 . . . 1.0 . . . . . . . . . . . . A . 23 TYR O . . . . . . . . . c30496_6e5h 1 . 6 . 2572 . 1 1 23 TYR OH O 6.206 2.700 1.447 . . . 1.0 . . . . . . . . . . . . A . 23 TYR OH . . . . . . . . . c30496_6e5h 1 . 6 . 2573 . 1 1 24 GLU C C -4.202 3.782 2.448 . . . 1.0 . . . . . . . . . . . . A . 24 GLU C . . . . . . . . . c30496_6e5h 1 . 6 . 2574 . 1 1 24 GLU CA C -3.423 4.998 2.912 . . . 1.0 . . . . . . . . . . . . A . 24 GLU CA . . . . . . . . . c30496_6e5h 1 . 6 . 2575 . 1 1 24 GLU CB C -4.089 6.258 2.358 . . . 1.0 . . . . . . . . . . . . A . 24 GLU CB . . . . . . . . . c30496_6e5h 1 . 6 . 2576 . 1 1 24 GLU CD C -4.290 8.761 2.474 . . . 1.0 . . . . . . . . . . . . A . 24 GLU CD . . . . . . . . . c30496_6e5h 1 . 6 . 2577 . 1 1 24 GLU CG C -3.427 7.557 2.780 . . . 1.0 . . . . . . . . . . . . A . 24 GLU CG . . . . . . . . . c30496_6e5h 1 . 6 . 2578 . 1 1 24 GLU H H -1.808 4.714 1.558 . . . 1.0 . . . . . . . . . . . . A . 24 GLU H . . . . . . . . . c30496_6e5h 1 . 6 . 2579 . 1 1 24 GLU HA H -3.447 5.032 3.992 . . . 1.0 . . . . . . . . . . . . A . 24 GLU HA . . . . . . . . . c30496_6e5h 1 . 6 . 2580 . 1 1 24 GLU HB2 H -4.076 6.210 1.282 . . . 1.0 . . . . . . . . . . . . A . 24 GLU HB2 . . . . . . . . . c30496_6e5h 1 . 6 . 2581 . 1 1 24 GLU HB3 H -5.116 6.280 2.694 . . . 1.0 . . . . . . . . . . . . A . 24 GLU HB3 . . . . . . . . . c30496_6e5h 1 . 6 . 2582 . 1 1 24 GLU HG2 H -3.241 7.527 3.843 . . . 1.0 . . . . . . . . . . . . A . 24 GLU HG2 . . . . . . . . . c30496_6e5h 1 . 6 . 2583 . 1 1 24 GLU HG3 H -2.490 7.659 2.253 . . . 1.0 . . . . . . . . . . . . A . 24 GLU HG3 . . . . . . . . . c30496_6e5h 1 . 6 . 2584 . 1 1 24 GLU N N -2.029 4.903 2.501 . . . 1.0 . . . . . . . . . . . . A . 24 GLU N . . . . . . . . . c30496_6e5h 1 . 6 . 2585 . 1 1 24 GLU O O -4.483 3.632 1.263 . . . 1.0 . . . . . . . . . . . . A . 24 GLU O . . . . . . . . . c30496_6e5h 1 . 6 . 2586 . 1 1 24 GLU OE1 O -4.123 9.369 1.399 . . . 1.0 . . . . . . . . . . . . A . 24 GLU OE1 . . . . . . . . . c30496_6e5h 1 . 6 . 2587 . 1 1 24 GLU OE2 O -5.144 9.104 3.313 . . . 1.0 . . . . . . . . . . . . A . 24 GLU OE2 . . . . . . . . . c30496_6e5h 1 . 6 . 2588 . 1 1 25 VAL C C -6.831 2.098 3.218 . . . 1.0 . . . . . . . . . . . . A . 25 VAL C . . . . . . . . . c30496_6e5h 1 . 6 . 2589 . 1 1 25 VAL CA C -5.356 1.754 3.065 . . . 1.0 . . . . . . . . . . . . A . 25 VAL CA . . . . . . . . . c30496_6e5h 1 . 6 . 2590 . 1 1 25 VAL CB C -5.011 0.558 3.974 . . . 1.0 . . . . . . . . . . . . A . 25 VAL CB . . . . . . . . . c30496_6e5h 1 . 6 . 2591 . 1 1 25 VAL CG1 C -5.880 -0.645 3.638 . . . 1.0 . . . . . . . . . . . . A . 25 VAL CG1 . . . . . . . . . c30496_6e5h 1 . 6 . 2592 . 1 1 25 VAL CG2 C -3.536 0.202 3.860 . . . 1.0 . . . . . . . . . . . . A . 25 VAL CG2 . . . . . . . . . c30496_6e5h 1 . 6 . 2593 . 1 1 25 VAL H H -4.252 3.062 4.305 . . . 1.0 . . . . . . . . . . . . A . 25 VAL H . . . . . . . . . c30496_6e5h 1 . 6 . 2594 . 1 1 25 VAL HA H -5.162 1.476 2.040 . . . 1.0 . . . . . . . . . . . . A . 25 VAL HA . . . . . . . . . c30496_6e5h 1 . 6 . 2595 . 1 1 25 VAL HB H -5.212 0.844 4.996 . . . 1.0 . . . . . . . . . . . . A . 25 VAL HB . . . . . . . . . c30496_6e5h 1 . 6 . 2596 . 1 1 25 VAL HG11 H -5.618 -1.472 4.281 . . . 1.0 . . . . . . . . . . . . A . 25 VAL HG11 . . . . . . . . . c30496_6e5h 1 . 6 . 2597 . 1 1 25 VAL HG12 H -5.723 -0.926 2.609 . . . 1.0 . . . . . . . . . . . . A . 25 VAL HG12 . . . . . . . . . c30496_6e5h 1 . 6 . 2598 . 1 1 25 VAL HG13 H -6.920 -0.390 3.786 . . . 1.0 . . . . . . . . . . . . A . 25 VAL HG13 . . . . . . . . . c30496_6e5h 1 . 6 . 2599 . 1 1 25 VAL HG21 H -3.313 -0.079 2.843 . . . 1.0 . . . . . . . . . . . . A . 25 VAL HG21 . . . . . . . . . c30496_6e5h 1 . 6 . 2600 . 1 1 25 VAL HG22 H -3.311 -0.622 4.520 . . . 1.0 . . . . . . . . . . . . A . 25 VAL HG22 . . . . . . . . . c30496_6e5h 1 . 6 . 2601 . 1 1 25 VAL HG23 H -2.937 1.057 4.135 . . . 1.0 . . . . . . . . . . . . A . 25 VAL HG23 . . . . . . . . . c30496_6e5h 1 . 6 . 2602 . 1 1 25 VAL N N -4.546 2.915 3.380 . . . 1.0 . . . . . . . . . . . . A . 25 VAL N . . . . . . . . . c30496_6e5h 1 . 6 . 2603 . 1 1 25 VAL O O -7.277 2.479 4.300 . . . 1.0 . . . . . . . . . . . . A . 25 VAL O . . . . . . . . . c30496_6e5h 1 . 6 . 2604 . 1 1 26 HIS C C -9.811 1.082 1.764 . . . 1.0 . . . . . . . . . . . . A . 26 HIS C . . . . . . . . . c30496_6e5h 1 . 6 . 2605 . 1 1 26 HIS CA C -8.998 2.304 2.165 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CA . . . . . . . . . c30496_6e5h 1 . 6 . 2606 . 1 1 26 HIS CB C -9.313 3.475 1.233 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CB . . . . . . . . . c30496_6e5h 1 . 6 . 2607 . 1 1 26 HIS CD2 C -11.082 5.042 2.287 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CD2 . . . . . . . . . c30496_6e5h 1 . 6 . 2608 . 1 1 26 HIS CE1 C -12.828 4.389 1.142 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CE1 . . . . . . . . . c30496_6e5h 1 . 6 . 2609 . 1 1 26 HIS CG C -10.671 4.069 1.446 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CG . . . . . . . . . c30496_6e5h 1 . 6 . 2610 . 1 1 26 HIS H H -7.162 1.723 1.284 . . . 1.0 . . . . . . . . . . . . A . 26 HIS H . . . . . . . . . c30496_6e5h 1 . 6 . 2611 . 1 1 26 HIS HA H -9.254 2.579 3.176 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HA . . . . . . . . . c30496_6e5h 1 . 6 . 2612 . 1 1 26 HIS HB2 H -8.583 4.253 1.384 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HB2 . . . . . . . . . c30496_6e5h 1 . 6 . 2613 . 1 1 26 HIS HB3 H -9.259 3.134 0.213 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HB3 . . . . . . . . . c30496_6e5h 1 . 6 . 2614 . 1 1 26 HIS HD1 H -11.819 2.994 0.037 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HD1 . . . . . . . . . c30496_6e5h 1 . 6 . 2615 . 1 1 26 HIS HD2 H -10.464 5.582 2.991 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HD2 . . . . . . . . . c30496_6e5h 1 . 6 . 2616 . 1 1 26 HIS HE1 H -13.835 4.300 0.767 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HE1 . . . . . . . . . c30496_6e5h 1 . 6 . 2617 . 1 1 26 HIS HE2 H -12.945 5.997 2.398 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HE2 . . . . . . . . . c30496_6e5h 1 . 6 . 2618 . 1 1 26 HIS N N -7.578 1.999 2.134 . . . 1.0 . . . . . . . . . . . . A . 26 HIS N . . . . . . . . . c30496_6e5h 1 . 6 . 2619 . 1 1 26 HIS ND1 N -11.789 3.679 0.741 . . . 1.0 . . . . . . . . . . . . A . 26 HIS ND1 . . . . . . . . . c30496_6e5h 1 . 6 . 2620 . 1 1 26 HIS NE2 N -12.426 5.224 2.079 . . . 1.0 . . . . . . . . . . . . A . 26 HIS NE2 . . . . . . . . . c30496_6e5h 1 . 6 . 2621 . 1 1 26 HIS O O -9.882 0.731 0.584 . . . 1.0 . . . . . . . . . . . . A . 26 HIS O . . . . . . . . . c30496_6e5h 1 . 6 . 2622 . 1 1 27 CYS C C -12.716 -0.285 2.464 . . . 1.0 . . . . . . . . . . . . A . 27 CYS C . . . . . . . . . c30496_6e5h 1 . 6 . 2623 . 1 1 27 CYS CA C -11.256 -0.719 2.497 . . . 1.0 . . . . . . . . . . . . A . 27 CYS CA . . . . . . . . . c30496_6e5h 1 . 6 . 2624 . 1 1 27 CYS CB C -11.044 -1.789 3.569 . . . 1.0 . . . . . . . . . . . . A . 27 CYS CB . . . . . . . . . c30496_6e5h 1 . 6 . 2625 . 1 1 27 CYS H H -10.263 0.723 3.674 . . . 1.0 . . . . . . . . . . . . A . 27 CYS H . . . . . . . . . c30496_6e5h 1 . 6 . 2626 . 1 1 27 CYS HA H -10.992 -1.125 1.533 . . . 1.0 . . . . . . . . . . . . A . 27 CYS HA . . . . . . . . . c30496_6e5h 1 . 6 . 2627 . 1 1 27 CYS HB2 H -11.294 -1.375 4.534 . . . 1.0 . . . . . . . . . . . . A . 27 CYS HB2 . . . . . . . . . c30496_6e5h 1 . 6 . 2628 . 1 1 27 CYS HB3 H -11.696 -2.623 3.362 . . . 1.0 . . . . . . . . . . . . A . 27 CYS HB3 . . . . . . . . . c30496_6e5h 1 . 6 . 2629 . 1 1 27 CYS N N -10.403 0.427 2.748 . . . 1.0 . . . . . . . . . . . . A . 27 CYS N . . . . . . . . . c30496_6e5h 1 . 6 . 2630 . 1 1 27 CYS O O -13.379 -0.192 3.499 . . . 1.0 . . . . . . . . . . . . A . 27 CYS O . . . . . . . . . c30496_6e5h 1 . 6 . 2631 . 1 1 27 CYS SG S -9.339 -2.425 3.662 . . . 1.0 . . . . . . . . . . . . A . 27 CYS SG . . . . . . . . . c30496_6e5h 1 . 6 . 2632 . 1 1 28 NH2 HN1 H -12.621 -0.087 0.495 . . . 1.0 . . . . . . . . . . . . A . 28 NH2 HN1 . . . . . . . . . c30496_6e5h 1 . 6 . 2633 . 1 1 28 NH2 HN2 H -14.137 0.319 1.221 . . . 1.0 . . . . . . . . . . . . A . 28 NH2 HN2 . . . . . . . . . c30496_6e5h 1 . 6 . 2634 . 1 1 28 NH2 N N -13.207 0.012 1.276 . . . 1.0 . . . . . . . . . . . . A . 28 NH2 N . . . . . . . . . c30496_6e5h 1 . 7 . 2635 . 1 1 1 ASN C C 10.146 -2.480 -1.584 . . . 1.0 . . . . . . . . . . . . A . 1 ASN C . . . . . . . . . c30496_6e5h 1 . 7 . 2636 . 1 1 1 ASN CA C 11.524 -2.629 -0.956 . . . 1.0 . . . . . . . . . . . . A . 1 ASN CA . . . . . . . . . c30496_6e5h 1 . 7 . 2637 . 1 1 1 ASN CB C 12.534 -1.783 -1.737 . . . 1.0 . . . . . . . . . . . . A . 1 ASN CB . . . . . . . . . c30496_6e5h 1 . 7 . 2638 . 1 1 1 ASN CG C 13.874 -1.673 -1.037 . . . 1.0 . . . . . . . . . . . . A . 1 ASN CG . . . . . . . . . c30496_6e5h 1 . 7 . 2639 . 1 1 1 ASN H1 H 11.289 -4.610 -0.345 . . . 1.0 . . . . . . . . . . . . A . 1 ASN H1 . . . . . . . . . c30496_6e5h 1 . 7 . 2640 . 1 1 1 ASN H2 H 12.900 -4.126 -0.512 . . . 1.0 . . . . . . . . . . . . A . 1 ASN H2 . . . . . . . . . c30496_6e5h 1 . 7 . 2641 . 1 1 1 ASN H3 H 11.969 -4.440 -1.886 . . . 1.0 . . . . . . . . . . . . A . 1 ASN H3 . . . . . . . . . c30496_6e5h 1 . 7 . 2642 . 1 1 1 ASN HA H 11.478 -2.272 0.062 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HA . . . . . . . . . c30496_6e5h 1 . 7 . 2643 . 1 1 1 ASN HB2 H 12.692 -2.230 -2.705 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HB2 . . . . . . . . . c30496_6e5h 1 . 7 . 2644 . 1 1 1 ASN HB3 H 12.133 -0.788 -1.865 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HB3 . . . . . . . . . c30496_6e5h 1 . 7 . 2645 . 1 1 1 ASN HD21 H 14.175 0.116 -1.846 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HD21 . . . . . . . . . c30496_6e5h 1 . 7 . 2646 . 1 1 1 ASN HD22 H 15.438 -0.468 -0.816 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HD22 . . . . . . . . . c30496_6e5h 1 . 7 . 2647 . 1 1 1 ASN N N 11.948 -4.049 -0.923 . . . 1.0 . . . . . . . . . . . . A . 1 ASN N . . . . . . . . . c30496_6e5h 1 . 7 . 2648 . 1 1 1 ASN ND2 N 14.564 -0.564 -1.254 . . . 1.0 . . . . . . . . . . . . A . 1 ASN ND2 . . . . . . . . . c30496_6e5h 1 . 7 . 2649 . 1 1 1 ASN O O 9.697 -1.369 -1.862 . . . 1.0 . . . . . . . . . . . . A . 1 ASN O . . . . . . . . . c30496_6e5h 1 . 7 . 2650 . 1 1 1 ASN OD1 O 14.287 -2.577 -0.309 . . . 1.0 . . . . . . . . . . . . A . 1 ASN OD1 . . . . . . . . . c30496_6e5h 1 . 7 . 2651 . 1 1 2 ASP C C 7.083 -3.416 -1.286 . . . 1.0 . . . . . . . . . . . . A . 2 ASP C . . . . . . . . . c30496_6e5h 1 . 7 . 2652 . 1 1 2 ASP CA C 8.132 -3.574 -2.383 . . . 1.0 . . . . . . . . . . . . A . 2 ASP CA . . . . . . . . . c30496_6e5h 1 . 7 . 2653 . 1 1 2 ASP CB C 7.882 -4.850 -3.207 . . . 1.0 . . . . . . . . . . . . A . 2 ASP CB . . . . . . . . . c30496_6e5h 1 . 7 . 2654 . 1 1 2 ASP CG C 8.025 -6.132 -2.400 . . . 1.0 . . . . . . . . . . . . A . 2 ASP CG . . . . . . . . . c30496_6e5h 1 . 7 . 2655 . 1 1 2 ASP H H 9.870 -4.458 -1.570 . . . 1.0 . . . . . . . . . . . . A . 2 ASP H . . . . . . . . . c30496_6e5h 1 . 7 . 2656 . 1 1 2 ASP HA H 8.074 -2.717 -3.039 . . . 1.0 . . . . . . . . . . . . A . 2 ASP HA . . . . . . . . . c30496_6e5h 1 . 7 . 2657 . 1 1 2 ASP HB2 H 6.883 -4.815 -3.609 . . . 1.0 . . . . . . . . . . . . A . 2 ASP HB2 . . . . . . . . . c30496_6e5h 1 . 7 . 2658 . 1 1 2 ASP HB3 H 8.588 -4.882 -4.023 . . . 1.0 . . . . . . . . . . . . A . 2 ASP HB3 . . . . . . . . . c30496_6e5h 1 . 7 . 2659 . 1 1 2 ASP N N 9.469 -3.594 -1.805 . . . 1.0 . . . . . . . . . . . . A . 2 ASP N . . . . . . . . . c30496_6e5h 1 . 7 . 2660 . 1 1 2 ASP O O 6.137 -4.196 -1.185 . . . 1.0 . . . . . . . . . . . . A . 2 ASP O . . . . . . . . . c30496_6e5h 1 . 7 . 2661 . 1 1 2 ASP OD1 O 9.096 -6.345 -1.792 . . . 1.0 . . . . . . . . . . . . A . 2 ASP OD1 . . . . . . . . . c30496_6e5h 1 . 7 . 2662 . 1 1 2 ASP OD2 O 7.063 -6.928 -2.358 . . . 1.0 . . . . . . . . . . . . A . 2 ASP OD2 . . . . . . . . . c30496_6e5h 1 . 7 . 2663 . 1 1 3 LYS C C 4.942 -1.923 0.237 . . . 1.0 . . . . . . . . . . . . A . 3 LYS C . . . . . . . . . c30496_6e5h 1 . 7 . 2664 . 1 1 3 LYS CA C 6.387 -2.127 0.670 . . . 1.0 . . . . . . . . . . . . A . 3 LYS CA . . . . . . . . . c30496_6e5h 1 . 7 . 2665 . 1 1 3 LYS CB C 6.865 -0.902 1.451 . . . 1.0 . . . . . . . . . . . . A . 3 LYS CB . . . . . . . . . c30496_6e5h 1 . 7 . 2666 . 1 1 3 LYS CD C 8.681 0.205 2.796 . . . 1.0 . . . . . . . . . . . . A . 3 LYS CD . . . . . . . . . c30496_6e5h 1 . 7 . 2667 . 1 1 3 LYS CE C 7.735 0.527 3.944 . . . 1.0 . . . . . . . . . . . . A . 3 LYS CE . . . . . . . . . c30496_6e5h 1 . 7 . 2668 . 1 1 3 LYS CG C 8.253 -1.054 2.053 . . . 1.0 . . . . . . . . . . . . A . 3 LYS CG . . . . . . . . . c30496_6e5h 1 . 7 . 2669 . 1 1 3 LYS H H 7.971 -1.736 -0.678 . . . 1.0 . . . . . . . . . . . . A . 3 LYS H . . . . . . . . . c30496_6e5h 1 . 7 . 2670 . 1 1 3 LYS HA H 6.438 -2.993 1.310 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HA . . . . . . . . . c30496_6e5h 1 . 7 . 2671 . 1 1 3 LYS HB2 H 6.877 -0.051 0.788 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HB2 . . . . . . . . . c30496_6e5h 1 . 7 . 2672 . 1 1 3 LYS HB3 H 6.169 -0.712 2.253 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HB3 . . . . . . . . . c30496_6e5h 1 . 7 . 2673 . 1 1 3 LYS HD2 H 9.673 0.057 3.192 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HD2 . . . . . . . . . c30496_6e5h 1 . 7 . 2674 . 1 1 3 LYS HD3 H 8.689 1.035 2.103 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HD3 . . . . . . . . . c30496_6e5h 1 . 7 . 2675 . 1 1 3 LYS HE2 H 6.739 0.656 3.548 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HE2 . . . . . . . . . c30496_6e5h 1 . 7 . 2676 . 1 1 3 LYS HE3 H 7.741 -0.300 4.637 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HE3 . . . . . . . . . c30496_6e5h 1 . 7 . 2677 . 1 1 3 LYS HG2 H 8.247 -1.883 2.745 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HG2 . . . . . . . . . c30496_6e5h 1 . 7 . 2678 . 1 1 3 LYS HG3 H 8.960 -1.251 1.260 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HG3 . . . . . . . . . c30496_6e5h 1 . 7 . 2679 . 1 1 3 LYS HZ1 H 9.069 1.646 5.088 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HZ1 . . . . . . . . . c30496_6e5h 1 . 7 . 2680 . 1 1 3 LYS HZ2 H 7.446 1.969 5.423 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HZ2 . . . . . . . . . c30496_6e5h 1 . 7 . 2681 . 1 1 3 LYS HZ3 H 8.153 2.571 4.008 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HZ3 . . . . . . . . . c30496_6e5h 1 . 7 . 2682 . 1 1 3 LYS N N 7.250 -2.370 -0.482 . . . 1.0 . . . . . . . . . . . . A . 3 LYS N . . . . . . . . . c30496_6e5h 1 . 7 . 2683 . 1 1 3 LYS NZ N 8.127 1.765 4.666 . . . 1.0 . . . . . . . . . . . . A . 3 LYS NZ . . . . . . . . . c30496_6e5h 1 . 7 . 2684 . 1 1 3 LYS O O 4.017 -2.463 0.846 . . . 1.0 . . . . . . . . . . . . A . 3 LYS O . . . . . . . . . c30496_6e5h 1 . 7 . 2685 . 1 1 4 CYS C C 2.766 -2.173 -1.812 . . . 1.0 . . . . . . . . . . . . A . 4 CYS C . . . . . . . . . c30496_6e5h 1 . 7 . 2686 . 1 1 4 CYS CA C 3.426 -0.878 -1.342 . . . 1.0 . . . . . . . . . . . . A . 4 CYS CA . . . . . . . . . c30496_6e5h 1 . 7 . 2687 . 1 1 4 CYS CB C 3.506 0.129 -2.492 . . . 1.0 . . . . . . . . . . . . A . 4 CYS CB . . . . . . . . . c30496_6e5h 1 . 7 . 2688 . 1 1 4 CYS H H 5.535 -0.752 -1.267 . . . 1.0 . . . . . . . . . . . . A . 4 CYS H . . . . . . . . . c30496_6e5h 1 . 7 . 2689 . 1 1 4 CYS HA H 2.838 -0.456 -0.543 . . . 1.0 . . . . . . . . . . . . A . 4 CYS HA . . . . . . . . . c30496_6e5h 1 . 7 . 2690 . 1 1 4 CYS HB2 H 3.980 1.030 -2.136 . . . 1.0 . . . . . . . . . . . . A . 4 CYS HB2 . . . . . . . . . c30496_6e5h 1 . 7 . 2691 . 1 1 4 CYS HB3 H 4.103 -0.294 -3.285 . . . 1.0 . . . . . . . . . . . . A . 4 CYS HB3 . . . . . . . . . c30496_6e5h 1 . 7 . 2692 . 1 1 4 CYS N N 4.756 -1.149 -0.821 . . . 1.0 . . . . . . . . . . . . A . 4 CYS N . . . . . . . . . c30496_6e5h 1 . 7 . 2693 . 1 1 4 CYS O O 1.573 -2.389 -1.601 . . . 1.0 . . . . . . . . . . . . A . 4 CYS O . . . . . . . . . c30496_6e5h 1 . 7 . 2694 . 1 1 4 CYS SG S 1.890 0.594 -3.199 . . . 1.0 . . . . . . . . . . . . A . 4 CYS SG . . . . . . . . . c30496_6e5h 1 . 7 . 2695 . 1 1 5 LYS C C 2.680 -5.212 -1.725 . . . 1.0 . . . . . . . . . . . . A . 5 LYS C . . . . . . . . . c30496_6e5h 1 . 7 . 2696 . 1 1 5 LYS CA C 3.075 -4.326 -2.900 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CA . . . . . . . . . c30496_6e5h 1 . 7 . 2697 . 1 1 5 LYS CB C 4.150 -5.020 -3.742 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CB . . . . . . . . . c30496_6e5h 1 . 7 . 2698 . 1 1 5 LYS CD C 2.687 -6.082 -5.497 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CD . . . . . . . . . c30496_6e5h 1 . 7 . 2699 . 1 1 5 LYS CE C 2.272 -7.385 -6.158 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CE . . . . . . . . . c30496_6e5h 1 . 7 . 2700 . 1 1 5 LYS CG C 3.693 -6.322 -4.383 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CG . . . . . . . . . c30496_6e5h 1 . 7 . 2701 . 1 1 5 LYS H H 4.511 -2.819 -2.538 . . . 1.0 . . . . . . . . . . . . A . 5 LYS H . . . . . . . . . c30496_6e5h 1 . 7 . 2702 . 1 1 5 LYS HA H 2.207 -4.145 -3.511 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HA . . . . . . . . . c30496_6e5h 1 . 7 . 2703 . 1 1 5 LYS HB2 H 4.463 -4.350 -4.529 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HB2 . . . . . . . . . c30496_6e5h 1 . 7 . 2704 . 1 1 5 LYS HB3 H 4.998 -5.237 -3.109 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HB3 . . . . . . . . . c30496_6e5h 1 . 7 . 2705 . 1 1 5 LYS HD2 H 1.809 -5.607 -5.084 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HD2 . . . . . . . . . c30496_6e5h 1 . 7 . 2706 . 1 1 5 LYS HD3 H 3.131 -5.439 -6.240 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HD3 . . . . . . . . . c30496_6e5h 1 . 7 . 2707 . 1 1 5 LYS HE2 H 3.158 -7.902 -6.496 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HE2 . . . . . . . . . c30496_6e5h 1 . 7 . 2708 . 1 1 5 LYS HE3 H 1.759 -7.995 -5.429 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HE3 . . . . . . . . . c30496_6e5h 1 . 7 . 2709 . 1 1 5 LYS HG2 H 4.552 -6.828 -4.794 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HG2 . . . . . . . . . c30496_6e5h 1 . 7 . 2710 . 1 1 5 LYS HG3 H 3.237 -6.941 -3.625 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HG3 . . . . . . . . . c30496_6e5h 1 . 7 . 2711 . 1 1 5 LYS HZ1 H 1.111 -8.063 -7.750 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HZ1 . . . . . . . . . c30496_6e5h 1 . 7 . 2712 . 1 1 5 LYS HZ2 H 1.847 -6.568 -8.029 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HZ2 . . . . . . . . . c30496_6e5h 1 . 7 . 2713 . 1 1 5 LYS HZ3 H 0.504 -6.669 -7.007 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HZ3 . . . . . . . . . c30496_6e5h 1 . 7 . 2714 . 1 1 5 LYS N N 3.564 -3.043 -2.418 . . . 1.0 . . . . . . . . . . . . A . 5 LYS N . . . . . . . . . c30496_6e5h 1 . 7 . 2715 . 1 1 5 LYS NZ N 1.372 -7.156 -7.316 . . . 1.0 . . . . . . . . . . . . A . 5 LYS NZ . . . . . . . . . c30496_6e5h 1 . 7 . 2716 . 1 1 5 LYS O O 1.651 -5.884 -1.760 . . . 1.0 . . . . . . . . . . . . A . 5 LYS O . . . . . . . . . c30496_6e5h 1 . 7 . 2717 . 1 1 6 GLU C C 1.934 -5.515 1.167 . . . 1.0 . . . . . . . . . . . . A . 6 GLU C . . . . . . . . . c30496_6e5h 1 . 7 . 2718 . 1 1 6 GLU CA C 3.238 -5.962 0.527 . . . 1.0 . . . . . . . . . . . . A . 6 GLU CA . . . . . . . . . c30496_6e5h 1 . 7 . 2719 . 1 1 6 GLU CB C 4.376 -5.811 1.541 . . . 1.0 . . . . . . . . . . . . A . 6 GLU CB . . . . . . . . . c30496_6e5h 1 . 7 . 2720 . 1 1 6 GLU CD C 6.761 -6.336 2.163 . . . 1.0 . . . . . . . . . . . . A . 6 GLU CD . . . . . . . . . c30496_6e5h 1 . 7 . 2721 . 1 1 6 GLU CG C 5.708 -6.382 1.079 . . . 1.0 . . . . . . . . . . . . A . 6 GLU CG . . . . . . . . . c30496_6e5h 1 . 7 . 2722 . 1 1 6 GLU H H 4.313 -4.633 -0.726 . . . 1.0 . . . . . . . . . . . . A . 6 GLU H . . . . . . . . . c30496_6e5h 1 . 7 . 2723 . 1 1 6 GLU HA H 3.148 -7.001 0.246 . . . 1.0 . . . . . . . . . . . . A . 6 GLU HA . . . . . . . . . c30496_6e5h 1 . 7 . 2724 . 1 1 6 GLU HB2 H 4.515 -4.759 1.751 . . . 1.0 . . . . . . . . . . . . A . 6 GLU HB2 . . . . . . . . . c30496_6e5h 1 . 7 . 2725 . 1 1 6 GLU HB3 H 4.093 -6.312 2.455 . . . 1.0 . . . . . . . . . . . . A . 6 GLU HB3 . . . . . . . . . c30496_6e5h 1 . 7 . 2726 . 1 1 6 GLU HG2 H 5.562 -7.408 0.784 . . . 1.0 . . . . . . . . . . . . A . 6 GLU HG2 . . . . . . . . . c30496_6e5h 1 . 7 . 2727 . 1 1 6 GLU HG3 H 6.060 -5.812 0.231 . . . 1.0 . . . . . . . . . . . . A . 6 GLU HG3 . . . . . . . . . c30496_6e5h 1 . 7 . 2728 . 1 1 6 GLU N N 3.503 -5.189 -0.681 . . . 1.0 . . . . . . . . . . . . A . 6 GLU N . . . . . . . . . c30496_6e5h 1 . 7 . 2729 . 1 1 6 GLU O O 1.116 -6.339 1.572 . . . 1.0 . . . . . . . . . . . . A . 6 GLU O . . . . . . . . . c30496_6e5h 1 . 7 . 2730 . 1 1 6 GLU OE1 O 6.938 -7.347 2.872 . . . 1.0 . . . . . . . . . . . . A . 6 GLU OE1 . . . . . . . . . c30496_6e5h 1 . 7 . 2731 . 1 1 6 GLU OE2 O 7.424 -5.286 2.311 . . . 1.0 . . . . . . . . . . . . A . 6 GLU OE2 . . . . . . . . . c30496_6e5h 1 . 7 . 2732 . 1 1 7 LEU C C -0.681 -3.969 0.983 . . . 1.0 . . . . . . . . . . . . A . 7 LEU C . . . . . . . . . c30496_6e5h 1 . 7 . 2733 . 1 1 7 LEU CA C 0.538 -3.652 1.836 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CA . . . . . . . . . c30496_6e5h 1 . 7 . 2734 . 1 1 7 LEU CB C 0.685 -2.145 2.025 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CB . . . . . . . . . c30496_6e5h 1 . 7 . 2735 . 1 1 7 LEU CD1 C 1.872 -0.206 3.087 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CD1 . . . . . . . . . c30496_6e5h 1 . 7 . 2736 . 1 1 7 LEU CD2 C 1.604 -2.332 4.363 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CD2 . . . . . . . . . c30496_6e5h 1 . 7 . 2737 . 1 1 7 LEU CG C 1.805 -1.719 2.982 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CG . . . . . . . . . c30496_6e5h 1 . 7 . 2738 . 1 1 7 LEU H H 2.429 -3.598 0.886 . . . 1.0 . . . . . . . . . . . . A . 7 LEU H . . . . . . . . . c30496_6e5h 1 . 7 . 2739 . 1 1 7 LEU HA H 0.407 -4.111 2.803 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HA . . . . . . . . . c30496_6e5h 1 . 7 . 2740 . 1 1 7 LEU HB2 H 0.877 -1.704 1.059 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HB2 . . . . . . . . . c30496_6e5h 1 . 7 . 2741 . 1 1 7 LEU HB3 H -0.247 -1.758 2.399 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HB3 . . . . . . . . . c30496_6e5h 1 . 7 . 2742 . 1 1 7 LEU HD11 H 2.049 0.217 2.108 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD11 . . . . . . . . . c30496_6e5h 1 . 7 . 2743 . 1 1 7 LEU HD12 H 2.677 0.074 3.749 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD12 . . . . . . . . . c30496_6e5h 1 . 7 . 2744 . 1 1 7 LEU HD13 H 0.938 0.172 3.478 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD13 . . . . . . . . . c30496_6e5h 1 . 7 . 2745 . 1 1 7 LEU HD21 H 1.663 -3.408 4.295 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD21 . . . . . . . . . c30496_6e5h 1 . 7 . 2746 . 1 1 7 LEU HD22 H 0.636 -2.049 4.746 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD22 . . . . . . . . . c30496_6e5h 1 . 7 . 2747 . 1 1 7 LEU HD23 H 2.372 -1.972 5.030 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD23 . . . . . . . . . c30496_6e5h 1 . 7 . 2748 . 1 1 7 LEU HG H 2.750 -2.070 2.594 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HG . . . . . . . . . c30496_6e5h 1 . 7 . 2749 . 1 1 7 LEU N N 1.741 -4.207 1.241 . . . 1.0 . . . . . . . . . . . . A . 7 LEU N . . . . . . . . . c30496_6e5h 1 . 7 . 2750 . 1 1 7 LEU O O -1.750 -4.271 1.507 . . . 1.0 . . . . . . . . . . . . A . 7 LEU O . . . . . . . . . c30496_6e5h 1 . 7 . 2751 . 1 1 8 LYS C C -1.959 -5.739 -1.114 . . . 1.0 . . . . . . . . . . . . A . 8 LYS C . . . . . . . . . c30496_6e5h 1 . 7 . 2752 . 1 1 8 LYS CA C -1.590 -4.269 -1.248 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CA . . . . . . . . . c30496_6e5h 1 . 7 . 2753 . 1 1 8 LYS CB C -1.200 -3.966 -2.695 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CB . . . . . . . . . c30496_6e5h 1 . 7 . 2754 . 1 1 8 LYS CD C -0.791 -2.241 -4.479 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CD . . . . . . . . . c30496_6e5h 1 . 7 . 2755 . 1 1 8 LYS CE C -1.666 -2.988 -5.474 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CE . . . . . . . . . c30496_6e5h 1 . 7 . 2756 . 1 1 8 LYS CG C -1.236 -2.488 -3.047 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CG . . . . . . . . . c30496_6e5h 1 . 7 . 2757 . 1 1 8 LYS H H 0.360 -3.642 -0.692 . . . 1.0 . . . . . . . . . . . . A . 8 LYS H . . . . . . . . . c30496_6e5h 1 . 7 . 2758 . 1 1 8 LYS HA H -2.450 -3.672 -0.986 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HA . . . . . . . . . c30496_6e5h 1 . 7 . 2759 . 1 1 8 LYS HB2 H -0.199 -4.331 -2.868 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HB2 . . . . . . . . . c30496_6e5h 1 . 7 . 2760 . 1 1 8 LYS HB3 H -1.879 -4.488 -3.353 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HB3 . . . . . . . . . c30496_6e5h 1 . 7 . 2761 . 1 1 8 LYS HD2 H -0.852 -1.185 -4.685 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HD2 . . . . . . . . . c30496_6e5h 1 . 7 . 2762 . 1 1 8 LYS HD3 H 0.229 -2.574 -4.589 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HD3 . . . . . . . . . c30496_6e5h 1 . 7 . 2763 . 1 1 8 LYS HE2 H -1.554 -4.048 -5.308 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HE2 . . . . . . . . . c30496_6e5h 1 . 7 . 2764 . 1 1 8 LYS HE3 H -2.695 -2.707 -5.310 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HE3 . . . . . . . . . c30496_6e5h 1 . 7 . 2765 . 1 1 8 LYS HG2 H -2.246 -2.126 -2.931 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HG2 . . . . . . . . . c30496_6e5h 1 . 7 . 2766 . 1 1 8 LYS HG3 H -0.580 -1.949 -2.380 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HG3 . . . . . . . . . c30496_6e5h 1 . 7 . 2767 . 1 1 8 LYS HZ1 H -0.307 -2.938 -7.055 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ1 . . . . . . . . . c30496_6e5h 1 . 7 . 2768 . 1 1 8 LYS HZ2 H -1.422 -1.667 -7.068 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ2 . . . . . . . . . c30496_6e5h 1 . 7 . 2769 . 1 1 8 LYS HZ3 H -1.904 -3.219 -7.531 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ3 . . . . . . . . . c30496_6e5h 1 . 7 . 2770 . 1 1 8 LYS N N -0.512 -3.921 -0.330 . . . 1.0 . . . . . . . . . . . . A . 8 LYS N . . . . . . . . . c30496_6e5h 1 . 7 . 2771 . 1 1 8 LYS NZ N -1.299 -2.682 -6.879 . . . 1.0 . . . . . . . . . . . . A . 8 LYS NZ . . . . . . . . . c30496_6e5h 1 . 7 . 2772 . 1 1 8 LYS O O -3.132 -6.105 -1.201 . . . 1.0 . . . . . . . . . . . . A . 8 LYS O . . . . . . . . . c30496_6e5h 1 . 7 . 2773 . 1 1 9 LYS C C -1.826 -8.290 0.603 . . . 1.0 . . . . . . . . . . . . A . 9 LYS C . . . . . . . . . c30496_6e5h 1 . 7 . 2774 . 1 1 9 LYS CA C -1.156 -8.001 -0.740 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CA . . . . . . . . . c30496_6e5h 1 . 7 . 2775 . 1 1 9 LYS CB C 0.190 -8.728 -0.831 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CB . . . . . . . . . c30496_6e5h 1 . 7 . 2776 . 1 1 9 LYS CD C 1.446 -10.909 -0.819 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CD . . . . . . . . . c30496_6e5h 1 . 7 . 2777 . 1 1 9 LYS CE C 2.234 -10.621 0.448 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CE . . . . . . . . . c30496_6e5h 1 . 7 . 2778 . 1 1 9 LYS CG C 0.078 -10.245 -0.796 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CG . . . . . . . . . c30496_6e5h 1 . 7 . 2779 . 1 1 9 LYS H H -0.034 -6.218 -0.893 . . . 1.0 . . . . . . . . . . . . A . 9 LYS H . . . . . . . . . c30496_6e5h 1 . 7 . 2780 . 1 1 9 LYS HA H -1.800 -8.343 -1.534 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HA . . . . . . . . . c30496_6e5h 1 . 7 . 2781 . 1 1 9 LYS HB2 H 0.674 -8.447 -1.756 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HB2 . . . . . . . . . c30496_6e5h 1 . 7 . 2782 . 1 1 9 LYS HB3 H 0.808 -8.415 -0.003 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HB3 . . . . . . . . . c30496_6e5h 1 . 7 . 2783 . 1 1 9 LYS HD2 H 1.316 -11.977 -0.915 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HD2 . . . . . . . . . c30496_6e5h 1 . 7 . 2784 . 1 1 9 LYS HD3 H 2.000 -10.535 -1.668 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HD3 . . . . . . . . . c30496_6e5h 1 . 7 . 2785 . 1 1 9 LYS HE2 H 3.195 -11.109 0.379 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HE2 . . . . . . . . . c30496_6e5h 1 . 7 . 2786 . 1 1 9 LYS HE3 H 2.378 -9.555 0.534 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HE3 . . . . . . . . . c30496_6e5h 1 . 7 . 2787 . 1 1 9 LYS HG2 H -0.438 -10.538 0.106 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HG2 . . . . . . . . . c30496_6e5h 1 . 7 . 2788 . 1 1 9 LYS HG3 H -0.486 -10.573 -1.657 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HG3 . . . . . . . . . c30496_6e5h 1 . 7 . 2789 . 1 1 9 LYS HZ1 H 2.070 -10.866 2.514 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HZ1 . . . . . . . . . c30496_6e5h 1 . 7 . 2790 . 1 1 9 LYS HZ2 H 1.426 -12.146 1.621 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HZ2 . . . . . . . . . c30496_6e5h 1 . 7 . 2791 . 1 1 9 LYS HZ3 H 0.586 -10.686 1.727 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HZ3 . . . . . . . . . c30496_6e5h 1 . 7 . 2792 . 1 1 9 LYS N N -0.951 -6.573 -0.912 . . . 1.0 . . . . . . . . . . . . A . 9 LYS N . . . . . . . . . c30496_6e5h 1 . 7 . 2793 . 1 1 9 LYS NZ N 1.530 -11.114 1.660 . . . 1.0 . . . . . . . . . . . . A . 9 LYS NZ . . . . . . . . . c30496_6e5h 1 . 7 . 2794 . 1 1 9 LYS O O -2.688 -9.164 0.708 . . . 1.0 . . . . . . . . . . . . A . 9 LYS O . . . . . . . . . c30496_6e5h 1 . 7 . 2795 . 1 1 10 ARG C C -3.422 -7.264 3.015 . . . 1.0 . . . . . . . . . . . . A . 10 ARG C . . . . . . . . . c30496_6e5h 1 . 7 . 2796 . 1 1 10 ARG CA C -1.964 -7.706 2.964 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CA . . . . . . . . . c30496_6e5h 1 . 7 . 2797 . 1 1 10 ARG CB C -1.133 -6.895 3.959 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CB . . . . . . . . . c30496_6e5h 1 . 7 . 2798 . 1 1 10 ARG CD C -0.579 -6.368 6.345 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CD . . . . . . . . . c30496_6e5h 1 . 7 . 2799 . 1 1 10 ARG CG C -1.537 -7.089 5.410 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CG . . . . . . . . . c30496_6e5h 1 . 7 . 2800 . 1 1 10 ARG CZ C 1.874 -6.182 6.612 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CZ . . . . . . . . . c30496_6e5h 1 . 7 . 2801 . 1 1 10 ARG H H -0.720 -6.873 1.470 . . . 1.0 . . . . . . . . . . . . A . 10 ARG H . . . . . . . . . c30496_6e5h 1 . 7 . 2802 . 1 1 10 ARG HA H -1.906 -8.751 3.227 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HA . . . . . . . . . c30496_6e5h 1 . 7 . 2803 . 1 1 10 ARG HB2 H -0.097 -7.178 3.856 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HB2 . . . . . . . . . c30496_6e5h 1 . 7 . 2804 . 1 1 10 ARG HB3 H -1.234 -5.847 3.719 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HB3 . . . . . . . . . c30496_6e5h 1 . 7 . 2805 . 1 1 10 ARG HD2 H -0.616 -5.308 6.130 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HD2 . . . . . . . . . c30496_6e5h 1 . 7 . 2806 . 1 1 10 ARG HD3 H -0.890 -6.539 7.366 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HD3 . . . . . . . . . c30496_6e5h 1 . 7 . 2807 . 1 1 10 ARG HE H 0.926 -7.699 5.718 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HE . . . . . . . . . c30496_6e5h 1 . 7 . 2808 . 1 1 10 ARG HG2 H -2.533 -6.691 5.554 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HG2 . . . . . . . . . c30496_6e5h 1 . 7 . 2809 . 1 1 10 ARG HG3 H -1.530 -8.147 5.642 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HG3 . . . . . . . . . c30496_6e5h 1 . 7 . 2810 . 1 1 10 ARG HH11 H 2.559 -4.530 7.562 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HH11 . . . . . . . . . c30496_6e5h 1 . 7 . 2811 . 1 1 10 ARG HH12 H 0.837 -4.626 7.396 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HH12 . . . . . . . . . c30496_6e5h 1 . 7 . 2812 . 1 1 10 ARG HH21 H 3.197 -7.565 5.940 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HH21 . . . . . . . . . c30496_6e5h 1 . 7 . 2813 . 1 1 10 ARG HH22 H 3.895 -6.201 6.754 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HH22 . . . . . . . . . c30496_6e5h 1 . 7 . 2814 . 1 1 10 ARG N N -1.419 -7.547 1.622 . . . 1.0 . . . . . . . . . . . . A . 10 ARG N . . . . . . . . . c30496_6e5h 1 . 7 . 2815 . 1 1 10 ARG NE N 0.798 -6.838 6.179 . . . 1.0 . . . . . . . . . . . . A . 10 ARG NE . . . . . . . . . c30496_6e5h 1 . 7 . 2816 . 1 1 10 ARG NH1 N 1.746 -5.019 7.239 . . . 1.0 . . . . . . . . . . . . A . 10 ARG NH1 . . . . . . . . . c30496_6e5h 1 . 7 . 2817 . 1 1 10 ARG NH2 N 3.085 -6.689 6.416 . . . 1.0 . . . . . . . . . . . . A . 10 ARG NH2 . . . . . . . . . c30496_6e5h 1 . 7 . 2818 . 1 1 10 ARG O O -4.285 -7.976 3.533 . . . 1.0 . . . . . . . . . . . . A . 10 ARG O . . . . . . . . . c30496_6e5h 1 . 7 . 2819 . 1 1 11 TYR C C -5.804 -6.001 1.211 . . . 1.0 . . . . . . . . . . . . A . 11 TYR C . . . . . . . . . c30496_6e5h 1 . 7 . 2820 . 1 1 11 TYR CA C -5.041 -5.546 2.450 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CA . . . . . . . . . c30496_6e5h 1 . 7 . 2821 . 1 1 11 TYR CB C -4.991 -4.024 2.512 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CB . . . . . . . . . c30496_6e5h 1 . 7 . 2822 . 1 1 11 TYR CD1 C -5.178 -3.446 4.949 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CD1 . . . . . . . . . c30496_6e5h 1 . 7 . 2823 . 1 1 11 TYR CD2 C -3.101 -3.037 3.863 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CD2 . . . . . . . . . c30496_6e5h 1 . 7 . 2824 . 1 1 11 TYR CE1 C -4.661 -2.958 6.131 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CE1 . . . . . . . . . c30496_6e5h 1 . 7 . 2825 . 1 1 11 TYR CE2 C -2.575 -2.551 5.040 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CE2 . . . . . . . . . c30496_6e5h 1 . 7 . 2826 . 1 1 11 TYR CG C -4.410 -3.495 3.799 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CG . . . . . . . . . c30496_6e5h 1 . 7 . 2827 . 1 1 11 TYR CZ C -3.360 -2.512 6.170 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CZ . . . . . . . . . c30496_6e5h 1 . 7 . 2828 . 1 1 11 TYR H H -2.967 -5.583 2.035 . . . 1.0 . . . . . . . . . . . . A . 11 TYR H . . . . . . . . . c30496_6e5h 1 . 7 . 2829 . 1 1 11 TYR HA H -5.552 -5.913 3.327 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HA . . . . . . . . . c30496_6e5h 1 . 7 . 2830 . 1 1 11 TYR HB2 H -4.387 -3.655 1.697 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HB2 . . . . . . . . . c30496_6e5h 1 . 7 . 2831 . 1 1 11 TYR HB3 H -5.991 -3.638 2.417 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HB3 . . . . . . . . . c30496_6e5h 1 . 7 . 2832 . 1 1 11 TYR HD1 H -6.197 -3.799 4.914 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HD1 . . . . . . . . . c30496_6e5h 1 . 7 . 2833 . 1 1 11 TYR HD2 H -2.488 -3.070 2.973 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HD2 . . . . . . . . . c30496_6e5h 1 . 7 . 2834 . 1 1 11 TYR HE1 H -5.276 -2.929 7.017 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HE1 . . . . . . . . . c30496_6e5h 1 . 7 . 2835 . 1 1 11 TYR HE2 H -1.553 -2.202 5.069 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HE2 . . . . . . . . . c30496_6e5h 1 . 7 . 2836 . 1 1 11 TYR HH H -2.527 -1.118 7.207 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HH . . . . . . . . . c30496_6e5h 1 . 7 . 2837 . 1 1 11 TYR N N -3.694 -6.095 2.458 . . . 1.0 . . . . . . . . . . . . A . 11 TYR N . . . . . . . . . c30496_6e5h 1 . 7 . 2838 . 1 1 11 TYR O O -6.235 -5.181 0.392 . . . 1.0 . . . . . . . . . . . . A . 11 TYR O . . . . . . . . . c30496_6e5h 1 . 7 . 2839 . 1 1 11 TYR OH O -2.843 -2.022 7.346 . . . 1.0 . . . . . . . . . . . . A . 11 TYR OH . . . . . . . . . c30496_6e5h 1 . 7 . 2840 . 1 1 12 ABA C C -8.083 -7.345 -0.135 . . . 1.0 . . . . . . . . . . . . A . 12 AIB C . . . . . . . . . c30496_6e5h 1 . 7 . 2841 . 1 1 12 ABA CA C -6.666 -7.931 -0.041 . . . 1.0 . . . . . . . . . . . . A . 12 AIB CA . . . . . . . . . c30496_6e5h 1 . 7 . 2842 . 1 1 12 ABA H H -5.582 -7.898 1.783 . . . 1.0 . . . . . . . . . . . . A . 12 AIB H . . . . . . . . . c30496_6e5h 1 . 7 . 2843 . 1 1 12 ABA N N -5.957 -7.316 1.087 . . . 1.0 . . . . . . . . . . . . A . 12 AIB N . . . . . . . . . c30496_6e5h 1 . 7 . 2844 . 1 1 12 ABA O O -8.853 -7.418 0.824 . . . 1.0 . . . . . . . . . . . . A . 12 AIB O . . . . . . . . . c30496_6e5h 1 . 7 . 2845 . 1 1 13 GLY C C -9.830 -4.730 -1.192 . . . 1.0 . . . . . . . . . . . . A . 13 GLY C . . . . . . . . . c30496_6e5h 1 . 7 . 2846 . 1 1 13 GLY CA C -9.752 -6.218 -1.462 . . . 1.0 . . . . . . . . . . . . A . 13 GLY CA . . . . . . . . . c30496_6e5h 1 . 7 . 2847 . 1 1 13 GLY H H -7.766 -6.697 -2.003 . . . 1.0 . . . . . . . . . . . . A . 13 GLY H . . . . . . . . . c30496_6e5h 1 . 7 . 2848 . 1 1 13 GLY HA2 H -10.063 -6.402 -2.478 . . . 1.0 . . . . . . . . . . . . A . 13 GLY HA2 . . . . . . . . . c30496_6e5h 1 . 7 . 2849 . 1 1 13 GLY HA3 H -10.428 -6.728 -0.794 . . . 1.0 . . . . . . . . . . . . A . 13 GLY HA3 . . . . . . . . . c30496_6e5h 1 . 7 . 2850 . 1 1 13 GLY N N -8.421 -6.758 -1.276 . . . 1.0 . . . . . . . . . . . . A . 13 GLY N . . . . . . . . . c30496_6e5h 1 . 7 . 2851 . 1 1 13 GLY O O -10.826 -4.087 -1.521 . . . 1.0 . . . . . . . . . . . . A . 13 GLY O . . . . . . . . . c30496_6e5h 1 . 7 . 2852 . 1 1 14 CYS C C -7.790 -2.038 -1.226 . . . 1.0 . . . . . . . . . . . . A . 14 CYS C . . . . . . . . . c30496_6e5h 1 . 7 . 2853 . 1 1 14 CYS CA C -8.756 -2.754 -0.298 . . . 1.0 . . . . . . . . . . . . A . 14 CYS CA . . . . . . . . . c30496_6e5h 1 . 7 . 2854 . 1 1 14 CYS CB C -8.329 -2.524 1.149 . . . 1.0 . . . . . . . . . . . . A . 14 CYS CB . . . . . . . . . c30496_6e5h 1 . 7 . 2855 . 1 1 14 CYS H H -8.016 -4.734 -0.349 . . . 1.0 . . . . . . . . . . . . A . 14 CYS H . . . . . . . . . c30496_6e5h 1 . 7 . 2856 . 1 1 14 CYS HA H -9.748 -2.358 -0.443 . . . 1.0 . . . . . . . . . . . . A . 14 CYS HA . . . . . . . . . c30496_6e5h 1 . 7 . 2857 . 1 1 14 CYS HB2 H -7.302 -2.826 1.258 . . . 1.0 . . . . . . . . . . . . A . 14 CYS HB2 . . . . . . . . . c30496_6e5h 1 . 7 . 2858 . 1 1 14 CYS HB3 H -8.413 -1.470 1.374 . . . 1.0 . . . . . . . . . . . . A . 14 CYS HB3 . . . . . . . . . c30496_6e5h 1 . 7 . 2859 . 1 1 14 CYS N N -8.786 -4.176 -0.597 . . . 1.0 . . . . . . . . . . . . A . 14 CYS N . . . . . . . . . c30496_6e5h 1 . 7 . 2860 . 1 1 14 CYS O O -6.832 -2.633 -1.721 . . . 1.0 . . . . . . . . . . . . A . 14 CYS O . . . . . . . . . c30496_6e5h 1 . 7 . 2861 . 1 1 14 CYS SG S -9.312 -3.437 2.383 . . . 1.0 . . . . . . . . . . . . A . 14 CYS SG . . . . . . . . . c30496_6e5h 1 . 7 . 2862 . 1 1 15 GLU C C -6.054 0.625 -1.424 . . . 1.0 . . . . . . . . . . . . A . 15 GLU C . . . . . . . . . c30496_6e5h 1 . 7 . 2863 . 1 1 15 GLU CA C -7.168 0.053 -2.281 . . . 1.0 . . . . . . . . . . . . A . 15 GLU CA . . . . . . . . . c30496_6e5h 1 . 7 . 2864 . 1 1 15 GLU CB C -7.940 1.201 -2.924 . . . 1.0 . . . . . . . . . . . . A . 15 GLU CB . . . . . . . . . c30496_6e5h 1 . 7 . 2865 . 1 1 15 GLU CD C -9.936 1.946 -4.254 . . . 1.0 . . . . . . . . . . . . A . 15 GLU CD . . . . . . . . . c30496_6e5h 1 . 7 . 2866 . 1 1 15 GLU CG C -9.138 0.766 -3.748 . . . 1.0 . . . . . . . . . . . . A . 15 GLU CG . . . . . . . . . c30496_6e5h 1 . 7 . 2867 . 1 1 15 GLU H H -8.844 -0.353 -1.061 . . . 1.0 . . . . . . . . . . . . A . 15 GLU H . . . . . . . . . c30496_6e5h 1 . 7 . 2868 . 1 1 15 GLU HA H -6.741 -0.573 -3.049 . . . 1.0 . . . . . . . . . . . . A . 15 GLU HA . . . . . . . . . c30496_6e5h 1 . 7 . 2869 . 1 1 15 GLU HB2 H -8.289 1.859 -2.146 . . . 1.0 . . . . . . . . . . . . A . 15 GLU HB2 . . . . . . . . . c30496_6e5h 1 . 7 . 2870 . 1 1 15 GLU HB3 H -7.269 1.748 -3.568 . . . 1.0 . . . . . . . . . . . . A . 15 GLU HB3 . . . . . . . . . c30496_6e5h 1 . 7 . 2871 . 1 1 15 GLU HG2 H -8.792 0.196 -4.597 . . . 1.0 . . . . . . . . . . . . A . 15 GLU HG2 . . . . . . . . . c30496_6e5h 1 . 7 . 2872 . 1 1 15 GLU HG3 H -9.780 0.150 -3.137 . . . 1.0 . . . . . . . . . . . . A . 15 GLU HG3 . . . . . . . . . c30496_6e5h 1 . 7 . 2873 . 1 1 15 GLU N N -8.045 -0.762 -1.460 . . . 1.0 . . . . . . . . . . . . A . 15 GLU N . . . . . . . . . c30496_6e5h 1 . 7 . 2874 . 1 1 15 GLU O O -6.317 1.287 -0.422 . . . 1.0 . . . . . . . . . . . . A . 15 GLU O . . . . . . . . . c30496_6e5h 1 . 7 . 2875 . 1 1 15 GLU OE1 O -9.623 2.451 -5.351 . . . 1.0 . . . . . . . . . . . . A . 15 GLU OE1 . . . . . . . . . c30496_6e5h 1 . 7 . 2876 . 1 1 15 GLU OE2 O -10.890 2.367 -3.567 . . . 1.0 . . . . . . . . . . . . A . 15 GLU OE2 . . . . . . . . . c30496_6e5h 1 . 7 . 2877 . 1 1 16 VAL C C -2.949 1.936 -1.872 . . . 1.0 . . . . . . . . . . . . A . 16 VAL C . . . . . . . . . c30496_6e5h 1 . 7 . 2878 . 1 1 16 VAL CA C -3.692 0.888 -1.057 . . . 1.0 . . . . . . . . . . . . A . 16 VAL CA . . . . . . . . . c30496_6e5h 1 . 7 . 2879 . 1 1 16 VAL CB C -2.713 -0.221 -0.630 . . . 1.0 . . . . . . . . . . . . A . 16 VAL CB . . . . . . . . . c30496_6e5h 1 . 7 . 2880 . 1 1 16 VAL CG1 C -1.555 0.364 0.165 . . . 1.0 . . . . . . . . . . . . A . 16 VAL CG1 . . . . . . . . . c30496_6e5h 1 . 7 . 2881 . 1 1 16 VAL CG2 C -3.435 -1.285 0.181 . . . 1.0 . . . . . . . . . . . . A . 16 VAL CG2 . . . . . . . . . c30496_6e5h 1 . 7 . 2882 . 1 1 16 VAL H H -4.661 -0.184 -2.596 . . . 1.0 . . . . . . . . . . . . A . 16 VAL H . . . . . . . . . c30496_6e5h 1 . 7 . 2883 . 1 1 16 VAL HA H -4.079 1.357 -0.164 . . . 1.0 . . . . . . . . . . . . A . 16 VAL HA . . . . . . . . . c30496_6e5h 1 . 7 . 2884 . 1 1 16 VAL HB H -2.314 -0.683 -1.521 . . . 1.0 . . . . . . . . . . . . A . 16 VAL HB . . . . . . . . . c30496_6e5h 1 . 7 . 2885 . 1 1 16 VAL HG11 H -1.933 0.817 1.070 . . . 1.0 . . . . . . . . . . . . A . 16 VAL HG11 . . . . . . . . . c30496_6e5h 1 . 7 . 2886 . 1 1 16 VAL HG12 H -1.053 1.114 -0.431 . . . 1.0 . . . . . . . . . . . . A . 16 VAL HG12 . . . . . . . . . c30496_6e5h 1 . 7 . 2887 . 1 1 16 VAL HG13 H -0.860 -0.421 0.418 . . . 1.0 . . . . . . . . . . . . A . 16 VAL HG13 . . . . . . . . . c30496_6e5h 1 . 7 . 2888 . 1 1 16 VAL HG21 H -4.168 -1.777 -0.441 . . . 1.0 . . . . . . . . . . . . A . 16 VAL HG21 . . . . . . . . . c30496_6e5h 1 . 7 . 2889 . 1 1 16 VAL HG22 H -3.928 -0.822 1.022 . . . 1.0 . . . . . . . . . . . . A . 16 VAL HG22 . . . . . . . . . c30496_6e5h 1 . 7 . 2890 . 1 1 16 VAL HG23 H -2.720 -2.012 0.539 . . . 1.0 . . . . . . . . . . . . A . 16 VAL HG23 . . . . . . . . . c30496_6e5h 1 . 7 . 2891 . 1 1 16 VAL N N -4.819 0.366 -1.801 . . . 1.0 . . . . . . . . . . . . A . 16 VAL N . . . . . . . . . c30496_6e5h 1 . 7 . 2892 . 1 1 16 VAL O O -2.431 1.657 -2.955 . . . 1.0 . . . . . . . . . . . . A . 16 VAL O . . . . . . . . . c30496_6e5h 1 . 7 . 2893 . 1 1 17 ARG C C -0.900 4.498 -1.333 . . . 1.0 . . . . . . . . . . . . A . 17 ARG C . . . . . . . . . c30496_6e5h 1 . 7 . 2894 . 1 1 17 ARG CA C -2.246 4.248 -1.994 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CA . . . . . . . . . c30496_6e5h 1 . 7 . 2895 . 1 1 17 ARG CB C -3.118 5.499 -1.911 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CB . . . . . . . . . c30496_6e5h 1 . 7 . 2896 . 1 1 17 ARG CD C -3.454 7.915 -2.475 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CD . . . . . . . . . c30496_6e5h 1 . 7 . 2897 . 1 1 17 ARG CG C -2.556 6.701 -2.653 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CG . . . . . . . . . c30496_6e5h 1 . 7 . 2898 . 1 1 17 ARG CZ C -5.920 7.928 -2.254 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CZ . . . . . . . . . c30496_6e5h 1 . 7 . 2899 . 1 1 17 ARG H H -3.345 3.289 -0.471 . . . 1.0 . . . . . . . . . . . . A . 17 ARG H . . . . . . . . . c30496_6e5h 1 . 7 . 2900 . 1 1 17 ARG HA H -2.089 3.989 -3.029 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HA . . . . . . . . . c30496_6e5h 1 . 7 . 2901 . 1 1 17 ARG HB2 H -4.089 5.273 -2.325 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HB2 . . . . . . . . . c30496_6e5h 1 . 7 . 2902 . 1 1 17 ARG HB3 H -3.234 5.770 -0.874 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HB3 . . . . . . . . . c30496_6e5h 1 . 7 . 2903 . 1 1 17 ARG HD2 H -3.492 8.169 -1.427 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HD2 . . . . . . . . . c30496_6e5h 1 . 7 . 2904 . 1 1 17 ARG HD3 H -3.034 8.741 -3.030 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HD3 . . . . . . . . . c30496_6e5h 1 . 7 . 2905 . 1 1 17 ARG HE H -4.913 7.264 -3.851 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HE . . . . . . . . . c30496_6e5h 1 . 7 . 2906 . 1 1 17 ARG HG2 H -1.576 6.927 -2.261 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HG2 . . . . . . . . . c30496_6e5h 1 . 7 . 2907 . 1 1 17 ARG HG3 H -2.484 6.465 -3.704 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HG3 . . . . . . . . . c30496_6e5h 1 . 7 . 2908 . 1 1 17 ARG HH11 H -4.943 8.687 -0.632 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH11 . . . . . . . . . c30496_6e5h 1 . 7 . 2909 . 1 1 17 ARG HH12 H -6.680 8.663 -0.524 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH12 . . . . . . . . . c30496_6e5h 1 . 7 . 2910 . 1 1 17 ARG HH21 H -7.181 7.240 -3.682 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH21 . . . . . . . . . c30496_6e5h 1 . 7 . 2911 . 1 1 17 ARG HH22 H -7.945 7.838 -2.244 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH22 . . . . . . . . . c30496_6e5h 1 . 7 . 2912 . 1 1 17 ARG N N -2.913 3.141 -1.342 . . . 1.0 . . . . . . . . . . . . A . 17 ARG N . . . . . . . . . c30496_6e5h 1 . 7 . 2913 . 1 1 17 ARG NE N -4.816 7.659 -2.953 . . . 1.0 . . . . . . . . . . . . A . 17 ARG NE . . . . . . . . . c30496_6e5h 1 . 7 . 2914 . 1 1 17 ARG NH1 N -5.842 8.467 -1.042 . . . 1.0 . . . . . . . . . . . . A . 17 ARG NH1 . . . . . . . . . c30496_6e5h 1 . 7 . 2915 . 1 1 17 ARG NH2 N -7.110 7.646 -2.768 . . . 1.0 . . . . . . . . . . . . A . 17 ARG NH2 . . . . . . . . . c30496_6e5h 1 . 7 . 2916 . 1 1 17 ARG O O -0.833 4.839 -0.152 . . . 1.0 . . . . . . . . . . . . A . 17 ARG O . . . . . . . . . c30496_6e5h 1 . 7 . 2917 . 1 1 18 CYS C C 2.129 5.776 -2.096 . . . 1.0 . . . . . . . . . . . . A . 18 CYS C . . . . . . . . . c30496_6e5h 1 . 7 . 2918 . 1 1 18 CYS CA C 1.506 4.492 -1.568 . . . 1.0 . . . . . . . . . . . . A . 18 CYS CA . . . . . . . . . c30496_6e5h 1 . 7 . 2919 . 1 1 18 CYS CB C 2.384 3.292 -1.923 . . . 1.0 . . . . . . . . . . . . A . 18 CYS CB . . . . . . . . . c30496_6e5h 1 . 7 . 2920 . 1 1 18 CYS H H 0.052 4.030 -3.020 . . . 1.0 . . . . . . . . . . . . A . 18 CYS H . . . . . . . . . c30496_6e5h 1 . 7 . 2921 . 1 1 18 CYS HA H 1.431 4.562 -0.495 . . . 1.0 . . . . . . . . . . . . A . 18 CYS HA . . . . . . . . . c30496_6e5h 1 . 7 . 2922 . 1 1 18 CYS HB2 H 3.419 3.598 -1.893 . . . 1.0 . . . . . . . . . . . . A . 18 CYS HB2 . . . . . . . . . c30496_6e5h 1 . 7 . 2923 . 1 1 18 CYS HB3 H 2.223 2.513 -1.195 . . . 1.0 . . . . . . . . . . . . A . 18 CYS HB3 . . . . . . . . . c30496_6e5h 1 . 7 . 2924 . 1 1 18 CYS N N 0.166 4.305 -2.087 . . . 1.0 . . . . . . . . . . . . A . 18 CYS N . . . . . . . . . c30496_6e5h 1 . 7 . 2925 . 1 1 18 CYS O O 2.240 5.972 -3.309 . . . 1.0 . . . . . . . . . . . . A . 18 CYS O . . . . . . . . . c30496_6e5h 1 . 7 . 2926 . 1 1 18 CYS SG S 2.071 2.582 -3.572 . . . 1.0 . . . . . . . . . . . . A . 18 CYS SG . . . . . . . . . c30496_6e5h 1 . 7 . 2927 . 1 1 19 ASP C C 4.432 8.030 -0.640 . . . 1.0 . . . . . . . . . . . . A . 19 ASP C . . . . . . . . . c30496_6e5h 1 . 7 . 2928 . 1 1 19 ASP CA C 3.219 7.873 -1.543 . . . 1.0 . . . . . . . . . . . . A . 19 ASP CA . . . . . . . . . c30496_6e5h 1 . 7 . 2929 . 1 1 19 ASP CB C 2.312 9.099 -1.423 . . . 1.0 . . . . . . . . . . . . A . 19 ASP CB . . . . . . . . . c30496_6e5h 1 . 7 . 2930 . 1 1 19 ASP CG C 2.968 10.345 -1.989 . . . 1.0 . . . . . . . . . . . . A . 19 ASP CG . . . . . . . . . c30496_6e5h 1 . 7 . 2931 . 1 1 19 ASP H H 2.333 6.477 -0.233 . . . 1.0 . . . . . . . . . . . . A . 19 ASP H . . . . . . . . . c30496_6e5h 1 . 7 . 2932 . 1 1 19 ASP HA H 3.552 7.776 -2.564 . . . 1.0 . . . . . . . . . . . . A . 19 ASP HA . . . . . . . . . c30496_6e5h 1 . 7 . 2933 . 1 1 19 ASP HB2 H 1.396 8.915 -1.964 . . . 1.0 . . . . . . . . . . . . A . 19 ASP HB2 . . . . . . . . . c30496_6e5h 1 . 7 . 2934 . 1 1 19 ASP HB3 H 2.086 9.270 -0.383 . . . 1.0 . . . . . . . . . . . . A . 19 ASP HB3 . . . . . . . . . c30496_6e5h 1 . 7 . 2935 . 1 1 19 ASP N N 2.515 6.656 -1.185 . . . 1.0 . . . . . . . . . . . . A . 19 ASP N . . . . . . . . . c30496_6e5h 1 . 7 . 2936 . 1 1 19 ASP O O 4.311 8.450 0.517 . . . 1.0 . . . . . . . . . . . . A . 19 ASP O . . . . . . . . . c30496_6e5h 1 . 7 . 2937 . 1 1 19 ASP OD1 O 3.568 11.121 -1.214 . . . 1.0 . . . . . . . . . . . . A . 19 ASP OD1 . . . . . . . . . c30496_6e5h 1 . 7 . 2938 . 1 1 19 ASP OD2 O 2.903 10.549 -3.216 . . . 1.0 . . . . . . . . . . . . A . 19 ASP OD2 . . . . . . . . . c30496_6e5h 1 . 7 . 2939 . 1 1 20 DPR C C 6.686 6.751 0.874 . . . 1.0 . . . . . . . . . . . . A . 20 DPR C . . . . . . . . . c30496_6e5h 1 . 7 . 2940 . 1 1 20 DPR CA C 6.834 7.663 -0.339 . . . 1.0 . . . . . . . . . . . . A . 20 DPR CA . . . . . . . . . c30496_6e5h 1 . 7 . 2941 . 1 1 20 DPR CB C 7.910 7.134 -1.288 . . . 1.0 . . . . . . . . . . . . A . 20 DPR CB . . . . . . . . . c30496_6e5h 1 . 7 . 2942 . 1 1 20 DPR CD C 5.867 7.222 -2.523 . . . 1.0 . . . . . . . . . . . . A . 20 DPR CD . . . . . . . . . c30496_6e5h 1 . 7 . 2943 . 1 1 20 DPR CG C 7.359 7.345 -2.655 . . . 1.0 . . . . . . . . . . . . A . 20 DPR CG . . . . . . . . . c30496_6e5h 1 . 7 . 2944 . 1 1 20 DPR HA H 7.098 8.656 -0.016 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HA . . . . . . . . . c30496_6e5h 1 . 7 . 2945 . 1 1 20 DPR HB2 H 8.823 7.691 -1.142 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HB2 . . . . . . . . . c30496_6e5h 1 . 7 . 2946 . 1 1 20 DPR HB3 H 8.083 6.088 -1.089 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HB3 . . . . . . . . . c30496_6e5h 1 . 7 . 2947 . 1 1 20 DPR HD2 H 5.375 7.867 -3.232 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HD2 . . . . . . . . . c30496_6e5h 1 . 7 . 2948 . 1 1 20 DPR HD3 H 5.557 6.196 -2.660 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HD3 . . . . . . . . . c30496_6e5h 1 . 7 . 2949 . 1 1 20 DPR HG2 H 7.625 8.329 -3.010 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HG2 . . . . . . . . . c30496_6e5h 1 . 7 . 2950 . 1 1 20 DPR HG3 H 7.739 6.589 -3.325 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HG3 . . . . . . . . . c30496_6e5h 1 . 7 . 2951 . 1 1 20 DPR N N 5.617 7.664 -1.142 . . . 1.0 . . . . . . . . . . . . A . 20 DPR N . . . . . . . . . c30496_6e5h 1 . 7 . 2952 . 1 1 20 DPR O O 6.258 5.601 0.749 . . . 1.0 . . . . . . . . . . . . A . 20 DPR O . . . . . . . . . c30496_6e5h 1 . 7 . 2953 . 1 1 21 PRO C C 5.500 6.551 3.904 . . . 1.0 . . . . . . . . . . . . A . 21 PRO C . . . . . . . . . c30496_6e5h 1 . 7 . 2954 . 1 1 21 PRO CA C 6.903 6.502 3.304 . . . 1.0 . . . . . . . . . . . . A . 21 PRO CA . . . . . . . . . c30496_6e5h 1 . 7 . 2955 . 1 1 21 PRO CB C 7.889 7.220 4.217 . . . 1.0 . . . . . . . . . . . . A . 21 PRO CB . . . . . . . . . c30496_6e5h 1 . 7 . 2956 . 1 1 21 PRO CD C 7.561 8.611 2.291 . . . 1.0 . . . . . . . . . . . . A . 21 PRO CD . . . . . . . . . c30496_6e5h 1 . 7 . 2957 . 1 1 21 PRO CG C 7.827 8.642 3.776 . . . 1.0 . . . . . . . . . . . . A . 21 PRO CG . . . . . . . . . c30496_6e5h 1 . 7 . 2958 . 1 1 21 PRO HA H 7.208 5.475 3.175 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HA . . . . . . . . . c30496_6e5h 1 . 7 . 2959 . 1 1 21 PRO HB2 H 7.578 7.108 5.244 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HB2 . . . . . . . . . c30496_6e5h 1 . 7 . 2960 . 1 1 21 PRO HB3 H 8.879 6.809 4.084 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HB3 . . . . . . . . . c30496_6e5h 1 . 7 . 2961 . 1 1 21 PRO HD2 H 6.840 9.366 2.019 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HD2 . . . . . . . . . c30496_6e5h 1 . 7 . 2962 . 1 1 21 PRO HD3 H 8.480 8.751 1.742 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HD3 . . . . . . . . . c30496_6e5h 1 . 7 . 2963 . 1 1 21 PRO HG2 H 7.023 9.150 4.288 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HG2 . . . . . . . . . c30496_6e5h 1 . 7 . 2964 . 1 1 21 PRO HG3 H 8.767 9.133 3.978 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HG3 . . . . . . . . . c30496_6e5h 1 . 7 . 2965 . 1 1 21 PRO N N 7.018 7.258 2.062 . . . 1.0 . . . . . . . . . . . . A . 21 PRO N . . . . . . . . . c30496_6e5h 1 . 7 . 2966 . 1 1 21 PRO O O 5.267 6.017 4.988 . . . 1.0 . . . . . . . . . . . . A . 21 PRO O . . . . . . . . . c30496_6e5h 1 . 7 . 2967 . 1 1 22 ARG C C 2.223 6.568 2.873 . . . 1.0 . . . . . . . . . . . . A . 22 ARG C . . . . . . . . . c30496_6e5h 1 . 7 . 2968 . 1 1 22 ARG CA C 3.213 7.338 3.730 . . . 1.0 . . . . . . . . . . . . A . 22 ARG CA . . . . . . . . . c30496_6e5h 1 . 7 . 2969 . 1 1 22 ARG CB C 2.829 8.815 3.805 . . . 1.0 . . . . . . . . . . . . A . 22 ARG CB . . . . . . . . . c30496_6e5h 1 . 7 . 2970 . 1 1 22 ARG CD C 3.325 11.077 4.789 . . . 1.0 . . . . . . . . . . . . A . 22 ARG CD . . . . . . . . . c30496_6e5h 1 . 7 . 2971 . 1 1 22 ARG CG C 3.769 9.631 4.676 . . . 1.0 . . . . . . . . . . . . A . 22 ARG CG . . . . . . . . . c30496_6e5h 1 . 7 . 2972 . 1 1 22 ARG CZ C 4.148 13.184 5.779 . . . 1.0 . . . . . . . . . . . . A . 22 ARG CZ . . . . . . . . . c30496_6e5h 1 . 7 . 2973 . 1 1 22 ARG H H 4.781 7.552 2.317 . . . 1.0 . . . . . . . . . . . . A . 22 ARG H . . . . . . . . . c30496_6e5h 1 . 7 . 2974 . 1 1 22 ARG HA H 3.199 6.923 4.726 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HA . . . . . . . . . c30496_6e5h 1 . 7 . 2975 . 1 1 22 ARG HB2 H 2.842 9.230 2.808 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HB2 . . . . . . . . . c30496_6e5h 1 . 7 . 2976 . 1 1 22 ARG HB3 H 1.831 8.898 4.208 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HB3 . . . . . . . . . c30496_6e5h 1 . 7 . 2977 . 1 1 22 ARG HD2 H 3.189 11.478 3.796 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HD2 . . . . . . . . . c30496_6e5h 1 . 7 . 2978 . 1 1 22 ARG HD3 H 2.387 11.111 5.323 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HD3 . . . . . . . . . c30496_6e5h 1 . 7 . 2979 . 1 1 22 ARG HE H 5.144 11.450 5.773 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HE . . . . . . . . . c30496_6e5h 1 . 7 . 2980 . 1 1 22 ARG HG2 H 3.795 9.199 5.664 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HG2 . . . . . . . . . c30496_6e5h 1 . 7 . 2981 . 1 1 22 ARG HG3 H 4.760 9.601 4.243 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HG3 . . . . . . . . . c30496_6e5h 1 . 7 . 2982 . 1 1 22 ARG HH11 H 2.283 13.301 4.994 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HH11 . . . . . . . . . c30496_6e5h 1 . 7 . 2983 . 1 1 22 ARG HH12 H 2.903 14.779 5.654 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HH12 . . . . . . . . . c30496_6e5h 1 . 7 . 2984 . 1 1 22 ARG HH21 H 4.998 14.830 6.605 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HH21 . . . . . . . . . c30496_6e5h 1 . 7 . 2985 . 1 1 22 ARG HH22 H 5.966 13.391 6.650 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HH22 . . . . . . . . . c30496_6e5h 1 . 7 . 2986 . 1 1 22 ARG N N 4.565 7.189 3.209 . . . 1.0 . . . . . . . . . . . . A . 22 ARG N . . . . . . . . . c30496_6e5h 1 . 7 . 2987 . 1 1 22 ARG NE N 4.306 11.893 5.501 . . . 1.0 . . . . . . . . . . . . A . 22 ARG NE . . . . . . . . . c30496_6e5h 1 . 7 . 2988 . 1 1 22 ARG NH1 N 3.021 13.804 5.451 . . . 1.0 . . . . . . . . . . . . A . 22 ARG NH1 . . . . . . . . . c30496_6e5h 1 . 7 . 2989 . 1 1 22 ARG NH2 N 5.114 13.855 6.393 . . . 1.0 . . . . . . . . . . . . A . 22 ARG NH2 . . . . . . . . . c30496_6e5h 1 . 7 . 2990 . 1 1 22 ARG O O 2.322 6.559 1.645 . . . 1.0 . . . . . . . . . . . . A . 22 ARG O . . . . . . . . . c30496_6e5h 1 . 7 . 2991 . 1 1 23 TYR C C -1.085 5.293 3.290 . . . 1.0 . . . . . . . . . . . . A . 23 TYR C . . . . . . . . . c30496_6e5h 1 . 7 . 2992 . 1 1 23 TYR CA C 0.341 5.042 2.826 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CA . . . . . . . . . c30496_6e5h 1 . 7 . 2993 . 1 1 23 TYR CB C 0.705 3.574 3.061 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CB . . . . . . . . . c30496_6e5h 1 . 7 . 2994 . 1 1 23 TYR CD1 C 3.102 3.355 3.792 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CD1 . . . . . . . . . c30496_6e5h 1 . 7 . 2995 . 1 1 23 TYR CD2 C 2.572 2.861 1.525 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CD2 . . . . . . . . . c30496_6e5h 1 . 7 . 2996 . 1 1 23 TYR CE1 C 4.431 3.063 3.548 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CE1 . . . . . . . . . c30496_6e5h 1 . 7 . 2997 . 1 1 23 TYR CE2 C 3.894 2.568 1.273 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CE2 . . . . . . . . . c30496_6e5h 1 . 7 . 2998 . 1 1 23 TYR CG C 2.154 3.258 2.789 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CG . . . . . . . . . c30496_6e5h 1 . 7 . 2999 . 1 1 23 TYR CZ C 4.823 2.683 2.287 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CZ . . . . . . . . . c30496_6e5h 1 . 7 . 3000 . 1 1 23 TYR H H 1.196 6.016 4.497 . . . 1.0 . . . . . . . . . . . . A . 23 TYR H . . . . . . . . . c30496_6e5h 1 . 7 . 3001 . 1 1 23 TYR HA H 0.410 5.256 1.772 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HA . . . . . . . . . c30496_6e5h 1 . 7 . 3002 . 1 1 23 TYR HB2 H 0.496 3.318 4.086 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HB2 . . . . . . . . . c30496_6e5h 1 . 7 . 3003 . 1 1 23 TYR HB3 H 0.104 2.956 2.412 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HB3 . . . . . . . . . c30496_6e5h 1 . 7 . 3004 . 1 1 23 TYR HD1 H 2.790 3.663 4.779 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HD1 . . . . . . . . . c30496_6e5h 1 . 7 . 3005 . 1 1 23 TYR HD2 H 1.843 2.781 0.732 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HD2 . . . . . . . . . c30496_6e5h 1 . 7 . 3006 . 1 1 23 TYR HE1 H 5.154 3.147 4.343 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HE1 . . . . . . . . . c30496_6e5h 1 . 7 . 3007 . 1 1 23 TYR HE2 H 4.197 2.258 0.285 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HE2 . . . . . . . . . c30496_6e5h 1 . 7 . 3008 . 1 1 23 TYR HH H 6.483 1.826 2.751 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HH . . . . . . . . . c30496_6e5h 1 . 7 . 3009 . 1 1 23 TYR N N 1.274 5.911 3.523 . . . 1.0 . . . . . . . . . . . . A . 23 TYR N . . . . . . . . . c30496_6e5h 1 . 7 . 3010 . 1 1 23 TYR O O -1.315 5.751 4.412 . . . 1.0 . . . . . . . . . . . . A . 23 TYR O . . . . . . . . . c30496_6e5h 1 . 7 . 3011 . 1 1 23 TYR OH O 6.139 2.374 2.035 . . . 1.0 . . . . . . . . . . . . A . 23 TYR OH . . . . . . . . . c30496_6e5h 1 . 7 . 3012 . 1 1 24 GLU C C -4.175 3.845 2.348 . . . 1.0 . . . . . . . . . . . . A . 24 GLU C . . . . . . . . . c30496_6e5h 1 . 7 . 3013 . 1 1 24 GLU CA C -3.448 5.117 2.753 . . . 1.0 . . . . . . . . . . . . A . 24 GLU CA . . . . . . . . . c30496_6e5h 1 . 7 . 3014 . 1 1 24 GLU CB C -4.082 6.317 2.045 . . . 1.0 . . . . . . . . . . . . A . 24 GLU CB . . . . . . . . . c30496_6e5h 1 . 7 . 3015 . 1 1 24 GLU CD C -4.106 8.813 1.693 . . . 1.0 . . . . . . . . . . . . A . 24 GLU CD . . . . . . . . . c30496_6e5h 1 . 7 . 3016 . 1 1 24 GLU CG C -3.439 7.650 2.392 . . . 1.0 . . . . . . . . . . . . A . 24 GLU CG . . . . . . . . . c30496_6e5h 1 . 7 . 3017 . 1 1 24 GLU H H -1.779 4.688 1.522 . . . 1.0 . . . . . . . . . . . . A . 24 GLU H . . . . . . . . . c30496_6e5h 1 . 7 . 3018 . 1 1 24 GLU HA H -3.532 5.245 3.822 . . . 1.0 . . . . . . . . . . . . A . 24 GLU HA . . . . . . . . . c30496_6e5h 1 . 7 . 3019 . 1 1 24 GLU HB2 H -4.002 6.172 0.979 . . . 1.0 . . . . . . . . . . . . A . 24 GLU HB2 . . . . . . . . . c30496_6e5h 1 . 7 . 3020 . 1 1 24 GLU HB3 H -5.127 6.365 2.314 . . . 1.0 . . . . . . . . . . . . A . 24 GLU HB3 . . . . . . . . . c30496_6e5h 1 . 7 . 3021 . 1 1 24 GLU HG2 H -3.509 7.804 3.459 . . . 1.0 . . . . . . . . . . . . A . 24 GLU HG2 . . . . . . . . . c30496_6e5h 1 . 7 . 3022 . 1 1 24 GLU HG3 H -2.399 7.620 2.100 . . . 1.0 . . . . . . . . . . . . A . 24 GLU HG3 . . . . . . . . . c30496_6e5h 1 . 7 . 3023 . 1 1 24 GLU N N -2.034 5.000 2.421 . . . 1.0 . . . . . . . . . . . . A . 24 GLU N . . . . . . . . . c30496_6e5h 1 . 7 . 3024 . 1 1 24 GLU O O -3.946 3.317 1.261 . . . 1.0 . . . . . . . . . . . . A . 24 GLU O . . . . . . . . . c30496_6e5h 1 . 7 . 3025 . 1 1 24 GLU OE1 O -3.730 9.116 0.542 . . . 1.0 . . . . . . . . . . . . A . 24 GLU OE1 . . . . . . . . . c30496_6e5h 1 . 7 . 3026 . 1 1 24 GLU OE2 O -5.009 9.433 2.290 . . . 1.0 . . . . . . . . . . . . A . 24 GLU OE2 . . . . . . . . . c30496_6e5h 1 . 7 . 3027 . 1 1 25 VAL C C -7.273 2.455 2.859 . . . 1.0 . . . . . . . . . . . . A . 25 VAL C . . . . . . . . . c30496_6e5h 1 . 7 . 3028 . 1 1 25 VAL CA C -5.785 2.143 2.937 . . . 1.0 . . . . . . . . . . . . A . 25 VAL CA . . . . . . . . . c30496_6e5h 1 . 7 . 3029 . 1 1 25 VAL CB C -5.536 1.061 4.007 . . . 1.0 . . . . . . . . . . . . A . 25 VAL CB . . . . . . . . . c30496_6e5h 1 . 7 . 3030 . 1 1 25 VAL CG1 C -6.345 -0.193 3.708 . . . 1.0 . . . . . . . . . . . . A . 25 VAL CG1 . . . . . . . . . c30496_6e5h 1 . 7 . 3031 . 1 1 25 VAL CG2 C -4.050 0.735 4.095 . . . 1.0 . . . . . . . . . . . . A . 25 VAL CG2 . . . . . . . . . c30496_6e5h 1 . 7 . 3032 . 1 1 25 VAL H H -5.180 3.818 4.069 . . . 1.0 . . . . . . . . . . . . A . 25 VAL H . . . . . . . . . c30496_6e5h 1 . 7 . 3033 . 1 1 25 VAL HA H -5.455 1.761 1.980 . . . 1.0 . . . . . . . . . . . . A . 25 VAL HA . . . . . . . . . c30496_6e5h 1 . 7 . 3034 . 1 1 25 VAL HB H -5.855 1.449 4.961 . . . 1.0 . . . . . . . . . . . . A . 25 VAL HB . . . . . . . . . c30496_6e5h 1 . 7 . 3035 . 1 1 25 VAL HG11 H -6.047 -0.593 2.749 . . . 1.0 . . . . . . . . . . . . A . 25 VAL HG11 . . . . . . . . . c30496_6e5h 1 . 7 . 3036 . 1 1 25 VAL HG12 H -7.395 0.053 3.685 . . . 1.0 . . . . . . . . . . . . A . 25 VAL HG12 . . . . . . . . . c30496_6e5h 1 . 7 . 3037 . 1 1 25 VAL HG13 H -6.165 -0.930 4.477 . . . 1.0 . . . . . . . . . . . . A . 25 VAL HG13 . . . . . . . . . c30496_6e5h 1 . 7 . 3038 . 1 1 25 VAL HG21 H -3.889 -0.021 4.851 . . . 1.0 . . . . . . . . . . . . A . 25 VAL HG21 . . . . . . . . . c30496_6e5h 1 . 7 . 3039 . 1 1 25 VAL HG22 H -3.501 1.628 4.357 . . . 1.0 . . . . . . . . . . . . A . 25 VAL HG22 . . . . . . . . . c30496_6e5h 1 . 7 . 3040 . 1 1 25 VAL HG23 H -3.704 0.369 3.141 . . . 1.0 . . . . . . . . . . . . A . 25 VAL HG23 . . . . . . . . . c30496_6e5h 1 . 7 . 3041 . 1 1 25 VAL N N -5.035 3.353 3.217 . . . 1.0 . . . . . . . . . . . . A . 25 VAL N . . . . . . . . . c30496_6e5h 1 . 7 . 3042 . 1 1 25 VAL O O -7.862 2.970 3.809 . . . 1.0 . . . . . . . . . . . . A . 25 VAL O . . . . . . . . . c30496_6e5h 1 . 7 . 3043 . 1 1 26 HIS C C -10.028 1.145 1.179 . . . 1.0 . . . . . . . . . . . . A . 26 HIS C . . . . . . . . . c30496_6e5h 1 . 7 . 3044 . 1 1 26 HIS CA C -9.271 2.435 1.483 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CA . . . . . . . . . c30496_6e5h 1 . 7 . 3045 . 1 1 26 HIS CB C -9.409 3.427 0.321 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CB . . . . . . . . . c30496_6e5h 1 . 7 . 3046 . 1 1 26 HIS CD2 C -11.744 4.494 0.723 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CD2 . . . . . . . . . c30496_6e5h 1 . 7 . 3047 . 1 1 26 HIS CE1 C -12.656 3.997 -1.204 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CE1 . . . . . . . . . c30496_6e5h 1 . 7 . 3048 . 1 1 26 HIS CG C -10.821 3.816 0.000 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CG . . . . . . . . . c30496_6e5h 1 . 7 . 3049 . 1 1 26 HIS H H -7.339 1.730 1.004 . . . 1.0 . . . . . . . . . . . . A . 26 HIS H . . . . . . . . . c30496_6e5h 1 . 7 . 3050 . 1 1 26 HIS HA H -9.677 2.878 2.377 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HA . . . . . . . . . c30496_6e5h 1 . 7 . 3051 . 1 1 26 HIS HB2 H -8.865 4.326 0.561 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HB2 . . . . . . . . . c30496_6e5h 1 . 7 . 3052 . 1 1 26 HIS HB3 H -8.980 2.987 -0.562 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HB3 . . . . . . . . . c30496_6e5h 1 . 7 . 3053 . 1 1 26 HIS HD1 H -11.015 3.028 -1.959 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HD1 . . . . . . . . . c30496_6e5h 1 . 7 . 3054 . 1 1 26 HIS HD2 H -11.616 4.888 1.720 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HD2 . . . . . . . . . c30496_6e5h 1 . 7 . 3055 . 1 1 26 HIS HE1 H -13.364 3.916 -2.015 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HE1 . . . . . . . . . c30496_6e5h 1 . 7 . 3056 . 1 1 26 HIS HE2 H -13.757 4.878 0.275 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HE2 . . . . . . . . . c30496_6e5h 1 . 7 . 3057 . 1 1 26 HIS N N -7.866 2.154 1.718 . . . 1.0 . . . . . . . . . . . . A . 26 HIS N . . . . . . . . . c30496_6e5h 1 . 7 . 3058 . 1 1 26 HIS ND1 N -11.428 3.519 -1.203 . . . 1.0 . . . . . . . . . . . . A . 26 HIS ND1 . . . . . . . . . c30496_6e5h 1 . 7 . 3059 . 1 1 26 HIS NE2 N -12.874 4.591 -0.048 . . . 1.0 . . . . . . . . . . . . A . 26 HIS NE2 . . . . . . . . . c30496_6e5h 1 . 7 . 3060 . 1 1 26 HIS O O -10.018 0.657 0.049 . . . 1.0 . . . . . . . . . . . . A . 26 HIS O . . . . . . . . . c30496_6e5h 1 . 7 . 3061 . 1 1 27 CYS C C -12.896 -0.247 1.673 . . . 1.0 . . . . . . . . . . . . A . 27 CYS C . . . . . . . . . c30496_6e5h 1 . 7 . 3062 . 1 1 27 CYS CA C -11.463 -0.614 2.025 . . . 1.0 . . . . . . . . . . . . A . 27 CYS CA . . . . . . . . . c30496_6e5h 1 . 7 . 3063 . 1 1 27 CYS CB C -11.433 -1.465 3.295 . . . 1.0 . . . . . . . . . . . . A . 27 CYS CB . . . . . . . . . c30496_6e5h 1 . 7 . 3064 . 1 1 27 CYS H H -10.592 0.990 3.089 . . . 1.0 . . . . . . . . . . . . A . 27 CYS H . . . . . . . . . c30496_6e5h 1 . 7 . 3065 . 1 1 27 CYS HA H -11.040 -1.180 1.210 . . . 1.0 . . . . . . . . . . . . A . 27 CYS HA . . . . . . . . . c30496_6e5h 1 . 7 . 3066 . 1 1 27 CYS HB2 H -11.831 -0.887 4.115 . . . 1.0 . . . . . . . . . . . . A . 27 CYS HB2 . . . . . . . . . c30496_6e5h 1 . 7 . 3067 . 1 1 27 CYS HB3 H -12.048 -2.338 3.144 . . . 1.0 . . . . . . . . . . . . A . 27 CYS HB3 . . . . . . . . . c30496_6e5h 1 . 7 . 3068 . 1 1 27 CYS N N -10.665 0.588 2.196 . . . 1.0 . . . . . . . . . . . . A . 27 CYS N . . . . . . . . . c30496_6e5h 1 . 7 . 3069 . 1 1 27 CYS O O -13.733 -0.029 2.550 . . . 1.0 . . . . . . . . . . . . A . 27 CYS O . . . . . . . . . c30496_6e5h 1 . 7 . 3070 . 1 1 27 CYS SG S -9.768 -2.029 3.773 . . . 1.0 . . . . . . . . . . . . A . 27 CYS SG . . . . . . . . . c30496_6e5h 1 . 7 . 3071 . 1 1 28 NH2 HN1 H -12.454 -0.342 -0.259 . . . 1.0 . . . . . . . . . . . . A . 28 NH2 HN1 . . . . . . . . . c30496_6e5h 1 . 7 . 3072 . 1 1 28 NH2 HN2 H -14.082 0.096 0.125 . . . 1.0 . . . . . . . . . . . . A . 28 NH2 HN2 . . . . . . . . . c30496_6e5h 1 . 7 . 3073 . 1 1 28 NH2 N N -13.172 -0.154 0.387 . . . 1.0 . . . . . . . . . . . . A . 28 NH2 N . . . . . . . . . c30496_6e5h 1 . 8 . 3074 . 1 1 1 ASN C C 8.453 -0.543 -1.379 . . . 1.0 . . . . . . . . . . . . A . 1 ASN C . . . . . . . . . c30496_6e5h 1 . 8 . 3075 . 1 1 1 ASN CA C 9.241 0.749 -1.180 . . . 1.0 . . . . . . . . . . . . A . 1 ASN CA . . . . . . . . . c30496_6e5h 1 . 8 . 3076 . 1 1 1 ASN CB C 8.827 1.779 -2.232 . . . 1.0 . . . . . . . . . . . . A . 1 ASN CB . . . . . . . . . c30496_6e5h 1 . 8 . 3077 . 1 1 1 ASN CG C 9.426 3.146 -1.972 . . . 1.0 . . . . . . . . . . . . A . 1 ASN CG . . . . . . . . . c30496_6e5h 1 . 8 . 3078 . 1 1 1 ASN H1 H 10.984 -0.138 -0.470 . . . 1.0 . . . . . . . . . . . . A . 1 ASN H1 . . . . . . . . . c30496_6e5h 1 . 8 . 3079 . 1 1 1 ASN H2 H 11.222 1.388 -1.151 . . . 1.0 . . . . . . . . . . . . A . 1 ASN H2 . . . . . . . . . c30496_6e5h 1 . 8 . 3080 . 1 1 1 ASN H3 H 10.947 0.052 -2.150 . . . 1.0 . . . . . . . . . . . . A . 1 ASN H3 . . . . . . . . . c30496_6e5h 1 . 8 . 3081 . 1 1 1 ASN HA H 9.013 1.140 -0.199 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HA . . . . . . . . . c30496_6e5h 1 . 8 . 3082 . 1 1 1 ASN HB2 H 9.153 1.443 -3.204 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HB2 . . . . . . . . . c30496_6e5h 1 . 8 . 3083 . 1 1 1 ASN HB3 H 7.751 1.874 -2.231 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HB3 . . . . . . . . . c30496_6e5h 1 . 8 . 3084 . 1 1 1 ASN HD21 H 9.395 3.557 -3.914 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HD21 . . . . . . . . . c30496_6e5h 1 . 8 . 3085 . 1 1 1 ASN HD22 H 10.032 4.796 -2.891 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HD22 . . . . . . . . . c30496_6e5h 1 . 8 . 3086 . 1 1 1 ASN N N 10.699 0.496 -1.242 . . . 1.0 . . . . . . . . . . . . A . 1 ASN N . . . . . . . . . c30496_6e5h 1 . 8 . 3087 . 1 1 1 ASN ND2 N 9.638 3.910 -3.030 . . . 1.0 . . . . . . . . . . . . A . 1 ASN ND2 . . . . . . . . . c30496_6e5h 1 . 8 . 3088 . 1 1 1 ASN O O 7.297 -0.514 -1.808 . . . 1.0 . . . . . . . . . . . . A . 1 ASN O . . . . . . . . . c30496_6e5h 1 . 8 . 3089 . 1 1 1 ASN OD1 O 9.691 3.514 -0.827 . . . 1.0 . . . . . . . . . . . . A . 1 ASN OD1 . . . . . . . . . c30496_6e5h 1 . 8 . 3090 . 1 1 2 ASP C C 7.254 -3.105 -0.204 . . . 1.0 . . . . . . . . . . . . A . 2 ASP C . . . . . . . . . c30496_6e5h 1 . 8 . 3091 . 1 1 2 ASP CA C 8.418 -2.979 -1.177 . . . 1.0 . . . . . . . . . . . . A . 2 ASP CA . . . . . . . . . c30496_6e5h 1 . 8 . 3092 . 1 1 2 ASP CB C 9.408 -4.122 -0.946 . . . 1.0 . . . . . . . . . . . . A . 2 ASP CB . . . . . . . . . c30496_6e5h 1 . 8 . 3093 . 1 1 2 ASP CG C 10.413 -4.267 -2.070 . . . 1.0 . . . . . . . . . . . . A . 2 ASP CG . . . . . . . . . c30496_6e5h 1 . 8 . 3094 . 1 1 2 ASP H H 9.990 -1.636 -0.699 . . . 1.0 . . . . . . . . . . . . A . 2 ASP H . . . . . . . . . c30496_6e5h 1 . 8 . 3095 . 1 1 2 ASP HA H 8.032 -3.050 -2.183 . . . 1.0 . . . . . . . . . . . . A . 2 ASP HA . . . . . . . . . c30496_6e5h 1 . 8 . 3096 . 1 1 2 ASP HB2 H 9.948 -3.943 -0.030 . . . 1.0 . . . . . . . . . . . . A . 2 ASP HB2 . . . . . . . . . c30496_6e5h 1 . 8 . 3097 . 1 1 2 ASP HB3 H 8.862 -5.049 -0.856 . . . 1.0 . . . . . . . . . . . . A . 2 ASP HB3 . . . . . . . . . c30496_6e5h 1 . 8 . 3098 . 1 1 2 ASP N N 9.071 -1.676 -1.045 . . . 1.0 . . . . . . . . . . . . A . 2 ASP N . . . . . . . . . c30496_6e5h 1 . 8 . 3099 . 1 1 2 ASP O O 6.357 -3.930 -0.397 . . . 1.0 . . . . . . . . . . . . A . 2 ASP O . . . . . . . . . c30496_6e5h 1 . 8 . 3100 . 1 1 2 ASP OD1 O 11.553 -3.779 -1.921 . . . 1.0 . . . . . . . . . . . . A . 2 ASP OD1 . . . . . . . . . c30496_6e5h 1 . 8 . 3101 . 1 1 2 ASP OD2 O 10.069 -4.867 -3.108 . . . 1.0 . . . . . . . . . . . . A . 2 ASP OD2 . . . . . . . . . c30496_6e5h 1 . 8 . 3102 . 1 1 3 LYS C C 4.859 -1.917 1.125 . . . 1.0 . . . . . . . . . . . . A . 3 LYS C . . . . . . . . . c30496_6e5h 1 . 8 . 3103 . 1 1 3 LYS CA C 6.178 -2.254 1.806 . . . 1.0 . . . . . . . . . . . . A . 3 LYS CA . . . . . . . . . c30496_6e5h 1 . 8 . 3104 . 1 1 3 LYS CB C 6.460 -1.256 2.931 . . . 1.0 . . . . . . . . . . . . A . 3 LYS CB . . . . . . . . . c30496_6e5h 1 . 8 . 3105 . 1 1 3 LYS CD C 7.733 -0.730 5.032 . . . 1.0 . . . . . . . . . . . . A . 3 LYS CD . . . . . . . . . c30496_6e5h 1 . 8 . 3106 . 1 1 3 LYS CE C 8.833 -1.182 5.978 . . . 1.0 . . . . . . . . . . . . A . 3 LYS CE . . . . . . . . . c30496_6e5h 1 . 8 . 3107 . 1 1 3 LYS CG C 7.571 -1.695 3.871 . . . 1.0 . . . . . . . . . . . . A . 3 LYS CG . . . . . . . . . c30496_6e5h 1 . 8 . 3108 . 1 1 3 LYS H H 8.018 -1.658 0.948 . . . 1.0 . . . . . . . . . . . . A . 3 LYS H . . . . . . . . . c30496_6e5h 1 . 8 . 3109 . 1 1 3 LYS HA H 6.102 -3.243 2.229 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HA . . . . . . . . . c30496_6e5h 1 . 8 . 3110 . 1 1 3 LYS HB2 H 6.741 -0.308 2.495 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HB2 . . . . . . . . . c30496_6e5h 1 . 8 . 3111 . 1 1 3 LYS HB3 H 5.559 -1.120 3.512 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HB3 . . . . . . . . . c30496_6e5h 1 . 8 . 3112 . 1 1 3 LYS HD2 H 7.983 0.247 4.646 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HD2 . . . . . . . . . c30496_6e5h 1 . 8 . 3113 . 1 1 3 LYS HD3 H 6.801 -0.676 5.577 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HD3 . . . . . . . . . c30496_6e5h 1 . 8 . 3114 . 1 1 3 LYS HE2 H 8.596 -2.173 6.334 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HE2 . . . . . . . . . c30496_6e5h 1 . 8 . 3115 . 1 1 3 LYS HE3 H 9.766 -1.209 5.436 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HE3 . . . . . . . . . c30496_6e5h 1 . 8 . 3116 . 1 1 3 LYS HG2 H 7.332 -2.673 4.261 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HG2 . . . . . . . . . c30496_6e5h 1 . 8 . 3117 . 1 1 3 LYS HG3 H 8.499 -1.743 3.324 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HG3 . . . . . . . . . c30496_6e5h 1 . 8 . 3118 . 1 1 3 LYS HZ1 H 9.201 0.693 6.817 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HZ1 . . . . . . . . . c30496_6e5h 1 . 8 . 3119 . 1 1 3 LYS HZ2 H 9.735 -0.599 7.765 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HZ2 . . . . . . . . . c30496_6e5h 1 . 8 . 3120 . 1 1 3 LYS HZ3 H 8.087 -0.240 7.682 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HZ3 . . . . . . . . . c30496_6e5h 1 . 8 . 3121 . 1 1 3 LYS N N 7.262 -2.272 0.834 . . . 1.0 . . . . . . . . . . . . A . 3 LYS N . . . . . . . . . c30496_6e5h 1 . 8 . 3122 . 1 1 3 LYS NZ N 8.974 -0.270 7.142 . . . 1.0 . . . . . . . . . . . . A . 3 LYS NZ . . . . . . . . . c30496_6e5h 1 . 8 . 3123 . 1 1 3 LYS O O 3.804 -2.367 1.554 . . . 1.0 . . . . . . . . . . . . A . 3 LYS O . . . . . . . . . c30496_6e5h 1 . 8 . 3124 . 1 1 4 CYS C C 3.107 -2.096 -1.270 . . . 1.0 . . . . . . . . . . . . A . 4 CYS C . . . . . . . . . c30496_6e5h 1 . 8 . 3125 . 1 1 4 CYS CA C 3.740 -0.822 -0.732 . . . 1.0 . . . . . . . . . . . . A . 4 CYS CA . . . . . . . . . c30496_6e5h 1 . 8 . 3126 . 1 1 4 CYS CB C 4.084 0.105 -1.898 . . . 1.0 . . . . . . . . . . . . A . 4 CYS CB . . . . . . . . . c30496_6e5h 1 . 8 . 3127 . 1 1 4 CYS H H 5.797 -0.785 -0.230 . . . 1.0 . . . . . . . . . . . . A . 4 CYS H . . . . . . . . . c30496_6e5h 1 . 8 . 3128 . 1 1 4 CYS HA H 3.036 -0.329 -0.081 . . . 1.0 . . . . . . . . . . . . A . 4 CYS HA . . . . . . . . . c30496_6e5h 1 . 8 . 3129 . 1 1 4 CYS HB2 H 4.409 1.056 -1.513 . . . 1.0 . . . . . . . . . . . . A . 4 CYS HB2 . . . . . . . . . c30496_6e5h 1 . 8 . 3130 . 1 1 4 CYS HB3 H 4.884 -0.338 -2.474 . . . 1.0 . . . . . . . . . . . . A . 4 CYS HB3 . . . . . . . . . c30496_6e5h 1 . 8 . 3131 . 1 1 4 CYS N N 4.927 -1.142 0.048 . . . 1.0 . . . . . . . . . . . . A . 4 CYS N . . . . . . . . . c30496_6e5h 1 . 8 . 3132 . 1 1 4 CYS O O 1.898 -2.289 -1.177 . . . 1.0 . . . . . . . . . . . . A . 4 CYS O . . . . . . . . . c30496_6e5h 1 . 8 . 3133 . 1 1 4 CYS SG S 2.686 0.407 -3.030 . . . 1.0 . . . . . . . . . . . . A . 4 CYS SG . . . . . . . . . c30496_6e5h 1 . 8 . 3134 . 1 1 5 LYS C C 2.970 -5.154 -1.297 . . . 1.0 . . . . . . . . . . . . A . 5 LYS C . . . . . . . . . c30496_6e5h 1 . 8 . 3135 . 1 1 5 LYS CA C 3.472 -4.220 -2.385 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CA . . . . . . . . . c30496_6e5h 1 . 8 . 3136 . 1 1 5 LYS CB C 4.580 -4.902 -3.194 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CB . . . . . . . . . c30496_6e5h 1 . 8 . 3137 . 1 1 5 LYS CD C 5.219 -2.875 -4.578 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CD . . . . . . . . . c30496_6e5h 1 . 8 . 3138 . 1 1 5 LYS CE C 5.453 -2.349 -5.987 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CE . . . . . . . . . c30496_6e5h 1 . 8 . 3139 . 1 1 5 LYS CG C 4.783 -4.332 -4.595 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CG . . . . . . . . . c30496_6e5h 1 . 8 . 3140 . 1 1 5 LYS H H 4.903 -2.785 -1.799 . . . 1.0 . . . . . . . . . . . . A . 5 LYS H . . . . . . . . . c30496_6e5h 1 . 8 . 3141 . 1 1 5 LYS HA H 2.651 -3.985 -3.045 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HA . . . . . . . . . c30496_6e5h 1 . 8 . 3142 . 1 1 5 LYS HB2 H 5.511 -4.804 -2.656 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HB2 . . . . . . . . . c30496_6e5h 1 . 8 . 3143 . 1 1 5 LYS HB3 H 4.342 -5.950 -3.289 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HB3 . . . . . . . . . c30496_6e5h 1 . 8 . 3144 . 1 1 5 LYS HD2 H 4.448 -2.283 -4.107 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HD2 . . . . . . . . . c30496_6e5h 1 . 8 . 3145 . 1 1 5 LYS HD3 H 6.137 -2.789 -4.015 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HD3 . . . . . . . . . c30496_6e5h 1 . 8 . 3146 . 1 1 5 LYS HE2 H 5.767 -1.320 -5.926 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HE2 . . . . . . . . . c30496_6e5h 1 . 8 . 3147 . 1 1 5 LYS HE3 H 6.234 -2.935 -6.450 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HE3 . . . . . . . . . c30496_6e5h 1 . 8 . 3148 . 1 1 5 LYS HG2 H 5.544 -4.908 -5.093 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HG2 . . . . . . . . . c30496_6e5h 1 . 8 . 3149 . 1 1 5 LYS HG3 H 3.855 -4.414 -5.142 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HG3 . . . . . . . . . c30496_6e5h 1 . 8 . 3150 . 1 1 5 LYS HZ1 H 4.415 -2.054 -7.774 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HZ1 . . . . . . . . . c30496_6e5h 1 . 8 . 3151 . 1 1 5 LYS HZ2 H 3.457 -1.882 -6.393 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HZ2 . . . . . . . . . c30496_6e5h 1 . 8 . 3152 . 1 1 5 LYS HZ3 H 3.916 -3.421 -6.915 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HZ3 . . . . . . . . . c30496_6e5h 1 . 8 . 3153 . 1 1 5 LYS N N 3.943 -2.974 -1.806 . . . 1.0 . . . . . . . . . . . . A . 5 LYS N . . . . . . . . . c30496_6e5h 1 . 8 . 3154 . 1 1 5 LYS NZ N 4.225 -2.432 -6.825 . . . 1.0 . . . . . . . . . . . . A . 5 LYS NZ . . . . . . . . . c30496_6e5h 1 . 8 . 3155 . 1 1 5 LYS O O 1.950 -5.816 -1.462 . . . 1.0 . . . . . . . . . . . . A . 5 LYS O . . . . . . . . . c30496_6e5h 1 . 8 . 3156 . 1 1 6 GLU C C 1.924 -5.593 1.486 . . . 1.0 . . . . . . . . . . . . A . 6 GLU C . . . . . . . . . c30496_6e5h 1 . 8 . 3157 . 1 1 6 GLU CA C 3.286 -6.018 0.951 . . . 1.0 . . . . . . . . . . . . A . 6 GLU CA . . . . . . . . . c30496_6e5h 1 . 8 . 3158 . 1 1 6 GLU CB C 4.331 -5.941 2.065 . . . 1.0 . . . . . . . . . . . . A . 6 GLU CB . . . . . . . . . c30496_6e5h 1 . 8 . 3159 . 1 1 6 GLU CD C 5.473 -8.112 1.478 . . . 1.0 . . . . . . . . . . . . A . 6 GLU CD . . . . . . . . . c30496_6e5h 1 . 8 . 3160 . 1 1 6 GLU CG C 5.643 -6.626 1.719 . . . 1.0 . . . . . . . . . . . . A . 6 GLU CG . . . . . . . . . c30496_6e5h 1 . 8 . 3161 . 1 1 6 GLU H H 4.497 -4.640 -0.114 . . . 1.0 . . . . . . . . . . . . A . 6 GLU H . . . . . . . . . c30496_6e5h 1 . 8 . 3162 . 1 1 6 GLU HA H 3.218 -7.038 0.603 . . . 1.0 . . . . . . . . . . . . A . 6 GLU HA . . . . . . . . . c30496_6e5h 1 . 8 . 3163 . 1 1 6 GLU HB2 H 4.538 -4.901 2.274 . . . 1.0 . . . . . . . . . . . . A . 6 GLU HB2 . . . . . . . . . c30496_6e5h 1 . 8 . 3164 . 1 1 6 GLU HB3 H 3.928 -6.404 2.953 . . . 1.0 . . . . . . . . . . . . A . 6 GLU HB3 . . . . . . . . . c30496_6e5h 1 . 8 . 3165 . 1 1 6 GLU HG2 H 6.048 -6.177 0.826 . . . 1.0 . . . . . . . . . . . . A . 6 GLU HG2 . . . . . . . . . c30496_6e5h 1 . 8 . 3166 . 1 1 6 GLU HG3 H 6.334 -6.486 2.536 . . . 1.0 . . . . . . . . . . . . A . 6 GLU HG3 . . . . . . . . . c30496_6e5h 1 . 8 . 3167 . 1 1 6 GLU N N 3.681 -5.187 -0.179 . . . 1.0 . . . . . . . . . . . . A . 6 GLU N . . . . . . . . . c30496_6e5h 1 . 8 . 3168 . 1 1 6 GLU O O 1.057 -6.431 1.741 . . . 1.0 . . . . . . . . . . . . A . 6 GLU O . . . . . . . . . c30496_6e5h 1 . 8 . 3169 . 1 1 6 GLU OE1 O 5.168 -8.841 2.445 . . . 1.0 . . . . . . . . . . . . A . 6 GLU OE1 . . . . . . . . . c30496_6e5h 1 . 8 . 3170 . 1 1 6 GLU OE2 O 5.659 -8.560 0.323 . . . 1.0 . . . . . . . . . . . . A . 6 GLU OE2 . . . . . . . . . c30496_6e5h 1 . 8 . 3171 . 1 1 7 LEU C C -0.639 -3.942 1.127 . . . 1.0 . . . . . . . . . . . . A . 7 LEU C . . . . . . . . . c30496_6e5h 1 . 8 . 3172 . 1 1 7 LEU CA C 0.478 -3.754 2.144 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CA . . . . . . . . . c30496_6e5h 1 . 8 . 3173 . 1 1 7 LEU CB C 0.633 -2.271 2.481 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CB . . . . . . . . . c30496_6e5h 1 . 8 . 3174 . 1 1 7 LEU CD1 C 1.835 -0.455 3.731 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CD1 . . . . . . . . . c30496_6e5h 1 . 8 . 3175 . 1 1 7 LEU CD2 C 1.183 -2.550 4.925 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CD2 . . . . . . . . . c30496_6e5h 1 . 8 . 3176 . 1 1 7 LEU CG C 1.639 -1.956 3.596 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CG . . . . . . . . . c30496_6e5h 1 . 8 . 3177 . 1 1 7 LEU H H 2.457 -3.666 1.398 . . . 1.0 . . . . . . . . . . . . A . 7 LEU H . . . . . . . . . c30496_6e5h 1 . 8 . 3178 . 1 1 7 LEU HA H 0.226 -4.296 3.041 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HA . . . . . . . . . c30496_6e5h 1 . 8 . 3179 . 1 1 7 LEU HB2 H 0.944 -1.753 1.586 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HB2 . . . . . . . . . c30496_6e5h 1 . 8 . 3180 . 1 1 7 LEU HB3 H -0.331 -1.890 2.777 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HB3 . . . . . . . . . c30496_6e5h 1 . 8 . 3181 . 1 1 7 LEU HD11 H 2.548 -0.254 4.519 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD11 . . . . . . . . . c30496_6e5h 1 . 8 . 3182 . 1 1 7 LEU HD12 H 0.892 0.012 3.974 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD12 . . . . . . . . . c30496_6e5h 1 . 8 . 3183 . 1 1 7 LEU HD13 H 2.207 -0.053 2.799 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD13 . . . . . . . . . c30496_6e5h 1 . 8 . 3184 . 1 1 7 LEU HD21 H 0.234 -2.119 5.205 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD21 . . . . . . . . . c30496_6e5h 1 . 8 . 3185 . 1 1 7 LEU HD22 H 1.916 -2.332 5.687 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD22 . . . . . . . . . c30496_6e5h 1 . 8 . 3186 . 1 1 7 LEU HD23 H 1.077 -3.621 4.826 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD23 . . . . . . . . . c30496_6e5h 1 . 8 . 3187 . 1 1 7 LEU HG H 2.593 -2.396 3.342 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HG . . . . . . . . . c30496_6e5h 1 . 8 . 3188 . 1 1 7 LEU N N 1.732 -4.290 1.636 . . . 1.0 . . . . . . . . . . . . A . 7 LEU N . . . . . . . . . c30496_6e5h 1 . 8 . 3189 . 1 1 7 LEU O O -1.749 -4.336 1.476 . . . 1.0 . . . . . . . . . . . . A . 7 LEU O . . . . . . . . . c30496_6e5h 1 . 8 . 3190 . 1 1 8 LYS C C -1.688 -5.246 -1.450 . . . 1.0 . . . . . . . . . . . . A . 8 LYS C . . . . . . . . . c30496_6e5h 1 . 8 . 3191 . 1 1 8 LYS CA C -1.317 -3.785 -1.200 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CA . . . . . . . . . c30496_6e5h 1 . 8 . 3192 . 1 1 8 LYS CB C -0.780 -3.134 -2.479 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CB . . . . . . . . . c30496_6e5h 1 . 8 . 3193 . 1 1 8 LYS CD C -1.283 -2.055 -4.699 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CD . . . . . . . . . c30496_6e5h 1 . 8 . 3194 . 1 1 8 LYS CE C -0.670 -0.708 -4.339 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CE . . . . . . . . . c30496_6e5h 1 . 8 . 3195 . 1 1 8 LYS CG C -1.861 -2.763 -3.482 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CG . . . . . . . . . c30496_6e5h 1 . 8 . 3196 . 1 1 8 LYS H H 0.586 -3.400 -0.356 . . . 1.0 . . . . . . . . . . . . A . 8 LYS H . . . . . . . . . c30496_6e5h 1 . 8 . 3197 . 1 1 8 LYS HA H -2.201 -3.257 -0.883 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HA . . . . . . . . . c30496_6e5h 1 . 8 . 3198 . 1 1 8 LYS HB2 H -0.245 -2.236 -2.212 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HB2 . . . . . . . . . c30496_6e5h 1 . 8 . 3199 . 1 1 8 LYS HB3 H -0.096 -3.819 -2.956 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HB3 . . . . . . . . . c30496_6e5h 1 . 8 . 3200 . 1 1 8 LYS HD2 H -0.520 -2.680 -5.134 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HD2 . . . . . . . . . c30496_6e5h 1 . 8 . 3201 . 1 1 8 LYS HD3 H -2.074 -1.898 -5.419 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HD3 . . . . . . . . . c30496_6e5h 1 . 8 . 3202 . 1 1 8 LYS HE2 H -1.433 -0.084 -3.899 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HE2 . . . . . . . . . c30496_6e5h 1 . 8 . 3203 . 1 1 8 LYS HE3 H 0.122 -0.866 -3.622 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HE3 . . . . . . . . . c30496_6e5h 1 . 8 . 3204 . 1 1 8 LYS HG2 H -2.363 -3.663 -3.806 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HG2 . . . . . . . . . c30496_6e5h 1 . 8 . 3205 . 1 1 8 LYS HG3 H -2.572 -2.108 -2.999 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HG3 . . . . . . . . . c30496_6e5h 1 . 8 . 3206 . 1 1 8 LYS HZ1 H 0.664 -0.579 -5.944 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ1 . . . . . . . . . c30496_6e5h 1 . 8 . 3207 . 1 1 8 LYS HZ2 H 0.260 0.917 -5.272 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ2 . . . . . . . . . c30496_6e5h 1 . 8 . 3208 . 1 1 8 LYS HZ3 H -0.849 0.106 -6.254 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ3 . . . . . . . . . c30496_6e5h 1 . 8 . 3209 . 1 1 8 LYS N N -0.331 -3.681 -0.134 . . . 1.0 . . . . . . . . . . . . A . 8 LYS N . . . . . . . . . c30496_6e5h 1 . 8 . 3210 . 1 1 8 LYS NZ N -0.110 -0.017 -5.532 . . . 1.0 . . . . . . . . . . . . A . 8 LYS NZ . . . . . . . . . c30496_6e5h 1 . 8 . 3211 . 1 1 8 LYS O O -2.760 -5.543 -1.971 . . . 1.0 . . . . . . . . . . . . A . 8 LYS O . . . . . . . . . c30496_6e5h 1 . 8 . 3212 . 1 1 9 LYS C C -1.858 -8.070 0.023 . . . 1.0 . . . . . . . . . . . . A . 9 LYS C . . . . . . . . . c30496_6e5h 1 . 8 . 3213 . 1 1 9 LYS CA C -1.060 -7.580 -1.185 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CA . . . . . . . . . c30496_6e5h 1 . 8 . 3214 . 1 1 9 LYS CB C 0.259 -8.351 -1.299 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CB . . . . . . . . . c30496_6e5h 1 . 8 . 3215 . 1 1 9 LYS CD C 1.428 -10.555 -1.628 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CD . . . . . . . . . c30496_6e5h 1 . 8 . 3216 . 1 1 9 LYS CE C 2.238 -10.054 -2.818 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CE . . . . . . . . . c30496_6e5h 1 . 8 . 3217 . 1 1 9 LYS CG C 0.087 -9.847 -1.509 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CG . . . . . . . . . c30496_6e5h 1 . 8 . 3218 . 1 1 9 LYS H H 0.087 -5.856 -0.760 . . . 1.0 . . . . . . . . . . . . A . 9 LYS H . . . . . . . . . c30496_6e5h 1 . 8 . 3219 . 1 1 9 LYS HA H -1.645 -7.744 -2.076 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HA . . . . . . . . . c30496_6e5h 1 . 8 . 3220 . 1 1 9 LYS HB2 H 0.818 -7.956 -2.134 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HB2 . . . . . . . . . c30496_6e5h 1 . 8 . 3221 . 1 1 9 LYS HB3 H 0.828 -8.201 -0.394 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HB3 . . . . . . . . . c30496_6e5h 1 . 8 . 3222 . 1 1 9 LYS HD2 H 1.993 -10.379 -0.725 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HD2 . . . . . . . . . c30496_6e5h 1 . 8 . 3223 . 1 1 9 LYS HD3 H 1.253 -11.614 -1.742 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HD3 . . . . . . . . . c30496_6e5h 1 . 8 . 3224 . 1 1 9 LYS HE2 H 2.436 -9.002 -2.687 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HE2 . . . . . . . . . c30496_6e5h 1 . 8 . 3225 . 1 1 9 LYS HE3 H 3.173 -10.593 -2.850 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HE3 . . . . . . . . . c30496_6e5h 1 . 8 . 3226 . 1 1 9 LYS HG2 H -0.453 -10.258 -0.670 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HG2 . . . . . . . . . c30496_6e5h 1 . 8 . 3227 . 1 1 9 LYS HG3 H -0.476 -10.010 -2.416 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HG3 . . . . . . . . . c30496_6e5h 1 . 8 . 3228 . 1 1 9 LYS HZ1 H 0.641 -9.702 -4.120 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HZ1 . . . . . . . . . c30496_6e5h 1 . 8 . 3229 . 1 1 9 LYS HZ2 H 1.294 -11.256 -4.243 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HZ2 . . . . . . . . . c30496_6e5h 1 . 8 . 3230 . 1 1 9 LYS HZ3 H 2.123 -9.935 -4.898 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HZ3 . . . . . . . . . c30496_6e5h 1 . 8 . 3231 . 1 1 9 LYS N N -0.793 -6.154 -1.083 . . . 1.0 . . . . . . . . . . . . A . 9 LYS N . . . . . . . . . c30496_6e5h 1 . 8 . 3232 . 1 1 9 LYS NZ N 1.524 -10.251 -4.109 . . . 1.0 . . . . . . . . . . . . A . 9 LYS NZ . . . . . . . . . c30496_6e5h 1 . 8 . 3233 . 1 1 9 LYS O O -2.798 -8.852 -0.118 . . . 1.0 . . . . . . . . . . . . A . 9 LYS O . . . . . . . . . c30496_6e5h 1 . 8 . 3234 . 1 1 10 ARG C C -3.583 -7.494 2.467 . . . 1.0 . . . . . . . . . . . . A . 10 ARG C . . . . . . . . . c30496_6e5h 1 . 8 . 3235 . 1 1 10 ARG CA C -2.146 -8.001 2.444 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CA . . . . . . . . . c30496_6e5h 1 . 8 . 3236 . 1 1 10 ARG CB C -1.389 -7.464 3.660 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CB . . . . . . . . . c30496_6e5h 1 . 8 . 3237 . 1 1 10 ARG CD C -1.222 -7.314 6.165 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CD . . . . . . . . . c30496_6e5h 1 . 8 . 3238 . 1 1 10 ARG CG C -2.024 -7.844 4.988 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CG . . . . . . . . . c30496_6e5h 1 . 8 . 3239 . 1 1 10 ARG CZ C 0.903 -7.901 7.276 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CZ . . . . . . . . . c30496_6e5h 1 . 8 . 3240 . 1 1 10 ARG H H -0.716 -6.983 1.255 . . . 1.0 . . . . . . . . . . . . A . 10 ARG H . . . . . . . . . c30496_6e5h 1 . 8 . 3241 . 1 1 10 ARG HA H -2.156 -9.079 2.484 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HA . . . . . . . . . c30496_6e5h 1 . 8 . 3242 . 1 1 10 ARG HB2 H -0.382 -7.851 3.642 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HB2 . . . . . . . . . c30496_6e5h 1 . 8 . 3243 . 1 1 10 ARG HB3 H -1.352 -6.387 3.601 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HB3 . . . . . . . . . c30496_6e5h 1 . 8 . 3244 . 1 1 10 ARG HD2 H -1.172 -6.238 6.093 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HD2 . . . . . . . . . c30496_6e5h 1 . 8 . 3245 . 1 1 10 ARG HD3 H -1.725 -7.591 7.081 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HD3 . . . . . . . . . c30496_6e5h 1 . 8 . 3246 . 1 1 10 ARG HE H 0.501 -8.205 5.340 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HE . . . . . . . . . c30496_6e5h 1 . 8 . 3247 . 1 1 10 ARG HG2 H -3.021 -7.427 5.030 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HG2 . . . . . . . . . c30496_6e5h 1 . 8 . 3248 . 1 1 10 ARG HG3 H -2.079 -8.921 5.055 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HG3 . . . . . . . . . c30496_6e5h 1 . 8 . 3249 . 1 1 10 ARG HH11 H 1.036 -7.469 9.248 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HH11 . . . . . . . . . c30496_6e5h 1 . 8 . 3250 . 1 1 10 ARG HH12 H -0.461 -7.026 8.494 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HH12 . . . . . . . . . c30496_6e5h 1 . 8 . 3251 . 1 1 10 ARG HH21 H 2.476 -8.758 6.331 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HH21 . . . . . . . . . c30496_6e5h 1 . 8 . 3252 . 1 1 10 ARG HH22 H 2.697 -8.464 8.027 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HH22 . . . . . . . . . c30496_6e5h 1 . 8 . 3253 . 1 1 10 ARG N N -1.476 -7.605 1.209 . . . 1.0 . . . . . . . . . . . . A . 10 ARG N . . . . . . . . . c30496_6e5h 1 . 8 . 3254 . 1 1 10 ARG NE N 0.138 -7.853 6.187 . . . 1.0 . . . . . . . . . . . . A . 10 ARG NE . . . . . . . . . c30496_6e5h 1 . 8 . 3255 . 1 1 10 ARG NH1 N 0.456 -7.429 8.432 . . . 1.0 . . . . . . . . . . . . A . 10 ARG NH1 . . . . . . . . . c30496_6e5h 1 . 8 . 3256 . 1 1 10 ARG NH2 N 2.124 -8.411 7.205 . . . 1.0 . . . . . . . . . . . . A . 10 ARG NH2 . . . . . . . . . c30496_6e5h 1 . 8 . 3257 . 1 1 10 ARG O O -4.513 -8.231 2.804 . . . 1.0 . . . . . . . . . . . . A . 10 ARG O . . . . . . . . . c30496_6e5h 1 . 8 . 3258 . 1 1 11 TYR C C -5.768 -5.844 0.741 . . . 1.0 . . . . . . . . . . . . A . 11 TYR C . . . . . . . . . c30496_6e5h 1 . 8 . 3259 . 1 1 11 TYR CA C -5.076 -5.618 2.078 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CA . . . . . . . . . c30496_6e5h 1 . 8 . 3260 . 1 1 11 TYR CB C -4.958 -4.124 2.370 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CB . . . . . . . . . c30496_6e5h 1 . 8 . 3261 . 1 1 11 TYR CD1 C -5.364 -3.835 4.846 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CD1 . . . . . . . . . c30496_6e5h 1 . 8 . 3262 . 1 1 11 TYR CD2 C -3.150 -3.527 4.022 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CD2 . . . . . . . . . c30496_6e5h 1 . 8 . 3263 . 1 1 11 TYR CE1 C -4.932 -3.555 6.125 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CE1 . . . . . . . . . c30496_6e5h 1 . 8 . 3264 . 1 1 11 TYR CE2 C -2.709 -3.249 5.300 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CE2 . . . . . . . . . c30496_6e5h 1 . 8 . 3265 . 1 1 11 TYR CG C -4.483 -3.826 3.772 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CG . . . . . . . . . c30496_6e5h 1 . 8 . 3266 . 1 1 11 TYR CZ C -3.612 -3.289 6.356 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CZ . . . . . . . . . c30496_6e5h 1 . 8 . 3267 . 1 1 11 TYR H H -2.982 -5.706 1.810 . . . 1.0 . . . . . . . . . . . . A . 11 TYR H . . . . . . . . . c30496_6e5h 1 . 8 . 3268 . 1 1 11 TYR HA H -5.665 -6.078 2.855 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HA . . . . . . . . . c30496_6e5h 1 . 8 . 3269 . 1 1 11 TYR HB2 H -4.256 -3.684 1.680 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HB2 . . . . . . . . . c30496_6e5h 1 . 8 . 3270 . 1 1 11 TYR HB3 H -5.924 -3.664 2.240 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HB3 . . . . . . . . . c30496_6e5h 1 . 8 . 3271 . 1 1 11 TYR HD1 H -6.405 -4.064 4.669 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HD1 . . . . . . . . . c30496_6e5h 1 . 8 . 3272 . 1 1 11 TYR HD2 H -2.453 -3.515 3.197 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HD2 . . . . . . . . . c30496_6e5h 1 . 8 . 3273 . 1 1 11 TYR HE1 H -5.633 -3.566 6.944 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HE1 . . . . . . . . . c30496_6e5h 1 . 8 . 3274 . 1 1 11 TYR HE2 H -1.669 -3.021 5.474 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HE2 . . . . . . . . . c30496_6e5h 1 . 8 . 3275 . 1 1 11 TYR HH H -2.580 -2.217 7.601 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HH . . . . . . . . . c30496_6e5h 1 . 8 . 3276 . 1 1 11 TYR N N -3.761 -6.237 2.092 . . . 1.0 . . . . . . . . . . . . A . 11 TYR N . . . . . . . . . c30496_6e5h 1 . 8 . 3277 . 1 1 11 TYR O O -6.396 -4.935 0.196 . . . 1.0 . . . . . . . . . . . . A . 11 TYR O . . . . . . . . . c30496_6e5h 1 . 8 . 3278 . 1 1 11 TYR OH O -3.170 -2.984 7.625 . . . 1.0 . . . . . . . . . . . . A . 11 TYR OH . . . . . . . . . c30496_6e5h 1 . 8 . 3279 . 1 1 12 ABA C C -7.794 -7.105 -0.944 . . . 1.0 . . . . . . . . . . . . A . 12 AIB C . . . . . . . . . c30496_6e5h 1 . 8 . 3280 . 1 1 12 ABA CA C -6.305 -7.475 -1.016 . . . 1.0 . . . . . . . . . . . . A . 12 AIB CA . . . . . . . . . c30496_6e5h 1 . 8 . 3281 . 1 1 12 ABA H H -5.104 -7.726 0.712 . . . 1.0 . . . . . . . . . . . . A . 12 AIB H . . . . . . . . . c30496_6e5h 1 . 8 . 3282 . 1 1 12 ABA N N -5.650 -7.070 0.232 . . . 1.0 . . . . . . . . . . . . A . 12 AIB N . . . . . . . . . c30496_6e5h 1 . 8 . 3283 . 1 1 12 ABA O O -8.463 -7.401 0.049 . . . 1.0 . . . . . . . . . . . . A . 12 AIB O . . . . . . . . . c30496_6e5h 1 . 8 . 3284 . 1 1 13 GLY C C -9.848 -4.569 -1.590 . . . 1.0 . . . . . . . . . . . . A . 13 GLY C . . . . . . . . . c30496_6e5h 1 . 8 . 3285 . 1 1 13 GLY CA C -9.689 -6.028 -1.974 . . . 1.0 . . . . . . . . . . . . A . 13 GLY CA . . . . . . . . . c30496_6e5h 1 . 8 . 3286 . 1 1 13 GLY H H -7.738 -6.251 -2.752 . . . 1.0 . . . . . . . . . . . . A . 13 GLY H . . . . . . . . . c30496_6e5h 1 . 8 . 3287 . 1 1 13 GLY HA2 H -10.100 -6.176 -2.959 . . . 1.0 . . . . . . . . . . . . A . 13 GLY HA2 . . . . . . . . . c30496_6e5h 1 . 8 . 3288 . 1 1 13 GLY HA3 H -10.235 -6.636 -1.270 . . . 1.0 . . . . . . . . . . . . A . 13 GLY HA3 . . . . . . . . . c30496_6e5h 1 . 8 . 3289 . 1 1 13 GLY N N -8.303 -6.447 -1.976 . . . 1.0 . . . . . . . . . . . . A . 13 GLY N . . . . . . . . . c30496_6e5h 1 . 8 . 3290 . 1 1 13 GLY O O -10.880 -3.956 -1.865 . . . 1.0 . . . . . . . . . . . . A . 13 GLY O . . . . . . . . . c30496_6e5h 1 . 8 . 3291 . 1 1 14 CYS C C -7.925 -1.804 -1.452 . . . 1.0 . . . . . . . . . . . . A . 14 CYS C . . . . . . . . . c30496_6e5h 1 . 8 . 3292 . 1 1 14 CYS CA C -8.842 -2.615 -0.552 . . . 1.0 . . . . . . . . . . . . A . 14 CYS CA . . . . . . . . . c30496_6e5h 1 . 8 . 3293 . 1 1 14 CYS CB C -8.378 -2.478 0.897 . . . 1.0 . . . . . . . . . . . . A . 14 CYS CB . . . . . . . . . c30496_6e5h 1 . 8 . 3294 . 1 1 14 CYS H H -8.035 -4.556 -0.751 . . . 1.0 . . . . . . . . . . . . A . 14 CYS H . . . . . . . . . c30496_6e5h 1 . 8 . 3295 . 1 1 14 CYS HA H -9.851 -2.244 -0.641 . . . 1.0 . . . . . . . . . . . . A . 14 CYS HA . . . . . . . . . c30496_6e5h 1 . 8 . 3296 . 1 1 14 CYS HB2 H -7.339 -2.766 0.958 . . . 1.0 . . . . . . . . . . . . A . 14 CYS HB2 . . . . . . . . . c30496_6e5h 1 . 8 . 3297 . 1 1 14 CYS HB3 H -8.477 -1.446 1.202 . . . 1.0 . . . . . . . . . . . . A . 14 CYS HB3 . . . . . . . . . c30496_6e5h 1 . 8 . 3298 . 1 1 14 CYS N N -8.828 -4.013 -0.955 . . . 1.0 . . . . . . . . . . . . A . 14 CYS N . . . . . . . . . c30496_6e5h 1 . 8 . 3299 . 1 1 14 CYS O O -7.032 -2.354 -2.097 . . . 1.0 . . . . . . . . . . . . A . 14 CYS O . . . . . . . . . c30496_6e5h 1 . 8 . 3300 . 1 1 14 CYS SG S -9.307 -3.501 2.083 . . . 1.0 . . . . . . . . . . . . A . 14 CYS SG . . . . . . . . . c30496_6e5h 1 . 8 . 3301 . 1 1 15 GLU C C -6.223 0.984 -1.401 . . . 1.0 . . . . . . . . . . . . A . 15 GLU C . . . . . . . . . c30496_6e5h 1 . 8 . 3302 . 1 1 15 GLU CA C -7.306 0.385 -2.278 . . . 1.0 . . . . . . . . . . . . A . 15 GLU CA . . . . . . . . . c30496_6e5h 1 . 8 . 3303 . 1 1 15 GLU CB C -8.131 1.499 -2.918 . . . 1.0 . . . . . . . . . . . . A . 15 GLU CB . . . . . . . . . c30496_6e5h 1 . 8 . 3304 . 1 1 15 GLU CD C -9.909 2.117 -4.598 . . . 1.0 . . . . . . . . . . . . A . 15 GLU CD . . . . . . . . . c30496_6e5h 1 . 8 . 3305 . 1 1 15 GLU CG C -9.243 1.000 -3.825 . . . 1.0 . . . . . . . . . . . . A . 15 GLU CG . . . . . . . . . c30496_6e5h 1 . 8 . 3306 . 1 1 15 GLU H H -8.880 -0.122 -0.964 . . . 1.0 . . . . . . . . . . . . A . 15 GLU H . . . . . . . . . c30496_6e5h 1 . 8 . 3307 . 1 1 15 GLU HA H -6.840 -0.203 -3.054 . . . 1.0 . . . . . . . . . . . . A . 15 GLU HA . . . . . . . . . c30496_6e5h 1 . 8 . 3308 . 1 1 15 GLU HB2 H -8.577 2.093 -2.135 . . . 1.0 . . . . . . . . . . . . A . 15 GLU HB2 . . . . . . . . . c30496_6e5h 1 . 8 . 3309 . 1 1 15 GLU HB3 H -7.474 2.127 -3.501 . . . 1.0 . . . . . . . . . . . . A . 15 GLU HB3 . . . . . . . . . c30496_6e5h 1 . 8 . 3310 . 1 1 15 GLU HG2 H -8.831 0.293 -4.530 . . . 1.0 . . . . . . . . . . . . A . 15 GLU HG2 . . . . . . . . . c30496_6e5h 1 . 8 . 3311 . 1 1 15 GLU HG3 H -9.989 0.508 -3.220 . . . 1.0 . . . . . . . . . . . . A . 15 GLU HG3 . . . . . . . . . c30496_6e5h 1 . 8 . 3312 . 1 1 15 GLU N N -8.143 -0.501 -1.491 . . . 1.0 . . . . . . . . . . . . A . 15 GLU N . . . . . . . . . c30496_6e5h 1 . 8 . 3313 . 1 1 15 GLU O O -6.501 1.805 -0.523 . . . 1.0 . . . . . . . . . . . . A . 15 GLU O . . . . . . . . . c30496_6e5h 1 . 8 . 3314 . 1 1 15 GLU OE1 O -9.474 2.405 -5.735 . . . 1.0 . . . . . . . . . . . . A . 15 GLU OE1 . . . . . . . . . c30496_6e5h 1 . 8 . 3315 . 1 1 15 GLU OE2 O -10.866 2.720 -4.069 . . . 1.0 . . . . . . . . . . . . A . 15 GLU OE2 . . . . . . . . . c30496_6e5h 1 . 8 . 3316 . 1 1 16 VAL C C -3.123 2.105 -1.684 . . . 1.0 . . . . . . . . . . . . A . 16 VAL C . . . . . . . . . c30496_6e5h 1 . 8 . 3317 . 1 1 16 VAL CA C -3.864 1.058 -0.872 . . . 1.0 . . . . . . . . . . . . A . 16 VAL CA . . . . . . . . . c30496_6e5h 1 . 8 . 3318 . 1 1 16 VAL CB C -2.881 -0.065 -0.479 . . . 1.0 . . . . . . . . . . . . A . 16 VAL CB . . . . . . . . . c30496_6e5h 1 . 8 . 3319 . 1 1 16 VAL CG1 C -1.731 0.492 0.349 . . . 1.0 . . . . . . . . . . . . A . 16 VAL CG1 . . . . . . . . . c30496_6e5h 1 . 8 . 3320 . 1 1 16 VAL CG2 C -3.602 -1.170 0.275 . . . 1.0 . . . . . . . . . . . . A . 16 VAL CG2 . . . . . . . . . c30496_6e5h 1 . 8 . 3321 . 1 1 16 VAL H H -4.845 -0.108 -2.332 . . . 1.0 . . . . . . . . . . . . A . 16 VAL H . . . . . . . . . c30496_6e5h 1 . 8 . 3322 . 1 1 16 VAL HA H -4.242 1.515 0.032 . . . 1.0 . . . . . . . . . . . . A . 16 VAL HA . . . . . . . . . c30496_6e5h 1 . 8 . 3323 . 1 1 16 VAL HB H -2.471 -0.484 -1.387 . . . 1.0 . . . . . . . . . . . . A . 16 VAL HB . . . . . . . . . c30496_6e5h 1 . 8 . 3324 . 1 1 16 VAL HG11 H -1.088 -0.317 0.666 . . . 1.0 . . . . . . . . . . . . A . 16 VAL HG11 . . . . . . . . . c30496_6e5h 1 . 8 . 3325 . 1 1 16 VAL HG12 H -2.124 1.000 1.217 . . . 1.0 . . . . . . . . . . . . A . 16 VAL HG12 . . . . . . . . . c30496_6e5h 1 . 8 . 3326 . 1 1 16 VAL HG13 H -1.161 1.190 -0.249 . . . 1.0 . . . . . . . . . . . . A . 16 VAL HG13 . . . . . . . . . c30496_6e5h 1 . 8 . 3327 . 1 1 16 VAL HG21 H -4.238 -1.716 -0.406 . . . 1.0 . . . . . . . . . . . . A . 16 VAL HG21 . . . . . . . . . c30496_6e5h 1 . 8 . 3328 . 1 1 16 VAL HG22 H -4.203 -0.736 1.055 . . . 1.0 . . . . . . . . . . . . A . 16 VAL HG22 . . . . . . . . . c30496_6e5h 1 . 8 . 3329 . 1 1 16 VAL HG23 H -2.875 -1.842 0.709 . . . 1.0 . . . . . . . . . . . . A . 16 VAL HG23 . . . . . . . . . c30496_6e5h 1 . 8 . 3330 . 1 1 16 VAL N N -4.995 0.555 -1.627 . . . 1.0 . . . . . . . . . . . . A . 16 VAL N . . . . . . . . . c30496_6e5h 1 . 8 . 3331 . 1 1 16 VAL O O -2.570 1.807 -2.744 . . . 1.0 . . . . . . . . . . . . A . 16 VAL O . . . . . . . . . c30496_6e5h 1 . 8 . 3332 . 1 1 17 ARG C C -1.004 4.490 -1.362 . . . 1.0 . . . . . . . . . . . . A . 17 ARG C . . . . . . . . . c30496_6e5h 1 . 8 . 3333 . 1 1 17 ARG CA C -2.431 4.411 -1.865 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CA . . . . . . . . . c30496_6e5h 1 . 8 . 3334 . 1 1 17 ARG CB C -3.135 5.750 -1.650 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CB . . . . . . . . . c30496_6e5h 1 . 8 . 3335 . 1 1 17 ARG CD C -5.120 7.188 -2.184 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CD . . . . . . . . . c30496_6e5h 1 . 8 . 3336 . 1 1 17 ARG CG C -4.573 5.771 -2.137 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CG . . . . . . . . . c30496_6e5h 1 . 8 . 3337 . 1 1 17 ARG CZ C -4.534 9.340 -3.247 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CZ . . . . . . . . . c30496_6e5h 1 . 8 . 3338 . 1 1 17 ARG H H -3.610 3.509 -0.356 . . . 1.0 . . . . . . . . . . . . A . 17 ARG H . . . . . . . . . c30496_6e5h 1 . 8 . 3339 . 1 1 17 ARG HA H -2.414 4.188 -2.920 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HA . . . . . . . . . c30496_6e5h 1 . 8 . 3340 . 1 1 17 ARG HB2 H -3.131 5.978 -0.598 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HB2 . . . . . . . . . c30496_6e5h 1 . 8 . 3341 . 1 1 17 ARG HB3 H -2.587 6.517 -2.176 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HB3 . . . . . . . . . c30496_6e5h 1 . 8 . 3342 . 1 1 17 ARG HD2 H -6.157 7.152 -2.485 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HD2 . . . . . . . . . c30496_6e5h 1 . 8 . 3343 . 1 1 17 ARG HD3 H -5.045 7.624 -1.198 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HD3 . . . . . . . . . c30496_6e5h 1 . 8 . 3344 . 1 1 17 ARG HE H -3.722 7.571 -3.712 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HE . . . . . . . . . c30496_6e5h 1 . 8 . 3345 . 1 1 17 ARG HG2 H -4.615 5.349 -3.129 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HG2 . . . . . . . . . c30496_6e5h 1 . 8 . 3346 . 1 1 17 ARG HG3 H -5.180 5.182 -1.467 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HG3 . . . . . . . . . c30496_6e5h 1 . 8 . 3347 . 1 1 17 ARG HH11 H -5.979 9.468 -1.831 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH11 . . . . . . . . . c30496_6e5h 1 . 8 . 3348 . 1 1 17 ARG HH12 H -5.527 10.973 -2.570 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH12 . . . . . . . . . c30496_6e5h 1 . 8 . 3349 . 1 1 17 ARG HH21 H -3.139 9.525 -4.705 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH21 . . . . . . . . . c30496_6e5h 1 . 8 . 3350 . 1 1 17 ARG HH22 H -3.905 11.006 -4.218 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH22 . . . . . . . . . c30496_6e5h 1 . 8 . 3351 . 1 1 17 ARG N N -3.131 3.331 -1.196 . . . 1.0 . . . . . . . . . . . . A . 17 ARG N . . . . . . . . . c30496_6e5h 1 . 8 . 3352 . 1 1 17 ARG NE N -4.377 8.022 -3.130 . . . 1.0 . . . . . . . . . . . . A . 17 ARG NE . . . . . . . . . c30496_6e5h 1 . 8 . 3353 . 1 1 17 ARG NH1 N -5.418 9.978 -2.490 . . . 1.0 . . . . . . . . . . . . A . 17 ARG NH1 . . . . . . . . . c30496_6e5h 1 . 8 . 3354 . 1 1 17 ARG NH2 N -3.802 10.011 -4.126 . . . 1.0 . . . . . . . . . . . . A . 17 ARG NH2 . . . . . . . . . c30496_6e5h 1 . 8 . 3355 . 1 1 17 ARG O O -0.766 4.542 -0.155 . . . 1.0 . . . . . . . . . . . . A . 17 ARG O . . . . . . . . . c30496_6e5h 1 . 8 . 3356 . 1 1 18 CYS C C 1.979 5.817 -2.405 . . . 1.0 . . . . . . . . . . . . A . 18 CYS C . . . . . . . . . c30496_6e5h 1 . 8 . 3357 . 1 1 18 CYS CA C 1.342 4.515 -1.947 . . . 1.0 . . . . . . . . . . . . A . 18 CYS CA . . . . . . . . . c30496_6e5h 1 . 8 . 3358 . 1 1 18 CYS CB C 2.068 3.334 -2.587 . . . 1.0 . . . . . . . . . . . . A . 18 CYS CB . . . . . . . . . c30496_6e5h 1 . 8 . 3359 . 1 1 18 CYS H H -0.323 4.447 -3.230 . . . 1.0 . . . . . . . . . . . . A . 18 CYS H . . . . . . . . . c30496_6e5h 1 . 8 . 3360 . 1 1 18 CYS HA H 1.426 4.439 -0.875 . . . 1.0 . . . . . . . . . . . . A . 18 CYS HA . . . . . . . . . c30496_6e5h 1 . 8 . 3361 . 1 1 18 CYS HB2 H 1.925 3.375 -3.656 . . . 1.0 . . . . . . . . . . . . A . 18 CYS HB2 . . . . . . . . . c30496_6e5h 1 . 8 . 3362 . 1 1 18 CYS HB3 H 3.123 3.412 -2.370 . . . 1.0 . . . . . . . . . . . . A . 18 CYS HB3 . . . . . . . . . c30496_6e5h 1 . 8 . 3363 . 1 1 18 CYS N N -0.064 4.480 -2.287 . . . 1.0 . . . . . . . . . . . . A . 18 CYS N . . . . . . . . . c30496_6e5h 1 . 8 . 3364 . 1 1 18 CYS O O 2.068 6.092 -3.603 . . . 1.0 . . . . . . . . . . . . A . 18 CYS O . . . . . . . . . c30496_6e5h 1 . 8 . 3365 . 1 1 18 CYS SG S 1.495 1.700 -2.019 . . . 1.0 . . . . . . . . . . . . A . 18 CYS SG . . . . . . . . . c30496_6e5h 1 . 8 . 3366 . 1 1 19 ASP C C 4.387 7.903 -0.894 . . . 1.0 . . . . . . . . . . . . A . 19 ASP C . . . . . . . . . c30496_6e5h 1 . 8 . 3367 . 1 1 19 ASP CA C 3.126 7.847 -1.740 . . . 1.0 . . . . . . . . . . . . A . 19 ASP CA . . . . . . . . . c30496_6e5h 1 . 8 . 3368 . 1 1 19 ASP CB C 2.244 9.067 -1.471 . . . 1.0 . . . . . . . . . . . . A . 19 ASP CB . . . . . . . . . c30496_6e5h 1 . 8 . 3369 . 1 1 19 ASP CG C 2.892 10.359 -1.928 . . . 1.0 . . . . . . . . . . . . A . 19 ASP CG . . . . . . . . . c30496_6e5h 1 . 8 . 3370 . 1 1 19 ASP H H 2.250 6.376 -0.507 . . . 1.0 . . . . . . . . . . . . A . 19 ASP H . . . . . . . . . c30496_6e5h 1 . 8 . 3371 . 1 1 19 ASP HA H 3.404 7.834 -2.783 . . . 1.0 . . . . . . . . . . . . A . 19 ASP HA . . . . . . . . . c30496_6e5h 1 . 8 . 3372 . 1 1 19 ASP HB2 H 1.308 8.950 -1.996 . . . 1.0 . . . . . . . . . . . . A . 19 ASP HB2 . . . . . . . . . c30496_6e5h 1 . 8 . 3373 . 1 1 19 ASP HB3 H 2.052 9.137 -0.411 . . . 1.0 . . . . . . . . . . . . A . 19 ASP HB3 . . . . . . . . . c30496_6e5h 1 . 8 . 3374 . 1 1 19 ASP N N 2.411 6.618 -1.448 . . . 1.0 . . . . . . . . . . . . A . 19 ASP N . . . . . . . . . c30496_6e5h 1 . 8 . 3375 . 1 1 19 ASP O O 4.385 8.437 0.219 . . . 1.0 . . . . . . . . . . . . A . 19 ASP O . . . . . . . . . c30496_6e5h 1 . 8 . 3376 . 1 1 19 ASP OD1 O 3.457 11.080 -1.078 . . . 1.0 . . . . . . . . . . . . A . 19 ASP OD1 . . . . . . . . . c30496_6e5h 1 . 8 . 3377 . 1 1 19 ASP OD2 O 2.852 10.661 -3.139 . . . 1.0 . . . . . . . . . . . . A . 19 ASP OD2 . . . . . . . . . c30496_6e5h 1 . 8 . 3378 . 1 1 20 DPR C C 6.578 6.379 0.603 . . . 1.0 . . . . . . . . . . . . A . 20 DPR C . . . . . . . . . c30496_6e5h 1 . 8 . 3379 . 1 1 20 DPR CA C 6.735 7.229 -0.656 . . . 1.0 . . . . . . . . . . . . A . 20 DPR CA . . . . . . . . . c30496_6e5h 1 . 8 . 3380 . 1 1 20 DPR CB C 7.706 6.576 -1.643 . . . 1.0 . . . . . . . . . . . . A . 20 DPR CB . . . . . . . . . c30496_6e5h 1 . 8 . 3381 . 1 1 20 DPR CD C 5.570 6.674 -2.720 . . . 1.0 . . . . . . . . . . . . A . 20 DPR CD . . . . . . . . . c30496_6e5h 1 . 8 . 3382 . 1 1 20 DPR CG C 6.838 5.873 -2.630 . . . 1.0 . . . . . . . . . . . . A . 20 DPR CG . . . . . . . . . c30496_6e5h 1 . 8 . 3383 . 1 1 20 DPR HA H 7.102 8.203 -0.388 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HA . . . . . . . . . c30496_6e5h 1 . 8 . 3384 . 1 1 20 DPR HB2 H 8.308 7.340 -2.114 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HB2 . . . . . . . . . c30496_6e5h 1 . 8 . 3385 . 1 1 20 DPR HB3 H 8.344 5.882 -1.116 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HB3 . . . . . . . . . c30496_6e5h 1 . 8 . 3386 . 1 1 20 DPR HD2 H 5.643 7.416 -3.502 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HD2 . . . . . . . . . c30496_6e5h 1 . 8 . 3387 . 1 1 20 DPR HD3 H 4.724 6.023 -2.891 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HD3 . . . . . . . . . c30496_6e5h 1 . 8 . 3388 . 1 1 20 DPR HG2 H 7.329 5.839 -3.592 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HG2 . . . . . . . . . c30496_6e5h 1 . 8 . 3389 . 1 1 20 DPR HG3 H 6.625 4.875 -2.281 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HG3 . . . . . . . . . c30496_6e5h 1 . 8 . 3390 . 1 1 20 DPR N N 5.479 7.314 -1.397 . . . 1.0 . . . . . . . . . . . . A . 20 DPR N . . . . . . . . . c30496_6e5h 1 . 8 . 3391 . 1 1 20 DPR O O 6.198 5.209 0.532 . . . 1.0 . . . . . . . . . . . . A . 20 DPR O . . . . . . . . . c30496_6e5h 1 . 8 . 3392 . 1 1 21 PRO C C 5.252 6.440 3.587 . . . 1.0 . . . . . . . . . . . . A . 21 PRO C . . . . . . . . . c30496_6e5h 1 . 8 . 3393 . 1 1 21 PRO CA C 6.680 6.302 3.056 . . . 1.0 . . . . . . . . . . . . A . 21 PRO CA . . . . . . . . . c30496_6e5h 1 . 8 . 3394 . 1 1 21 PRO CB C 7.664 7.043 3.955 . . . 1.0 . . . . . . . . . . . . A . 21 PRO CB . . . . . . . . . c30496_6e5h 1 . 8 . 3395 . 1 1 21 PRO CD C 7.427 8.321 1.933 . . . 1.0 . . . . . . . . . . . . A . 21 PRO CD . . . . . . . . . c30496_6e5h 1 . 8 . 3396 . 1 1 21 PRO CG C 7.683 8.434 3.418 . . . 1.0 . . . . . . . . . . . . A . 21 PRO CG . . . . . . . . . c30496_6e5h 1 . 8 . 3397 . 1 1 21 PRO HA H 6.947 5.257 3.007 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HA . . . . . . . . . c30496_6e5h 1 . 8 . 3398 . 1 1 21 PRO HB2 H 7.315 7.016 4.977 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HB2 . . . . . . . . . c30496_6e5h 1 . 8 . 3399 . 1 1 21 PRO HB3 H 8.637 6.583 3.888 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HB3 . . . . . . . . . c30496_6e5h 1 . 8 . 3400 . 1 1 21 PRO HD2 H 6.720 9.071 1.614 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HD2 . . . . . . . . . c30496_6e5h 1 . 8 . 3401 . 1 1 21 PRO HD3 H 8.351 8.417 1.385 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HD3 . . . . . . . . . c30496_6e5h 1 . 8 . 3402 . 1 1 21 PRO HG2 H 6.906 9.018 3.887 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HG2 . . . . . . . . . c30496_6e5h 1 . 8 . 3403 . 1 1 21 PRO HG3 H 8.649 8.882 3.597 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HG3 . . . . . . . . . c30496_6e5h 1 . 8 . 3404 . 1 1 21 PRO N N 6.863 6.967 1.772 . . . 1.0 . . . . . . . . . . . . A . 21 PRO N . . . . . . . . . c30496_6e5h 1 . 8 . 3405 . 1 1 21 PRO O O 4.932 5.941 4.668 . . . 1.0 . . . . . . . . . . . . A . 21 PRO O . . . . . . . . . c30496_6e5h 1 . 8 . 3406 . 1 1 22 ARG C C 2.122 6.303 2.522 . . . 1.0 . . . . . . . . . . . . A . 22 ARG C . . . . . . . . . c30496_6e5h 1 . 8 . 3407 . 1 1 22 ARG CA C 3.011 7.307 3.228 . . . 1.0 . . . . . . . . . . . . A . 22 ARG CA . . . . . . . . . c30496_6e5h 1 . 8 . 3408 . 1 1 22 ARG CB C 2.530 8.726 2.915 . . . 1.0 . . . . . . . . . . . . A . 22 ARG CB . . . . . . . . . c30496_6e5h 1 . 8 . 3409 . 1 1 22 ARG CD C 2.664 11.183 3.426 . . . 1.0 . . . . . . . . . . . . A . 22 ARG CD . . . . . . . . . c30496_6e5h 1 . 8 . 3410 . 1 1 22 ARG CG C 3.290 9.814 3.655 . . . 1.0 . . . . . . . . . . . . A . 22 ARG CG . . . . . . . . . c30496_6e5h 1 . 8 . 3411 . 1 1 22 ARG CZ C 1.916 12.575 1.525 . . . 1.0 . . . . . . . . . . . . A . 22 ARG CZ . . . . . . . . . c30496_6e5h 1 . 8 . 3412 . 1 1 22 ARG H H 4.702 7.483 1.965 . . . 1.0 . . . . . . . . . . . . A . 22 ARG H . . . . . . . . . c30496_6e5h 1 . 8 . 3413 . 1 1 22 ARG HA H 2.950 7.140 4.291 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HA . . . . . . . . . c30496_6e5h 1 . 8 . 3414 . 1 1 22 ARG HB2 H 2.636 8.901 1.855 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HB2 . . . . . . . . . c30496_6e5h 1 . 8 . 3415 . 1 1 22 ARG HB3 H 1.486 8.802 3.181 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HB3 . . . . . . . . . c30496_6e5h 1 . 8 . 3416 . 1 1 22 ARG HD2 H 1.658 11.174 3.820 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HD2 . . . . . . . . . c30496_6e5h 1 . 8 . 3417 . 1 1 22 ARG HD3 H 3.248 11.923 3.955 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HD3 . . . . . . . . . c30496_6e5h 1 . 8 . 3418 . 1 1 22 ARG HE H 3.123 10.988 1.380 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HE . . . . . . . . . c30496_6e5h 1 . 8 . 3419 . 1 1 22 ARG HG2 H 3.272 9.595 4.713 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HG2 . . . . . . . . . c30496_6e5h 1 . 8 . 3420 . 1 1 22 ARG HG3 H 4.312 9.830 3.307 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HG3 . . . . . . . . . c30496_6e5h 1 . 8 . 3421 . 1 1 22 ARG HH11 H 1.177 13.168 3.318 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HH11 . . . . . . . . . c30496_6e5h 1 . 8 . 3422 . 1 1 22 ARG HH12 H 0.685 14.124 1.957 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HH12 . . . . . . . . . c30496_6e5h 1 . 8 . 3423 . 1 1 22 ARG HH21 H 1.413 13.598 -0.148 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HH21 . . . . . . . . . c30496_6e5h 1 . 8 . 3424 . 1 1 22 ARG HH22 H 2.468 12.233 -0.397 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HH22 . . . . . . . . . c30496_6e5h 1 . 8 . 3425 . 1 1 22 ARG N N 4.398 7.119 2.827 . . . 1.0 . . . . . . . . . . . . A . 22 ARG N . . . . . . . . . c30496_6e5h 1 . 8 . 3426 . 1 1 22 ARG NE N 2.611 11.545 2.009 . . . 1.0 . . . . . . . . . . . . A . 22 ARG NE . . . . . . . . . c30496_6e5h 1 . 8 . 3427 . 1 1 22 ARG NH1 N 1.202 13.350 2.332 . . . 1.0 . . . . . . . . . . . . A . 22 ARG NH1 . . . . . . . . . c30496_6e5h 1 . 8 . 3428 . 1 1 22 ARG NH2 N 1.932 12.824 0.225 . . . 1.0 . . . . . . . . . . . . A . 22 ARG NH2 . . . . . . . . . c30496_6e5h 1 . 8 . 3429 . 1 1 22 ARG O O 2.241 6.102 1.313 . . . 1.0 . . . . . . . . . . . . A . 22 ARG O . . . . . . . . . c30496_6e5h 1 . 8 . 3430 . 1 1 23 TYR C C -1.060 4.878 3.273 . . . 1.0 . . . . . . . . . . . . A . 23 TYR C . . . . . . . . . c30496_6e5h 1 . 8 . 3431 . 1 1 23 TYR CA C 0.339 4.675 2.726 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CA . . . . . . . . . c30496_6e5h 1 . 8 . 3432 . 1 1 23 TYR CB C 0.830 3.262 3.046 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CB . . . . . . . . . c30496_6e5h 1 . 8 . 3433 . 1 1 23 TYR CD1 C 3.265 2.978 3.605 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CD1 . . . . . . . . . c30496_6e5h 1 . 8 . 3434 . 1 1 23 TYR CD2 C 2.616 2.840 1.319 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CD2 . . . . . . . . . c30496_6e5h 1 . 8 . 3435 . 1 1 23 TYR CE1 C 4.576 2.742 3.250 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CE1 . . . . . . . . . c30496_6e5h 1 . 8 . 3436 . 1 1 23 TYR CE2 C 3.926 2.609 0.955 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CE2 . . . . . . . . . c30496_6e5h 1 . 8 . 3437 . 1 1 23 TYR CG C 2.265 3.029 2.649 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CG . . . . . . . . . c30496_6e5h 1 . 8 . 3438 . 1 1 23 TYR CZ C 4.912 2.640 1.912 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CZ . . . . . . . . . c30496_6e5h 1 . 8 . 3439 . 1 1 23 TYR H H 1.188 5.886 4.235 . . . 1.0 . . . . . . . . . . . . A . 23 TYR H . . . . . . . . . c30496_6e5h 1 . 8 . 3440 . 1 1 23 TYR HA H 0.319 4.806 1.656 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HA . . . . . . . . . c30496_6e5h 1 . 8 . 3441 . 1 1 23 TYR HB2 H 0.743 3.086 4.104 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HB2 . . . . . . . . . c30496_6e5h 1 . 8 . 3442 . 1 1 23 TYR HB3 H 0.218 2.551 2.512 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HB3 . . . . . . . . . c30496_6e5h 1 . 8 . 3443 . 1 1 23 TYR HD1 H 3.006 3.123 4.644 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HD1 . . . . . . . . . c30496_6e5h 1 . 8 . 3444 . 1 1 23 TYR HD2 H 1.847 2.876 0.562 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HD2 . . . . . . . . . c30496_6e5h 1 . 8 . 3445 . 1 1 23 TYR HE1 H 5.338 2.704 4.009 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HE1 . . . . . . . . . c30496_6e5h 1 . 8 . 3446 . 1 1 23 TYR HE2 H 4.180 2.467 -0.084 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HE2 . . . . . . . . . c30496_6e5h 1 . 8 . 3447 . 1 1 23 TYR HH H 6.523 1.538 2.058 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HH . . . . . . . . . c30496_6e5h 1 . 8 . 3448 . 1 1 23 TYR N N 1.242 5.670 3.278 . . . 1.0 . . . . . . . . . . . . A . 23 TYR N . . . . . . . . . c30496_6e5h 1 . 8 . 3449 . 1 1 23 TYR O O -1.247 5.051 4.479 . . . 1.0 . . . . . . . . . . . . A . 23 TYR O . . . . . . . . . c30496_6e5h 1 . 8 . 3450 . 1 1 23 TYR OH O 6.208 2.312 1.571 . . . 1.0 . . . . . . . . . . . . A . 23 TYR OH . . . . . . . . . c30496_6e5h 1 . 8 . 3451 . 1 1 24 GLU C C -4.297 3.919 2.358 . . . 1.0 . . . . . . . . . . . . A . 24 GLU C . . . . . . . . . c30496_6e5h 1 . 8 . 3452 . 1 1 24 GLU CA C -3.422 5.090 2.781 . . . 1.0 . . . . . . . . . . . . A . 24 GLU CA . . . . . . . . . c30496_6e5h 1 . 8 . 3453 . 1 1 24 GLU CB C -3.956 6.386 2.166 . . . 1.0 . . . . . . . . . . . . A . 24 GLU CB . . . . . . . . . c30496_6e5h 1 . 8 . 3454 . 1 1 24 GLU CD C -3.676 8.875 1.884 . . . 1.0 . . . . . . . . . . . . A . 24 GLU CD . . . . . . . . . c30496_6e5h 1 . 8 . 3455 . 1 1 24 GLU CG C -3.060 7.593 2.398 . . . 1.0 . . . . . . . . . . . . A . 24 GLU CG . . . . . . . . . c30496_6e5h 1 . 8 . 3456 . 1 1 24 GLU H H -1.826 4.695 1.440 . . . 1.0 . . . . . . . . . . . . A . 24 GLU H . . . . . . . . . c30496_6e5h 1 . 8 . 3457 . 1 1 24 GLU HA H -3.449 5.172 3.858 . . . 1.0 . . . . . . . . . . . . A . 24 GLU HA . . . . . . . . . c30496_6e5h 1 . 8 . 3458 . 1 1 24 GLU HB2 H -4.068 6.248 1.103 . . . 1.0 . . . . . . . . . . . . A . 24 GLU HB2 . . . . . . . . . c30496_6e5h 1 . 8 . 3459 . 1 1 24 GLU HB3 H -4.924 6.600 2.593 . . . 1.0 . . . . . . . . . . . . A . 24 GLU HB3 . . . . . . . . . c30496_6e5h 1 . 8 . 3460 . 1 1 24 GLU HG2 H -2.882 7.696 3.457 . . . 1.0 . . . . . . . . . . . . A . 24 GLU HG2 . . . . . . . . . c30496_6e5h 1 . 8 . 3461 . 1 1 24 GLU HG3 H -2.120 7.432 1.890 . . . 1.0 . . . . . . . . . . . . A . 24 GLU HG3 . . . . . . . . . c30496_6e5h 1 . 8 . 3462 . 1 1 24 GLU N N -2.039 4.865 2.387 . . . 1.0 . . . . . . . . . . . . A . 24 GLU N . . . . . . . . . c30496_6e5h 1 . 8 . 3463 . 1 1 24 GLU O O -4.637 3.775 1.183 . . . 1.0 . . . . . . . . . . . . A . 24 GLU O . . . . . . . . . c30496_6e5h 1 . 8 . 3464 . 1 1 24 GLU OE1 O -3.852 9.010 0.657 . . . 1.0 . . . . . . . . . . . . A . 24 GLU OE1 . . . . . . . . . c30496_6e5h 1 . 8 . 3465 . 1 1 24 GLU OE2 O -3.986 9.762 2.708 . . . 1.0 . . . . . . . . . . . . A . 24 GLU OE2 . . . . . . . . . c30496_6e5h 1 . 8 . 3466 . 1 1 25 VAL C C -6.961 2.296 3.127 . . . 1.0 . . . . . . . . . . . . A . 25 VAL C . . . . . . . . . c30496_6e5h 1 . 8 . 3467 . 1 1 25 VAL CA C -5.486 1.920 3.051 . . . 1.0 . . . . . . . . . . . . A . 25 VAL CA . . . . . . . . . c30496_6e5h 1 . 8 . 3468 . 1 1 25 VAL CB C -5.199 0.777 4.048 . . . 1.0 . . . . . . . . . . . . A . 25 VAL CB . . . . . . . . . c30496_6e5h 1 . 8 . 3469 . 1 1 25 VAL CG1 C -6.114 -0.411 3.787 . . . 1.0 . . . . . . . . . . . . A . 25 VAL CG1 . . . . . . . . . c30496_6e5h 1 . 8 . 3470 . 1 1 25 VAL CG2 C -3.739 0.355 3.976 . . . 1.0 . . . . . . . . . . . . A . 25 VAL CG2 . . . . . . . . . c30496_6e5h 1 . 8 . 3471 . 1 1 25 VAL H H -4.345 3.247 4.235 . . . 1.0 . . . . . . . . . . . . A . 25 VAL H . . . . . . . . . c30496_6e5h 1 . 8 . 3472 . 1 1 25 VAL HA H -5.264 1.569 2.054 . . . 1.0 . . . . . . . . . . . . A . 25 VAL HA . . . . . . . . . c30496_6e5h 1 . 8 . 3473 . 1 1 25 VAL HB H -5.396 1.143 5.045 . . . 1.0 . . . . . . . . . . . . A . 25 VAL HB . . . . . . . . . c30496_6e5h 1 . 8 . 3474 . 1 1 25 VAL HG11 H -5.950 -0.779 2.786 . . . 1.0 . . . . . . . . . . . . A . 25 VAL HG11 . . . . . . . . . c30496_6e5h 1 . 8 . 3475 . 1 1 25 VAL HG12 H -7.145 -0.102 3.891 . . . 1.0 . . . . . . . . . . . . A . 25 VAL HG12 . . . . . . . . . c30496_6e5h 1 . 8 . 3476 . 1 1 25 VAL HG13 H -5.900 -1.194 4.498 . . . 1.0 . . . . . . . . . . . . A . 25 VAL HG13 . . . . . . . . . c30496_6e5h 1 . 8 . 3477 . 1 1 25 VAL HG21 H -3.105 1.205 4.178 . . . 1.0 . . . . . . . . . . . . A . 25 VAL HG21 . . . . . . . . . c30496_6e5h 1 . 8 . 3478 . 1 1 25 VAL HG22 H -3.523 -0.030 2.992 . . . 1.0 . . . . . . . . . . . . A . 25 VAL HG22 . . . . . . . . . c30496_6e5h 1 . 8 . 3479 . 1 1 25 VAL HG23 H -3.549 -0.415 4.712 . . . 1.0 . . . . . . . . . . . . A . 25 VAL HG23 . . . . . . . . . c30496_6e5h 1 . 8 . 3480 . 1 1 25 VAL N N -4.649 3.079 3.318 . . . 1.0 . . . . . . . . . . . . A . 25 VAL N . . . . . . . . . c30496_6e5h 1 . 8 . 3481 . 1 1 25 VAL O O -7.431 2.801 4.147 . . . 1.0 . . . . . . . . . . . . A . 25 VAL O . . . . . . . . . c30496_6e5h 1 . 8 . 3482 . 1 1 26 HIS C C -9.883 1.107 1.606 . . . 1.0 . . . . . . . . . . . . A . 26 HIS C . . . . . . . . . c30496_6e5h 1 . 8 . 3483 . 1 1 26 HIS CA C -9.107 2.357 2.001 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CA . . . . . . . . . c30496_6e5h 1 . 8 . 3484 . 1 1 26 HIS CB C -9.408 3.490 1.013 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CB . . . . . . . . . c30496_6e5h 1 . 8 . 3485 . 1 1 26 HIS CD2 C -8.785 5.636 2.331 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CD2 . . . . . . . . . c30496_6e5h 1 . 8 . 3486 . 1 1 26 HIS CE1 C -7.254 6.414 0.974 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CE1 . . . . . . . . . c30496_6e5h 1 . 8 . 3487 . 1 1 26 HIS CG C -8.678 4.766 1.301 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CG . . . . . . . . . c30496_6e5h 1 . 8 . 3488 . 1 1 26 HIS H H -7.240 1.710 1.236 . . . 1.0 . . . . . . . . . . . . A . 26 HIS H . . . . . . . . . c30496_6e5h 1 . 8 . 3489 . 1 1 26 HIS HA H -9.413 2.659 2.988 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HA . . . . . . . . . c30496_6e5h 1 . 8 . 3490 . 1 1 26 HIS HB2 H -9.134 3.172 0.022 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HB2 . . . . . . . . . c30496_6e5h 1 . 8 . 3491 . 1 1 26 HIS HB3 H -10.466 3.701 1.036 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HB3 . . . . . . . . . c30496_6e5h 1 . 8 . 3492 . 1 1 26 HIS HD1 H -7.413 4.890 -0.385 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HD1 . . . . . . . . . c30496_6e5h 1 . 8 . 3493 . 1 1 26 HIS HD2 H -9.454 5.550 3.173 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HD2 . . . . . . . . . c30496_6e5h 1 . 8 . 3494 . 1 1 26 HIS HE1 H -6.489 7.039 0.538 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HE1 . . . . . . . . . c30496_6e5h 1 . 8 . 3495 . 1 1 26 HIS HE2 H -7.810 7.474 2.637 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HE2 . . . . . . . . . c30496_6e5h 1 . 8 . 3496 . 1 1 26 HIS N N -7.680 2.072 2.040 . . . 1.0 . . . . . . . . . . . . A . 26 HIS N . . . . . . . . . c30496_6e5h 1 . 8 . 3497 . 1 1 26 HIS ND1 N -7.712 5.286 0.466 . . . 1.0 . . . . . . . . . . . . A . 26 HIS ND1 . . . . . . . . . c30496_6e5h 1 . 8 . 3498 . 1 1 26 HIS NE2 N -7.888 6.650 2.104 . . . 1.0 . . . . . . . . . . . . A . 26 HIS NE2 . . . . . . . . . c30496_6e5h 1 . 8 . 3499 . 1 1 26 HIS O O -9.785 0.639 0.473 . . . 1.0 . . . . . . . . . . . . A . 26 HIS O . . . . . . . . . c30496_6e5h 1 . 8 . 3500 . 1 1 27 CYS C C -12.892 -0.260 2.096 . . . 1.0 . . . . . . . . . . . . A . 27 CYS C . . . . . . . . . c30496_6e5h 1 . 8 . 3501 . 1 1 27 CYS CA C -11.429 -0.630 2.285 . . . 1.0 . . . . . . . . . . . . A . 27 CYS CA . . . . . . . . . c30496_6e5h 1 . 8 . 3502 . 1 1 27 CYS CB C -11.286 -1.632 3.432 . . . 1.0 . . . . . . . . . . . . A . 27 CYS CB . . . . . . . . . c30496_6e5h 1 . 8 . 3503 . 1 1 27 CYS H H -10.654 0.960 3.439 . . . 1.0 . . . . . . . . . . . . A . 27 CYS H . . . . . . . . . c30496_6e5h 1 . 8 . 3504 . 1 1 27 CYS HA H -11.064 -1.080 1.376 . . . 1.0 . . . . . . . . . . . . A . 27 CYS HA . . . . . . . . . c30496_6e5h 1 . 8 . 3505 . 1 1 27 CYS HB2 H -11.587 -1.158 4.352 . . . 1.0 . . . . . . . . . . . . A . 27 CYS HB2 . . . . . . . . . c30496_6e5h 1 . 8 . 3506 . 1 1 27 CYS HB3 H -11.931 -2.476 3.240 . . . 1.0 . . . . . . . . . . . . A . 27 CYS HB3 . . . . . . . . . c30496_6e5h 1 . 8 . 3507 . 1 1 27 CYS N N -10.633 0.558 2.545 . . . 1.0 . . . . . . . . . . . . A . 27 CYS N . . . . . . . . . c30496_6e5h 1 . 8 . 3508 . 1 1 27 CYS O O -13.679 -0.270 3.041 . . . 1.0 . . . . . . . . . . . . A . 27 CYS O . . . . . . . . . c30496_6e5h 1 . 8 . 3509 . 1 1 27 CYS SG S -9.592 -2.267 3.669 . . . 1.0 . . . . . . . . . . . . A . 27 CYS SG . . . . . . . . . c30496_6e5h 1 . 8 . 3510 . 1 1 28 NH2 HN1 H -12.567 0.060 0.167 . . . 1.0 . . . . . . . . . . . . A . 28 NH2 HN1 . . . . . . . . . c30496_6e5h 1 . 8 . 3511 . 1 1 28 NH2 HN2 H -14.184 0.322 0.714 . . . 1.0 . . . . . . . . . . . . A . 28 NH2 HN2 . . . . . . . . . c30496_6e5h 1 . 8 . 3512 . 1 1 28 NH2 N N -13.251 0.075 0.871 . . . 1.0 . . . . . . . . . . . . A . 28 NH2 N . . . . . . . . . c30496_6e5h 1 . 9 . 3513 . 1 1 1 ASN C C 9.778 -2.437 -1.746 . . . 1.0 . . . . . . . . . . . . A . 1 ASN C . . . . . . . . . c30496_6e5h 1 . 9 . 3514 . 1 1 1 ASN CA C 11.119 -2.321 -1.038 . . . 1.0 . . . . . . . . . . . . A . 1 ASN CA . . . . . . . . . c30496_6e5h 1 . 9 . 3515 . 1 1 1 ASN CB C 10.887 -1.957 0.435 . . . 1.0 . . . . . . . . . . . . A . 1 ASN CB . . . . . . . . . c30496_6e5h 1 . 9 . 3516 . 1 1 1 ASN CG C 12.171 -1.711 1.198 . . . 1.0 . . . . . . . . . . . . A . 1 ASN CG . . . . . . . . . c30496_6e5h 1 . 9 . 3517 . 1 1 1 ASN H1 H 12.115 -1.557 -2.694 . . . 1.0 . . . . . . . . . . . . A . 1 ASN H1 . . . . . . . . . c30496_6e5h 1 . 9 . 3518 . 1 1 1 ASN H2 H 12.857 -1.189 -1.220 . . . 1.0 . . . . . . . . . . . . A . 1 ASN H2 . . . . . . . . . c30496_6e5h 1 . 9 . 3519 . 1 1 1 ASN H3 H 11.450 -0.374 -1.688 . . . 1.0 . . . . . . . . . . . . A . 1 ASN H3 . . . . . . . . . c30496_6e5h 1 . 9 . 3520 . 1 1 1 ASN HA H 11.636 -3.268 -1.099 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HA . . . . . . . . . c30496_6e5h 1 . 9 . 3521 . 1 1 1 ASN HB2 H 10.292 -1.060 0.483 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HB2 . . . . . . . . . c30496_6e5h 1 . 9 . 3522 . 1 1 1 ASN HB3 H 10.353 -2.762 0.917 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HB3 . . . . . . . . . c30496_6e5h 1 . 9 . 3523 . 1 1 1 ASN HD21 H 11.222 -0.473 2.428 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HD21 . . . . . . . . . c30496_6e5h 1 . 9 . 3524 . 1 1 1 ASN HD22 H 12.908 -0.693 2.735 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HD22 . . . . . . . . . c30496_6e5h 1 . 9 . 3525 . 1 1 1 ASN N N 11.944 -1.290 -1.705 . . . 1.0 . . . . . . . . . . . . A . 1 ASN N . . . . . . . . . c30496_6e5h 1 . 9 . 3526 . 1 1 1 ASN ND2 N 12.093 -0.877 2.223 . . . 1.0 . . . . . . . . . . . . A . 1 ASN ND2 . . . . . . . . . c30496_6e5h 1 . 9 . 3527 . 1 1 1 ASN O O 9.279 -1.456 -2.291 . . . 1.0 . . . . . . . . . . . . A . 1 ASN O . . . . . . . . . c30496_6e5h 1 . 9 . 3528 . 1 1 1 ASN OD1 O 13.222 -2.263 0.873 . . . 1.0 . . . . . . . . . . . . A . 1 ASN OD1 . . . . . . . . . c30496_6e5h 1 . 9 . 3529 . 1 1 2 ASP C C 6.767 -3.613 -1.375 . . . 1.0 . . . . . . . . . . . . A . 2 ASP C . . . . . . . . . c30496_6e5h 1 . 9 . 3530 . 1 1 2 ASP CA C 7.892 -3.843 -2.376 . . . 1.0 . . . . . . . . . . . . A . 2 ASP CA . . . . . . . . . c30496_6e5h 1 . 9 . 3531 . 1 1 2 ASP CB C 7.800 -5.257 -2.970 . . . 1.0 . . . . . . . . . . . . A . 2 ASP CB . . . . . . . . . c30496_6e5h 1 . 9 . 3532 . 1 1 2 ASP CG C 8.120 -6.354 -1.968 . . . 1.0 . . . . . . . . . . . . A . 2 ASP CG . . . . . . . . . c30496_6e5h 1 . 9 . 3533 . 1 1 2 ASP H H 9.640 -4.383 -1.304 . . . 1.0 . . . . . . . . . . . . A . 2 ASP H . . . . . . . . . c30496_6e5h 1 . 9 . 3534 . 1 1 2 ASP HA H 7.794 -3.122 -3.172 . . . 1.0 . . . . . . . . . . . . A . 2 ASP HA . . . . . . . . . c30496_6e5h 1 . 9 . 3535 . 1 1 2 ASP HB2 H 6.798 -5.418 -3.334 . . . 1.0 . . . . . . . . . . . . A . 2 ASP HB2 . . . . . . . . . c30496_6e5h 1 . 9 . 3536 . 1 1 2 ASP HB3 H 8.492 -5.337 -3.796 . . . 1.0 . . . . . . . . . . . . A . 2 ASP HB3 . . . . . . . . . c30496_6e5h 1 . 9 . 3537 . 1 1 2 ASP N N 9.193 -3.627 -1.745 . . . 1.0 . . . . . . . . . . . . A . 2 ASP N . . . . . . . . . c30496_6e5h 1 . 9 . 3538 . 1 1 2 ASP O O 5.807 -4.377 -1.311 . . . 1.0 . . . . . . . . . . . . A . 2 ASP O . . . . . . . . . c30496_6e5h 1 . 9 . 3539 . 1 1 2 ASP OD1 O 9.293 -6.771 -1.881 . . . 1.0 . . . . . . . . . . . . A . 2 ASP OD1 . . . . . . . . . c30496_6e5h 1 . 9 . 3540 . 1 1 2 ASP OD2 O 7.195 -6.798 -1.253 . . . 1.0 . . . . . . . . . . . . A . 2 ASP OD2 . . . . . . . . . c30496_6e5h 1 . 9 . 3541 . 1 1 3 LYS C C 4.536 -2.035 -0.050 . . . 1.0 . . . . . . . . . . . . A . 3 LYS C . . . . . . . . . c30496_6e5h 1 . 9 . 3542 . 1 1 3 LYS CA C 5.952 -2.242 0.465 . . . 1.0 . . . . . . . . . . . . A . 3 LYS CA . . . . . . . . . c30496_6e5h 1 . 9 . 3543 . 1 1 3 LYS CB C 6.412 -1.011 1.244 . . . 1.0 . . . . . . . . . . . . A . 3 LYS CB . . . . . . . . . c30496_6e5h 1 . 9 . 3544 . 1 1 3 LYS CD C 8.230 0.077 2.605 . . . 1.0 . . . . . . . . . . . . A . 3 LYS CD . . . . . . . . . c30496_6e5h 1 . 9 . 3545 . 1 1 3 LYS CE C 7.327 0.412 3.781 . . . 1.0 . . . . . . . . . . . . A . 3 LYS CE . . . . . . . . . c30496_6e5h 1 . 9 . 3546 . 1 1 3 LYS CG C 7.775 -1.186 1.894 . . . 1.0 . . . . . . . . . . . . A . 3 LYS CG . . . . . . . . . c30496_6e5h 1 . 9 . 3547 . 1 1 3 LYS H H 7.595 -1.889 -0.820 . . . 1.0 . . . . . . . . . . . . A . 3 LYS H . . . . . . . . . c30496_6e5h 1 . 9 . 3548 . 1 1 3 LYS HA H 5.955 -3.092 1.128 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HA . . . . . . . . . c30496_6e5h 1 . 9 . 3549 . 1 1 3 LYS HB2 H 6.464 -0.170 0.569 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HB2 . . . . . . . . . c30496_6e5h 1 . 9 . 3550 . 1 1 3 LYS HB3 H 5.691 -0.798 2.018 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HB3 . . . . . . . . . c30496_6e5h 1 . 9 . 3551 . 1 1 3 LYS HD2 H 9.236 -0.069 2.967 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HD2 . . . . . . . . . c30496_6e5h 1 . 9 . 3552 . 1 1 3 LYS HD3 H 8.213 0.898 1.904 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HD3 . . . . . . . . . c30496_6e5h 1 . 9 . 3553 . 1 1 3 LYS HE2 H 6.337 0.625 3.409 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HE2 . . . . . . . . . c30496_6e5h 1 . 9 . 3554 . 1 1 3 LYS HE3 H 7.287 -0.440 4.441 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HE3 . . . . . . . . . c30496_6e5h 1 . 9 . 3555 . 1 1 3 LYS HG2 H 7.717 -1.989 2.613 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HG2 . . . . . . . . . c30496_6e5h 1 . 9 . 3556 . 1 1 3 LYS HG3 H 8.494 -1.437 1.130 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HG3 . . . . . . . . . c30496_6e5h 1 . 9 . 3557 . 1 1 3 LYS HZ1 H 7.177 1.795 5.336 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HZ1 . . . . . . . . . c30496_6e5h 1 . 9 . 3558 . 1 1 3 LYS HZ2 H 7.863 2.424 3.926 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HZ2 . . . . . . . . . c30496_6e5h 1 . 9 . 3559 . 1 1 3 LYS HZ3 H 8.768 1.402 4.921 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HZ3 . . . . . . . . . c30496_6e5h 1 . 9 . 3560 . 1 1 3 LYS N N 6.878 -2.527 -0.623 . . . 1.0 . . . . . . . . . . . . A . 3 LYS N . . . . . . . . . c30496_6e5h 1 . 9 . 3561 . 1 1 3 LYS NZ N 7.818 1.590 4.542 . . . 1.0 . . . . . . . . . . . . A . 3 LYS NZ . . . . . . . . . c30496_6e5h 1 . 9 . 3562 . 1 1 3 LYS O O 3.576 -2.476 0.574 . . . 1.0 . . . . . . . . . . . . A . 3 LYS O . . . . . . . . . c30496_6e5h 1 . 9 . 3563 . 1 1 4 CYS C C 2.421 -2.463 -2.109 . . . 1.0 . . . . . . . . . . . . A . 4 CYS C . . . . . . . . . c30496_6e5h 1 . 9 . 3564 . 1 1 4 CYS CA C 3.115 -1.142 -1.806 . . . 1.0 . . . . . . . . . . . . A . 4 CYS CA . . . . . . . . . c30496_6e5h 1 . 9 . 3565 . 1 1 4 CYS CB C 3.275 -0.327 -3.091 . . . 1.0 . . . . . . . . . . . . A . 4 CYS CB . . . . . . . . . c30496_6e5h 1 . 9 . 3566 . 1 1 4 CYS H H 5.221 -1.041 -1.643 . . . 1.0 . . . . . . . . . . . . A . 4 CYS H . . . . . . . . . c30496_6e5h 1 . 9 . 3567 . 1 1 4 CYS HA H 2.513 -0.582 -1.106 . . . 1.0 . . . . . . . . . . . . A . 4 CYS HA . . . . . . . . . c30496_6e5h 1 . 9 . 3568 . 1 1 4 CYS HB2 H 4.009 -0.807 -3.720 . . . 1.0 . . . . . . . . . . . . A . 4 CYS HB2 . . . . . . . . . c30496_6e5h 1 . 9 . 3569 . 1 1 4 CYS HB3 H 2.328 -0.296 -3.609 . . . 1.0 . . . . . . . . . . . . A . 4 CYS HB3 . . . . . . . . . c30496_6e5h 1 . 9 . 3570 . 1 1 4 CYS N N 4.415 -1.376 -1.193 . . . 1.0 . . . . . . . . . . . . A . 4 CYS N . . . . . . . . . c30496_6e5h 1 . 9 . 3571 . 1 1 4 CYS O O 1.227 -2.625 -1.859 . . . 1.0 . . . . . . . . . . . . A . 4 CYS O . . . . . . . . . c30496_6e5h 1 . 9 . 3572 . 1 1 4 CYS SG S 3.819 1.393 -2.826 . . . 1.0 . . . . . . . . . . . . A . 4 CYS SG . . . . . . . . . c30496_6e5h 1 . 9 . 3573 . 1 1 5 LYS C C 2.350 -5.531 -1.719 . . . 1.0 . . . . . . . . . . . . A . 5 LYS C . . . . . . . . . c30496_6e5h 1 . 9 . 3574 . 1 1 5 LYS CA C 2.662 -4.726 -2.971 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CA . . . . . . . . . c30496_6e5h 1 . 9 . 3575 . 1 1 5 LYS CB C 3.664 -5.488 -3.840 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CB . . . . . . . . . c30496_6e5h 1 . 9 . 3576 . 1 1 5 LYS CD C 4.983 -5.608 -5.980 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CD . . . . . . . . . c30496_6e5h 1 . 9 . 3577 . 1 1 5 LYS CE C 4.503 -7.025 -6.249 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CE . . . . . . . . . c30496_6e5h 1 . 9 . 3578 . 1 1 5 LYS CG C 3.967 -4.816 -5.171 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CG . . . . . . . . . c30496_6e5h 1 . 9 . 3579 . 1 1 5 LYS H H 4.148 -3.246 -2.721 . . . 1.0 . . . . . . . . . . . . A . 5 LYS H . . . . . . . . . c30496_6e5h 1 . 9 . 3580 . 1 1 5 LYS HA H 1.750 -4.575 -3.529 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HA . . . . . . . . . c30496_6e5h 1 . 9 . 3581 . 1 1 5 LYS HB2 H 4.591 -5.585 -3.294 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HB2 . . . . . . . . . c30496_6e5h 1 . 9 . 3582 . 1 1 5 LYS HB3 H 3.269 -6.473 -4.040 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HB3 . . . . . . . . . c30496_6e5h 1 . 9 . 3583 . 1 1 5 LYS HD2 H 5.144 -5.109 -6.923 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HD2 . . . . . . . . . c30496_6e5h 1 . 9 . 3584 . 1 1 5 LYS HD3 H 5.911 -5.650 -5.429 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HD3 . . . . . . . . . c30496_6e5h 1 . 9 . 3585 . 1 1 5 LYS HE2 H 4.413 -7.546 -5.308 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HE2 . . . . . . . . . c30496_6e5h 1 . 9 . 3586 . 1 1 5 LYS HE3 H 3.536 -6.980 -6.727 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HE3 . . . . . . . . . c30496_6e5h 1 . 9 . 3587 . 1 1 5 LYS HG2 H 3.053 -4.740 -5.740 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HG2 . . . . . . . . . c30496_6e5h 1 . 9 . 3588 . 1 1 5 LYS HG3 H 4.360 -3.828 -4.986 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HG3 . . . . . . . . . c30496_6e5h 1 . 9 . 3589 . 1 1 5 LYS HZ1 H 5.122 -8.753 -7.233 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HZ1 . . . . . . . . . c30496_6e5h 1 . 9 . 3590 . 1 1 5 LYS HZ2 H 6.393 -7.775 -6.708 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HZ2 . . . . . . . . . c30496_6e5h 1 . 9 . 3591 . 1 1 5 LYS HZ3 H 5.487 -7.326 -8.063 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HZ3 . . . . . . . . . c30496_6e5h 1 . 9 . 3592 . 1 1 5 LYS N N 3.192 -3.419 -2.610 . . . 1.0 . . . . . . . . . . . . A . 5 LYS N . . . . . . . . . c30496_6e5h 1 . 9 . 3593 . 1 1 5 LYS NZ N 5.442 -7.771 -7.123 . . . 1.0 . . . . . . . . . . . . A . 5 LYS NZ . . . . . . . . . c30496_6e5h 1 . 9 . 3594 . 1 1 5 LYS O O 1.321 -6.200 -1.632 . . . 1.0 . . . . . . . . . . . . A . 5 LYS O . . . . . . . . . c30496_6e5h 1 . 9 . 3595 . 1 1 6 GLU C C 1.815 -5.697 1.214 . . . 1.0 . . . . . . . . . . . . A . 6 GLU C . . . . . . . . . c30496_6e5h 1 . 9 . 3596 . 1 1 6 GLU CA C 3.102 -6.134 0.520 . . . 1.0 . . . . . . . . . . . . A . 6 GLU CA . . . . . . . . . c30496_6e5h 1 . 9 . 3597 . 1 1 6 GLU CB C 4.319 -5.821 1.395 . . . 1.0 . . . . . . . . . . . . A . 6 GLU CB . . . . . . . . . c30496_6e5h 1 . 9 . 3598 . 1 1 6 GLU CD C 5.553 -6.162 3.556 . . . 1.0 . . . . . . . . . . . . A . 6 GLU CD . . . . . . . . . c30496_6e5h 1 . 9 . 3599 . 1 1 6 GLU CG C 4.367 -6.576 2.710 . . . 1.0 . . . . . . . . . . . . A . 6 GLU CG . . . . . . . . . c30496_6e5h 1 . 9 . 3600 . 1 1 6 GLU H H 4.048 -4.893 -0.900 . . . 1.0 . . . . . . . . . . . . A . 6 GLU H . . . . . . . . . c30496_6e5h 1 . 9 . 3601 . 1 1 6 GLU HA H 3.060 -7.195 0.327 . . . 1.0 . . . . . . . . . . . . A . 6 GLU HA . . . . . . . . . c30496_6e5h 1 . 9 . 3602 . 1 1 6 GLU HB2 H 5.212 -6.062 0.840 . . . 1.0 . . . . . . . . . . . . A . 6 GLU HB2 . . . . . . . . . c30496_6e5h 1 . 9 . 3603 . 1 1 6 GLU HB3 H 4.322 -4.763 1.615 . . . 1.0 . . . . . . . . . . . . A . 6 GLU HB3 . . . . . . . . . c30496_6e5h 1 . 9 . 3604 . 1 1 6 GLU HG2 H 3.460 -6.377 3.263 . . . 1.0 . . . . . . . . . . . . A . 6 GLU HG2 . . . . . . . . . c30496_6e5h 1 . 9 . 3605 . 1 1 6 GLU HG3 H 4.441 -7.634 2.504 . . . 1.0 . . . . . . . . . . . . A . 6 GLU HG3 . . . . . . . . . c30496_6e5h 1 . 9 . 3606 . 1 1 6 GLU N N 3.248 -5.444 -0.752 . . . 1.0 . . . . . . . . . . . . A . 6 GLU N . . . . . . . . . c30496_6e5h 1 . 9 . 3607 . 1 1 6 GLU O O 1.046 -6.521 1.716 . . . 1.0 . . . . . . . . . . . . A . 6 GLU O . . . . . . . . . c30496_6e5h 1 . 9 . 3608 . 1 1 6 GLU OE1 O 5.347 -5.539 4.620 . . . 1.0 . . . . . . . . . . . . A . 6 GLU OE1 . . . . . . . . . c30496_6e5h 1 . 9 . 3609 . 1 1 6 GLU OE2 O 6.700 -6.443 3.158 . . . 1.0 . . . . . . . . . . . . A . 6 GLU OE2 . . . . . . . . . c30496_6e5h 1 . 9 . 3610 . 1 1 7 LEU C C -0.848 -4.137 0.980 . . . 1.0 . . . . . . . . . . . . A . 7 LEU C . . . . . . . . . c30496_6e5h 1 . 9 . 3611 . 1 1 7 LEU CA C 0.386 -3.829 1.823 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CA . . . . . . . . . c30496_6e5h 1 . 9 . 3612 . 1 1 7 LEU CB C 0.561 -2.322 1.996 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CB . . . . . . . . . c30496_6e5h 1 . 9 . 3613 . 1 1 7 LEU CD1 C 1.937 -0.400 2.848 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CD1 . . . . . . . . . c30496_6e5h 1 . 9 . 3614 . 1 1 7 LEU CD2 C 1.481 -2.340 4.337 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CD2 . . . . . . . . . c30496_6e5h 1 . 9 . 3615 . 1 1 7 LEU CG C 1.726 -1.903 2.902 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CG . . . . . . . . . c30496_6e5h 1 . 9 . 3616 . 1 1 7 LEU H H 2.220 -3.791 0.776 . . . 1.0 . . . . . . . . . . . . A . 7 LEU H . . . . . . . . . c30496_6e5h 1 . 9 . 3617 . 1 1 7 LEU HA H 0.266 -4.283 2.794 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HA . . . . . . . . . c30496_6e5h 1 . 9 . 3618 . 1 1 7 LEU HB2 H 0.719 -1.890 1.020 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HB2 . . . . . . . . . c30496_6e5h 1 . 9 . 3619 . 1 1 7 LEU HB3 H -0.350 -1.921 2.408 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HB3 . . . . . . . . . c30496_6e5h 1 . 9 . 3620 . 1 1 7 LEU HD11 H 2.767 -0.130 3.487 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD11 . . . . . . . . . c30496_6e5h 1 . 9 . 3621 . 1 1 7 LEU HD12 H 1.044 0.103 3.189 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD12 . . . . . . . . . c30496_6e5h 1 . 9 . 3622 . 1 1 7 LEU HD13 H 2.155 -0.102 1.832 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD13 . . . . . . . . . c30496_6e5h 1 . 9 . 3623 . 1 1 7 LEU HD21 H 1.359 -3.411 4.373 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD21 . . . . . . . . . c30496_6e5h 1 . 9 . 3624 . 1 1 7 LEU HD22 H 0.589 -1.861 4.710 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD22 . . . . . . . . . c30496_6e5h 1 . 9 . 3625 . 1 1 7 LEU HD23 H 2.324 -2.054 4.949 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD23 . . . . . . . . . c30496_6e5h 1 . 9 . 3626 . 1 1 7 LEU HG H 2.631 -2.380 2.556 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HG . . . . . . . . . c30496_6e5h 1 . 9 . 3627 . 1 1 7 LEU N N 1.574 -4.394 1.209 . . . 1.0 . . . . . . . . . . . . A . 7 LEU N . . . . . . . . . c30496_6e5h 1 . 9 . 3628 . 1 1 7 LEU O O -1.926 -4.394 1.511 . . . 1.0 . . . . . . . . . . . . A . 7 LEU O . . . . . . . . . c30496_6e5h 1 . 9 . 3629 . 1 1 8 LYS C C -2.249 -5.867 -1.060 . . . 1.0 . . . . . . . . . . . . A . 8 LYS C . . . . . . . . . c30496_6e5h 1 . 9 . 3630 . 1 1 8 LYS CA C -1.751 -4.436 -1.271 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CA . . . . . . . . . c30496_6e5h 1 . 9 . 3631 . 1 1 8 LYS CB C -1.256 -4.255 -2.712 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CB . . . . . . . . . c30496_6e5h 1 . 9 . 3632 . 1 1 8 LYS CD C -3.444 -3.616 -3.797 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CD . . . . . . . . . c30496_6e5h 1 . 9 . 3633 . 1 1 8 LYS CE C -4.339 -3.827 -5.010 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CE . . . . . . . . . c30496_6e5h 1 . 9 . 3634 . 1 1 8 LYS CG C -2.278 -4.591 -3.789 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CG . . . . . . . . . c30496_6e5h 1 . 9 . 3635 . 1 1 8 LYS H H 0.206 -3.860 -0.697 . . . 1.0 . . . . . . . . . . . . A . 8 LYS H . . . . . . . . . c30496_6e5h 1 . 9 . 3636 . 1 1 8 LYS HA H -2.563 -3.752 -1.087 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HA . . . . . . . . . c30496_6e5h 1 . 9 . 3637 . 1 1 8 LYS HB2 H -0.957 -3.226 -2.846 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HB2 . . . . . . . . . c30496_6e5h 1 . 9 . 3638 . 1 1 8 LYS HB3 H -0.394 -4.888 -2.860 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HB3 . . . . . . . . . c30496_6e5h 1 . 9 . 3639 . 1 1 8 LYS HD2 H -4.030 -3.760 -2.903 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HD2 . . . . . . . . . c30496_6e5h 1 . 9 . 3640 . 1 1 8 LYS HD3 H -3.057 -2.607 -3.817 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HD3 . . . . . . . . . c30496_6e5h 1 . 9 . 3641 . 1 1 8 LYS HE2 H -5.144 -3.110 -4.974 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HE2 . . . . . . . . . c30496_6e5h 1 . 9 . 3642 . 1 1 8 LYS HE3 H -3.753 -3.664 -5.902 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HE3 . . . . . . . . . c30496_6e5h 1 . 9 . 3643 . 1 1 8 LYS HG2 H -1.794 -4.560 -4.753 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HG2 . . . . . . . . . c30496_6e5h 1 . 9 . 3644 . 1 1 8 LYS HG3 H -2.656 -5.585 -3.608 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HG3 . . . . . . . . . c30496_6e5h 1 . 9 . 3645 . 1 1 8 LYS HZ1 H -5.522 -5.364 -4.226 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ1 . . . . . . . . . c30496_6e5h 1 . 9 . 3646 . 1 1 8 LYS HZ2 H -4.167 -5.912 -5.077 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ2 . . . . . . . . . c30496_6e5h 1 . 9 . 3647 . 1 1 8 LYS HZ3 H -5.502 -5.306 -5.915 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ3 . . . . . . . . . c30496_6e5h 1 . 9 . 3648 . 1 1 8 LYS N N -0.673 -4.115 -0.337 . . . 1.0 . . . . . . . . . . . . A . 8 LYS N . . . . . . . . . c30496_6e5h 1 . 9 . 3649 . 1 1 8 LYS NZ N -4.921 -5.198 -5.059 . . . 1.0 . . . . . . . . . . . . A . 8 LYS NZ . . . . . . . . . c30496_6e5h 1 . 9 . 3650 . 1 1 8 LYS O O -3.448 -6.141 -1.150 . . . 1.0 . . . . . . . . . . . . A . 8 LYS O . . . . . . . . . c30496_6e5h 1 . 9 . 3651 . 1 1 9 LYS C C -2.172 -8.401 0.856 . . . 1.0 . . . . . . . . . . . . A . 9 LYS C . . . . . . . . . c30496_6e5h 1 . 9 . 3652 . 1 1 9 LYS CA C -1.666 -8.172 -0.565 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CA . . . . . . . . . c30496_6e5h 1 . 9 . 3653 . 1 1 9 LYS CB C -0.457 -9.066 -0.850 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CB . . . . . . . . . c30496_6e5h 1 . 9 . 3654 . 1 1 9 LYS CD C 1.203 -9.907 -2.540 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CD . . . . . . . . . c30496_6e5h 1 . 9 . 3655 . 1 1 9 LYS CE C 1.638 -9.879 -3.996 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CE . . . . . . . . . c30496_6e5h 1 . 9 . 3656 . 1 1 9 LYS CG C -0.016 -9.037 -2.307 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CG . . . . . . . . . c30496_6e5h 1 . 9 . 3657 . 1 1 9 LYS H H -0.377 -6.499 -0.747 . . . 1.0 . . . . . . . . . . . . A . 9 LYS H . . . . . . . . . c30496_6e5h 1 . 9 . 3658 . 1 1 9 LYS HA H -2.456 -8.425 -1.253 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HA . . . . . . . . . c30496_6e5h 1 . 9 . 3659 . 1 1 9 LYS HB2 H 0.372 -8.739 -0.238 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HB2 . . . . . . . . . c30496_6e5h 1 . 9 . 3660 . 1 1 9 LYS HB3 H -0.704 -10.085 -0.591 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HB3 . . . . . . . . . c30496_6e5h 1 . 9 . 3661 . 1 1 9 LYS HD2 H 2.015 -9.546 -1.926 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HD2 . . . . . . . . . c30496_6e5h 1 . 9 . 3662 . 1 1 9 LYS HD3 H 0.965 -10.924 -2.263 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HD3 . . . . . . . . . c30496_6e5h 1 . 9 . 3663 . 1 1 9 LYS HE2 H 0.816 -10.213 -4.611 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HE2 . . . . . . . . . c30496_6e5h 1 . 9 . 3664 . 1 1 9 LYS HE3 H 1.898 -8.865 -4.262 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HE3 . . . . . . . . . c30496_6e5h 1 . 9 . 3665 . 1 1 9 LYS HG2 H -0.823 -9.398 -2.926 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HG2 . . . . . . . . . c30496_6e5h 1 . 9 . 3666 . 1 1 9 LYS HG3 H 0.222 -8.019 -2.581 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HG3 . . . . . . . . . c30496_6e5h 1 . 9 . 3667 . 1 1 9 LYS HZ1 H 2.579 -11.743 -4.006 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HZ1 . . . . . . . . . c30496_6e5h 1 . 9 . 3668 . 1 1 9 LYS HZ2 H 3.616 -10.456 -3.661 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HZ2 . . . . . . . . . c30496_6e5h 1 . 9 . 3669 . 1 1 9 LYS HZ3 H 3.089 -10.713 -5.244 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HZ3 . . . . . . . . . c30496_6e5h 1 . 9 . 3670 . 1 1 9 LYS N N -1.322 -6.774 -0.786 . . . 1.0 . . . . . . . . . . . . A . 9 LYS N . . . . . . . . . c30496_6e5h 1 . 9 . 3671 . 1 1 9 LYS NZ N 2.810 -10.758 -4.243 . . . 1.0 . . . . . . . . . . . . A . 9 LYS NZ . . . . . . . . . c30496_6e5h 1 . 9 . 3672 . 1 1 9 LYS O O -3.071 -9.214 1.075 . . . 1.0 . . . . . . . . . . . . A . 9 LYS O . . . . . . . . . c30496_6e5h 1 . 9 . 3673 . 1 1 10 ARG C C -3.447 -7.320 3.386 . . . 1.0 . . . . . . . . . . . . A . 10 ARG C . . . . . . . . . c30496_6e5h 1 . 9 . 3674 . 1 1 10 ARG CA C -2.006 -7.788 3.213 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CA . . . . . . . . . c30496_6e5h 1 . 9 . 3675 . 1 1 10 ARG CB C -1.077 -6.959 4.101 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CB . . . . . . . . . c30496_6e5h 1 . 9 . 3676 . 1 1 10 ARG CD C -0.320 -6.351 6.412 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CD . . . . . . . . . c30496_6e5h 1 . 9 . 3677 . 1 1 10 ARG CG C -1.375 -7.073 5.589 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CG . . . . . . . . . c30496_6e5h 1 . 9 . 3678 . 1 1 10 ARG CZ C 2.140 -6.163 6.213 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CZ . . . . . . . . . c30496_6e5h 1 . 9 . 3679 . 1 1 10 ARG H H -0.856 -7.077 1.579 . . . 1.0 . . . . . . . . . . . . A . 10 ARG H . . . . . . . . . c30496_6e5h 1 . 9 . 3680 . 1 1 10 ARG HA H -1.938 -8.825 3.503 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HA . . . . . . . . . c30496_6e5h 1 . 9 . 3681 . 1 1 10 ARG HB2 H -0.060 -7.279 3.935 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HB2 . . . . . . . . . c30496_6e5h 1 . 9 . 3682 . 1 1 10 ARG HB3 H -1.167 -5.923 3.820 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HB3 . . . . . . . . . c30496_6e5h 1 . 9 . 3683 . 1 1 10 ARG HD2 H -0.342 -5.300 6.162 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HD2 . . . . . . . . . c30496_6e5h 1 . 9 . 3684 . 1 1 10 ARG HD3 H -0.548 -6.476 7.461 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HD3 . . . . . . . . . c30496_6e5h 1 . 9 . 3685 . 1 1 10 ARG HE H 1.085 -7.828 5.892 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HE . . . . . . . . . c30496_6e5h 1 . 9 . 3686 . 1 1 10 ARG HG2 H -2.340 -6.630 5.788 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HG2 . . . . . . . . . c30496_6e5h 1 . 9 . 3687 . 1 1 10 ARG HG3 H -1.389 -8.118 5.866 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HG3 . . . . . . . . . c30496_6e5h 1 . 9 . 3688 . 1 1 10 ARG HH11 H 2.952 -4.356 6.642 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HH11 . . . . . . . . . c30496_6e5h 1 . 9 . 3689 . 1 1 10 ARG HH12 H 1.234 -4.462 6.845 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HH12 . . . . . . . . . c30496_6e5h 1 . 9 . 3690 . 1 1 10 ARG HH21 H 3.328 -7.694 5.632 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HH21 . . . . . . . . . c30496_6e5h 1 . 9 . 3691 . 1 1 10 ARG HH22 H 4.149 -6.192 5.927 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HH22 . . . . . . . . . c30496_6e5h 1 . 9 . 3692 . 1 1 10 ARG N N -1.593 -7.684 1.815 . . . 1.0 . . . . . . . . . . . . A . 10 ARG N . . . . . . . . . c30496_6e5h 1 . 9 . 3693 . 1 1 10 ARG NE N 1.020 -6.880 6.149 . . . 1.0 . . . . . . . . . . . . A . 10 ARG NE . . . . . . . . . c30496_6e5h 1 . 9 . 3694 . 1 1 10 ARG NH1 N 2.106 -4.893 6.595 . . . 1.0 . . . . . . . . . . . . A . 10 ARG NH1 . . . . . . . . . c30496_6e5h 1 . 9 . 3695 . 1 1 10 ARG NH2 N 3.296 -6.730 5.906 . . . 1.0 . . . . . . . . . . . . A . 10 ARG NH2 . . . . . . . . . c30496_6e5h 1 . 9 . 3696 . 1 1 10 ARG O O -4.263 -7.998 4.014 . . . 1.0 . . . . . . . . . . . . A . 10 ARG O . . . . . . . . . c30496_6e5h 1 . 9 . 3697 . 1 1 11 TYR C C -5.923 -6.123 1.715 . . . 1.0 . . . . . . . . . . . . A . 11 TYR C . . . . . . . . . c30496_6e5h 1 . 9 . 3698 . 1 1 11 TYR CA C -5.098 -5.617 2.893 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CA . . . . . . . . . c30496_6e5h 1 . 9 . 3699 . 1 1 11 TYR CB C -5.060 -4.090 2.906 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CB . . . . . . . . . c30496_6e5h 1 . 9 . 3700 . 1 1 11 TYR CD1 C -5.105 -3.280 5.293 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CD1 . . . . . . . . . c30496_6e5h 1 . 9 . 3701 . 1 1 11 TYR CD2 C -3.036 -3.186 4.117 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CD2 . . . . . . . . . c30496_6e5h 1 . 9 . 3702 . 1 1 11 TYR CE1 C -4.497 -2.746 6.412 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CE1 . . . . . . . . . c30496_6e5h 1 . 9 . 3703 . 1 1 11 TYR CE2 C -2.421 -2.654 5.230 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CE2 . . . . . . . . . c30496_6e5h 1 . 9 . 3704 . 1 1 11 TYR CG C -4.386 -3.508 4.128 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CG . . . . . . . . . c30496_6e5h 1 . 9 . 3705 . 1 1 11 TYR CZ C -3.156 -2.436 6.376 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CZ . . . . . . . . . c30496_6e5h 1 . 9 . 3706 . 1 1 11 TYR H H -3.055 -5.656 2.351 . . . 1.0 . . . . . . . . . . . . A . 11 TYR H . . . . . . . . . c30496_6e5h 1 . 9 . 3707 . 1 1 11 TYR HA H -5.550 -5.963 3.812 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HA . . . . . . . . . c30496_6e5h 1 . 9 . 3708 . 1 1 11 TYR HB2 H -4.525 -3.743 2.035 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HB2 . . . . . . . . . c30496_6e5h 1 . 9 . 3709 . 1 1 11 TYR HB3 H -6.070 -3.716 2.876 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HB3 . . . . . . . . . c30496_6e5h 1 . 9 . 3710 . 1 1 11 TYR HD1 H -6.156 -3.526 5.318 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HD1 . . . . . . . . . c30496_6e5h 1 . 9 . 3711 . 1 1 11 TYR HD2 H -2.462 -3.358 3.218 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HD2 . . . . . . . . . c30496_6e5h 1 . 9 . 3712 . 1 1 11 TYR HE1 H -5.073 -2.577 7.309 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HE1 . . . . . . . . . c30496_6e5h 1 . 9 . 3713 . 1 1 11 TYR HE2 H -1.371 -2.413 5.202 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HE2 . . . . . . . . . c30496_6e5h 1 . 9 . 3714 . 1 1 11 TYR HH H -1.970 -1.177 7.225 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HH . . . . . . . . . c30496_6e5h 1 . 9 . 3715 . 1 1 11 TYR N N -3.753 -6.160 2.829 . . . 1.0 . . . . . . . . . . . . A . 11 TYR N . . . . . . . . . c30496_6e5h 1 . 9 . 3716 . 1 1 11 TYR O O -6.117 -5.411 0.727 . . . 1.0 . . . . . . . . . . . . A . 11 TYR O . . . . . . . . . c30496_6e5h 1 . 9 . 3717 . 1 1 11 TYR OH O -2.546 -1.904 7.490 . . . 1.0 . . . . . . . . . . . . A . 11 TYR OH . . . . . . . . . c30496_6e5h 1 . 9 . 3718 . 1 1 12 ABA C C -8.337 -7.208 0.347 . . . 1.0 . . . . . . . . . . . . A . 12 AIB C . . . . . . . . . c30496_6e5h 1 . 9 . 3719 . 1 1 12 ABA CA C -7.120 -8.050 0.761 . . . 1.0 . . . . . . . . . . . . A . 12 AIB CA . . . . . . . . . c30496_6e5h 1 . 9 . 3720 . 1 1 12 ABA H H -6.189 -7.861 2.655 . . . 1.0 . . . . . . . . . . . . A . 12 AIB H . . . . . . . . . c30496_6e5h 1 . 9 . 3721 . 1 1 12 ABA N N -6.371 -7.372 1.826 . . . 1.0 . . . . . . . . . . . . A . 12 AIB N . . . . . . . . . c30496_6e5h 1 . 9 . 3722 . 1 1 12 ABA O O -9.232 -6.960 1.157 . . . 1.0 . . . . . . . . . . . . A . 12 AIB O . . . . . . . . . c30496_6e5h 1 . 9 . 3723 . 1 1 13 GLY C C -9.402 -4.540 -1.214 . . . 1.0 . . . . . . . . . . . . A . 13 GLY C . . . . . . . . . c30496_6e5h 1 . 9 . 3724 . 1 1 13 GLY CA C -9.503 -6.036 -1.415 . . . 1.0 . . . . . . . . . . . . A . 13 GLY CA . . . . . . . . . c30496_6e5h 1 . 9 . 3725 . 1 1 13 GLY H H -7.579 -6.899 -1.479 . . . 1.0 . . . . . . . . . . . . A . 13 GLY H . . . . . . . . . c30496_6e5h 1 . 9 . 3726 . 1 1 13 GLY HA2 H -9.596 -6.238 -2.470 . . . 1.0 . . . . . . . . . . . . A . 13 GLY HA2 . . . . . . . . . c30496_6e5h 1 . 9 . 3727 . 1 1 13 GLY HA3 H -10.388 -6.395 -0.912 . . . 1.0 . . . . . . . . . . . . A . 13 GLY HA3 . . . . . . . . . c30496_6e5h 1 . 9 . 3728 . 1 1 13 GLY N N -8.356 -6.752 -0.901 . . . 1.0 . . . . . . . . . . . . A . 13 GLY N . . . . . . . . . c30496_6e5h 1 . 9 . 3729 . 1 1 13 GLY O O -10.240 -3.783 -1.705 . . . 1.0 . . . . . . . . . . . . A . 13 GLY O . . . . . . . . . c30496_6e5h 1 . 9 . 3730 . 1 1 14 CYS C C -7.270 -2.064 -1.236 . . . 1.0 . . . . . . . . . . . . A . 14 CYS C . . . . . . . . . c30496_6e5h 1 . 9 . 3731 . 1 1 14 CYS CA C -8.213 -2.690 -0.225 . . . 1.0 . . . . . . . . . . . . A . 14 CYS CA . . . . . . . . . c30496_6e5h 1 . 9 . 3732 . 1 1 14 CYS CB C -7.668 -2.468 1.179 . . . 1.0 . . . . . . . . . . . . A . 14 CYS CB . . . . . . . . . c30496_6e5h 1 . 9 . 3733 . 1 1 14 CYS H H -7.737 -4.747 -0.129 . . . 1.0 . . . . . . . . . . . . A . 14 CYS H . . . . . . . . . c30496_6e5h 1 . 9 . 3734 . 1 1 14 CYS HA H -9.178 -2.216 -0.307 . . . 1.0 . . . . . . . . . . . . A . 14 CYS HA . . . . . . . . . c30496_6e5h 1 . 9 . 3735 . 1 1 14 CYS HB2 H -6.669 -2.868 1.231 . . . 1.0 . . . . . . . . . . . . A . 14 CYS HB2 . . . . . . . . . c30496_6e5h 1 . 9 . 3736 . 1 1 14 CYS HB3 H -7.635 -1.405 1.375 . . . 1.0 . . . . . . . . . . . . A . 14 CYS HB3 . . . . . . . . . c30496_6e5h 1 . 9 . 3737 . 1 1 14 CYS N N -8.387 -4.104 -0.490 . . . 1.0 . . . . . . . . . . . . A . 14 CYS N . . . . . . . . . c30496_6e5h 1 . 9 . 3738 . 1 1 14 CYS O O -6.322 -2.698 -1.702 . . . 1.0 . . . . . . . . . . . . A . 14 CYS O . . . . . . . . . c30496_6e5h 1 . 9 . 3739 . 1 1 14 CYS SG S -8.656 -3.244 2.499 . . . 1.0 . . . . . . . . . . . . A . 14 CYS SG . . . . . . . . . c30496_6e5h 1 . 9 . 3740 . 1 1 15 GLU C C -5.701 0.743 -1.670 . . . 1.0 . . . . . . . . . . . . A . 15 GLU C . . . . . . . . . c30496_6e5h 1 . 9 . 3741 . 1 1 15 GLU CA C -6.703 -0.064 -2.472 . . . 1.0 . . . . . . . . . . . . A . 15 GLU CA . . . . . . . . . c30496_6e5h 1 . 9 . 3742 . 1 1 15 GLU CB C -7.557 0.854 -3.344 . . . 1.0 . . . . . . . . . . . . A . 15 GLU CB . . . . . . . . . c30496_6e5h 1 . 9 . 3743 . 1 1 15 GLU CD C -9.517 1.041 -4.922 . . . 1.0 . . . . . . . . . . . . A . 15 GLU CD . . . . . . . . . c30496_6e5h 1 . 9 . 3744 . 1 1 15 GLU CG C -8.610 0.111 -4.148 . . . 1.0 . . . . . . . . . . . . A . 15 GLU CG . . . . . . . . . c30496_6e5h 1 . 9 . 3745 . 1 1 15 GLU H H -8.323 -0.381 -1.172 . . . 1.0 . . . . . . . . . . . . A . 15 GLU H . . . . . . . . . c30496_6e5h 1 . 9 . 3746 . 1 1 15 GLU HA H -6.172 -0.764 -3.099 . . . 1.0 . . . . . . . . . . . . A . 15 GLU HA . . . . . . . . . c30496_6e5h 1 . 9 . 3747 . 1 1 15 GLU HB2 H -8.058 1.570 -2.708 . . . 1.0 . . . . . . . . . . . . A . 15 GLU HB2 . . . . . . . . . c30496_6e5h 1 . 9 . 3748 . 1 1 15 GLU HB3 H -6.913 1.381 -4.030 . . . 1.0 . . . . . . . . . . . . A . 15 GLU HB3 . . . . . . . . . c30496_6e5h 1 . 9 . 3749 . 1 1 15 GLU HG2 H -8.115 -0.544 -4.848 . . . 1.0 . . . . . . . . . . . . A . 15 GLU HG2 . . . . . . . . . c30496_6e5h 1 . 9 . 3750 . 1 1 15 GLU HG3 H -9.215 -0.477 -3.472 . . . 1.0 . . . . . . . . . . . . A . 15 GLU HG3 . . . . . . . . . c30496_6e5h 1 . 9 . 3751 . 1 1 15 GLU N N -7.540 -0.817 -1.565 . . . 1.0 . . . . . . . . . . . . A . 15 GLU N . . . . . . . . . c30496_6e5h 1 . 9 . 3752 . 1 1 15 GLU O O -6.047 1.746 -1.044 . . . 1.0 . . . . . . . . . . . . A . 15 GLU O . . . . . . . . . c30496_6e5h 1 . 9 . 3753 . 1 1 15 GLU OE1 O -9.340 1.158 -6.155 . . . 1.0 . . . . . . . . . . . . A . 15 GLU OE1 . . . . . . . . . c30496_6e5h 1 . 9 . 3754 . 1 1 15 GLU OE2 O -10.398 1.670 -4.302 . . . 1.0 . . . . . . . . . . . . A . 15 GLU OE2 . . . . . . . . . c30496_6e5h 1 . 9 . 3755 . 1 1 16 VAL C C -2.684 1.922 -1.785 . . . 1.0 . . . . . . . . . . . . A . 16 VAL C . . . . . . . . . c30496_6e5h 1 . 9 . 3756 . 1 1 16 VAL CA C -3.419 0.925 -0.902 . . . 1.0 . . . . . . . . . . . . A . 16 VAL CA . . . . . . . . . c30496_6e5h 1 . 9 . 3757 . 1 1 16 VAL CB C -2.421 -0.102 -0.333 . . . 1.0 . . . . . . . . . . . . A . 16 VAL CB . . . . . . . . . c30496_6e5h 1 . 9 . 3758 . 1 1 16 VAL CG1 C -1.329 0.594 0.461 . . . 1.0 . . . . . . . . . . . . A . 16 VAL CG1 . . . . . . . . . c30496_6e5h 1 . 9 . 3759 . 1 1 16 VAL CG2 C -3.147 -1.122 0.533 . . . 1.0 . . . . . . . . . . . . A . 16 VAL CG2 . . . . . . . . . c30496_6e5h 1 . 9 . 3760 . 1 1 16 VAL H H -4.264 -0.531 -2.171 . . . 1.0 . . . . . . . . . . . . A . 16 VAL H . . . . . . . . . c30496_6e5h 1 . 9 . 3761 . 1 1 16 VAL HA H -3.874 1.454 -0.076 . . . 1.0 . . . . . . . . . . . . A . 16 VAL HA . . . . . . . . . c30496_6e5h 1 . 9 . 3762 . 1 1 16 VAL HB H -1.961 -0.623 -1.159 . . . 1.0 . . . . . . . . . . . . A . 16 VAL HB . . . . . . . . . c30496_6e5h 1 . 9 . 3763 . 1 1 16 VAL HG11 H -1.770 1.100 1.308 . . . 1.0 . . . . . . . . . . . . A . 16 VAL HG11 . . . . . . . . . c30496_6e5h 1 . 9 . 3764 . 1 1 16 VAL HG12 H -0.831 1.314 -0.171 . . . 1.0 . . . . . . . . . . . . A . 16 VAL HG12 . . . . . . . . . c30496_6e5h 1 . 9 . 3765 . 1 1 16 VAL HG13 H -0.616 -0.138 0.808 . . . 1.0 . . . . . . . . . . . . A . 16 VAL HG13 . . . . . . . . . c30496_6e5h 1 . 9 . 3766 . 1 1 16 VAL HG21 H -3.893 -1.630 -0.057 . . . 1.0 . . . . . . . . . . . . A . 16 VAL HG21 . . . . . . . . . c30496_6e5h 1 . 9 . 3767 . 1 1 16 VAL HG22 H -3.623 -0.617 1.357 . . . 1.0 . . . . . . . . . . . . A . 16 VAL HG22 . . . . . . . . . c30496_6e5h 1 . 9 . 3768 . 1 1 16 VAL HG23 H -2.438 -1.842 0.913 . . . 1.0 . . . . . . . . . . . . A . 16 VAL HG23 . . . . . . . . . c30496_6e5h 1 . 9 . 3769 . 1 1 16 VAL N N -4.472 0.272 -1.654 . . . 1.0 . . . . . . . . . . . . A . 16 VAL N . . . . . . . . . c30496_6e5h 1 . 9 . 3770 . 1 1 16 VAL O O -2.136 1.557 -2.823 . . . 1.0 . . . . . . . . . . . . A . 16 VAL O . . . . . . . . . c30496_6e5h 1 . 9 . 3771 . 1 1 17 ARG C C -0.675 4.526 -1.597 . . . 1.0 . . . . . . . . . . . . A . 17 ARG C . . . . . . . . . c30496_6e5h 1 . 9 . 3772 . 1 1 17 ARG CA C -2.054 4.226 -2.157 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CA . . . . . . . . . c30496_6e5h 1 . 9 . 3773 . 1 1 17 ARG CB C -2.903 5.498 -2.145 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CB . . . . . . . . . c30496_6e5h 1 . 9 . 3774 . 1 1 17 ARG CD C -3.292 7.791 -3.102 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CD . . . . . . . . . c30496_6e5h 1 . 9 . 3775 . 1 1 17 ARG CG C -2.522 6.487 -3.234 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CG . . . . . . . . . c30496_6e5h 1 . 9 . 3776 . 1 1 17 ARG CZ C -3.510 9.366 -1.205 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CZ . . . . . . . . . c30496_6e5h 1 . 9 . 3777 . 1 1 17 ARG H H -3.131 3.406 -0.532 . . . 1.0 . . . . . . . . . . . . A . 17 ARG H . . . . . . . . . c30496_6e5h 1 . 9 . 3778 . 1 1 17 ARG HA H -1.954 3.877 -3.173 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HA . . . . . . . . . c30496_6e5h 1 . 9 . 3779 . 1 1 17 ARG HB2 H -3.939 5.227 -2.278 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HB2 . . . . . . . . . c30496_6e5h 1 . 9 . 3780 . 1 1 17 ARG HB3 H -2.785 5.984 -1.189 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HB3 . . . . . . . . . c30496_6e5h 1 . 9 . 3781 . 1 1 17 ARG HD2 H -3.234 8.323 -4.040 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HD2 . . . . . . . . . c30496_6e5h 1 . 9 . 3782 . 1 1 17 ARG HD3 H -4.323 7.561 -2.885 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HD3 . . . . . . . . . c30496_6e5h 1 . 9 . 3783 . 1 1 17 ARG HE H -1.779 8.699 -1.953 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HE . . . . . . . . . c30496_6e5h 1 . 9 . 3784 . 1 1 17 ARG HG2 H -1.466 6.697 -3.162 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HG2 . . . . . . . . . c30496_6e5h 1 . 9 . 3785 . 1 1 17 ARG HG3 H -2.738 6.048 -4.197 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HG3 . . . . . . . . . c30496_6e5h 1 . 9 . 3786 . 1 1 17 ARG HH11 H -5.280 8.704 -1.939 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH11 . . . . . . . . . c30496_6e5h 1 . 9 . 3787 . 1 1 17 ARG HH12 H -5.398 9.847 -0.641 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH12 . . . . . . . . . c30496_6e5h 1 . 9 . 3788 . 1 1 17 ARG HH21 H -1.928 10.216 -0.251 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH21 . . . . . . . . . c30496_6e5h 1 . 9 . 3789 . 1 1 17 ARG HH22 H -3.498 10.704 0.318 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH22 . . . . . . . . . c30496_6e5h 1 . 9 . 3790 . 1 1 17 ARG N N -2.692 3.179 -1.381 . . . 1.0 . . . . . . . . . . . . A . 17 ARG N . . . . . . . . . c30496_6e5h 1 . 9 . 3791 . 1 1 17 ARG NE N -2.757 8.644 -2.036 . . . 1.0 . . . . . . . . . . . . A . 17 ARG NE . . . . . . . . . c30496_6e5h 1 . 9 . 3792 . 1 1 17 ARG NH1 N -4.834 9.300 -1.267 . . . 1.0 . . . . . . . . . . . . A . 17 ARG NH1 . . . . . . . . . c30496_6e5h 1 . 9 . 3793 . 1 1 17 ARG NH2 N -2.935 10.158 -0.309 . . . 1.0 . . . . . . . . . . . . A . 17 ARG NH2 . . . . . . . . . c30496_6e5h 1 . 9 . 3794 . 1 1 17 ARG O O -0.523 4.780 -0.398 . . . 1.0 . . . . . . . . . . . . A . 17 ARG O . . . . . . . . . c30496_6e5h 1 . 9 . 3795 . 1 1 18 CYS C C 1.866 6.305 -1.999 . . . 1.0 . . . . . . . . . . . . A . 18 CYS C . . . . . . . . . c30496_6e5h 1 . 9 . 3796 . 1 1 18 CYS CA C 1.684 4.796 -2.075 . . . 1.0 . . . . . . . . . . . . A . 18 CYS CA . . . . . . . . . c30496_6e5h 1 . 9 . 3797 . 1 1 18 CYS CB C 2.660 4.201 -3.089 . . . 1.0 . . . . . . . . . . . . A . 18 CYS CB . . . . . . . . . c30496_6e5h 1 . 9 . 3798 . 1 1 18 CYS H H 0.137 4.259 -3.397 . . . 1.0 . . . . . . . . . . . . A . 18 CYS H . . . . . . . . . c30496_6e5h 1 . 9 . 3799 . 1 1 18 CYS HA H 1.864 4.363 -1.103 . . . 1.0 . . . . . . . . . . . . A . 18 CYS HA . . . . . . . . . c30496_6e5h 1 . 9 . 3800 . 1 1 18 CYS HB2 H 2.647 4.802 -3.985 . . . 1.0 . . . . . . . . . . . . A . 18 CYS HB2 . . . . . . . . . c30496_6e5h 1 . 9 . 3801 . 1 1 18 CYS HB3 H 3.654 4.214 -2.668 . . . 1.0 . . . . . . . . . . . . A . 18 CYS HB3 . . . . . . . . . c30496_6e5h 1 . 9 . 3802 . 1 1 18 CYS N N 0.322 4.493 -2.463 . . . 1.0 . . . . . . . . . . . . A . 18 CYS N . . . . . . . . . c30496_6e5h 1 . 9 . 3803 . 1 1 18 CYS O O 1.784 7.000 -3.015 . . . 1.0 . . . . . . . . . . . . A . 18 CYS O . . . . . . . . . c30496_6e5h 1 . 9 . 3804 . 1 1 18 CYS SG S 2.278 2.484 -3.566 . . . 1.0 . . . . . . . . . . . . A . 18 CYS SG . . . . . . . . . c30496_6e5h 1 . 9 . 3805 . 1 1 19 ASP C C 3.560 8.547 0.077 . . . 1.0 . . . . . . . . . . . . A . 19 ASP C . . . . . . . . . c30496_6e5h 1 . 9 . 3806 . 1 1 19 ASP CA C 2.217 8.245 -0.585 . . . 1.0 . . . . . . . . . . . . A . 19 ASP CA . . . . . . . . . c30496_6e5h 1 . 9 . 3807 . 1 1 19 ASP CB C 1.061 8.733 0.294 . . . 1.0 . . . . . . . . . . . . A . 19 ASP CB . . . . . . . . . c30496_6e5h 1 . 9 . 3808 . 1 1 19 ASP CG C 0.822 10.226 0.189 . . . 1.0 . . . . . . . . . . . . A . 19 ASP CG . . . . . . . . . c30496_6e5h 1 . 9 . 3809 . 1 1 19 ASP H H 2.207 6.207 -0.030 . . . 1.0 . . . . . . . . . . . . A . 19 ASP H . . . . . . . . . c30496_6e5h 1 . 9 . 3810 . 1 1 19 ASP HA H 2.171 8.738 -1.543 . . . 1.0 . . . . . . . . . . . . A . 19 ASP HA . . . . . . . . . c30496_6e5h 1 . 9 . 3811 . 1 1 19 ASP HB2 H 0.156 8.223 0.000 . . . 1.0 . . . . . . . . . . . . A . 19 ASP HB2 . . . . . . . . . c30496_6e5h 1 . 9 . 3812 . 1 1 19 ASP HB3 H 1.281 8.493 1.324 . . . 1.0 . . . . . . . . . . . . A . 19 ASP HB3 . . . . . . . . . c30496_6e5h 1 . 9 . 3813 . 1 1 19 ASP N N 2.097 6.811 -0.800 . . . 1.0 . . . . . . . . . . . . A . 19 ASP N . . . . . . . . . c30496_6e5h 1 . 9 . 3814 . 1 1 19 ASP O O 3.629 8.813 1.281 . . . 1.0 . . . . . . . . . . . . A . 19 ASP O . . . . . . . . . c30496_6e5h 1 . 9 . 3815 . 1 1 19 ASP OD1 O 1.705 11.002 0.622 . . . 1.0 . . . . . . . . . . . . A . 19 ASP OD1 . . . . . . . . . c30496_6e5h 1 . 9 . 3816 . 1 1 19 ASP OD2 O -0.233 10.636 -0.327 . . . 1.0 . . . . . . . . . . . . A . 19 ASP OD2 . . . . . . . . . c30496_6e5h 1 . 9 . 3817 . 1 1 20 DPR C C 6.305 7.520 0.857 . . . 1.0 . . . . . . . . . . . . A . 20 DPR C . . . . . . . . . c30496_6e5h 1 . 9 . 3818 . 1 1 20 DPR CA C 6.007 8.620 -0.162 . . . 1.0 . . . . . . . . . . . . A . 20 DPR CA . . . . . . . . . c30496_6e5h 1 . 9 . 3819 . 1 1 20 DPR CB C 6.913 8.479 -1.384 . . . 1.0 . . . . . . . . . . . . A . 20 DPR CB . . . . . . . . . c30496_6e5h 1 . 9 . 3820 . 1 1 20 DPR CD C 4.660 8.322 -2.161 . . . 1.0 . . . . . . . . . . . . A . 20 DPR CD . . . . . . . . . c30496_6e5h 1 . 9 . 3821 . 1 1 20 DPR CG C 6.038 8.770 -2.552 . . . 1.0 . . . . . . . . . . . . A . 20 DPR CG . . . . . . . . . c30496_6e5h 1 . 9 . 3822 . 1 1 20 DPR HA H 6.165 9.584 0.291 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HA . . . . . . . . . c30496_6e5h 1 . 9 . 3823 . 1 1 20 DPR HB2 H 7.722 9.188 -1.313 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HB2 . . . . . . . . . c30496_6e5h 1 . 9 . 3824 . 1 1 20 DPR HB3 H 7.308 7.475 -1.427 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HB3 . . . . . . . . . c30496_6e5h 1 . 9 . 3825 . 1 1 20 DPR HD2 H 3.915 8.947 -2.628 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HD2 . . . . . . . . . c30496_6e5h 1 . 9 . 3826 . 1 1 20 DPR HD3 H 4.506 7.286 -2.428 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HD3 . . . . . . . . . c30496_6e5h 1 . 9 . 3827 . 1 1 20 DPR HG2 H 6.045 9.829 -2.758 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HG2 . . . . . . . . . c30496_6e5h 1 . 9 . 3828 . 1 1 20 DPR HG3 H 6.380 8.218 -3.414 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HG3 . . . . . . . . . c30496_6e5h 1 . 9 . 3829 . 1 1 20 DPR N N 4.652 8.493 -0.700 . . . 1.0 . . . . . . . . . . . . A . 20 DPR N . . . . . . . . . c30496_6e5h 1 . 9 . 3830 . 1 1 20 DPR O O 6.119 6.334 0.574 . . . 1.0 . . . . . . . . . . . . A . 20 DPR O . . . . . . . . . c30496_6e5h 1 . 9 . 3831 . 1 1 21 PRO C C 5.729 6.543 3.856 . . . 1.0 . . . . . . . . . . . . A . 21 PRO C . . . . . . . . . c30496_6e5h 1 . 9 . 3832 . 1 1 21 PRO CA C 7.015 6.953 3.143 . . . 1.0 . . . . . . . . . . . . A . 21 PRO CA . . . . . . . . . c30496_6e5h 1 . 9 . 3833 . 1 1 21 PRO CB C 7.922 7.747 4.081 . . . 1.0 . . . . . . . . . . . . A . 21 PRO CB . . . . . . . . . c30496_6e5h 1 . 9 . 3834 . 1 1 21 PRO CD C 7.083 9.287 2.447 . . . 1.0 . . . . . . . . . . . . A . 21 PRO CD . . . . . . . . . c30496_6e5h 1 . 9 . 3835 . 1 1 21 PRO CG C 7.511 9.166 3.887 . . . 1.0 . . . . . . . . . . . . A . 21 PRO CG . . . . . . . . . c30496_6e5h 1 . 9 . 3836 . 1 1 21 PRO HA H 7.530 6.071 2.792 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HA . . . . . . . . . c30496_6e5h 1 . 9 . 3837 . 1 1 21 PRO HB2 H 7.764 7.423 5.099 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HB2 . . . . . . . . . c30496_6e5h 1 . 9 . 3838 . 1 1 21 PRO HB3 H 8.955 7.594 3.804 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HB3 . . . . . . . . . c30496_6e5h 1 . 9 . 3839 . 1 1 21 PRO HD2 H 6.211 9.920 2.366 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HD2 . . . . . . . . . c30496_6e5h 1 . 9 . 3840 . 1 1 21 PRO HD3 H 7.889 9.677 1.845 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HD3 . . . . . . . . . c30496_6e5h 1 . 9 . 3841 . 1 1 21 PRO HG2 H 6.688 9.402 4.542 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HG2 . . . . . . . . . c30496_6e5h 1 . 9 . 3842 . 1 1 21 PRO HG3 H 8.348 9.820 4.085 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HG3 . . . . . . . . . c30496_6e5h 1 . 9 . 3843 . 1 1 21 PRO N N 6.760 7.900 2.057 . . . 1.0 . . . . . . . . . . . . A . 21 PRO N . . . . . . . . . c30496_6e5h 1 . 9 . 3844 . 1 1 21 PRO O O 5.741 5.709 4.767 . . . 1.0 . . . . . . . . . . . . A . 21 PRO O . . . . . . . . . c30496_6e5h 1 . 9 . 3845 . 1 1 22 ARG C C 2.448 6.113 3.039 . . . 1.0 . . . . . . . . . . . . A . 22 ARG C . . . . . . . . . c30496_6e5h 1 . 9 . 3846 . 1 1 22 ARG CA C 3.329 6.850 4.030 . . . 1.0 . . . . . . . . . . . . A . 22 ARG CA . . . . . . . . . c30496_6e5h 1 . 9 . 3847 . 1 1 22 ARG CB C 2.659 8.146 4.484 . . . 1.0 . . . . . . . . . . . . A . 22 ARG CB . . . . . . . . . c30496_6e5h 1 . 9 . 3848 . 1 1 22 ARG CD C 2.765 10.165 5.996 . . . 1.0 . . . . . . . . . . . . A . 22 ARG CD . . . . . . . . . c30496_6e5h 1 . 9 . 3849 . 1 1 22 ARG CG C 3.391 8.828 5.630 . . . 1.0 . . . . . . . . . . . . A . 22 ARG CG . . . . . . . . . c30496_6e5h 1 . 9 . 3850 . 1 1 22 ARG CZ C 0.852 10.748 7.450 . . . 1.0 . . . . . . . . . . . . A . 22 ARG CZ . . . . . . . . . c30496_6e5h 1 . 9 . 3851 . 1 1 22 ARG H H 4.667 7.760 2.677 . . . 1.0 . . . . . . . . . . . . A . 22 ARG H . . . . . . . . . c30496_6e5h 1 . 9 . 3852 . 1 1 22 ARG HA H 3.490 6.217 4.888 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HA . . . . . . . . . c30496_6e5h 1 . 9 . 3853 . 1 1 22 ARG HB2 H 2.623 8.829 3.649 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HB2 . . . . . . . . . c30496_6e5h 1 . 9 . 3854 . 1 1 22 ARG HB3 H 1.655 7.926 4.804 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HB3 . . . . . . . . . c30496_6e5h 1 . 9 . 3855 . 1 1 22 ARG HD2 H 3.348 10.611 6.787 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HD2 . . . . . . . . . c30496_6e5h 1 . 9 . 3856 . 1 1 22 ARG HD3 H 2.796 10.807 5.128 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HD3 . . . . . . . . . c30496_6e5h 1 . 9 . 3857 . 1 1 22 ARG HE H 0.789 9.426 5.949 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HE . . . . . . . . . c30496_6e5h 1 . 9 . 3858 . 1 1 22 ARG HG2 H 3.365 8.183 6.495 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HG2 . . . . . . . . . c30496_6e5h 1 . 9 . 3859 . 1 1 22 ARG HG3 H 4.419 8.991 5.335 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HG3 . . . . . . . . . c30496_6e5h 1 . 9 . 3860 . 1 1 22 ARG HH11 H 2.595 11.640 7.963 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HH11 . . . . . . . . . c30496_6e5h 1 . 9 . 3861 . 1 1 22 ARG HH12 H 1.223 12.089 8.924 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HH12 . . . . . . . . . c30496_6e5h 1 . 9 . 3862 . 1 1 22 ARG HH21 H -0.831 11.170 8.499 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HH21 . . . . . . . . . c30496_6e5h 1 . 9 . 3863 . 1 1 22 ARG HH22 H -1.032 10.037 7.198 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HH22 . . . . . . . . . c30496_6e5h 1 . 9 . 3864 . 1 1 22 ARG N N 4.620 7.131 3.434 . . . 1.0 . . . . . . . . . . . . A . 22 ARG N . . . . . . . . . c30496_6e5h 1 . 9 . 3865 . 1 1 22 ARG NE N 1.375 10.043 6.445 . . . 1.0 . . . . . . . . . . . . A . 22 ARG NE . . . . . . . . . c30496_6e5h 1 . 9 . 3866 . 1 1 22 ARG NH1 N 1.619 11.555 8.171 . . . 1.0 . . . . . . . . . . . . A . 22 ARG NH1 . . . . . . . . . c30496_6e5h 1 . 9 . 3867 . 1 1 22 ARG NH2 N -0.439 10.640 7.742 . . . 1.0 . . . . . . . . . . . . A . 22 ARG NH2 . . . . . . . . . c30496_6e5h 1 . 9 . 3868 . 1 1 22 ARG O O 2.685 6.156 1.834 . . . 1.0 . . . . . . . . . . . . A . 22 ARG O . . . . . . . . . c30496_6e5h 1 . 9 . 3869 . 1 1 23 TYR C C -0.865 4.779 3.164 . . . 1.0 . . . . . . . . . . . . A . 23 TYR C . . . . . . . . . c30496_6e5h 1 . 9 . 3870 . 1 1 23 TYR CA C 0.569 4.636 2.691 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CA . . . . . . . . . c30496_6e5h 1 . 9 . 3871 . 1 1 23 TYR CB C 0.985 3.164 2.673 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CB . . . . . . . . . c30496_6e5h 1 . 9 . 3872 . 1 1 23 TYR CD1 C 3.464 2.988 3.108 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CD1 . . . . . . . . . c30496_6e5h 1 . 9 . 3873 . 1 1 23 TYR CD2 C 2.690 2.689 0.875 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CD2 . . . . . . . . . c30496_6e5h 1 . 9 . 3874 . 1 1 23 TYR CE1 C 4.762 2.792 2.691 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CE1 . . . . . . . . . c30496_6e5h 1 . 9 . 3875 . 1 1 23 TYR CE2 C 3.987 2.490 0.451 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CE2 . . . . . . . . . c30496_6e5h 1 . 9 . 3876 . 1 1 23 TYR CG C 2.407 2.940 2.210 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CG . . . . . . . . . c30496_6e5h 1 . 9 . 3877 . 1 1 23 TYR CZ C 5.021 2.544 1.362 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CZ . . . . . . . . . c30496_6e5h 1 . 9 . 3878 . 1 1 23 TYR H H 1.315 5.401 4.514 . . . 1.0 . . . . . . . . . . . . A . 23 TYR H . . . . . . . . . c30496_6e5h 1 . 9 . 3879 . 1 1 23 TYR HA H 0.645 5.033 1.691 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HA . . . . . . . . . c30496_6e5h 1 . 9 . 3880 . 1 1 23 TYR HB2 H 0.894 2.757 3.666 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HB2 . . . . . . . . . c30496_6e5h 1 . 9 . 3881 . 1 1 23 TYR HB3 H 0.331 2.625 2.006 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HB3 . . . . . . . . . c30496_6e5h 1 . 9 . 3882 . 1 1 23 TYR HD1 H 3.257 3.183 4.150 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HD1 . . . . . . . . . c30496_6e5h 1 . 9 . 3883 . 1 1 23 TYR HD2 H 1.878 2.649 0.164 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HD2 . . . . . . . . . c30496_6e5h 1 . 9 . 3884 . 1 1 23 TYR HE1 H 5.570 2.834 3.407 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HE1 . . . . . . . . . c30496_6e5h 1 . 9 . 3885 . 1 1 23 TYR HE2 H 4.187 2.294 -0.591 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HE2 . . . . . . . . . c30496_6e5h 1 . 9 . 3886 . 1 1 23 TYR HH H 6.448 2.786 0.094 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HH . . . . . . . . . c30496_6e5h 1 . 9 . 3887 . 1 1 23 TYR N N 1.456 5.407 3.544 . . . 1.0 . . . . . . . . . . . . A . 23 TYR N . . . . . . . . . c30496_6e5h 1 . 9 . 3888 . 1 1 23 TYR O O -1.151 4.660 4.357 . . . 1.0 . . . . . . . . . . . . A . 23 TYR O . . . . . . . . . c30496_6e5h 1 . 9 . 3889 . 1 1 23 TYR OH O 6.318 2.348 0.944 . . . 1.0 . . . . . . . . . . . . A . 23 TYR OH . . . . . . . . . c30496_6e5h 1 . 9 . 3890 . 1 1 24 GLU C C -3.994 4.048 2.156 . . . 1.0 . . . . . . . . . . . . A . 24 GLU C . . . . . . . . . c30496_6e5h 1 . 9 . 3891 . 1 1 24 GLU CA C -3.160 5.254 2.552 . . . 1.0 . . . . . . . . . . . . A . 24 GLU CA . . . . . . . . . c30496_6e5h 1 . 9 . 3892 . 1 1 24 GLU CB C -3.686 6.509 1.851 . . . 1.0 . . . . . . . . . . . . A . 24 GLU CB . . . . . . . . . c30496_6e5h 1 . 9 . 3893 . 1 1 24 GLU CD C -3.071 8.094 3.723 . . . 1.0 . . . . . . . . . . . . A . 24 GLU CD . . . . . . . . . c30496_6e5h 1 . 9 . 3894 . 1 1 24 GLU CG C -2.958 7.785 2.244 . . . 1.0 . . . . . . . . . . . . A . 24 GLU CG . . . . . . . . . c30496_6e5h 1 . 9 . 3895 . 1 1 24 GLU H H -1.475 5.048 1.282 . . . 1.0 . . . . . . . . . . . . A . 24 GLU H . . . . . . . . . c30496_6e5h 1 . 9 . 3896 . 1 1 24 GLU HA H -3.231 5.392 3.620 . . . 1.0 . . . . . . . . . . . . A . 24 GLU HA . . . . . . . . . c30496_6e5h 1 . 9 . 3897 . 1 1 24 GLU HB2 H -3.586 6.380 0.783 . . . 1.0 . . . . . . . . . . . . A . 24 GLU HB2 . . . . . . . . . c30496_6e5h 1 . 9 . 3898 . 1 1 24 GLU HB3 H -4.732 6.627 2.094 . . . 1.0 . . . . . . . . . . . . A . 24 GLU HB3 . . . . . . . . . c30496_6e5h 1 . 9 . 3899 . 1 1 24 GLU HG2 H -1.913 7.679 1.995 . . . 1.0 . . . . . . . . . . . . A . 24 GLU HG2 . . . . . . . . . c30496_6e5h 1 . 9 . 3900 . 1 1 24 GLU HG3 H -3.378 8.609 1.686 . . . 1.0 . . . . . . . . . . . . A . 24 GLU HG3 . . . . . . . . . c30496_6e5h 1 . 9 . 3901 . 1 1 24 GLU N N -1.761 5.031 2.225 . . . 1.0 . . . . . . . . . . . . A . 24 GLU N . . . . . . . . . c30496_6e5h 1 . 9 . 3902 . 1 1 24 GLU O O -4.083 3.699 0.982 . . . 1.0 . . . . . . . . . . . . A . 24 GLU O . . . . . . . . . c30496_6e5h 1 . 9 . 3903 . 1 1 24 GLU OE1 O -2.069 7.929 4.448 . . . 1.0 . . . . . . . . . . . . A . 24 GLU OE1 . . . . . . . . . c30496_6e5h 1 . 9 . 3904 . 1 1 24 GLU OE2 O -4.162 8.509 4.165 . . . 1.0 . . . . . . . . . . . . A . 24 GLU OE2 . . . . . . . . . c30496_6e5h 1 . 9 . 3905 . 1 1 25 VAL C C -6.846 2.552 2.661 . . . 1.0 . . . . . . . . . . . . A . 25 VAL C . . . . . . . . . c30496_6e5h 1 . 9 . 3906 . 1 1 25 VAL CA C -5.379 2.211 2.891 . . . 1.0 . . . . . . . . . . . . A . 25 VAL CA . . . . . . . . . c30496_6e5h 1 . 9 . 3907 . 1 1 25 VAL CB C -5.254 1.219 4.066 . . . 1.0 . . . . . . . . . . . . A . 25 VAL CB . . . . . . . . . c30496_6e5h 1 . 9 . 3908 . 1 1 25 VAL CG1 C -6.073 -0.036 3.805 . . . 1.0 . . . . . . . . . . . . A . 25 VAL CG1 . . . . . . . . . c30496_6e5h 1 . 9 . 3909 . 1 1 25 VAL CG2 C -3.795 0.860 4.309 . . . 1.0 . . . . . . . . . . . . A . 25 VAL CG2 . . . . . . . . . c30496_6e5h 1 . 9 . 3910 . 1 1 25 VAL H H -4.551 3.774 4.048 . . . 1.0 . . . . . . . . . . . . A . 25 VAL H . . . . . . . . . c30496_6e5h 1 . 9 . 3911 . 1 1 25 VAL HA H -4.986 1.740 2.003 . . . 1.0 . . . . . . . . . . . . A . 25 VAL HA . . . . . . . . . c30496_6e5h 1 . 9 . 3912 . 1 1 25 VAL HB H -5.639 1.695 4.956 . . . 1.0 . . . . . . . . . . . . A . 25 VAL HB . . . . . . . . . c30496_6e5h 1 . 9 . 3913 . 1 1 25 VAL HG11 H -5.707 -0.524 2.915 . . . 1.0 . . . . . . . . . . . . A . 25 VAL HG11 . . . . . . . . . c30496_6e5h 1 . 9 . 3914 . 1 1 25 VAL HG12 H -7.109 0.234 3.667 . . . 1.0 . . . . . . . . . . . . A . 25 VAL HG12 . . . . . . . . . c30496_6e5h 1 . 9 . 3915 . 1 1 25 VAL HG13 H -5.983 -0.706 4.647 . . . 1.0 . . . . . . . . . . . . A . 25 VAL HG13 . . . . . . . . . c30496_6e5h 1 . 9 . 3916 . 1 1 25 VAL HG21 H -3.381 0.416 3.415 . . . 1.0 . . . . . . . . . . . . A . 25 VAL HG21 . . . . . . . . . c30496_6e5h 1 . 9 . 3917 . 1 1 25 VAL HG22 H -3.729 0.155 5.124 . . . 1.0 . . . . . . . . . . . . A . 25 VAL HG22 . . . . . . . . . c30496_6e5h 1 . 9 . 3918 . 1 1 25 VAL HG23 H -3.241 1.753 4.557 . . . 1.0 . . . . . . . . . . . . A . 25 VAL HG23 . . . . . . . . . c30496_6e5h 1 . 9 . 3919 . 1 1 25 VAL N N -4.607 3.415 3.136 . . . 1.0 . . . . . . . . . . . . A . 25 VAL N . . . . . . . . . c30496_6e5h 1 . 9 . 3920 . 1 1 25 VAL O O -7.527 3.056 3.555 . . . 1.0 . . . . . . . . . . . . A . 25 VAL O . . . . . . . . . c30496_6e5h 1 . 9 . 3921 . 1 1 26 HIS C C -9.462 1.286 0.818 . . . 1.0 . . . . . . . . . . . . A . 26 HIS C . . . . . . . . . c30496_6e5h 1 . 9 . 3922 . 1 1 26 HIS CA C -8.707 2.576 1.103 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CA . . . . . . . . . c30496_6e5h 1 . 9 . 3923 . 1 1 26 HIS CB C -8.775 3.508 -0.110 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CB . . . . . . . . . c30496_6e5h 1 . 9 . 3924 . 1 1 26 HIS CD2 C -7.204 5.472 0.525 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CD2 . . . . . . . . . c30496_6e5h 1 . 9 . 3925 . 1 1 26 HIS CE1 C -8.675 7.089 0.472 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CE1 . . . . . . . . . c30496_6e5h 1 . 9 . 3926 . 1 1 26 HIS CG C -8.396 4.925 0.192 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CG . . . . . . . . . c30496_6e5h 1 . 9 . 3927 . 1 1 26 HIS H H -6.726 1.910 0.768 . . . 1.0 . . . . . . . . . . . . A . 26 HIS H . . . . . . . . . c30496_6e5h 1 . 9 . 3928 . 1 1 26 HIS HA H -9.165 3.066 1.946 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HA . . . . . . . . . c30496_6e5h 1 . 9 . 3929 . 1 1 26 HIS HB2 H -8.100 3.145 -0.868 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HB2 . . . . . . . . . c30496_6e5h 1 . 9 . 3930 . 1 1 26 HIS HB3 H -9.779 3.507 -0.501 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HB3 . . . . . . . . . c30496_6e5h 1 . 9 . 3931 . 1 1 26 HIS HD1 H -10.253 5.892 -0.043 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HD1 . . . . . . . . . c30496_6e5h 1 . 9 . 3932 . 1 1 26 HIS HD2 H -6.269 4.944 0.637 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HD2 . . . . . . . . . c30496_6e5h 1 . 9 . 3933 . 1 1 26 HIS HE1 H -9.131 8.065 0.529 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HE1 . . . . . . . . . c30496_6e5h 1 . 9 . 3934 . 1 1 26 HIS HE2 H -6.780 7.426 1.154 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HE2 . . . . . . . . . c30496_6e5h 1 . 9 . 3935 . 1 1 26 HIS N N -7.323 2.296 1.452 . . . 1.0 . . . . . . . . . . . . A . 26 HIS N . . . . . . . . . c30496_6e5h 1 . 9 . 3936 . 1 1 26 HIS ND1 N -9.295 5.965 0.169 . . . 1.0 . . . . . . . . . . . . A . 26 HIS ND1 . . . . . . . . . c30496_6e5h 1 . 9 . 3937 . 1 1 26 HIS NE2 N -7.403 6.820 0.695 . . . 1.0 . . . . . . . . . . . . A . 26 HIS NE2 . . . . . . . . . c30496_6e5h 1 . 9 . 3938 . 1 1 26 HIS O O -9.442 0.778 -0.300 . . . 1.0 . . . . . . . . . . . . A . 26 HIS O . . . . . . . . . c30496_6e5h 1 . 9 . 3939 . 1 1 27 CYS C C -12.300 -0.178 1.241 . . . 1.0 . . . . . . . . . . . . A . 27 CYS C . . . . . . . . . c30496_6e5h 1 . 9 . 3940 . 1 1 27 CYS CA C -10.878 -0.479 1.690 . . . 1.0 . . . . . . . . . . . . A . 27 CYS CA . . . . . . . . . c30496_6e5h 1 . 9 . 3941 . 1 1 27 CYS CB C -10.897 -1.254 3.007 . . . 1.0 . . . . . . . . . . . . A . 27 CYS CB . . . . . . . . . c30496_6e5h 1 . 9 . 3942 . 1 1 27 CYS H H -10.106 1.205 2.705 . . . 1.0 . . . . . . . . . . . . A . 27 CYS H . . . . . . . . . c30496_6e5h 1 . 9 . 3943 . 1 1 27 CYS HA H -10.395 -1.079 0.936 . . . 1.0 . . . . . . . . . . . . A . 27 CYS HA . . . . . . . . . c30496_6e5h 1 . 9 . 3944 . 1 1 27 CYS HB2 H -11.398 -0.661 3.756 . . . 1.0 . . . . . . . . . . . . A . 27 CYS HB2 . . . . . . . . . c30496_6e5h 1 . 9 . 3945 . 1 1 27 CYS HB3 H -11.441 -2.174 2.863 . . . 1.0 . . . . . . . . . . . . A . 27 CYS HB3 . . . . . . . . . c30496_6e5h 1 . 9 . 3946 . 1 1 27 CYS N N -10.120 0.753 1.833 . . . 1.0 . . . . . . . . . . . . A . 27 CYS N . . . . . . . . . c30496_6e5h 1 . 9 . 3947 . 1 1 27 CYS O O -12.750 -0.645 0.196 . . . 1.0 . . . . . . . . . . . . A . 27 CYS O . . . . . . . . . c30496_6e5h 1 . 9 . 3948 . 1 1 27 CYS SG S -9.244 -1.677 3.648 . . . 1.0 . . . . . . . . . . . . A . 27 CYS SG . . . . . . . . . c30496_6e5h 1 . 9 . 3949 . 1 1 28 NH2 HN1 H -12.587 0.934 2.860 . . . 1.0 . . . . . . . . . . . . A . 28 NH2 HN1 . . . . . . . . . c30496_6e5h 1 . 9 . 3950 . 1 1 28 NH2 HN2 H -13.939 0.790 1.792 . . . 1.0 . . . . . . . . . . . . A . 28 NH2 HN2 . . . . . . . . . c30496_6e5h 1 . 9 . 3951 . 1 1 28 NH2 N N -13.012 0.594 2.042 . . . 1.0 . . . . . . . . . . . . A . 28 NH2 N . . . . . . . . . c30496_6e5h 1 . 10 . 3952 . 1 1 1 ASN C C 10.253 -1.715 -0.149 . . . 1.0 . . . . . . . . . . . . A . 1 ASN C . . . . . . . . . c30496_6e5h 1 . 10 . 3953 . 1 1 1 ASN CA C 11.559 -1.682 0.632 . . . 1.0 . . . . . . . . . . . . A . 1 ASN CA . . . . . . . . . c30496_6e5h 1 . 10 . 3954 . 1 1 1 ASN CB C 11.328 -2.161 2.076 . . . 1.0 . . . . . . . . . . . . A . 1 ASN CB . . . . . . . . . c30496_6e5h 1 . 10 . 3955 . 1 1 1 ASN CG C 12.619 -2.299 2.861 . . . 1.0 . . . . . . . . . . . . A . 1 ASN CG . . . . . . . . . c30496_6e5h 1 . 10 . 3956 . 1 1 1 ASN H1 H 12.282 0.002 -0.347 . . . 1.0 . . . . . . . . . . . . A . 1 ASN H1 . . . . . . . . . c30496_6e5h 1 . 10 . 3957 . 1 1 1 ASN H2 H 12.997 -0.267 1.159 . . . 1.0 . . . . . . . . . . . . A . 1 ASN H2 . . . . . . . . . c30496_6e5h 1 . 10 . 3958 . 1 1 1 ASN H3 H 11.424 0.349 1.064 . . . 1.0 . . . . . . . . . . . . A . 1 ASN H3 . . . . . . . . . c30496_6e5h 1 . 10 . 3959 . 1 1 1 ASN HA H 12.274 -2.332 0.149 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HA . . . . . . . . . c30496_6e5h 1 . 10 . 3960 . 1 1 1 ASN HB2 H 10.696 -1.450 2.587 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HB2 . . . . . . . . . c30496_6e5h 1 . 10 . 3961 . 1 1 1 ASN HB3 H 10.836 -3.122 2.057 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HB3 . . . . . . . . . c30496_6e5h 1 . 10 . 3962 . 1 1 1 ASN HD21 H 11.649 -1.999 4.573 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HD21 . . . . . . . . . c30496_6e5h 1 . 10 . 3963 . 1 1 1 ASN HD22 H 13.358 -2.254 4.705 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HD22 . . . . . . . . . c30496_6e5h 1 . 10 . 3964 . 1 1 1 ASN N N 12.106 -0.306 0.629 . . . 1.0 . . . . . . . . . . . . A . 1 ASN N . . . . . . . . . c30496_6e5h 1 . 10 . 3965 . 1 1 1 ASN ND2 N 12.534 -2.171 4.177 . . . 1.0 . . . . . . . . . . . . A . 1 ASN ND2 . . . . . . . . . c30496_6e5h 1 . 10 . 3966 . 1 1 1 ASN O O 9.666 -0.670 -0.424 . . . 1.0 . . . . . . . . . . . . A . 1 ASN O . . . . . . . . . c30496_6e5h 1 . 10 . 3967 . 1 1 1 ASN OD1 O 13.686 -2.532 2.290 . . . 1.0 . . . . . . . . . . . . A . 1 ASN OD1 . . . . . . . . . c30496_6e5h 1 . 10 . 3968 . 1 1 2 ASP C C 7.351 -3.124 -0.323 . . . 1.0 . . . . . . . . . . . . A . 2 ASP C . . . . . . . . . c30496_6e5h 1 . 10 . 3969 . 1 1 2 ASP CA C 8.554 -3.057 -1.265 . . . 1.0 . . . . . . . . . . . . A . 2 ASP CA . . . . . . . . . c30496_6e5h 1 . 10 . 3970 . 1 1 2 ASP CB C 8.601 -4.289 -2.188 . . . 1.0 . . . . . . . . . . . . A . 2 ASP CB . . . . . . . . . c30496_6e5h 1 . 10 . 3971 . 1 1 2 ASP CG C 9.097 -5.550 -1.502 . . . 1.0 . . . . . . . . . . . . A . 2 ASP CG . . . . . . . . . c30496_6e5h 1 . 10 . 3972 . 1 1 2 ASP H H 10.313 -3.713 -0.277 . . . 1.0 . . . . . . . . . . . . A . 2 ASP H . . . . . . . . . c30496_6e5h 1 . 10 . 3973 . 1 1 2 ASP HA H 8.448 -2.172 -1.878 . . . 1.0 . . . . . . . . . . . . A . 2 ASP HA . . . . . . . . . c30496_6e5h 1 . 10 . 3974 . 1 1 2 ASP HB2 H 7.609 -4.481 -2.563 . . . 1.0 . . . . . . . . . . . . A . 2 ASP HB2 . . . . . . . . . c30496_6e5h 1 . 10 . 3975 . 1 1 2 ASP HB3 H 9.256 -4.075 -3.021 . . . 1.0 . . . . . . . . . . . . A . 2 ASP HB3 . . . . . . . . . c30496_6e5h 1 . 10 . 3976 . 1 1 2 ASP N N 9.800 -2.908 -0.516 . . . 1.0 . . . . . . . . . . . . A . 2 ASP N . . . . . . . . . c30496_6e5h 1 . 10 . 3977 . 1 1 2 ASP O O 6.467 -3.973 -0.469 . . . 1.0 . . . . . . . . . . . . A . 2 ASP O . . . . . . . . . c30496_6e5h 1 . 10 . 3978 . 1 1 2 ASP OD1 O 8.310 -6.207 -0.797 . . . 1.0 . . . . . . . . . . . . A . 2 ASP OD1 . . . . . . . . . c30496_6e5h 1 . 10 . 3979 . 1 1 2 ASP OD2 O 10.287 -5.897 -1.677 . . . 1.0 . . . . . . . . . . . . A . 2 ASP OD2 . . . . . . . . . c30496_6e5h 1 . 10 . 3980 . 1 1 3 LYS C C 4.902 -1.889 0.904 . . . 1.0 . . . . . . . . . . . . A . 3 LYS C . . . . . . . . . c30496_6e5h 1 . 10 . 3981 . 1 1 3 LYS CA C 6.238 -2.107 1.603 . . . 1.0 . . . . . . . . . . . . A . 3 LYS CA . . . . . . . . . c30496_6e5h 1 . 10 . 3982 . 1 1 3 LYS CB C 6.511 -0.969 2.595 . . . 1.0 . . . . . . . . . . . . A . 3 LYS CB . . . . . . . . . c30496_6e5h 1 . 10 . 3983 . 1 1 3 LYS CD C 5.187 -1.883 4.546 . . . 1.0 . . . . . . . . . . . . A . 3 LYS CD . . . . . . . . . c30496_6e5h 1 . 10 . 3984 . 1 1 3 LYS CE C 6.306 -1.950 5.572 . . . 1.0 . . . . . . . . . . . . A . 3 LYS CE . . . . . . . . . c30496_6e5h 1 . 10 . 3985 . 1 1 3 LYS CG C 5.376 -0.722 3.581 . . . 1.0 . . . . . . . . . . . . A . 3 LYS CG . . . . . . . . . c30496_6e5h 1 . 10 . 3986 . 1 1 3 LYS H H 8.038 -1.528 0.661 . . . 1.0 . . . . . . . . . . . . A . 3 LYS H . . . . . . . . . c30496_6e5h 1 . 10 . 3987 . 1 1 3 LYS HA H 6.204 -3.041 2.139 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HA . . . . . . . . . c30496_6e5h 1 . 10 . 3988 . 1 1 3 LYS HB2 H 7.402 -1.204 3.157 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HB2 . . . . . . . . . c30496_6e5h 1 . 10 . 3989 . 1 1 3 LYS HB3 H 6.679 -0.056 2.041 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HB3 . . . . . . . . . c30496_6e5h 1 . 10 . 3990 . 1 1 3 LYS HD2 H 4.247 -1.754 5.064 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HD2 . . . . . . . . . c30496_6e5h 1 . 10 . 3991 . 1 1 3 LYS HD3 H 5.166 -2.806 3.986 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HD3 . . . . . . . . . c30496_6e5h 1 . 10 . 3992 . 1 1 3 LYS HE2 H 7.247 -2.067 5.056 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HE2 . . . . . . . . . c30496_6e5h 1 . 10 . 3993 . 1 1 3 LYS HE3 H 6.316 -1.028 6.133 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HE3 . . . . . . . . . c30496_6e5h 1 . 10 . 3994 . 1 1 3 LYS HG2 H 5.598 0.169 4.149 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HG2 . . . . . . . . . c30496_6e5h 1 . 10 . 3995 . 1 1 3 LYS HG3 H 4.463 -0.576 3.025 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HG3 . . . . . . . . . c30496_6e5h 1 . 10 . 3996 . 1 1 3 LYS HZ1 H 6.203 -3.991 6.006 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HZ1 . . . . . . . . . c30496_6e5h 1 . 10 . 3997 . 1 1 3 LYS HZ2 H 5.188 -3.036 6.961 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HZ2 . . . . . . . . . c30496_6e5h 1 . 10 . 3998 . 1 1 3 LYS HZ3 H 6.852 -3.055 7.255 . . . 1.0 . . . . . . . . . . . . A . 3 LYS HZ3 . . . . . . . . . c30496_6e5h 1 . 10 . 3999 . 1 1 3 LYS N N 7.317 -2.189 0.626 . . . 1.0 . . . . . . . . . . . . A . 3 LYS N . . . . . . . . . c30496_6e5h 1 . 10 . 4000 . 1 1 3 LYS NZ N 6.125 -3.086 6.513 . . . 1.0 . . . . . . . . . . . . A . 3 LYS NZ . . . . . . . . . c30496_6e5h 1 . 10 . 4001 . 1 1 3 LYS O O 3.881 -2.441 1.310 . . . 1.0 . . . . . . . . . . . . A . 3 LYS O . . . . . . . . . c30496_6e5h 1 . 10 . 4002 . 1 1 4 CYS C C 3.154 -2.153 -1.456 . . . 1.0 . . . . . . . . . . . . A . 4 CYS C . . . . . . . . . c30496_6e5h 1 . 10 . 4003 . 1 1 4 CYS CA C 3.745 -0.840 -0.961 . . . 1.0 . . . . . . . . . . . . A . 4 CYS CA . . . . . . . . . c30496_6e5h 1 . 10 . 4004 . 1 1 4 CYS CB C 4.097 0.053 -2.153 . . . 1.0 . . . . . . . . . . . . A . 4 CYS CB . . . . . . . . . c30496_6e5h 1 . 10 . 4005 . 1 1 4 CYS H H 5.773 -0.658 -0.401 . . . 1.0 . . . . . . . . . . . . A . 4 CYS H . . . . . . . . . c30496_6e5h 1 . 10 . 4006 . 1 1 4 CYS HA H 3.017 -0.339 -0.344 . . . 1.0 . . . . . . . . . . . . A . 4 CYS HA . . . . . . . . . c30496_6e5h 1 . 10 . 4007 . 1 1 4 CYS HB2 H 4.480 0.993 -1.790 . . . 1.0 . . . . . . . . . . . . A . 4 CYS HB2 . . . . . . . . . c30496_6e5h 1 . 10 . 4008 . 1 1 4 CYS HB3 H 4.860 -0.435 -2.743 . . . 1.0 . . . . . . . . . . . . A . 4 CYS HB3 . . . . . . . . . c30496_6e5h 1 . 10 . 4009 . 1 1 4 CYS N N 4.929 -1.092 -0.156 . . . 1.0 . . . . . . . . . . . . A . 4 CYS N . . . . . . . . . c30496_6e5h 1 . 10 . 4010 . 1 1 4 CYS O O 1.955 -2.396 -1.328 . . . 1.0 . . . . . . . . . . . . A . 4 CYS O . . . . . . . . . c30496_6e5h 1 . 10 . 4011 . 1 1 4 CYS SG S 2.692 0.415 -3.257 . . . 1.0 . . . . . . . . . . . . A . 4 CYS SG . . . . . . . . . c30496_6e5h 1 . 10 . 4012 . 1 1 5 LYS C C 3.070 -5.191 -1.415 . . . 1.0 . . . . . . . . . . . . A . 5 LYS C . . . . . . . . . c30496_6e5h 1 . 10 . 4013 . 1 1 5 LYS CA C 3.591 -4.291 -2.525 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CA . . . . . . . . . c30496_6e5h 1 . 10 . 4014 . 1 1 5 LYS CB C 4.749 -4.970 -3.257 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CB . . . . . . . . . c30496_6e5h 1 . 10 . 4015 . 1 1 5 LYS CD C 4.315 -3.944 -5.523 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CD . . . . . . . . . c30496_6e5h 1 . 10 . 4016 . 1 1 5 LYS CE C 4.937 -3.212 -6.702 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CE . . . . . . . . . c30496_6e5h 1 . 10 . 4017 . 1 1 5 LYS CG C 5.323 -4.147 -4.402 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CG . . . . . . . . . c30496_6e5h 1 . 10 . 4018 . 1 1 5 LYS H H 4.970 -2.791 -1.982 . . . 1.0 . . . . . . . . . . . . A . 5 LYS H . . . . . . . . . c30496_6e5h 1 . 10 . 4019 . 1 1 5 LYS HA H 2.791 -4.103 -3.223 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HA . . . . . . . . . c30496_6e5h 1 . 10 . 4020 . 1 1 5 LYS HB2 H 5.541 -5.160 -2.549 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HB2 . . . . . . . . . c30496_6e5h 1 . 10 . 4021 . 1 1 5 LYS HB3 H 4.404 -5.912 -3.658 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HB3 . . . . . . . . . c30496_6e5h 1 . 10 . 4022 . 1 1 5 LYS HD2 H 3.960 -4.907 -5.858 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HD2 . . . . . . . . . c30496_6e5h 1 . 10 . 4023 . 1 1 5 LYS HD3 H 3.486 -3.362 -5.150 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HD3 . . . . . . . . . c30496_6e5h 1 . 10 . 4024 . 1 1 5 LYS HE2 H 5.307 -2.257 -6.359 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HE2 . . . . . . . . . c30496_6e5h 1 . 10 . 4025 . 1 1 5 LYS HE3 H 5.760 -3.800 -7.080 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HE3 . . . . . . . . . c30496_6e5h 1 . 10 . 4026 . 1 1 5 LYS HG2 H 5.618 -3.181 -4.022 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HG2 . . . . . . . . . c30496_6e5h 1 . 10 . 4027 . 1 1 5 LYS HG3 H 6.188 -4.657 -4.796 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HG3 . . . . . . . . . c30496_6e5h 1 . 10 . 4028 . 1 1 5 LYS HZ1 H 4.426 -2.519 -8.602 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HZ1 . . . . . . . . . c30496_6e5h 1 . 10 . 4029 . 1 1 5 LYS HZ2 H 3.186 -2.377 -7.464 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HZ2 . . . . . . . . . c30496_6e5h 1 . 10 . 4030 . 1 1 5 LYS HZ3 H 3.561 -3.890 -8.116 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HZ3 . . . . . . . . . c30496_6e5h 1 . 10 . 4031 . 1 1 5 LYS N N 4.017 -3.014 -1.980 . . . 1.0 . . . . . . . . . . . . A . 5 LYS N . . . . . . . . . c30496_6e5h 1 . 10 . 4032 . 1 1 5 LYS NZ N 3.959 -2.985 -7.797 . . . 1.0 . . . . . . . . . . . . A . 5 LYS NZ . . . . . . . . . c30496_6e5h 1 . 10 . 4033 . 1 1 5 LYS O O 2.068 -5.879 -1.584 . . . 1.0 . . . . . . . . . . . . A . 5 LYS O . . . . . . . . . c30496_6e5h 1 . 10 . 4034 . 1 1 6 GLU C C 1.946 -5.543 1.366 . . . 1.0 . . . . . . . . . . . . A . 6 GLU C . . . . . . . . . c30496_6e5h 1 . 10 . 4035 . 1 1 6 GLU CA C 3.336 -5.945 0.884 . . . 1.0 . . . . . . . . . . . . A . 6 GLU CA . . . . . . . . . c30496_6e5h 1 . 10 . 4036 . 1 1 6 GLU CB C 4.345 -5.779 2.020 . . . 1.0 . . . . . . . . . . . . A . 6 GLU CB . . . . . . . . . c30496_6e5h 1 . 10 . 4037 . 1 1 6 GLU CD C 5.429 -8.027 1.681 . . . 1.0 . . . . . . . . . . . . A . 6 GLU CD . . . . . . . . . c30496_6e5h 1 . 10 . 4038 . 1 1 6 GLU CG C 5.644 -6.532 1.796 . . . 1.0 . . . . . . . . . . . . A . 6 GLU CG . . . . . . . . . c30496_6e5h 1 . 10 . 4039 . 1 1 6 GLU H H 4.547 -4.590 -0.210 . . . 1.0 . . . . . . . . . . . . A . 6 GLU H . . . . . . . . . c30496_6e5h 1 . 10 . 4040 . 1 1 6 GLU HA H 3.311 -6.982 0.586 . . . 1.0 . . . . . . . . . . . . A . 6 GLU HA . . . . . . . . . c30496_6e5h 1 . 10 . 4041 . 1 1 6 GLU HB2 H 4.576 -4.729 2.128 . . . 1.0 . . . . . . . . . . . . A . 6 GLU HB2 . . . . . . . . . c30496_6e5h 1 . 10 . 4042 . 1 1 6 GLU HB3 H 3.898 -6.136 2.935 . . . 1.0 . . . . . . . . . . . . A . 6 GLU HB3 . . . . . . . . . c30496_6e5h 1 . 10 . 4043 . 1 1 6 GLU HG2 H 6.102 -6.179 0.884 . . . 1.0 . . . . . . . . . . . . A . 6 GLU HG2 . . . . . . . . . c30496_6e5h 1 . 10 . 4044 . 1 1 6 GLU HG3 H 6.308 -6.341 2.626 . . . 1.0 . . . . . . . . . . . . A . 6 GLU HG3 . . . . . . . . . c30496_6e5h 1 . 10 . 4045 . 1 1 6 GLU N N 3.745 -5.158 -0.275 . . . 1.0 . . . . . . . . . . . . A . 6 GLU N . . . . . . . . . c30496_6e5h 1 . 10 . 4046 . 1 1 6 GLU O O 1.128 -6.395 1.724 . . . 1.0 . . . . . . . . . . . . A . 6 GLU O . . . . . . . . . c30496_6e5h 1 . 10 . 4047 . 1 1 6 GLU OE1 O 5.037 -8.654 2.687 . . . 1.0 . . . . . . . . . . . . A . 6 GLU OE1 . . . . . . . . . c30496_6e5h 1 . 10 . 4048 . 1 1 6 GLU OE2 O 5.649 -8.581 0.582 . . . 1.0 . . . . . . . . . . . . A . 6 GLU OE2 . . . . . . . . . c30496_6e5h 1 . 10 . 4049 . 1 1 7 LEU C C -0.674 -4.054 0.759 . . . 1.0 . . . . . . . . . . . . A . 7 LEU C . . . . . . . . . c30496_6e5h 1 . 10 . 4050 . 1 1 7 LEU CA C 0.389 -3.736 1.801 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CA . . . . . . . . . c30496_6e5h 1 . 10 . 4051 . 1 1 7 LEU CB C 0.470 -2.232 2.050 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CB . . . . . . . . . c30496_6e5h 1 . 10 . 4052 . 1 1 7 LEU CD1 C 1.486 -0.295 3.280 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CD1 . . . . . . . . . c30496_6e5h 1 . 10 . 4053 . 1 1 7 LEU CD2 C 1.080 -2.440 4.487 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CD2 . . . . . . . . . c30496_6e5h 1 . 10 . 4054 . 1 1 7 LEU CG C 1.451 -1.807 3.152 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CG . . . . . . . . . c30496_6e5h 1 . 10 . 4055 . 1 1 7 LEU H H 2.374 -3.611 1.080 . . . 1.0 . . . . . . . . . . . . A . 7 LEU H . . . . . . . . . c30496_6e5h 1 . 10 . 4056 . 1 1 7 LEU HA H 0.126 -4.231 2.722 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HA . . . . . . . . . c30496_6e5h 1 . 10 . 4057 . 1 1 7 LEU HB2 H 0.768 -1.756 1.128 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HB2 . . . . . . . . . c30496_6e5h 1 . 10 . 4058 . 1 1 7 LEU HB3 H -0.512 -1.880 2.316 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HB3 . . . . . . . . . c30496_6e5h 1 . 10 . 4059 . 1 1 7 LEU HD11 H 0.499 0.071 3.520 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD11 . . . . . . . . . c30496_6e5h 1 . 10 . 4060 . 1 1 7 LEU HD12 H 1.815 0.139 2.347 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD12 . . . . . . . . . c30496_6e5h 1 . 10 . 4061 . 1 1 7 LEU HD13 H 2.173 -0.016 4.067 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD13 . . . . . . . . . c30496_6e5h 1 . 10 . 4062 . 1 1 7 LEU HD21 H 0.079 -2.145 4.757 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD21 . . . . . . . . . c30496_6e5h 1 . 10 . 4063 . 1 1 7 LEU HD22 H 1.770 -2.105 5.248 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD22 . . . . . . . . . c30496_6e5h 1 . 10 . 4064 . 1 1 7 LEU HD23 H 1.130 -3.515 4.405 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD23 . . . . . . . . . c30496_6e5h 1 . 10 . 4065 . 1 1 7 LEU HG H 2.444 -2.144 2.887 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HG . . . . . . . . . c30496_6e5h 1 . 10 . 4066 . 1 1 7 LEU N N 1.681 -4.246 1.373 . . . 1.0 . . . . . . . . . . . . A . 7 LEU N . . . . . . . . . c30496_6e5h 1 . 10 . 4067 . 1 1 7 LEU O O -1.816 -4.370 1.099 . . . 1.0 . . . . . . . . . . . . A . 7 LEU O . . . . . . . . . c30496_6e5h 1 . 10 . 4068 . 1 1 8 LYS C C -1.553 -5.830 -1.508 . . . 1.0 . . . . . . . . . . . . A . 8 LYS C . . . . . . . . . c30496_6e5h 1 . 10 . 4069 . 1 1 8 LYS CA C -1.166 -4.359 -1.611 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CA . . . . . . . . . c30496_6e5h 1 . 10 . 4070 . 1 1 8 LYS CB C -0.490 -4.108 -2.964 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CB . . . . . . . . . c30496_6e5h 1 . 10 . 4071 . 1 1 8 LYS CD C -1.653 -2.068 -3.891 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CD . . . . . . . . . c30496_6e5h 1 . 10 . 4072 . 1 1 8 LYS CE C -1.433 -0.698 -4.515 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CE . . . . . . . . . c30496_6e5h 1 . 10 . 4073 . 1 1 8 LYS CG C -0.352 -2.640 -3.350 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CG . . . . . . . . . c30496_6e5h 1 . 10 . 4074 . 1 1 8 LYS H H 0.629 -3.674 -0.708 . . . 1.0 . . . . . . . . . . . . A . 8 LYS H . . . . . . . . . c30496_6e5h 1 . 10 . 4075 . 1 1 8 LYS HA H -2.058 -3.756 -1.540 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HA . . . . . . . . . c30496_6e5h 1 . 10 . 4076 . 1 1 8 LYS HB2 H 0.498 -4.539 -2.939 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HB2 . . . . . . . . . c30496_6e5h 1 . 10 . 4077 . 1 1 8 LYS HB3 H -1.065 -4.604 -3.732 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HB3 . . . . . . . . . c30496_6e5h 1 . 10 . 4078 . 1 1 8 LYS HD2 H -2.044 -2.736 -4.643 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HD2 . . . . . . . . . c30496_6e5h 1 . 10 . 4079 . 1 1 8 LYS HD3 H -2.362 -1.976 -3.085 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HD3 . . . . . . . . . c30496_6e5h 1 . 10 . 4080 . 1 1 8 LYS HE2 H -1.082 -0.021 -3.751 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HE2 . . . . . . . . . c30496_6e5h 1 . 10 . 4081 . 1 1 8 LYS HE3 H -0.683 -0.785 -5.287 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HE3 . . . . . . . . . c30496_6e5h 1 . 10 . 4082 . 1 1 8 LYS HG2 H -0.066 -2.075 -2.477 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HG2 . . . . . . . . . c30496_6e5h 1 . 10 . 4083 . 1 1 8 LYS HG3 H 0.413 -2.548 -4.107 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HG3 . . . . . . . . . c30496_6e5h 1 . 10 . 4084 . 1 1 8 LYS HZ1 H -3.102 -0.838 -5.765 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ1 . . . . . . . . . c30496_6e5h 1 . 10 . 4085 . 1 1 8 LYS HZ2 H -2.466 0.720 -5.644 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ2 . . . . . . . . . c30496_6e5h 1 . 10 . 4086 . 1 1 8 LYS HZ3 H -3.365 0.079 -4.370 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ3 . . . . . . . . . c30496_6e5h 1 . 10 . 4087 . 1 1 8 LYS N N -0.282 -3.987 -0.509 . . . 1.0 . . . . . . . . . . . . A . 8 LYS N . . . . . . . . . c30496_6e5h 1 . 10 . 4088 . 1 1 8 LYS NZ N -2.678 -0.147 -5.113 . . . 1.0 . . . . . . . . . . . . A . 8 LYS NZ . . . . . . . . . c30496_6e5h 1 . 10 . 4089 . 1 1 8 LYS O O -2.677 -6.212 -1.826 . . . 1.0 . . . . . . . . . . . . A . 8 LYS O . . . . . . . . . c30496_6e5h 1 . 10 . 4090 . 1 1 9 LYS C C -1.789 -8.296 0.303 . . . 1.0 . . . . . . . . . . . . A . 9 LYS C . . . . . . . . . c30496_6e5h 1 . 10 . 4091 . 1 1 9 LYS CA C -0.859 -8.076 -0.882 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CA . . . . . . . . . c30496_6e5h 1 . 10 . 4092 . 1 1 9 LYS CB C 0.453 -8.836 -0.657 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CB . . . . . . . . . c30496_6e5h 1 . 10 . 4093 . 1 1 9 LYS CD C 2.715 -9.476 -1.519 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CD . . . . . . . . . c30496_6e5h 1 . 10 . 4094 . 1 1 9 LYS CE C 3.704 -9.351 -2.666 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CE . . . . . . . . . c30496_6e5h 1 . 10 . 4095 . 1 1 9 LYS CG C 1.393 -8.811 -1.848 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CG . . . . . . . . . c30496_6e5h 1 . 10 . 4096 . 1 1 9 LYS H H 0.295 -6.300 -0.900 . . . 1.0 . . . . . . . . . . . . A . 9 LYS H . . . . . . . . . c30496_6e5h 1 . 10 . 4097 . 1 1 9 LYS HA H -1.336 -8.450 -1.772 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HA . . . . . . . . . c30496_6e5h 1 . 10 . 4098 . 1 1 9 LYS HB2 H 0.968 -8.399 0.187 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HB2 . . . . . . . . . c30496_6e5h 1 . 10 . 4099 . 1 1 9 LYS HB3 H 0.222 -9.867 -0.429 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HB3 . . . . . . . . . c30496_6e5h 1 . 10 . 4100 . 1 1 9 LYS HD2 H 3.136 -9.004 -0.643 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HD2 . . . . . . . . . c30496_6e5h 1 . 10 . 4101 . 1 1 9 LYS HD3 H 2.540 -10.523 -1.317 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HD3 . . . . . . . . . c30496_6e5h 1 . 10 . 4102 . 1 1 9 LYS HE2 H 3.849 -8.305 -2.886 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HE2 . . . . . . . . . c30496_6e5h 1 . 10 . 4103 . 1 1 9 LYS HE3 H 4.644 -9.787 -2.361 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HE3 . . . . . . . . . c30496_6e5h 1 . 10 . 4104 . 1 1 9 LYS HG2 H 0.933 -9.337 -2.672 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HG2 . . . . . . . . . c30496_6e5h 1 . 10 . 4105 . 1 1 9 LYS HG3 H 1.576 -7.784 -2.131 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HG3 . . . . . . . . . c30496_6e5h 1 . 10 . 4106 . 1 1 9 LYS HZ1 H 3.925 -9.919 -4.662 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HZ1 . . . . . . . . . c30496_6e5h 1 . 10 . 4107 . 1 1 9 LYS HZ2 H 2.322 -9.645 -4.206 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HZ2 . . . . . . . . . c30496_6e5h 1 . 10 . 4108 . 1 1 9 LYS HZ3 H 3.109 -11.056 -3.715 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HZ3 . . . . . . . . . c30496_6e5h 1 . 10 . 4109 . 1 1 9 LYS N N -0.605 -6.656 -1.077 . . . 1.0 . . . . . . . . . . . . A . 9 LYS N . . . . . . . . . c30496_6e5h 1 . 10 . 4110 . 1 1 9 LYS NZ N 3.230 -10.040 -3.897 . . . 1.0 . . . . . . . . . . . . A . 9 LYS NZ . . . . . . . . . c30496_6e5h 1 . 10 . 4111 . 1 1 9 LYS O O -2.753 -9.058 0.213 . . . 1.0 . . . . . . . . . . . . A . 9 LYS O . . . . . . . . . c30496_6e5h 1 . 10 . 4112 . 1 1 10 ARG C C -3.707 -7.354 2.457 . . . 1.0 . . . . . . . . . . . . A . 10 ARG C . . . . . . . . . c30496_6e5h 1 . 10 . 4113 . 1 1 10 ARG CA C -2.252 -7.773 2.640 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CA . . . . . . . . . c30496_6e5h 1 . 10 . 4114 . 1 1 10 ARG CB C -1.621 -6.947 3.763 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CB . . . . . . . . . c30496_6e5h 1 . 10 . 4115 . 1 1 10 ARG CD C -1.675 -6.259 6.185 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CD . . . . . . . . . c30496_6e5h 1 . 10 . 4116 . 1 1 10 ARG CG C -2.270 -7.170 5.122 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CG . . . . . . . . . c30496_6e5h 1 . 10 . 4117 . 1 1 10 ARG CZ C 0.528 -5.774 7.195 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CZ . . . . . . . . . c30496_6e5h 1 . 10 . 4118 . 1 1 10 ARG H H -0.730 -6.996 1.389 . . . 1.0 . . . . . . . . . . . . A . 10 ARG H . . . . . . . . . c30496_6e5h 1 . 10 . 4119 . 1 1 10 ARG HA H -2.224 -8.815 2.916 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HA . . . . . . . . . c30496_6e5h 1 . 10 . 4120 . 1 1 10 ARG HB2 H -0.576 -7.203 3.840 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HB2 . . . . . . . . . c30496_6e5h 1 . 10 . 4121 . 1 1 10 ARG HB3 H -1.708 -5.899 3.517 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HB3 . . . . . . . . . c30496_6e5h 1 . 10 . 4122 . 1 1 10 ARG HD2 H -1.910 -5.235 5.935 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HD2 . . . . . . . . . c30496_6e5h 1 . 10 . 4123 . 1 1 10 ARG HD3 H -2.120 -6.504 7.140 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HD3 . . . . . . . . . c30496_6e5h 1 . 10 . 4124 . 1 1 10 ARG HE H 0.225 -6.990 5.634 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HE . . . . . . . . . c30496_6e5h 1 . 10 . 4125 . 1 1 10 ARG HG2 H -3.329 -6.966 5.040 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HG2 . . . . . . . . . c30496_6e5h 1 . 10 . 4126 . 1 1 10 ARG HG3 H -2.121 -8.200 5.415 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HG3 . . . . . . . . . c30496_6e5h 1 . 10 . 4127 . 1 1 10 ARG HH11 H 0.530 -4.528 8.795 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HH11 . . . . . . . . . c30496_6e5h 1 . 10 . 4128 . 1 1 10 ARG HH12 H -1.033 -4.889 8.138 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HH12 . . . . . . . . . c30496_6e5h 1 . 10 . 4129 . 1 1 10 ARG HH21 H 2.273 -6.530 6.507 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HH21 . . . . . . . . . c30496_6e5h 1 . 10 . 4130 . 1 1 10 ARG HH22 H 2.415 -5.466 7.870 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HH22 . . . . . . . . . c30496_6e5h 1 . 10 . 4131 . 1 1 10 ARG N N -1.492 -7.617 1.405 . . . 1.0 . . . . . . . . . . . . A . 10 ARG N . . . . . . . . . c30496_6e5h 1 . 10 . 4132 . 1 1 10 ARG NE N -0.221 -6.400 6.288 . . . 1.0 . . . . . . . . . . . . A . 10 ARG NE . . . . . . . . . c30496_6e5h 1 . 10 . 4133 . 1 1 10 ARG NH1 N -0.037 -5.000 8.114 . . . 1.0 . . . . . . . . . . . . A . 10 ARG NH1 . . . . . . . . . c30496_6e5h 1 . 10 . 4134 . 1 1 10 ARG NH2 N 1.843 -5.937 7.191 . . . 1.0 . . . . . . . . . . . . A . 10 ARG NH2 . . . . . . . . . c30496_6e5h 1 . 10 . 4135 . 1 1 10 ARG O O -4.625 -8.126 2.729 . . . 1.0 . . . . . . . . . . . . A . 10 ARG O . . . . . . . . . c30496_6e5h 1 . 10 . 4136 . 1 1 11 TYR C C -5.850 -5.838 0.500 . . . 1.0 . . . . . . . . . . . . A . 11 TYR C . . . . . . . . . c30496_6e5h 1 . 10 . 4137 . 1 1 11 TYR CA C -5.251 -5.579 1.878 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CA . . . . . . . . . c30496_6e5h 1 . 10 . 4138 . 1 1 11 TYR CB C -5.223 -4.082 2.158 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CB . . . . . . . . . c30496_6e5h 1 . 10 . 4139 . 1 1 11 TYR CD1 C -5.500 -3.826 4.651 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CD1 . . . . . . . . . c30496_6e5h 1 . 10 . 4140 . 1 1 11 TYR CD2 C -3.385 -3.297 3.690 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CD2 . . . . . . . . . c30496_6e5h 1 . 10 . 4141 . 1 1 11 TYR CE1 C -5.016 -3.511 5.902 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CE1 . . . . . . . . . c30496_6e5h 1 . 10 . 4142 . 1 1 11 TYR CE2 C -2.894 -2.979 4.939 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CE2 . . . . . . . . . c30496_6e5h 1 . 10 . 4143 . 1 1 11 TYR CG C -4.694 -3.725 3.525 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CG . . . . . . . . . c30496_6e5h 1 . 10 . 4144 . 1 1 11 TYR CZ C -3.730 -3.049 6.039 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CZ . . . . . . . . . c30496_6e5h 1 . 10 . 4145 . 1 1 11 TYR H H -3.142 -5.596 1.687 . . . 1.0 . . . . . . . . . . . . A . 11 TYR H . . . . . . . . . c30496_6e5h 1 . 10 . 4146 . 1 1 11 TYR HA H -5.868 -6.060 2.622 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HA . . . . . . . . . c30496_6e5h 1 . 10 . 4147 . 1 1 11 TYR HB2 H -4.600 -3.598 1.423 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HB2 . . . . . . . . . c30496_6e5h 1 . 10 . 4148 . 1 1 11 TYR HB3 H -6.226 -3.699 2.082 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HB3 . . . . . . . . . c30496_6e5h 1 . 10 . 4149 . 1 1 11 TYR HD1 H -6.523 -4.156 4.538 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HD1 . . . . . . . . . c30496_6e5h 1 . 10 . 4150 . 1 1 11 TYR HD2 H -2.748 -3.210 2.822 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HD2 . . . . . . . . . c30496_6e5h 1 . 10 . 4151 . 1 1 11 TYR HE1 H -5.657 -3.596 6.763 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HE1 . . . . . . . . . c30496_6e5h 1 . 10 . 4152 . 1 1 11 TYR HE2 H -1.873 -2.648 5.048 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HE2 . . . . . . . . . c30496_6e5h 1 . 10 . 4153 . 1 1 11 TYR HH H -3.493 -3.469 7.915 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HH . . . . . . . . . c30496_6e5h 1 . 10 . 4154 . 1 1 11 TYR N N -3.912 -6.136 1.984 . . . 1.0 . . . . . . . . . . . . A . 11 TYR N . . . . . . . . . c30496_6e5h 1 . 10 . 4155 . 1 1 11 TYR O O -6.184 -4.900 -0.229 . . . 1.0 . . . . . . . . . . . . A . 11 TYR O . . . . . . . . . c30496_6e5h 1 . 10 . 4156 . 1 1 11 TYR OH O -3.227 -2.779 7.291 . . . 1.0 . . . . . . . . . . . . A . 11 TYR OH . . . . . . . . . c30496_6e5h 1 . 10 . 4157 . 1 1 12 ABA C C -7.932 -6.969 -1.364 . . . 1.0 . . . . . . . . . . . . A . 12 AIB C . . . . . . . . . c30496_6e5h 1 . 10 . 4158 . 1 1 12 ABA CA C -6.528 -7.542 -1.138 . . . 1.0 . . . . . . . . . . . . A . 12 AIB CA . . . . . . . . . c30496_6e5h 1 . 10 . 4159 . 1 1 12 ABA H H -5.751 -7.804 0.823 . . . 1.0 . . . . . . . . . . . . A . 12 AIB H . . . . . . . . . c30496_6e5h 1 . 10 . 4160 . 1 1 12 ABA N N -6.002 -7.117 0.167 . . . 1.0 . . . . . . . . . . . . A . 12 AIB N . . . . . . . . . c30496_6e5h 1 . 10 . 4161 . 1 1 12 ABA O O -8.364 -6.793 -2.505 . . . 1.0 . . . . . . . . . . . . A . 12 AIB O . . . . . . . . . c30496_6e5h 1 . 10 . 4162 . 1 1 13 GLY C C -10.056 -4.676 -0.104 . . . 1.0 . . . . . . . . . . . . A . 13 GLY C . . . . . . . . . c30496_6e5h 1 . 10 . 4163 . 1 1 13 GLY CA C -9.981 -6.161 -0.387 . . . 1.0 . . . . . . . . . . . . A . 13 GLY CA . . . . . . . . . c30496_6e5h 1 . 10 . 4164 . 1 1 13 GLY H H -8.237 -6.828 0.603 . . . 1.0 . . . . . . . . . . . . A . 13 GLY H . . . . . . . . . c30496_6e5h 1 . 10 . 4165 . 1 1 13 GLY HA2 H -10.346 -6.343 -1.386 . . . 1.0 . . . . . . . . . . . . A . 13 GLY HA2 . . . . . . . . . c30496_6e5h 1 . 10 . 4166 . 1 1 13 GLY HA3 H -10.612 -6.682 0.316 . . . 1.0 . . . . . . . . . . . . A . 13 GLY HA3 . . . . . . . . . c30496_6e5h 1 . 10 . 4167 . 1 1 13 GLY N N -8.636 -6.683 -0.281 . . . 1.0 . . . . . . . . . . . . A . 13 GLY N . . . . . . . . . c30496_6e5h 1 . 10 . 4168 . 1 1 13 GLY O O -11.104 -4.169 0.298 . . . 1.0 . . . . . . . . . . . . A . 13 GLY O . . . . . . . . . c30496_6e5h 1 . 10 . 4169 . 1 1 14 CYS C C -8.110 -1.861 -1.185 . . . 1.0 . . . . . . . . . . . . A . 14 CYS C . . . . . . . . . c30496_6e5h 1 . 10 . 4170 . 1 1 14 CYS CA C -8.919 -2.536 -0.090 . . . 1.0 . . . . . . . . . . . . A . 14 CYS CA . . . . . . . . . c30496_6e5h 1 . 10 . 4171 . 1 1 14 CYS CB C -8.301 -2.196 1.264 . . . 1.0 . . . . . . . . . . . . A . 14 CYS CB . . . . . . . . . c30496_6e5h 1 . 10 . 4172 . 1 1 14 CYS H H -8.119 -4.438 -0.558 . . . 1.0 . . . . . . . . . . . . A . 14 CYS H . . . . . . . . . c30496_6e5h 1 . 10 . 4173 . 1 1 14 CYS HA H -9.934 -2.172 -0.121 . . . 1.0 . . . . . . . . . . . . A . 14 CYS HA . . . . . . . . . c30496_6e5h 1 . 10 . 4174 . 1 1 14 CYS HB2 H -7.244 -2.384 1.217 . . . 1.0 . . . . . . . . . . . . A . 14 CYS HB2 . . . . . . . . . c30496_6e5h 1 . 10 . 4175 . 1 1 14 CYS HB3 H -8.463 -1.146 1.468 . . . 1.0 . . . . . . . . . . . . A . 14 CYS HB3 . . . . . . . . . c30496_6e5h 1 . 10 . 4176 . 1 1 14 CYS N N -8.946 -3.976 -0.289 . . . 1.0 . . . . . . . . . . . . A . 14 CYS N . . . . . . . . . c30496_6e5h 1 . 10 . 4177 . 1 1 14 CYS O O -7.403 -2.520 -1.948 . . . 1.0 . . . . . . . . . . . . A . 14 CYS O . . . . . . . . . c30496_6e5h 1 . 10 . 4178 . 1 1 14 CYS SG S -8.978 -3.145 2.668 . . . 1.0 . . . . . . . . . . . . A . 14 CYS SG . . . . . . . . . c30496_6e5h 1 . 10 . 4179 . 1 1 15 GLU C C -6.286 0.906 -1.430 . . . 1.0 . . . . . . . . . . . . A . 15 GLU C . . . . . . . . . c30496_6e5h 1 . 10 . 4180 . 1 1 15 GLU CA C -7.434 0.248 -2.177 . . . 1.0 . . . . . . . . . . . . A . 15 GLU CA . . . . . . . . . c30496_6e5h 1 . 10 . 4181 . 1 1 15 GLU CB C -8.297 1.310 -2.852 . . . 1.0 . . . . . . . . . . . . A . 15 GLU CB . . . . . . . . . c30496_6e5h 1 . 10 . 4182 . 1 1 15 GLU CD C -8.810 -0.135 -4.853 . . . 1.0 . . . . . . . . . . . . A . 15 GLU CD . . . . . . . . . c30496_6e5h 1 . 10 . 4183 . 1 1 15 GLU CG C -9.378 0.730 -3.747 . . . 1.0 . . . . . . . . . . . . A . 15 GLU CG . . . . . . . . . c30496_6e5h 1 . 10 . 4184 . 1 1 15 GLU H H -8.867 -0.092 -0.671 . . . 1.0 . . . . . . . . . . . . A . 15 GLU H . . . . . . . . . c30496_6e5h 1 . 10 . 4185 . 1 1 15 GLU HA H -7.032 -0.413 -2.929 . . . 1.0 . . . . . . . . . . . . A . 15 GLU HA . . . . . . . . . c30496_6e5h 1 . 10 . 4186 . 1 1 15 GLU HB2 H -8.774 1.908 -2.089 . . . 1.0 . . . . . . . . . . . . A . 15 GLU HB2 . . . . . . . . . c30496_6e5h 1 . 10 . 4187 . 1 1 15 GLU HB3 H -7.663 1.945 -3.452 . . . 1.0 . . . . . . . . . . . . A . 15 GLU HB3 . . . . . . . . . c30496_6e5h 1 . 10 . 4188 . 1 1 15 GLU HG2 H -10.043 0.129 -3.146 . . . 1.0 . . . . . . . . . . . . A . 15 GLU HG2 . . . . . . . . . c30496_6e5h 1 . 10 . 4189 . 1 1 15 GLU HG3 H -9.931 1.542 -4.194 . . . 1.0 . . . . . . . . . . . . A . 15 GLU HG3 . . . . . . . . . c30496_6e5h 1 . 10 . 4190 . 1 1 15 GLU N N -8.225 -0.546 -1.258 . . . 1.0 . . . . . . . . . . . . A . 15 GLU N . . . . . . . . . c30496_6e5h 1 . 10 . 4191 . 1 1 15 GLU O O -6.494 1.829 -0.641 . . . 1.0 . . . . . . . . . . . . A . 15 GLU O . . . . . . . . . c30496_6e5h 1 . 10 . 4192 . 1 1 15 GLU OE1 O -8.985 -1.369 -4.803 . . . 1.0 . . . . . . . . . . . . A . 15 GLU OE1 . . . . . . . . . c30496_6e5h 1 . 10 . 4193 . 1 1 15 GLU OE2 O -8.183 0.417 -5.783 . . . 1.0 . . . . . . . . . . . . A . 15 GLU OE2 . . . . . . . . . c30496_6e5h 1 . 10 . 4194 . 1 1 16 VAL C C -3.201 1.973 -1.843 . . . 1.0 . . . . . . . . . . . . A . 16 VAL C . . . . . . . . . c30496_6e5h 1 . 10 . 4195 . 1 1 16 VAL CA C -3.907 0.935 -0.981 . . . 1.0 . . . . . . . . . . . . A . 16 VAL CA . . . . . . . . . c30496_6e5h 1 . 10 . 4196 . 1 1 16 VAL CB C -2.904 -0.189 -0.652 . . . 1.0 . . . . . . . . . . . . A . 16 VAL CB . . . . . . . . . c30496_6e5h 1 . 10 . 4197 . 1 1 16 VAL CG1 C -1.706 0.366 0.103 . . . 1.0 . . . . . . . . . . . . A . 16 VAL CG1 . . . . . . . . . c30496_6e5h 1 . 10 . 4198 . 1 1 16 VAL CG2 C -3.571 -1.304 0.141 . . . 1.0 . . . . . . . . . . . . A . 16 VAL CG2 . . . . . . . . . c30496_6e5h 1 . 10 . 4199 . 1 1 16 VAL H H -4.981 -0.306 -2.313 . . . 1.0 . . . . . . . . . . . . A . 16 VAL H . . . . . . . . . c30496_6e5h 1 . 10 . 4200 . 1 1 16 VAL HA H -4.223 1.396 -0.058 . . . 1.0 . . . . . . . . . . . . A . 16 VAL HA . . . . . . . . . c30496_6e5h 1 . 10 . 4201 . 1 1 16 VAL HB H -2.549 -0.604 -1.584 . . . 1.0 . . . . . . . . . . . . A . 16 VAL HB . . . . . . . . . c30496_6e5h 1 . 10 . 4202 . 1 1 16 VAL HG11 H -1.222 1.121 -0.499 . . . 1.0 . . . . . . . . . . . . A . 16 VAL HG11 . . . . . . . . . c30496_6e5h 1 . 10 . 4203 . 1 1 16 VAL HG12 H -1.009 -0.433 0.307 . . . 1.0 . . . . . . . . . . . . A . 16 VAL HG12 . . . . . . . . . c30496_6e5h 1 . 10 . 4204 . 1 1 16 VAL HG13 H -2.037 0.802 1.032 . . . 1.0 . . . . . . . . . . . . A . 16 VAL HG13 . . . . . . . . . c30496_6e5h 1 . 10 . 4205 . 1 1 16 VAL HG21 H -4.368 -1.737 -0.444 . . . 1.0 . . . . . . . . . . . . A . 16 VAL HG21 . . . . . . . . . c30496_6e5h 1 . 10 . 4206 . 1 1 16 VAL HG22 H -3.975 -0.903 1.056 . . . 1.0 . . . . . . . . . . . . A . 16 VAL HG22 . . . . . . . . . c30496_6e5h 1 . 10 . 4207 . 1 1 16 VAL HG23 H -2.840 -2.065 0.373 . . . 1.0 . . . . . . . . . . . . A . 16 VAL HG23 . . . . . . . . . c30496_6e5h 1 . 10 . 4208 . 1 1 16 VAL N N -5.084 0.418 -1.661 . . . 1.0 . . . . . . . . . . . . A . 16 VAL N . . . . . . . . . c30496_6e5h 1 . 10 . 4209 . 1 1 16 VAL O O -2.731 1.658 -2.933 . . . 1.0 . . . . . . . . . . . . A . 16 VAL O . . . . . . . . . c30496_6e5h 1 . 10 . 4210 . 1 1 17 ARG C C -1.011 4.380 -1.463 . . . 1.0 . . . . . . . . . . . . A . 17 ARG C . . . . . . . . . c30496_6e5h 1 . 10 . 4211 . 1 1 17 ARG CA C -2.401 4.246 -2.059 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CA . . . . . . . . . c30496_6e5h 1 . 10 . 4212 . 1 1 17 ARG CB C -3.130 5.589 -1.986 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CB . . . . . . . . . c30496_6e5h 1 . 10 . 4213 . 1 1 17 ARG CD C -2.278 6.475 -4.187 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CD . . . . . . . . . c30496_6e5h 1 . 10 . 4214 . 1 1 17 ARG CG C -2.390 6.718 -2.690 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CG . . . . . . . . . c30496_6e5h 1 . 10 . 4215 . 1 1 17 ARG CZ C -1.263 7.573 -6.150 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CZ . . . . . . . . . c30496_6e5h 1 . 10 . 4216 . 1 1 17 ARG H H -3.595 3.415 -0.517 . . . 1.0 . . . . . . . . . . . . A . 17 ARG H . . . . . . . . . c30496_6e5h 1 . 10 . 4217 . 1 1 17 ARG HA H -2.307 3.952 -3.091 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HA . . . . . . . . . c30496_6e5h 1 . 10 . 4218 . 1 1 17 ARG HB2 H -4.101 5.483 -2.443 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HB2 . . . . . . . . . c30496_6e5h 1 . 10 . 4219 . 1 1 17 ARG HB3 H -3.257 5.860 -0.953 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HB3 . . . . . . . . . c30496_6e5h 1 . 10 . 4220 . 1 1 17 ARG HD2 H -1.898 5.478 -4.352 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HD2 . . . . . . . . . c30496_6e5h 1 . 10 . 4221 . 1 1 17 ARG HD3 H -3.259 6.562 -4.628 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HD3 . . . . . . . . . c30496_6e5h 1 . 10 . 4222 . 1 1 17 ARG HE H -0.828 7.998 -4.244 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HE . . . . . . . . . c30496_6e5h 1 . 10 . 4223 . 1 1 17 ARG HG2 H -2.924 7.642 -2.526 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HG2 . . . . . . . . . c30496_6e5h 1 . 10 . 4224 . 1 1 17 ARG HG3 H -1.397 6.795 -2.272 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HG3 . . . . . . . . . c30496_6e5h 1 . 10 . 4225 . 1 1 17 ARG HH11 H -2.671 6.190 -6.606 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH11 . . . . . . . . . c30496_6e5h 1 . 10 . 4226 . 1 1 17 ARG HH12 H -1.912 6.953 -7.965 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH12 . . . . . . . . . c30496_6e5h 1 . 10 . 4227 . 1 1 17 ARG HH21 H 0.173 8.998 -6.032 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH21 . . . . . . . . . c30496_6e5h 1 . 10 . 4228 . 1 1 17 ARG HH22 H -0.301 8.549 -7.639 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH22 . . . . . . . . . c30496_6e5h 1 . 10 . 4229 . 1 1 17 ARG N N -3.139 3.203 -1.363 . . . 1.0 . . . . . . . . . . . . A . 17 ARG N . . . . . . . . . c30496_6e5h 1 . 10 . 4230 . 1 1 17 ARG NE N -1.383 7.436 -4.831 . . . 1.0 . . . . . . . . . . . . A . 17 ARG NE . . . . . . . . . c30496_6e5h 1 . 10 . 4231 . 1 1 17 ARG NH1 N -2.009 6.849 -6.972 . . . 1.0 . . . . . . . . . . . . A . 17 ARG NH1 . . . . . . . . . c30496_6e5h 1 . 10 . 4232 . 1 1 17 ARG NH2 N -0.396 8.442 -6.646 . . . 1.0 . . . . . . . . . . . . A . 17 ARG NH2 . . . . . . . . . c30496_6e5h 1 . 10 . 4233 . 1 1 17 ARG O O -0.857 4.516 -0.249 . . . 1.0 . . . . . . . . . . . . A . 17 ARG O . . . . . . . . . c30496_6e5h 1 . 10 . 4234 . 1 1 18 CYS C C 1.951 5.794 -2.263 . . . 1.0 . . . . . . . . . . . . A . 18 CYS C . . . . . . . . . c30496_6e5h 1 . 10 . 4235 . 1 1 18 CYS CA C 1.368 4.439 -1.877 . . . 1.0 . . . . . . . . . . . . A . 18 CYS CA . . . . . . . . . c30496_6e5h 1 . 10 . 4236 . 1 1 18 CYS CB C 2.193 3.313 -2.495 . . . 1.0 . . . . . . . . . . . . A . 18 CYS CB . . . . . . . . . c30496_6e5h 1 . 10 . 4237 . 1 1 18 CYS H H -0.192 4.206 -3.269 . . . 1.0 . . . . . . . . . . . . A . 18 CYS H . . . . . . . . . c30496_6e5h 1 . 10 . 4238 . 1 1 18 CYS HA H 1.384 4.340 -0.804 . . . 1.0 . . . . . . . . . . . . A . 18 CYS HA . . . . . . . . . c30496_6e5h 1 . 10 . 4239 . 1 1 18 CYS HB2 H 2.222 3.443 -3.567 . . . 1.0 . . . . . . . . . . . . A . 18 CYS HB2 . . . . . . . . . c30496_6e5h 1 . 10 . 4240 . 1 1 18 CYS HB3 H 3.196 3.354 -2.103 . . . 1.0 . . . . . . . . . . . . A . 18 CYS HB3 . . . . . . . . . c30496_6e5h 1 . 10 . 4241 . 1 1 18 CYS N N -0.007 4.330 -2.315 . . . 1.0 . . . . . . . . . . . . A . 18 CYS N . . . . . . . . . c30496_6e5h 1 . 10 . 4242 . 1 1 18 CYS O O 1.891 6.197 -3.425 . . . 1.0 . . . . . . . . . . . . A . 18 CYS O . . . . . . . . . c30496_6e5h 1 . 10 . 4243 . 1 1 18 CYS SG S 1.525 1.650 -2.153 . . . 1.0 . . . . . . . . . . . . A . 18 CYS SG . . . . . . . . . c30496_6e5h 1 . 10 . 4244 . 1 1 19 ASP C C 4.401 7.877 -0.687 . . . 1.0 . . . . . . . . . . . . A . 19 ASP C . . . . . . . . . c30496_6e5h 1 . 10 . 4245 . 1 1 19 ASP CA C 3.138 7.779 -1.528 . . . 1.0 . . . . . . . . . . . . A . 19 ASP CA . . . . . . . . . c30496_6e5h 1 . 10 . 4246 . 1 1 19 ASP CB C 2.198 8.943 -1.206 . . . 1.0 . . . . . . . . . . . . A . 19 ASP CB . . . . . . . . . c30496_6e5h 1 . 10 . 4247 . 1 1 19 ASP CG C 2.782 10.283 -1.609 . . . 1.0 . . . . . . . . . . . . A . 19 ASP CG . . . . . . . . . c30496_6e5h 1 . 10 . 4248 . 1 1 19 ASP H H 2.436 6.165 -0.359 . . . 1.0 . . . . . . . . . . . . A . 19 ASP H . . . . . . . . . c30496_6e5h 1 . 10 . 4249 . 1 1 19 ASP HA H 3.409 7.820 -2.573 . . . 1.0 . . . . . . . . . . . . A . 19 ASP HA . . . . . . . . . c30496_6e5h 1 . 10 . 4250 . 1 1 19 ASP HB2 H 1.266 8.802 -1.732 . . . 1.0 . . . . . . . . . . . . A . 19 ASP HB2 . . . . . . . . . c30496_6e5h 1 . 10 . 4251 . 1 1 19 ASP HB3 H 2.008 8.957 -0.144 . . . 1.0 . . . . . . . . . . . . A . 19 ASP HB3 . . . . . . . . . c30496_6e5h 1 . 10 . 4252 . 1 1 19 ASP N N 2.483 6.505 -1.283 . . . 1.0 . . . . . . . . . . . . A . 19 ASP N . . . . . . . . . c30496_6e5h 1 . 10 . 4253 . 1 1 19 ASP O O 4.388 8.437 0.410 . . . 1.0 . . . . . . . . . . . . A . 19 ASP O . . . . . . . . . c30496_6e5h 1 . 10 . 4254 . 1 1 19 ASP OD1 O 3.157 11.065 -0.710 . . . 1.0 . . . . . . . . . . . . A . 19 ASP OD1 . . . . . . . . . c30496_6e5h 1 . 10 . 4255 . 1 1 19 ASP OD2 O 2.887 10.557 -2.824 . . . 1.0 . . . . . . . . . . . . A . 19 ASP OD2 . . . . . . . . . c30496_6e5h 1 . 10 . 4256 . 1 1 20 DPR C C 6.666 6.535 0.858 . . . 1.0 . . . . . . . . . . . . A . 20 DPR C . . . . . . . . . c30496_6e5h 1 . 10 . 4257 . 1 1 20 DPR CA C 6.779 7.297 -0.462 . . . 1.0 . . . . . . . . . . . . A . 20 DPR CA . . . . . . . . . c30496_6e5h 1 . 10 . 4258 . 1 1 20 DPR CB C 7.752 6.602 -1.417 . . . 1.0 . . . . . . . . . . . . A . 20 DPR CB . . . . . . . . . c30496_6e5h 1 . 10 . 4259 . 1 1 20 DPR CD C 5.611 6.640 -2.491 . . . 1.0 . . . . . . . . . . . . A . 20 DPR CD . . . . . . . . . c30496_6e5h 1 . 10 . 4260 . 1 1 20 DPR CG C 6.889 5.856 -2.377 . . . 1.0 . . . . . . . . . . . . A . 20 DPR CG . . . . . . . . . c30496_6e5h 1 . 10 . 4261 . 1 1 20 DPR HA H 7.127 8.296 -0.267 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HA . . . . . . . . . c30496_6e5h 1 . 10 . 4262 . 1 1 20 DPR HB2 H 8.354 7.345 -1.921 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HB2 . . . . . . . . . c30496_6e5h 1 . 10 . 4263 . 1 1 20 DPR HB3 H 8.390 5.934 -0.861 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HB3 . . . . . . . . . c30496_6e5h 1 . 10 . 4264 . 1 1 20 DPR HD2 H 5.676 7.361 -3.292 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HD2 . . . . . . . . . c30496_6e5h 1 . 10 . 4265 . 1 1 20 DPR HD3 H 4.773 5.974 -2.648 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HD3 . . . . . . . . . c30496_6e5h 1 . 10 . 4266 . 1 1 20 DPR HG2 H 7.377 5.792 -3.338 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HG2 . . . . . . . . . c30496_6e5h 1 . 10 . 4267 . 1 1 20 DPR HG3 H 6.688 4.869 -1.993 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HG3 . . . . . . . . . c30496_6e5h 1 . 10 . 4268 . 1 1 20 DPR N N 5.508 7.310 -1.185 . . . 1.0 . . . . . . . . . . . . A . 20 DPR N . . . . . . . . . c30496_6e5h 1 . 10 . 4269 . 1 1 20 DPR O O 6.401 5.331 0.876 . . . 1.0 . . . . . . . . . . . . A . 20 DPR O . . . . . . . . . c30496_6e5h 1 . 10 . 4270 . 1 1 21 PRO C C 5.297 6.713 3.834 . . . 1.0 . . . . . . . . . . . . A . 21 PRO C . . . . . . . . . c30496_6e5h 1 . 10 . 4271 . 1 1 21 PRO CA C 6.734 6.659 3.312 . . . 1.0 . . . . . . . . . . . . A . 21 PRO CA . . . . . . . . . c30496_6e5h 1 . 10 . 4272 . 1 1 21 PRO CB C 7.644 7.552 4.149 . . . 1.0 . . . . . . . . . . . . A . 21 PRO CB . . . . . . . . . c30496_6e5h 1 . 10 . 4273 . 1 1 21 PRO CD C 7.294 8.650 2.039 . . . 1.0 . . . . . . . . . . . . A . 21 PRO CD . . . . . . . . . c30496_6e5h 1 . 10 . 4274 . 1 1 21 PRO CG C 7.533 8.895 3.508 . . . 1.0 . . . . . . . . . . . . A . 21 PRO CG . . . . . . . . . c30496_6e5h 1 . 10 . 4275 . 1 1 21 PRO HA H 7.092 5.642 3.344 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HA . . . . . . . . . c30496_6e5h 1 . 10 . 4276 . 1 1 21 PRO HB2 H 7.298 7.567 5.171 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HB2 . . . . . . . . . c30496_6e5h 1 . 10 . 4277 . 1 1 21 PRO HB3 H 8.657 7.180 4.108 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HB3 . . . . . . . . . c30496_6e5h 1 . 10 . 4278 . 1 1 21 PRO HD2 H 6.514 9.300 1.670 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HD2 . . . . . . . . . c30496_6e5h 1 . 10 . 4279 . 1 1 21 PRO HD3 H 8.205 8.800 1.481 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HD3 . . . . . . . . . c30496_6e5h 1 . 10 . 4280 . 1 1 21 PRO HG2 H 6.701 9.435 3.936 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HG2 . . . . . . . . . c30496_6e5h 1 . 10 . 4281 . 1 1 21 PRO HG3 H 8.450 9.447 3.652 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HG3 . . . . . . . . . c30496_6e5h 1 . 10 . 4282 . 1 1 21 PRO N N 6.871 7.237 1.980 . . . 1.0 . . . . . . . . . . . . A . 21 PRO N . . . . . . . . . c30496_6e5h 1 . 10 . 4283 . 1 1 21 PRO O O 5.017 6.277 4.949 . . . 1.0 . . . . . . . . . . . . A . 21 PRO O . . . . . . . . . c30496_6e5h 1 . 10 . 4284 . 1 1 22 ARG C C 2.142 6.359 2.670 . . . 1.0 . . . . . . . . . . . . A . 22 ARG C . . . . . . . . . c30496_6e5h 1 . 10 . 4285 . 1 1 22 ARG CA C 2.994 7.361 3.426 . . . 1.0 . . . . . . . . . . . . A . 22 ARG CA . . . . . . . . . c30496_6e5h 1 . 10 . 4286 . 1 1 22 ARG CB C 2.464 8.769 3.171 . . . 1.0 . . . . . . . . . . . . A . 22 ARG CB . . . . . . . . . c30496_6e5h 1 . 10 . 4287 . 1 1 22 ARG CD C 2.486 11.196 3.744 . . . 1.0 . . . . . . . . . . . . A . 22 ARG CD . . . . . . . . . c30496_6e5h 1 . 10 . 4288 . 1 1 22 ARG CG C 3.095 9.840 4.041 . . . 1.0 . . . . . . . . . . . . A . 22 ARG CG . . . . . . . . . c30496_6e5h 1 . 10 . 4289 . 1 1 22 ARG CZ C 2.870 13.542 4.370 . . . 1.0 . . . . . . . . . . . . A . 22 ARG CZ . . . . . . . . . c30496_6e5h 1 . 10 . 4290 . 1 1 22 ARG H H 4.663 7.567 2.136 . . . 1.0 . . . . . . . . . . . . A . 22 ARG H . . . . . . . . . c30496_6e5h 1 . 10 . 4291 . 1 1 22 ARG HA H 2.930 7.145 4.481 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HA . . . . . . . . . c30496_6e5h 1 . 10 . 4292 . 1 1 22 ARG HB2 H 2.647 9.025 2.138 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HB2 . . . . . . . . . c30496_6e5h 1 . 10 . 4293 . 1 1 22 ARG HB3 H 1.399 8.773 3.349 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HB3 . . . . . . . . . c30496_6e5h 1 . 10 . 4294 . 1 1 22 ARG HD2 H 2.720 11.462 2.724 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HD2 . . . . . . . . . c30496_6e5h 1 . 10 . 4295 . 1 1 22 ARG HD3 H 1.414 11.125 3.858 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HD3 . . . . . . . . . c30496_6e5h 1 . 10 . 4296 . 1 1 22 ARG HE H 3.420 11.958 5.469 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HE . . . . . . . . . c30496_6e5h 1 . 10 . 4297 . 1 1 22 ARG HG2 H 2.928 9.598 5.081 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HG2 . . . . . . . . . c30496_6e5h 1 . 10 . 4298 . 1 1 22 ARG HG3 H 4.157 9.878 3.843 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HG3 . . . . . . . . . c30496_6e5h 1 . 10 . 4299 . 1 1 22 ARG HH11 H 1.971 13.271 2.571 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HH11 . . . . . . . . . c30496_6e5h 1 . 10 . 4300 . 1 1 22 ARG HH12 H 2.226 14.924 3.034 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HH12 . . . . . . . . . c30496_6e5h 1 . 10 . 4301 . 1 1 22 ARG HH21 H 3.226 15.420 5.039 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HH21 . . . . . . . . . c30496_6e5h 1 . 10 . 4302 . 1 1 22 ARG HH22 H 3.738 14.145 6.098 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HH22 . . . . . . . . . c30496_6e5h 1 . 10 . 4303 . 1 1 22 ARG N N 4.390 7.250 3.029 . . . 1.0 . . . . . . . . . . . . A . 22 ARG N . . . . . . . . . c30496_6e5h 1 . 10 . 4304 . 1 1 22 ARG NE N 2.987 12.242 4.630 . . . 1.0 . . . . . . . . . . . . A . 22 ARG NE . . . . . . . . . c30496_6e5h 1 . 10 . 4305 . 1 1 22 ARG NH1 N 2.309 13.945 3.235 . . . 1.0 . . . . . . . . . . . . A . 22 ARG NH1 . . . . . . . . . c30496_6e5h 1 . 10 . 4306 . 1 1 22 ARG NH2 N 3.315 14.439 5.237 . . . 1.0 . . . . . . . . . . . . A . 22 ARG NH2 . . . . . . . . . c30496_6e5h 1 . 10 . 4307 . 1 1 22 ARG O O 2.381 6.091 1.492 . . . 1.0 . . . . . . . . . . . . A . 22 ARG O . . . . . . . . . c30496_6e5h 1 . 10 . 4308 . 1 1 23 TYR C C -1.170 5.077 3.200 . . . 1.0 . . . . . . . . . . . . A . 23 TYR C . . . . . . . . . c30496_6e5h 1 . 10 . 4309 . 1 1 23 TYR CA C 0.257 4.836 2.738 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CA . . . . . . . . . c30496_6e5h 1 . 10 . 4310 . 1 1 23 TYR CB C 0.679 3.408 3.083 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CB . . . . . . . . . c30496_6e5h 1 . 10 . 4311 . 1 1 23 TYR CD1 C 3.112 3.214 3.715 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CD1 . . . . . . . . . c30496_6e5h 1 . 10 . 4312 . 1 1 23 TYR CD2 C 2.487 2.722 1.470 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CD2 . . . . . . . . . c30496_6e5h 1 . 10 . 4313 . 1 1 23 TYR CE1 C 4.429 2.947 3.412 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CE1 . . . . . . . . . c30496_6e5h 1 . 10 . 4314 . 1 1 23 TYR CE2 C 3.803 2.451 1.160 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CE2 . . . . . . . . . c30496_6e5h 1 . 10 . 4315 . 1 1 23 TYR CG C 2.119 3.107 2.750 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CG . . . . . . . . . c30496_6e5h 1 . 10 . 4316 . 1 1 23 TYR CZ C 4.771 2.566 2.134 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CZ . . . . . . . . . c30496_6e5h 1 . 10 . 4317 . 1 1 23 TYR H H 1.023 6.044 4.291 . . . 1.0 . . . . . . . . . . . . A . 23 TYR H . . . . . . . . . c30496_6e5h 1 . 10 . 4318 . 1 1 23 TYR HA H 0.305 4.968 1.669 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HA . . . . . . . . . c30496_6e5h 1 . 10 . 4319 . 1 1 23 TYR HB2 H 0.541 3.242 4.138 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HB2 . . . . . . . . . c30496_6e5h 1 . 10 . 4320 . 1 1 23 TYR HB3 H 0.060 2.718 2.530 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HB3 . . . . . . . . . c30496_6e5h 1 . 10 . 4321 . 1 1 23 TYR HD1 H 2.841 3.516 4.716 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HD1 . . . . . . . . . c30496_6e5h 1 . 10 . 4322 . 1 1 23 TYR HD2 H 1.724 2.634 0.709 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HD2 . . . . . . . . . c30496_6e5h 1 . 10 . 4323 . 1 1 23 TYR HE1 H 5.184 3.035 4.175 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HE1 . . . . . . . . . c30496_6e5h 1 . 10 . 4324 . 1 1 23 TYR HE2 H 4.069 2.154 0.159 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HE2 . . . . . . . . . c30496_6e5h 1 . 10 . 4325 . 1 1 23 TYR HH H 6.291 2.650 0.959 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HH . . . . . . . . . c30496_6e5h 1 . 10 . 4326 . 1 1 23 TYR N N 1.154 5.801 3.351 . . . 1.0 . . . . . . . . . . . . A . 23 TYR N . . . . . . . . . c30496_6e5h 1 . 10 . 4327 . 1 1 23 TYR O O -1.417 5.330 4.382 . . . 1.0 . . . . . . . . . . . . A . 23 TYR O . . . . . . . . . c30496_6e5h 1 . 10 . 4328 . 1 1 23 TYR OH O 6.085 2.295 1.832 . . . 1.0 . . . . . . . . . . . . A . 23 TYR OH . . . . . . . . . c30496_6e5h 1 . 10 . 4329 . 1 1 24 GLU C C -4.336 4.022 2.189 . . . 1.0 . . . . . . . . . . . . A . 24 GLU C . . . . . . . . . c30496_6e5h 1 . 10 . 4330 . 1 1 24 GLU CA C -3.504 5.234 2.576 . . . 1.0 . . . . . . . . . . . . A . 24 GLU CA . . . . . . . . . c30496_6e5h 1 . 10 . 4331 . 1 1 24 GLU CB C -4.017 6.473 1.839 . . . 1.0 . . . . . . . . . . . . A . 24 GLU CB . . . . . . . . . c30496_6e5h 1 . 10 . 4332 . 1 1 24 GLU CD C -3.723 8.927 1.353 . . . 1.0 . . . . . . . . . . . . A . 24 GLU CD . . . . . . . . . c30496_6e5h 1 . 10 . 4333 . 1 1 24 GLU CG C -3.210 7.730 2.118 . . . 1.0 . . . . . . . . . . . . A . 24 GLU CG . . . . . . . . . c30496_6e5h 1 . 10 . 4334 . 1 1 24 GLU H H -1.843 4.771 1.347 . . . 1.0 . . . . . . . . . . . . A . 24 GLU H . . . . . . . . . c30496_6e5h 1 . 10 . 4335 . 1 1 24 GLU HA H -3.589 5.392 3.640 . . . 1.0 . . . . . . . . . . . . A . 24 GLU HA . . . . . . . . . c30496_6e5h 1 . 10 . 4336 . 1 1 24 GLU HB2 H -3.990 6.283 0.778 . . . 1.0 . . . . . . . . . . . . A . 24 GLU HB2 . . . . . . . . . c30496_6e5h 1 . 10 . 4337 . 1 1 24 GLU HB3 H -5.040 6.656 2.136 . . . 1.0 . . . . . . . . . . . . A . 24 GLU HB3 . . . . . . . . . c30496_6e5h 1 . 10 . 4338 . 1 1 24 GLU HG2 H -3.260 7.949 3.174 . . . 1.0 . . . . . . . . . . . . A . 24 GLU HG2 . . . . . . . . . c30496_6e5h 1 . 10 . 4339 . 1 1 24 GLU HG3 H -2.183 7.553 1.836 . . . 1.0 . . . . . . . . . . . . A . 24 GLU HG3 . . . . . . . . . c30496_6e5h 1 . 10 . 4340 . 1 1 24 GLU N N -2.103 5.001 2.270 . . . 1.0 . . . . . . . . . . . . A . 24 GLU N . . . . . . . . . c30496_6e5h 1 . 10 . 4341 . 1 1 24 GLU O O -4.650 3.819 1.014 . . . 1.0 . . . . . . . . . . . . A . 24 GLU O . . . . . . . . . c30496_6e5h 1 . 10 . 4342 . 1 1 24 GLU OE1 O -3.329 9.104 0.182 . . . 1.0 . . . . . . . . . . . . A . 24 GLU OE1 . . . . . . . . . c30496_6e5h 1 . 10 . 4343 . 1 1 24 GLU OE2 O -4.524 9.701 1.919 . . . 1.0 . . . . . . . . . . . . A . 24 GLU OE2 . . . . . . . . . c30496_6e5h 1 . 10 . 4344 . 1 1 25 VAL C C -6.963 2.363 3.022 . . . 1.0 . . . . . . . . . . . . A . 25 VAL C . . . . . . . . . c30496_6e5h 1 . 10 . 4345 . 1 1 25 VAL CA C -5.479 2.024 2.944 . . . 1.0 . . . . . . . . . . . . A . 25 VAL CA . . . . . . . . . c30496_6e5h 1 . 10 . 4346 . 1 1 25 VAL CB C -5.151 0.912 3.961 . . . 1.0 . . . . . . . . . . . . A . 25 VAL CB . . . . . . . . . c30496_6e5h 1 . 10 . 4347 . 1 1 25 VAL CG1 C -6.035 -0.304 3.733 . . . 1.0 . . . . . . . . . . . . A . 25 VAL CG1 . . . . . . . . . c30496_6e5h 1 . 10 . 4348 . 1 1 25 VAL CG2 C -3.680 0.529 3.881 . . . 1.0 . . . . . . . . . . . . A . 25 VAL CG2 . . . . . . . . . c30496_6e5h 1 . 10 . 4349 . 1 1 25 VAL H H -4.374 3.414 4.088 . . . 1.0 . . . . . . . . . . . . A . 25 VAL H . . . . . . . . . c30496_6e5h 1 . 10 . 4350 . 1 1 25 VAL HA H -5.255 1.657 1.953 . . . 1.0 . . . . . . . . . . . . A . 25 VAL HA . . . . . . . . . c30496_6e5h 1 . 10 . 4351 . 1 1 25 VAL HB H -5.351 1.292 4.952 . . . 1.0 . . . . . . . . . . . . A . 25 VAL HB . . . . . . . . . c30496_6e5h 1 . 10 . 4352 . 1 1 25 VAL HG11 H -5.789 -1.070 4.454 . . . 1.0 . . . . . . . . . . . . A . 25 VAL HG11 . . . . . . . . . c30496_6e5h 1 . 10 . 4353 . 1 1 25 VAL HG12 H -5.873 -0.683 2.736 . . . 1.0 . . . . . . . . . . . . A . 25 VAL HG12 . . . . . . . . . c30496_6e5h 1 . 10 . 4354 . 1 1 25 VAL HG13 H -7.071 -0.021 3.847 . . . 1.0 . . . . . . . . . . . . A . 25 VAL HG13 . . . . . . . . . c30496_6e5h 1 . 10 . 4355 . 1 1 25 VAL HG21 H -3.069 1.395 4.086 . . . 1.0 . . . . . . . . . . . . A . 25 VAL HG21 . . . . . . . . . c30496_6e5h 1 . 10 . 4356 . 1 1 25 VAL HG22 H -3.458 0.159 2.893 . . . 1.0 . . . . . . . . . . . . A . 25 VAL HG22 . . . . . . . . . c30496_6e5h 1 . 10 . 4357 . 1 1 25 VAL HG23 H -3.466 -0.241 4.609 . . . 1.0 . . . . . . . . . . . . A . 25 VAL HG23 . . . . . . . . . c30496_6e5h 1 . 10 . 4358 . 1 1 25 VAL N N -4.674 3.210 3.174 . . . 1.0 . . . . . . . . . . . . A . 25 VAL N . . . . . . . . . c30496_6e5h 1 . 10 . 4359 . 1 1 25 VAL O O -7.478 2.713 4.083 . . . 1.0 . . . . . . . . . . . . A . 25 VAL O . . . . . . . . . c30496_6e5h 1 . 10 . 4360 . 1 1 26 HIS C C -9.873 1.315 1.616 . . . 1.0 . . . . . . . . . . . . A . 26 HIS C . . . . . . . . . c30496_6e5h 1 . 10 . 4361 . 1 1 26 HIS CA C -9.062 2.584 1.829 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CA . . . . . . . . . c30496_6e5h 1 . 10 . 4362 . 1 1 26 HIS CB C -9.352 3.585 0.707 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CB . . . . . . . . . c30496_6e5h 1 . 10 . 4363 . 1 1 26 HIS CD2 C -8.840 5.807 1.942 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CD2 . . . . . . . . . c30496_6e5h 1 . 10 . 4364 . 1 1 26 HIS CE1 C -7.497 6.696 0.461 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CE1 . . . . . . . . . c30496_6e5h 1 . 10 . 4365 . 1 1 26 HIS CG C -8.729 4.932 0.916 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CG . . . . . . . . . c30496_6e5h 1 . 10 . 4366 . 1 1 26 HIS H H -7.176 1.990 1.072 . . . 1.0 . . . . . . . . . . . . A . 26 HIS H . . . . . . . . . c30496_6e5h 1 . 10 . 4367 . 1 1 26 HIS HA H -9.345 3.019 2.773 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HA . . . . . . . . . c30496_6e5h 1 . 10 . 4368 . 1 1 26 HIS HB2 H -8.971 3.191 -0.220 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HB2 . . . . . . . . . c30496_6e5h 1 . 10 . 4369 . 1 1 26 HIS HB3 H -10.418 3.719 0.620 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HB3 . . . . . . . . . c30496_6e5h 1 . 10 . 4370 . 1 1 26 HIS HD1 H -7.611 5.137 -0.863 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HD1 . . . . . . . . . c30496_6e5h 1 . 10 . 4371 . 1 1 26 HIS HD2 H -9.433 5.676 2.834 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HD2 . . . . . . . . . c30496_6e5h 1 . 10 . 4372 . 1 1 26 HIS HE1 H -6.834 7.381 -0.041 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HE1 . . . . . . . . . c30496_6e5h 1 . 10 . 4373 . 1 1 26 HIS HE2 H -7.834 7.621 2.254 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HE2 . . . . . . . . . c30496_6e5h 1 . 10 . 4374 . 1 1 26 HIS N N -7.641 2.275 1.891 . . . 1.0 . . . . . . . . . . . . A . 26 HIS N . . . . . . . . . c30496_6e5h 1 . 10 . 4375 . 1 1 26 HIS ND1 N -7.883 5.522 0.005 . . . 1.0 . . . . . . . . . . . . A . 26 HIS ND1 . . . . . . . . . c30496_6e5h 1 . 10 . 4376 . 1 1 26 HIS NE2 N -8.064 6.893 1.634 . . . 1.0 . . . . . . . . . . . . A . 26 HIS NE2 . . . . . . . . . c30496_6e5h 1 . 10 . 4377 . 1 1 26 HIS O O -9.944 0.793 0.507 . . . 1.0 . . . . . . . . . . . . A . 26 HIS O . . . . . . . . . c30496_6e5h 1 . 10 . 4378 . 1 1 27 CYS C C -12.747 -0.010 2.516 . . . 1.0 . . . . . . . . . . . . A . 27 CYS C . . . . . . . . . c30496_6e5h 1 . 10 . 4379 . 1 1 27 CYS CA C -11.276 -0.383 2.621 . . . 1.0 . . . . . . . . . . . . A . 27 CYS CA . . . . . . . . . c30496_6e5h 1 . 10 . 4380 . 1 1 27 CYS CB C -11.040 -1.256 3.854 . . . 1.0 . . . . . . . . . . . . A . 27 CYS CB . . . . . . . . . c30496_6e5h 1 . 10 . 4381 . 1 1 27 CYS H H -10.343 1.261 3.553 . . . 1.0 . . . . . . . . . . . . A . 27 CYS H . . . . . . . . . c30496_6e5h 1 . 10 . 4382 . 1 1 27 CYS HA H -10.991 -0.932 1.738 . . . 1.0 . . . . . . . . . . . . A . 27 CYS HA . . . . . . . . . c30496_6e5h 1 . 10 . 4383 . 1 1 27 CYS HB2 H -11.355 -0.716 4.733 . . . 1.0 . . . . . . . . . . . . A . 27 CYS HB2 . . . . . . . . . c30496_6e5h 1 . 10 . 4384 . 1 1 27 CYS HB3 H -11.626 -2.157 3.763 . . . 1.0 . . . . . . . . . . . . A . 27 CYS HB3 . . . . . . . . . c30496_6e5h 1 . 10 . 4385 . 1 1 27 CYS N N -10.459 0.814 2.688 . . . 1.0 . . . . . . . . . . . . A . 27 CYS N . . . . . . . . . c30496_6e5h 1 . 10 . 4386 . 1 1 27 CYS O O -13.406 -0.291 1.514 . . . 1.0 . . . . . . . . . . . . A . 27 CYS O . . . . . . . . . c30496_6e5h 1 . 10 . 4387 . 1 1 27 CYS SG S -9.300 -1.744 4.100 . . . 1.0 . . . . . . . . . . . . A . 27 CYS SG . . . . . . . . . c30496_6e5h 1 . 10 . 4388 . 1 1 28 NH2 HN1 H -12.678 0.815 4.322 . . . 1.0 . . . . . . . . . . . . A . 28 NH2 HN1 . . . . . . . . . c30496_6e5h 1 . 10 . 4389 . 1 1 28 NH2 HN2 H -14.212 0.868 3.522 . . . 1.0 . . . . . . . . . . . . A . 28 NH2 HN2 . . . . . . . . . c30496_6e5h 1 . 10 . 4390 . 1 1 28 NH2 N N -13.265 0.621 3.556 . . . 1.0 . . . . . . . . . . . . A . 28 NH2 N . . . . . . . . . c30496_6e5h 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 c30496_6e5h _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 6e5h.mr . . 'MR format' 1 comment 'Not applicable' 'Not applicable' 0 c30496_6e5h 1 1 6e5h.mr . . XPLOR/CNS 2 distance NOE ambi 391 c30496_6e5h 1 1 6e5h.mr . . XPLOR/CNS 3 distance 'hydrogen bond' simple 26 c30496_6e5h 1 1 6e5h.mr . . XPLOR/CNS 4 'dihedral angle' 'Not applicable' 'Not applicable' 17 c30496_6e5h 1 1 6e5h.mr . . 'MR format' 5 'nomenclature mapping' 'Not applicable' 'Not applicable' 0 c30496_6e5h 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 c30496_6e5h _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 . . . . c30496_6e5h 1 stop_ loop_ _Gen_dist_constraint.ID _Gen_dist_constraint.Member_ID _Gen_dist_constraint.Member_logic_code _Gen_dist_constraint.Assembly_atom_ID_1 _Gen_dist_constraint.Entity_assembly_ID_1 _Gen_dist_constraint.Entity_ID_1 _Gen_dist_constraint.Comp_index_ID_1 _Gen_dist_constraint.Seq_ID_1 _Gen_dist_constraint.Comp_ID_1 _Gen_dist_constraint.Atom_ID_1 _Gen_dist_constraint.Atom_type_1 _Gen_dist_constraint.Atom_isotope_number_1 _Gen_dist_constraint.Resonance_ID_1 _Gen_dist_constraint.Assembly_atom_ID_2 _Gen_dist_constraint.Entity_assembly_ID_2 _Gen_dist_constraint.Entity_ID_2 _Gen_dist_constraint.Comp_index_ID_2 _Gen_dist_constraint.Seq_ID_2 _Gen_dist_constraint.Comp_ID_2 _Gen_dist_constraint.Atom_ID_2 _Gen_dist_constraint.Atom_type_2 _Gen_dist_constraint.Atom_isotope_number_2 _Gen_dist_constraint.Resonance_ID_2 _Gen_dist_constraint.Intensity_val _Gen_dist_constraint.Intensity_lower_val_err _Gen_dist_constraint.Intensity_upper_val_err _Gen_dist_constraint.Distance_val _Gen_dist_constraint.Distance_lower_bound_val _Gen_dist_constraint.Distance_upper_bound_val _Gen_dist_constraint.Contribution_fractional_val _Gen_dist_constraint.Spectral_peak_ID _Gen_dist_constraint.Spectral_peak_list_ID _Gen_dist_constraint.PDB_record_ID_1 _Gen_dist_constraint.PDB_model_num_1 _Gen_dist_constraint.PDB_strand_ID_1 _Gen_dist_constraint.PDB_ins_code_1 _Gen_dist_constraint.PDB_residue_no_1 _Gen_dist_constraint.PDB_residue_name_1 _Gen_dist_constraint.PDB_atom_name_1 _Gen_dist_constraint.PDB_record_ID_2 _Gen_dist_constraint.PDB_model_num_2 _Gen_dist_constraint.PDB_strand_ID_2 _Gen_dist_constraint.PDB_ins_code_2 _Gen_dist_constraint.PDB_residue_no_2 _Gen_dist_constraint.PDB_residue_name_2 _Gen_dist_constraint.PDB_atom_name_2 _Gen_dist_constraint.Auth_entity_assembly_ID_1 _Gen_dist_constraint.Auth_asym_ID_1 _Gen_dist_constraint.Auth_chain_ID_1 _Gen_dist_constraint.Auth_seq_ID_1 _Gen_dist_constraint.Auth_comp_ID_1 _Gen_dist_constraint.Auth_atom_ID_1 _Gen_dist_constraint.Auth_alt_ID_1 _Gen_dist_constraint.Auth_atom_name_1 _Gen_dist_constraint.Auth_entity_assembly_ID_2 _Gen_dist_constraint.Auth_asym_ID_2 _Gen_dist_constraint.Auth_chain_ID_2 _Gen_dist_constraint.Auth_seq_ID_2 _Gen_dist_constraint.Auth_comp_ID_2 _Gen_dist_constraint.Auth_atom_ID_2 _Gen_dist_constraint.Auth_alt_ID_2 _Gen_dist_constraint.Auth_atom_name_2 _Gen_dist_constraint.Entry_ID _Gen_dist_constraint.Gen_dist_constraint_list_ID 1 1 . . 1 1 19 19 ASP HB2 H . . . 1 1 19 19 ASP HB3 H . . . . . 1.770 1.378 2.162 . . . . . A . 19 ASP HB2 . . A . 19 ASP HB3 . . . 19 . HB1 . . . . . 19 . HB2 . . c30496_6e5h 1 2 1 . . 1 1 14 14 CYS HB2 H . . . 1 1 14 14 CYS HB3 H . . . . . 1.791 1.390 2.192 . . . . . A . 14 CYS HB2 . . A . 14 CYS HB3 . . . 14 . HB1 . . . . . 14 . HB2 . . c30496_6e5h 1 3 1 . . 1 1 27 27 CYS HB2 H . . . 1 1 27 27 CYS HB3 H . . . . . 1.792 1.390 2.194 . . . . . A . 27 CYS HB2 . . A . 27 CYS HB3 . . . 27 . HB1 . . . . . 27 . HB2 . . c30496_6e5h 1 4 1 OR . 1 1 23 23 TYR HD1 H . . . 1 1 23 23 TYR HE2 H . . . . . 1.799 1.395 2.203 . . . . . A . 23 TYR HD1 . . A . 23 TYR HE2 . . . 23 . HD1 . . . . . 23 . HE2 . . c30496_6e5h 1 4 2 OR . 1 1 23 23 TYR HD2 H . . . 1 1 23 23 TYR HE2 H . . . . . 1.799 1.395 2.203 . . . . . A . 23 TYR HD2 . . A . 23 TYR HE2 . . . 23 . HD2 . . . . . 23 . HE2 . . c30496_6e5h 1 4 3 OR . 1 1 23 23 TYR HE1 H . . . 1 1 23 23 TYR HD2 H . . . . . 1.799 1.395 2.203 . . . . . A . 23 TYR HE1 . . A . 23 TYR HD2 . . . 23 . HE1 . . . . . 23 . HD2 . . c30496_6e5h 1 4 4 OR . 1 1 23 23 TYR HE1 H . . . 1 1 23 23 TYR HD1 H . . . . . 1.799 1.395 2.203 . . . . . A . 23 TYR HE1 . . A . 23 TYR HD1 . . . 23 . HE1 . . . . . 23 . HD1 . . c30496_6e5h 1 5 1 . . 1 1 11 11 TYR HB2 H . . . 1 1 11 11 TYR HB3 H . . . . . 1.799 1.395 2.203 . . . . . A . 11 TYR HB2 . . A . 11 TYR HB3 . . . 11 . HB1 . . . . . 11 . HB2 . . c30496_6e5h 1 6 1 . . 1 1 18 18 CYS HB2 H . . . 1 1 18 18 CYS HB3 H . . . . . 1.800 1.395 2.205 . . . . . A . 18 CYS HB2 . . A . 18 CYS HB3 . . . 18 . HB1 . . . . . 18 . HB2 . . c30496_6e5h 1 7 1 . . 1 1 1 1 ASN HD21 H . . . 1 1 1 1 ASN HD22 H . . . . . 1.800 1.395 2.205 . . . . . A . 1 ASN HD21 . . A . 1 ASN HD22 . . . 1 . HD21 . . . . . 1 . HD22 . . c30496_6e5h 1 8 1 . . 1 1 20 20 DPR HB2 H . . . 1 1 20 20 DPR HB3 H . . . . . 1.835 1.414 2.256 . . . . . A . 20 DPR HB2 . . A . 20 DPR HB3 . . . 20 . HB1 . . . . . 20 . HB2 . . c30496_6e5h 1 9 1 . . 1 1 21 21 PRO HD2 H . . . 1 1 21 21 PRO HD3 H . . . . . 1.849 1.422 2.276 . . . . . A . 21 PRO HD2 . . A . 21 PRO HD3 . . . 21 . HD1 . . . . . 21 . HD2 . . c30496_6e5h 1 10 1 . . 1 1 20 20 DPR HD2 H . . . 1 1 20 20 DPR HD3 H . . . . . 1.855 1.425 2.285 . . . . . A . 20 DPR HD2 . . A . 20 DPR HD3 . . . 20 . HD1 . . . . . 20 . HD2 . . c30496_6e5h 1 11 1 OR . 1 1 11 11 TYR HD1 H . . . 1 1 11 11 TYR HE2 H . . . . . 1.983 1.491 2.475 . . . . . A . 11 TYR HD1 . . A . 11 TYR HE2 . . . 11 . HD1 . . . . . 11 . HE2 . . c30496_6e5h 1 11 2 OR . 1 1 11 11 TYR HD2 H . . . 1 1 11 11 TYR HE2 H . . . . . 1.983 1.491 2.475 . . . . . A . 11 TYR HD2 . . A . 11 TYR HE2 . . . 11 . HD2 . . . . . 11 . HE2 . . c30496_6e5h 1 11 3 OR . 1 1 11 11 TYR HE1 H . . . 1 1 11 11 TYR HD2 H . . . . . 1.983 1.491 2.475 . . . . . A . 11 TYR HE1 . . A . 11 TYR HD2 . . . 11 . HE1 . . . . . 11 . HD2 . . c30496_6e5h 1 11 4 OR . 1 1 11 11 TYR HE1 H . . . 1 1 11 11 TYR HD1 H . . . . . 1.983 1.491 2.475 . . . . . A . 11 TYR HE1 . . A . 11 TYR HD1 . . . 11 . HE1 . . . . . 11 . HD1 . . c30496_6e5h 1 12 1 . . 1 1 24 24 GLU HA H . . . 1 1 25 25 VAL H H . . . . . 2.008 1.504 2.512 . . . . . A . 24 GLU HA . . A . 25 VAL H . . . 24 . HA . . . . . 25 . HN . . c30496_6e5h 1 13 1 . . 1 1 15 15 GLU HA H . . . 1 1 16 16 VAL H H . . . . . 2.013 1.506 2.520 . . . . . A . 15 GLU HA . . A . 16 VAL H . . . 15 . HA . . . . . 16 . HN . . c30496_6e5h 1 14 1 . . 1 1 17 17 ARG HA H . . . 1 1 18 18 CYS H H . . . . . 2.037 1.518 2.556 . . . . . A . 17 ARG HA . . A . 18 CYS H . . . 17 . HA . . . . . 18 . HN . . c30496_6e5h 1 15 1 . . 1 1 25 25 VAL HA H . . . 1 1 26 26 HIS H H . . . . . 2.060 1.530 2.590 . . . . . A . 25 VAL HA . . A . 26 HIS H . . . 25 . HA . . . . . 26 . HN . . c30496_6e5h 1 16 1 . . 1 1 26 26 HIS HA H . . . 1 1 27 27 CYS H H . . . . . 2.104 1.551 2.657 . . . . . A . 26 HIS HA . . A . 27 CYS H . . . 26 . HA . . . . . 27 . HN . . c30496_6e5h 1 17 1 . . 1 1 22 22 ARG HA H . . . 1 1 23 23 TYR H H . . . . . 2.127 1.561 2.693 . . . . . A . 22 ARG HA . . A . 23 TYR H . . . 22 . HA . . . . . 23 . HN . . c30496_6e5h 1 18 1 . . 1 1 10 10 ARG HG2 H . . . 1 1 10 10 ARG HG3 H . . . . . 2.132 1.564 2.700 . . . . . A . 10 ARG HG2 . . A . 10 ARG HG3 . . . 10 . HG1 . . . . . 10 . HG2 . . c30496_6e5h 1 19 1 . . 1 1 23 23 TYR HA H . . . 1 1 24 24 GLU H H . . . . . 2.133 1.564 2.702 . . . . . A . 23 TYR HA . . A . 24 GLU H . . . 23 . HA . . . . . 24 . HN . . c30496_6e5h 1 20 1 . . 1 1 16 16 VAL HA H . . . 1 1 17 17 ARG H H . . . . . 2.137 1.566 2.708 . . . . . A . 16 VAL HA . . A . 17 ARG H . . . 16 . HA . . . . . 17 . HN . . c30496_6e5h 1 21 1 . . 1 1 7 7 LEU HG H . . . 1 1 7 7 LEU HA H . . . . . 2.142 1.569 2.715 . . . . . A . 7 LEU HG . . A . 7 LEU HA . . . 7 . HG . . . . . 7 . HA . . c30496_6e5h 1 22 1 . . 1 1 20 20 DPR HD3 H . . . 1 1 19 19 ASP HA H . . . . . 2.148 1.571 2.725 . . . . . A . 20 DPR HD3 . . A . 19 ASP HA . . . 20 . HD2 . . . . . 19 . HA . . c30496_6e5h 1 23 1 OR . 1 1 4 4 CYS H H . . . 1 1 4 4 CYS HB2 H . . . . . 2.180 1.586 2.774 . . . . . A . 4 CYS H . . A . 4 CYS HB2 . . . 4 . HN . . . . . 4 . HB1 . . c30496_6e5h 1 23 2 OR . 1 1 4 4 CYS HB3 H . . . 1 1 4 4 CYS H H . . . . . 2.180 1.586 2.774 . . . . . A . 4 CYS HB3 . . A . 4 CYS H . . . 4 . HB2 . . . . . 4 . HN . . c30496_6e5h 1 24 1 . . 1 1 21 21 PRO HD3 H . . . 1 1 20 20 DPR HA H . . . . . 2.186 1.588 2.784 . . . . . A . 21 PRO HD3 . . A . 20 DPR HA . . . 21 . HD2 . . . . . 20 . HA . . c30496_6e5h 1 25 1 . . 1 1 14 14 CYS HA H . . . 1 1 15 15 GLU H H . . . . . 2.242 1.614 2.870 . . . . . A . 14 CYS HA . . A . 15 GLU H . . . 14 . HA . . . . . 15 . HN . . c30496_6e5h 1 26 1 . . 1 1 18 18 CYS H H . . . 1 1 18 18 CYS HA H . . . . . 2.248 1.616 2.880 . . . . . A . 18 CYS H . . A . 18 CYS HA . . . 18 . HN . . . . . 18 . HA . . c30496_6e5h 1 27 1 . . 1 1 21 21 PRO HD2 H . . . 1 1 20 20 DPR HA H . . . . . 2.254 1.619 2.889 . . . . . A . 21 PRO HD2 . . A . 20 DPR HA . . . 21 . HD1 . . . . . 20 . HA . . c30496_6e5h 1 28 1 OR . 1 1 22 22 ARG H H . . . 1 1 22 22 ARG HB2 H . . . . . 2.257 1.620 2.894 . . . . . A . 22 ARG H . . A . 22 ARG HB2 . . . 22 . HN . . . . . 22 . HB1 . . c30496_6e5h 1 28 2 OR . 1 1 22 22 ARG HB3 H . . . 1 1 22 22 ARG H H . . . . . 2.257 1.620 2.894 . . . . . A . 22 ARG HB3 . . A . 22 ARG H . . . 22 . HB2 . . . . . 22 . HN . . c30496_6e5h 1 29 1 . . 1 1 16 16 VAL HB H . . . 1 1 16 16 VAL MG2 H . . . . . 2.266 1.624 2.908 . . . . . A . 16 VAL HB . . A . 16 VAL MG2 . . . 16 . HB . . . . . 16 . HG21 . . c30496_6e5h 1 30 1 OR . 1 1 11 11 TYR HB2 H . . . 1 1 11 11 TYR HD2 H . . . . . 2.270 1.626 2.914 . . . . . A . 11 TYR HB2 . . A . 11 TYR HD2 . . . 11 . HB1 . . . . . 11 . HD2 . . c30496_6e5h 1 30 2 OR . 1 1 11 11 TYR HB2 H . . . 1 1 11 11 TYR HD1 H . . . . . 2.270 1.626 2.914 . . . . . A . 11 TYR HB2 . . A . 11 TYR HD1 . . . 11 . HB1 . . . . . 11 . HD1 . . c30496_6e5h 1 31 1 . . 1 1 25 25 VAL MG2 H . . . 1 1 25 25 VAL MG1 H . . . . . 2.274 1.627 2.921 . . . . . A . 25 VAL MG2 . . A . 25 VAL MG1 . . . 25 . HG21 . . . . . 25 . HG11 . . c30496_6e5h 1 32 1 OR . 1 1 23 23 TYR HD2 H . . . 1 1 23 23 TYR HB2 H . . . . . 2.294 1.636 2.952 . . . . . A . 23 TYR HD2 . . A . 23 TYR HB2 . . . 23 . HD2 . . . . . 23 . HB1 . . c30496_6e5h 1 32 2 OR . 1 1 23 23 TYR HD1 H . . . 1 1 23 23 TYR HB2 H . . . . . 2.294 1.636 2.952 . . . . . A . 23 TYR HD1 . . A . 23 TYR HB2 . . . 23 . HD1 . . . . . 23 . HB1 . . c30496_6e5h 1 33 1 . . 1 1 25 25 VAL MG2 H . . . 1 1 25 25 VAL HB H . . . . . 2.302 1.639 2.965 . . . . . A . 25 VAL MG2 . . A . 25 VAL HB . . . 25 . HG21 . . . . . 25 . HB . . c30496_6e5h 1 34 1 OR . 1 1 23 23 TYR HD2 H . . . 1 1 23 23 TYR HB3 H . . . . . 2.306 1.641 2.971 . . . . . A . 23 TYR HD2 . . A . 23 TYR HB3 . . . 23 . HD2 . . . . . 23 . HB2 . . c30496_6e5h 1 34 2 OR . 1 1 23 23 TYR HD1 H . . . 1 1 23 23 TYR HB3 H . . . . . 2.306 1.641 2.971 . . . . . A . 23 TYR HD1 . . A . 23 TYR HB3 . . . 23 . HD1 . . . . . 23 . HB2 . . c30496_6e5h 1 35 1 OR . 1 1 3 3 LYS H H . . . 1 1 3 3 LYS HB2 H . . . . . 2.307 1.642 2.972 . . . . . A . 3 LYS H . . A . 3 LYS HB2 . . . 3 . HN . . . . . 3 . HB1 . . c30496_6e5h 1 35 2 OR . 1 1 3 3 LYS HB3 H . . . 1 1 3 3 LYS H H . . . . . 2.307 1.642 2.972 . . . . . A . 3 LYS HB3 . . A . 3 LYS H . . . 3 . HB2 . . . . . 3 . HN . . c30496_6e5h 1 36 1 . . 1 1 20 20 DPR HB3 H . . . 1 1 20 20 DPR HA H . . . . . 2.310 1.643 2.977 . . . . . A . 20 DPR HB3 . . A . 20 DPR HA . . . 20 . HB2 . . . . . 20 . HA . . c30496_6e5h 1 37 1 OR . 1 1 22 22 ARG HA H . . . 1 1 22 22 ARG HB2 H . . . . . 2.311 1.643 2.979 . . . . . A . 22 ARG HA . . A . 22 ARG HB2 . . . 22 . HA . . . . . 22 . HB1 . . c30496_6e5h 1 37 2 OR . 1 1 22 22 ARG HA H . . . 1 1 22 22 ARG HB3 H . . . . . 2.311 1.643 2.979 . . . . . A . 22 ARG HA . . A . 22 ARG HB3 . . . 22 . HA . . . . . 22 . HB2 . . c30496_6e5h 1 38 1 OR . 1 1 6 6 GLU H H . . . 1 1 6 6 GLU HB2 H . . . . . 2.314 1.644 2.984 . . . . . A . 6 GLU H . . A . 6 GLU HB2 . . . 6 . HN . . . . . 6 . HB1 . . c30496_6e5h 1 38 2 OR . 1 1 6 6 GLU HB3 H . . . 1 1 6 6 GLU H H . . . . . 2.314 1.644 2.984 . . . . . A . 6 GLU HB3 . . A . 6 GLU H . . . 6 . HB2 . . . . . 6 . HN . . c30496_6e5h 1 39 1 OR . 1 1 5 5 LYS H H . . . 1 1 5 5 LYS HB2 H . . . . . 2.319 1.647 2.991 . . . . . A . 5 LYS H . . A . 5 LYS HB2 . . . 5 . HN . . . . . 5 . HB1 . . c30496_6e5h 1 39 2 OR . 1 1 5 5 LYS HB3 H . . . 1 1 5 5 LYS H H . . . . . 2.319 1.647 2.991 . . . . . A . 5 LYS HB3 . . A . 5 LYS H . . . 5 . HB2 . . . . . 5 . HN . . c30496_6e5h 1 40 1 OR . 1 1 15 15 GLU HA H . . . 1 1 15 15 GLU HB2 H . . . . . 2.330 1.651 3.009 . . . . . A . 15 GLU HA . . A . 15 GLU HB2 . . . 15 . HA . . . . . 15 . HB1 . . c30496_6e5h 1 40 2 OR . 1 1 15 15 GLU HA H . . . 1 1 15 15 GLU HB3 H . . . . . 2.330 1.651 3.009 . . . . . A . 15 GLU HA . . A . 15 GLU HB3 . . . 15 . HA . . . . . 15 . HB2 . . c30496_6e5h 1 41 1 . . 1 1 13 13 GLY H H . . . 1 1 13 13 GLY HA2 H . . . . . 2.336 1.654 3.018 . . . . . A . 13 GLY H . . A . 13 GLY HA2 . . . 13 . HN . . . . . 13 . HA1 . . c30496_6e5h 1 42 1 . . 1 1 14 14 CYS HB3 H . . . 1 1 11 11 TYR HB3 H . . . . . 2.338 1.655 3.021 . . . . . A . 14 CYS HB3 . . A . 11 TYR HB3 . . . 14 . HB2 . . . . . 11 . HB2 . . c30496_6e5h 1 43 1 . . 1 1 3 3 LYS H H . . . 1 1 2 2 ASP HA H . . . . . 2.344 1.657 3.031 . . . . . A . 3 LYS H . . A . 2 ASP HA . . . 3 . HN . . . . . 2 . HA . . c30496_6e5h 1 44 1 . . 1 1 25 25 VAL MG1 H . . . 1 1 25 25 VAL HB H . . . . . 2.345 1.658 3.032 . . . . . A . 25 VAL MG1 . . A . 25 VAL HB . . . 25 . HG11 . . . . . 25 . HB . . c30496_6e5h 1 45 1 OR . 1 1 4 4 CYS HB2 H . . . 1 1 4 4 CYS HA H . . . . . 2.345 1.657 3.033 . . . . . A . 4 CYS HB2 . . A . 4 CYS HA . . . 4 . HB1 . . . . . 4 . HA . . c30496_6e5h 1 45 2 OR . 1 1 4 4 CYS HB3 H . . . 1 1 4 4 CYS HA H . . . . . 2.345 1.657 3.033 . . . . . A . 4 CYS HB3 . . A . 4 CYS HA . . . 4 . HB2 . . . . . 4 . HA . . c30496_6e5h 1 46 1 OR . 1 1 15 15 GLU H H . . . 1 1 15 15 GLU HB2 H . . . . . 2.356 1.662 3.050 . . . . . A . 15 GLU H . . A . 15 GLU HB2 . . . 15 . HN . . . . . 15 . HB1 . . c30496_6e5h 1 46 2 OR . 1 1 15 15 GLU H H . . . 1 1 15 15 GLU HB3 H . . . . . 2.356 1.662 3.050 . . . . . A . 15 GLU H . . A . 15 GLU HB3 . . . 15 . HN . . . . . 15 . HB2 . . c30496_6e5h 1 47 1 OR . 1 1 11 11 TYR HD2 H . . . 1 1 11 11 TYR HA H . . . . . 2.356 1.662 3.050 . . . . . A . 11 TYR HD2 . . A . 11 TYR HA . . . 11 . HD2 . . . . . 11 . HA . . c30496_6e5h 1 47 2 OR . 1 1 11 11 TYR HD1 H . . . 1 1 11 11 TYR HA H . . . . . 2.356 1.662 3.050 . . . . . A . 11 TYR HD1 . . A . 11 TYR HA . . . 11 . HD1 . . . . . 11 . HA . . c30496_6e5h 1 48 1 . . 1 1 23 23 TYR HA H . . . 1 1 23 23 TYR HB3 H . . . . . 2.357 1.662 3.052 . . . . . A . 23 TYR HA . . A . 23 TYR HB3 . . . 23 . HA . . . . . 23 . HB2 . . c30496_6e5h 1 49 1 . . 1 1 23 23 TYR HA H . . . 1 1 23 23 TYR HB2 H . . . . . 2.360 1.664 3.056 . . . . . A . 23 TYR HA . . A . 23 TYR HB2 . . . 23 . HA . . . . . 23 . HB1 . . c30496_6e5h 1 50 1 OR . 1 1 11 11 TYR HB3 H . . . 1 1 11 11 TYR HD2 H . . . . . 2.361 1.664 3.058 . . . . . A . 11 TYR HB3 . . A . 11 TYR HD2 . . . 11 . HB2 . . . . . 11 . HD2 . . c30496_6e5h 1 50 2 OR . 1 1 11 11 TYR HB3 H . . . 1 1 11 11 TYR HD1 H . . . . . 2.361 1.664 3.058 . . . . . A . 11 TYR HB3 . . A . 11 TYR HD1 . . . 11 . HB2 . . . . . 11 . HD1 . . c30496_6e5h 1 51 1 . . 1 1 21 21 PRO HA H . . . 1 1 21 21 PRO HB3 H . . . . . 2.363 1.665 3.061 . . . . . A . 21 PRO HA . . A . 21 PRO HB3 . . . 21 . HA . . . . . 21 . HB2 . . c30496_6e5h 1 52 1 . . 1 1 16 16 VAL HB H . . . 1 1 16 16 VAL MG1 H . . . . . 2.371 1.669 3.073 . . . . . A . 16 VAL HB . . A . 16 VAL MG1 . . . 16 . HB . . . . . 16 . HG11 . . c30496_6e5h 1 53 1 . . 1 1 14 14 CYS HB2 H . . . 1 1 14 14 CYS HA H . . . . . 2.381 1.673 3.089 . . . . . A . 14 CYS HB2 . . A . 14 CYS HA . . . 14 . HB1 . . . . . 14 . HA . . c30496_6e5h 1 54 1 . . 1 1 10 10 ARG HG3 H . . . 1 1 10 10 ARG HA H . . . . . 2.382 1.673 3.091 . . . . . A . 10 ARG HG3 . . A . 10 ARG HA . . . 10 . HG2 . . . . . 10 . HA . . c30496_6e5h 1 55 1 . . 1 1 7 7 LEU MD2 H . . . 1 1 7 7 LEU MD1 H . . . . . 2.382 1.673 3.091 . . . . . A . 7 LEU MD2 . . A . 7 LEU MD1 . . . 7 . HD21 . . . . . 7 . HD11 . . c30496_6e5h 1 56 1 . . 1 1 7 7 LEU HB3 H . . . 1 1 7 7 LEU H H . . . . . 2.383 1.673 3.093 . . . . . A . 7 LEU HB3 . . A . 7 LEU H . . . 7 . HB2 . . . . . 7 . HN . . c30496_6e5h 1 57 1 OR . 1 1 8 8 LYS HA H . . . 1 1 8 8 LYS HB2 H . . . . . 2.399 1.680 3.118 . . . . . A . 8 LYS HA . . A . 8 LYS HB2 . . . 8 . HA . . . . . 8 . HB1 . . c30496_6e5h 1 57 2 OR . 1 1 8 8 LYS HB3 H . . . 1 1 8 8 LYS HA H . . . . . 2.399 1.680 3.118 . . . . . A . 8 LYS HB3 . . A . 8 LYS HA . . . 8 . HB2 . . . . . 8 . HA . . c30496_6e5h 1 58 1 . . 1 1 21 21 PRO HD3 H . . . 1 1 21 21 PRO HG2 H . . . . . 2.410 1.684 3.136 . . . . . A . 21 PRO HD3 . . A . 21 PRO HG2 . . . 21 . HD2 . . . . . 21 . HG1 . . c30496_6e5h 1 59 1 . . 1 1 14 14 CYS HB2 H . . . 1 1 15 15 GLU H H . . . . . 2.416 1.687 3.145 . . . . . A . 14 CYS HB2 . . A . 15 GLU H . . . 14 . HB1 . . . . . 15 . HN . . c30496_6e5h 1 60 1 . . 1 1 16 16 VAL H H . . . 1 1 16 16 VAL HB H . . . . . 2.418 1.687 3.149 . . . . . A . 16 VAL H . . A . 16 VAL HB . . . 16 . HN . . . . . 16 . HB . . c30496_6e5h 1 61 1 . . 1 1 7 7 LEU HG H . . . 1 1 7 7 LEU MD2 H . . . . . 2.420 1.688 3.152 . . . . . A . 7 LEU HG . . A . 7 LEU MD2 . . . 7 . HG . . . . . 7 . HD21 . . c30496_6e5h 1 62 1 . . 1 1 11 11 TYR HB2 H . . . 1 1 11 11 TYR H H . . . . . 2.421 1.688 3.154 . . . . . A . 11 TYR HB2 . . A . 11 TYR H . . . 11 . HB1 . . . . . 11 . HN . . c30496_6e5h 1 63 1 . . 1 1 17 17 ARG HA H . . . 1 1 17 17 ARG HB2 H . . . . . 2.423 1.689 3.157 . . . . . A . 17 ARG HA . . A . 17 ARG HB2 . . . 17 . HA . . . . . 17 . HB1 . . c30496_6e5h 1 64 1 . . 1 1 18 18 CYS HB2 H . . . 1 1 18 18 CYS H H . . . . . 2.425 1.690 3.160 . . . . . A . 18 CYS HB2 . . A . 18 CYS H . . . 18 . HB1 . . . . . 18 . HN . . c30496_6e5h 1 65 1 . . 1 1 17 17 ARG HA H . . . 1 1 17 17 ARG HB3 H . . . . . 2.433 1.693 3.173 . . . . . A . 17 ARG HA . . A . 17 ARG HB3 . . . 17 . HA . . . . . 17 . HB2 . . c30496_6e5h 1 66 1 . . 1 1 27 27 CYS HB3 H . . . 1 1 27 27 CYS HA H . . . . . 2.433 1.693 3.173 . . . . . A . 27 CYS HB3 . . A . 27 CYS HA . . . 27 . HB2 . . . . . 27 . HA . . c30496_6e5h 1 67 1 . . 1 1 25 25 VAL H H . . . 1 1 25 25 VAL HB H . . . . . 2.433 1.693 3.173 . . . . . A . 25 VAL H . . A . 25 VAL HB . . . 25 . HN . . . . . 25 . HB . . c30496_6e5h 1 68 1 OR . 1 1 8 8 LYS HA H . . . 1 1 8 8 LYS HG2 H . . . . . 2.436 1.694 3.178 . . . . . A . 8 LYS HA . . A . 8 LYS HG2 . . . 8 . HA . . . . . 8 . HG1 . . c30496_6e5h 1 68 2 OR . 1 1 8 8 LYS HA H . . . 1 1 8 8 LYS HG3 H . . . . . 2.436 1.694 3.178 . . . . . A . 8 LYS HA . . A . 8 LYS HG3 . . . 8 . HA . . . . . 8 . HG2 . . c30496_6e5h 1 69 1 . . 1 1 27 27 CYS HB2 H . . . 1 1 27 27 CYS H H . . . . . 2.436 1.694 3.178 . . . . . A . 27 CYS HB2 . . A . 27 CYS H . . . 27 . HB1 . . . . . 27 . HN . . c30496_6e5h 1 70 1 . . 1 1 21 21 PRO HA H . . . 1 1 21 21 PRO HB2 H . . . . . 2.441 1.696 3.186 . . . . . A . 21 PRO HA . . A . 21 PRO HB2 . . . 21 . HA . . . . . 21 . HB1 . . c30496_6e5h 1 71 1 . . 1 1 7 7 LEU HA H . . . 1 1 7 7 LEU MD2 H . . . . . 2.443 1.697 3.189 . . . . . A . 7 LEU HA . . A . 7 LEU MD2 . . . 7 . HA . . . . . 7 . HD21 . . c30496_6e5h 1 72 1 . . 1 1 11 11 TYR HB3 H . . . 1 1 11 11 TYR HA H . . . . . 2.445 1.698 3.192 . . . . . A . 11 TYR HB3 . . A . 11 TYR HA . . . 11 . HB2 . . . . . 11 . HA . . c30496_6e5h 1 73 1 . . 1 1 26 26 HIS HA H . . . 1 1 26 26 HIS HB2 H . . . . . 2.449 1.699 3.199 . . . . . A . 26 HIS HA . . A . 26 HIS HB2 . . . 26 . HA . . . . . 26 . HB1 . . c30496_6e5h 1 74 1 . . 1 1 6 6 GLU H H . . . 1 1 5 5 LYS H H . . . . . 2.454 1.701 3.207 . . . . . A . 6 GLU H . . A . 5 LYS H . . . 6 . HN . . . . . 5 . HN . . c30496_6e5h 1 75 1 OR . 1 1 25 25 VAL H H . . . 1 1 24 24 GLU HB2 H . . . . . 2.461 1.704 3.218 . . . . . A . 25 VAL H . . A . 24 GLU HB2 . . . 25 . HN . . . . . 24 . HB1 . . c30496_6e5h 1 75 2 OR . 1 1 25 25 VAL H H . . . 1 1 24 24 GLU HB3 H . . . . . 2.461 1.704 3.218 . . . . . A . 25 VAL H . . A . 24 GLU HB3 . . . 25 . HN . . . . . 24 . HB2 . . c30496_6e5h 1 76 1 . . 1 1 2 2 ASP HA H . . . 1 1 2 2 ASP HB2 H . . . . . 2.462 1.704 3.220 . . . . . A . 2 ASP HA . . A . 2 ASP HB2 . . . 2 . HA . . . . . 2 . HB1 . . c30496_6e5h 1 77 1 . . 1 1 14 14 CYS HB3 H . . . 1 1 14 14 CYS H H . . . . . 2.470 1.707 3.233 . . . . . A . 14 CYS HB3 . . A . 14 CYS H . . . 14 . HB2 . . . . . 14 . HN . . c30496_6e5h 1 78 1 . . 1 1 13 13 GLY H H . . . 1 1 13 13 GLY HA3 H . . . . . 2.475 1.709 3.241 . . . . . A . 13 GLY H . . A . 13 GLY HA3 . . . 13 . HN . . . . . 13 . HA2 . . c30496_6e5h 1 79 1 . . 1 1 16 16 VAL HA H . . . 1 1 16 16 VAL MG2 H . . . . . 2.477 1.710 3.244 . . . . . A . 16 VAL HA . . A . 16 VAL MG2 . . . 16 . HA . . . . . 16 . HG21 . . c30496_6e5h 1 80 1 . . 1 1 20 20 DPR HD2 H . . . 1 1 20 20 DPR HG3 H . . . . . 2.481 1.712 3.250 . . . . . A . 20 DPR HD2 . . A . 20 DPR HG3 . . . 20 . HD1 . . . . . 20 . HG2 . . c30496_6e5h 1 81 1 . . 1 1 21 21 PRO HD2 H . . . 1 1 21 21 PRO HG2 H . . . . . 2.486 1.713 3.259 . . . . . A . 21 PRO HD2 . . A . 21 PRO HG2 . . . 21 . HD1 . . . . . 21 . HG1 . . c30496_6e5h 1 82 1 . . 1 1 19 19 ASP HB2 H . . . 1 1 19 19 ASP HA H . . . . . 2.487 1.714 3.260 . . . . . A . 19 ASP HB2 . . A . 19 ASP HA . . . 19 . HB1 . . . . . 19 . HA . . c30496_6e5h 1 83 1 . . 1 1 21 21 PRO HD2 H . . . 1 1 21 21 PRO HG3 H . . . . . 2.491 1.715 3.267 . . . . . A . 21 PRO HD2 . . A . 21 PRO HG3 . . . 21 . HD1 . . . . . 21 . HG2 . . c30496_6e5h 1 84 1 OR . 1 1 11 11 TYR HD2 H . . . 1 1 11 11 TYR H H . . . . . 2.491 1.715 3.267 . . . . . A . 11 TYR HD2 . . A . 11 TYR H . . . 11 . HD2 . . . . . 11 . HN . . c30496_6e5h 1 84 2 OR . 1 1 11 11 TYR HD1 H . . . 1 1 11 11 TYR H H . . . . . 2.491 1.715 3.267 . . . . . A . 11 TYR HD1 . . A . 11 TYR H . . . 11 . HD1 . . . . . 11 . HN . . c30496_6e5h 1 85 1 . . 1 1 25 25 VAL HA H . . . 1 1 25 25 VAL MG2 H . . . . . 2.494 1.717 3.271 . . . . . A . 25 VAL HA . . A . 25 VAL MG2 . . . 25 . HA . . . . . 25 . HG21 . . c30496_6e5h 1 86 1 . . 1 1 7 7 LEU HG H . . . 1 1 7 7 LEU H H . . . . . 2.497 1.717 3.277 . . . . . A . 7 LEU HG . . A . 7 LEU H . . . 7 . HG . . . . . 7 . HN . . c30496_6e5h 1 87 1 . . 1 1 16 16 VAL HA H . . . 1 1 16 16 VAL MG1 H . . . . . 2.497 1.717 3.277 . . . . . A . 16 VAL HA . . A . 16 VAL MG1 . . . 16 . HA . . . . . 16 . HG11 . . c30496_6e5h 1 88 1 . . 1 1 10 10 ARG HB3 H . . . 1 1 10 10 ARG H H . . . . . 2.497 1.717 3.277 . . . . . A . 10 ARG HB3 . . A . 10 ARG H . . . 10 . HB2 . . . . . 10 . HN . . c30496_6e5h 1 89 1 OR . 1 1 4 4 CYS HB2 H . . . 1 1 5 5 LYS H H . . . . . 2.499 1.719 3.279 . . . . . A . 4 CYS HB2 . . A . 5 LYS H . . . 4 . HB1 . . . . . 5 . HN . . c30496_6e5h 1 89 2 OR . 1 1 4 4 CYS HB3 H . . . 1 1 5 5 LYS H H . . . . . 2.499 1.719 3.279 . . . . . A . 4 CYS HB3 . . A . 5 LYS H . . . 4 . HB2 . . . . . 5 . HN . . c30496_6e5h 1 90 1 . . 1 1 20 20 DPR HD3 H . . . 1 1 20 20 DPR HG2 H . . . . . 2.499 1.719 3.279 . . . . . A . 20 DPR HD3 . . A . 20 DPR HG2 . . . 20 . HD2 . . . . . 20 . HG1 . . c30496_6e5h 1 91 1 OR . 1 1 11 11 TYR HE1 H . . . 1 1 7 7 LEU MD2 H . . . . . 2.501 1.719 3.283 . . . . . A . 11 TYR HE1 . . A . 7 LEU MD2 . . . 11 . HE1 . . . . . 7 . HD21 . . c30496_6e5h 1 91 2 OR . 1 1 11 11 TYR HE2 H . . . 1 1 7 7 LEU MD2 H . . . . . 2.501 1.719 3.283 . . . . . A . 11 TYR HE2 . . A . 7 LEU MD2 . . . 11 . HE2 . . . . . 7 . HD21 . . c30496_6e5h 1 92 1 OR . 1 1 15 15 GLU HB2 H . . . 1 1 15 15 GLU HG3 H . . . . . 2.504 1.720 3.288 . . . . . A . 15 GLU HB2 . . A . 15 GLU HG3 . . . 15 . HB1 . . . . . 15 . HG2 . . c30496_6e5h 1 92 2 OR . 1 1 15 15 GLU HB3 H . . . 1 1 15 15 GLU HG3 H . . . . . 2.504 1.720 3.288 . . . . . A . 15 GLU HB3 . . A . 15 GLU HG3 . . . 15 . HB2 . . . . . 15 . HG2 . . c30496_6e5h 1 93 1 . . 1 1 19 19 ASP HB3 H . . . 1 1 19 19 ASP HA H . . . . . 2.505 1.720 3.290 . . . . . A . 19 ASP HB3 . . A . 19 ASP HA . . . 19 . HB2 . . . . . 19 . HA . . c30496_6e5h 1 94 1 . . 1 1 11 11 TYR HB2 H . . . 1 1 16 16 VAL MG2 H . . . . . 2.505 1.720 3.290 . . . . . A . 11 TYR HB2 . . A . 16 VAL MG2 . . . 11 . HB1 . . . . . 16 . HG21 . . c30496_6e5h 1 95 1 . . 1 1 10 10 ARG H H . . . 1 1 10 10 ARG HB2 H . . . . . 2.517 1.725 3.309 . . . . . A . 10 ARG H . . A . 10 ARG HB2 . . . 10 . HN . . . . . 10 . HB1 . . c30496_6e5h 1 96 1 . . 1 1 18 18 CYS HA H . . . 1 1 19 19 ASP H H . . . . . 2.537 1.732 3.342 . . . . . A . 18 CYS HA . . A . 19 ASP H . . . 18 . HA . . . . . 19 . HN . . c30496_6e5h 1 97 1 . . 1 1 26 26 HIS HA H . . . 1 1 26 26 HIS HB3 H . . . . . 2.548 1.737 3.359 . . . . . A . 26 HIS HA . . A . 26 HIS HB3 . . . 26 . HA . . . . . 26 . HB2 . . c30496_6e5h 1 98 1 . . 1 1 16 16 VAL MG2 H . . . 1 1 8 8 LYS HA H . . . . . 2.555 1.739 3.371 . . . . . A . 16 VAL MG2 . . A . 8 LYS HA . . . 16 . HG21 . . . . . 8 . HA . . c30496_6e5h 1 99 1 . . 1 1 6 6 GLU H H . . . 1 1 7 7 LEU H H . . . . . 2.558 1.740 3.376 . . . . . A . 6 GLU H . . A . 7 LEU H . . . 6 . HN . . . . . 7 . HN . . c30496_6e5h 1 100 1 . . 1 1 16 16 VAL MG2 H . . . 1 1 25 25 VAL MG2 H . . . . . 2.567 1.743 3.391 . . . . . A . 16 VAL MG2 . . A . 25 VAL MG2 . . . 16 . HG21 . . . . . 25 . HG21 . . c30496_6e5h 1 101 1 OR . 1 1 1 1 ASN HA H . . . 1 1 1 1 ASN HB2 H . . . . . 2.585 1.750 3.420 . . . . . A . 1 ASN HA . . A . 1 ASN HB2 . . . 1 . HA . . . . . 1 . HB1 . . c30496_6e5h 1 101 2 OR . 1 1 1 1 ASN HA H . . . 1 1 1 1 ASN HB3 H . . . . . 2.585 1.750 3.420 . . . . . A . 1 ASN HA . . A . 1 ASN HB3 . . . 1 . HA . . . . . 1 . HB2 . . c30496_6e5h 1 102 1 OR . 1 1 23 23 TYR H H . . . 1 1 22 22 ARG HB2 H . . . . . 2.590 1.751 3.429 . . . . . A . 23 TYR H . . A . 22 ARG HB2 . . . 23 . HN . . . . . 22 . HB1 . . c30496_6e5h 1 102 2 OR . 1 1 23 23 TYR H H . . . 1 1 22 22 ARG HB3 H . . . . . 2.590 1.751 3.429 . . . . . A . 23 TYR H . . A . 22 ARG HB3 . . . 23 . HN . . . . . 22 . HB2 . . c30496_6e5h 1 103 1 . . 1 1 7 7 LEU HG H . . . 1 1 7 7 LEU MD1 H . . . . . 2.590 1.751 3.429 . . . . . A . 7 LEU HG . . A . 7 LEU MD1 . . . 7 . HG . . . . . 7 . HD11 . . c30496_6e5h 1 104 1 OR . 1 1 22 22 ARG HB2 H . . . 1 1 22 22 ARG HE H . . . . . 2.590 1.751 3.429 . . . . . A . 22 ARG HB2 . . A . 22 ARG HE . . . 22 . HB1 . . . . . 22 . HE . . c30496_6e5h 1 104 2 OR . 1 1 22 22 ARG HB3 H . . . 1 1 22 22 ARG HE H . . . . . 2.590 1.751 3.429 . . . . . A . 22 ARG HB3 . . A . 22 ARG HE . . . 22 . HB2 . . . . . 22 . HE . . c30496_6e5h 1 105 1 OR . 1 1 9 9 LYS HA H . . . 1 1 9 9 LYS HB2 H . . . . . 2.592 1.752 3.432 . . . . . A . 9 LYS HA . . A . 9 LYS HB2 . . . 9 . HA . . . . . 9 . HB1 . . c30496_6e5h 1 105 2 OR . 1 1 9 9 LYS HB3 H . . . 1 1 9 9 LYS HA H . . . . . 2.592 1.752 3.432 . . . . . A . 9 LYS HB3 . . A . 9 LYS HA . . . 9 . HB2 . . . . . 9 . HA . . c30496_6e5h 1 106 1 OR . 1 1 22 22 ARG HA H . . . 1 1 22 22 ARG HG2 H . . . . . 2.597 1.754 3.440 . . . . . A . 22 ARG HA . . A . 22 ARG HG2 . . . 22 . HA . . . . . 22 . HG1 . . c30496_6e5h 1 106 2 OR . 1 1 22 22 ARG HA H . . . 1 1 22 22 ARG HG3 H . . . . . 2.597 1.754 3.440 . . . . . A . 22 ARG HA . . A . 22 ARG HG3 . . . 22 . HA . . . . . 22 . HG2 . . c30496_6e5h 1 107 1 . . 1 1 20 20 DPR HB2 H . . . 1 1 20 20 DPR HA H . . . . . 2.599 1.755 3.443 . . . . . A . 20 DPR HB2 . . A . 20 DPR HA . . . 20 . HB1 . . . . . 20 . HA . . c30496_6e5h 1 108 1 . . 1 1 25 25 VAL HA H . . . 1 1 25 25 VAL MG1 H . . . . . 2.600 1.755 3.445 . . . . . A . 25 VAL HA . . A . 25 VAL MG1 . . . 25 . HA . . . . . 25 . HG11 . . c30496_6e5h 1 109 1 . . 1 1 17 17 ARG H H . . . 1 1 17 17 ARG HB2 H . . . . . 2.605 1.756 3.454 . . . . . A . 17 ARG H . . A . 17 ARG HB2 . . . 17 . HN . . . . . 17 . HB1 . . c30496_6e5h 1 110 1 OR . 1 1 6 6 GLU HB2 H . . . 1 1 7 7 LEU H H . . . . . 2.607 1.757 3.457 . . . . . A . 6 GLU HB2 . . A . 7 LEU H . . . 6 . HB1 . . . . . 7 . HN . . c30496_6e5h 1 110 2 OR . 1 1 6 6 GLU HB3 H . . . 1 1 7 7 LEU H H . . . . . 2.607 1.757 3.457 . . . . . A . 6 GLU HB3 . . A . 7 LEU H . . . 6 . HB2 . . . . . 7 . HN . . c30496_6e5h 1 111 1 . . 1 1 10 10 ARG H H . . . 1 1 9 9 LYS H H . . . . . 2.609 1.758 3.460 . . . . . A . 10 ARG H . . A . 9 LYS H . . . 10 . HN . . . . . 9 . HN . . c30496_6e5h 1 112 1 . . 1 1 24 24 GLU H H . . . 1 1 17 17 ARG H H . . . . . 2.609 1.758 3.460 . . . . . A . 24 GLU H . . A . 17 ARG H . . . 24 . HN . . . . . 17 . HN . . c30496_6e5h 1 113 1 OR . 1 1 6 6 GLU H H . . . 1 1 5 5 LYS HB2 H . . . . . 2.613 1.760 3.466 . . . . . A . 6 GLU H . . A . 5 LYS HB2 . . . 6 . HN . . . . . 5 . HB1 . . c30496_6e5h 1 113 2 OR . 1 1 6 6 GLU H H . . . 1 1 5 5 LYS HB3 H . . . . . 2.613 1.760 3.466 . . . . . A . 6 GLU H . . A . 5 LYS HB3 . . . 6 . HN . . . . . 5 . HB2 . . c30496_6e5h 1 114 1 . . 1 1 11 11 TYR HA H . . . 1 1 12 12 ABA H H . . . . . 2.613 1.760 3.466 . . . . . A . 11 TYR HA . . A . 12 AIB H . . . 11 . HA . . . . . 12 . HN . . c30496_6e5h 1 115 1 . . 1 1 20 20 DPR HD2 H . . . 1 1 20 20 DPR HG2 H . . . . . 2.620 1.762 3.478 . . . . . A . 20 DPR HD2 . . A . 20 DPR HG2 . . . 20 . HD1 . . . . . 20 . HG1 . . c30496_6e5h 1 116 1 OR . 1 1 24 24 GLU HA H . . . 1 1 24 24 GLU HB2 H . . . . . 2.625 1.764 3.486 . . . . . A . 24 GLU HA . . A . 24 GLU HB2 . . . 24 . HA . . . . . 24 . HB1 . . c30496_6e5h 1 116 2 OR . 1 1 24 24 GLU HA H . . . 1 1 24 24 GLU HB3 H . . . . . 2.625 1.764 3.486 . . . . . A . 24 GLU HA . . A . 24 GLU HB3 . . . 24 . HA . . . . . 24 . HB2 . . c30496_6e5h 1 117 1 . . 1 1 13 13 GLY H H . . . 1 1 14 14 CYS H H . . . . . 2.629 1.765 3.493 . . . . . A . 13 GLY H . . A . 14 CYS H . . . 13 . HN . . . . . 14 . HN . . c30496_6e5h 1 118 1 . . 1 1 14 14 CYS HB2 H . . . 1 1 25 25 VAL MG1 H . . . . . 2.629 1.765 3.493 . . . . . A . 14 CYS HB2 . . A . 25 VAL MG1 . . . 14 . HB1 . . . . . 25 . HG11 . . c30496_6e5h 1 119 1 . . 1 1 7 7 LEU MD1 H . . . 1 1 7 7 LEU HB2 H . . . . . 2.634 1.766 3.502 . . . . . A . 7 LEU MD1 . . A . 7 LEU HB2 . . . 7 . HD11 . . . . . 7 . HB1 . . c30496_6e5h 1 120 1 OR . 1 1 10 10 ARG H H . . . 1 1 9 9 LYS HB2 H . . . . . 2.634 1.766 3.502 . . . . . A . 10 ARG H . . A . 9 LYS HB2 . . . 10 . HN . . . . . 9 . HB1 . . c30496_6e5h 1 120 2 OR . 1 1 10 10 ARG H H . . . 1 1 9 9 LYS HB3 H . . . . . 2.634 1.766 3.502 . . . . . A . 10 ARG H . . A . 9 LYS HB3 . . . 10 . HN . . . . . 9 . HB2 . . c30496_6e5h 1 121 1 . . 1 1 2 2 ASP HA H . . . 1 1 2 2 ASP HB3 H . . . . . 2.642 1.769 3.515 . . . . . A . 2 ASP HA . . A . 2 ASP HB3 . . . 2 . HA . . . . . 2 . HB2 . . c30496_6e5h 1 122 1 . . 1 1 11 11 TYR H H . . . 1 1 10 10 ARG HB2 H . . . . . 2.642 1.769 3.515 . . . . . A . 11 TYR H . . A . 10 ARG HB2 . . . 11 . HN . . . . . 10 . HB1 . . c30496_6e5h 1 123 1 . . 1 1 21 21 PRO HD3 H . . . 1 1 21 21 PRO HG3 H . . . . . 2.644 1.770 3.518 . . . . . A . 21 PRO HD3 . . A . 21 PRO HG3 . . . 21 . HD2 . . . . . 21 . HG2 . . c30496_6e5h 1 124 1 . . 1 1 4 4 CYS H H . . . 1 1 5 5 LYS H H . . . . . 2.644 1.770 3.518 . . . . . A . 4 CYS H . . A . 5 LYS H . . . 4 . HN . . . . . 5 . HN . . c30496_6e5h 1 125 1 OR . 1 1 23 23 TYR HE2 H . . . 1 1 4 4 CYS HB2 H . . . . . 2.648 1.772 3.524 . . . . . A . 23 TYR HE2 . . A . 4 CYS HB2 . . . 23 . HE2 . . . . . 4 . HB1 . . c30496_6e5h 1 125 2 OR . 1 1 23 23 TYR HE2 H . . . 1 1 4 4 CYS HB3 H . . . . . 2.648 1.772 3.524 . . . . . A . 23 TYR HE2 . . A . 4 CYS HB3 . . . 23 . HE2 . . . . . 4 . HB2 . . c30496_6e5h 1 125 3 OR . 1 1 23 23 TYR HE1 H . . . 1 1 4 4 CYS HB3 H . . . . . 2.648 1.772 3.524 . . . . . A . 23 TYR HE1 . . A . 4 CYS HB3 . . . 23 . HE1 . . . . . 4 . HB2 . . c30496_6e5h 1 125 4 OR . 1 1 23 23 TYR HE1 H . . . 1 1 4 4 CYS HB2 H . . . . . 2.648 1.772 3.524 . . . . . A . 23 TYR HE1 . . A . 4 CYS HB2 . . . 23 . HE1 . . . . . 4 . HB1 . . c30496_6e5h 1 126 1 OR . 1 1 6 6 GLU HB2 H . . . 1 1 6 6 GLU HG3 H . . . . . 2.652 1.773 3.531 . . . . . A . 6 GLU HB2 . . A . 6 GLU HG3 . . . 6 . HB1 . . . . . 6 . HG2 . . c30496_6e5h 1 126 2 OR . 1 1 6 6 GLU HB3 H . . . 1 1 6 6 GLU HG3 H . . . . . 2.652 1.773 3.531 . . . . . A . 6 GLU HB3 . . A . 6 GLU HG3 . . . 6 . HB2 . . . . . 6 . HG2 . . c30496_6e5h 1 127 1 . . 1 1 26 26 HIS H H . . . 1 1 26 26 HIS HB2 H . . . . . 2.654 1.774 3.534 . . . . . A . 26 HIS H . . A . 26 HIS HB2 . . . 26 . HN . . . . . 26 . HB1 . . c30496_6e5h 1 128 1 . . 1 1 17 17 ARG H H . . . 1 1 16 16 VAL MG1 H . . . . . 2.656 1.774 3.538 . . . . . A . 17 ARG H . . A . 16 VAL MG1 . . . 17 . HN . . . . . 16 . HG11 . . c30496_6e5h 1 129 1 . . 1 1 7 7 LEU MD2 H . . . 1 1 7 7 LEU HB2 H . . . . . 2.656 1.774 3.538 . . . . . A . 7 LEU MD2 . . A . 7 LEU HB2 . . . 7 . HD21 . . . . . 7 . HB1 . . c30496_6e5h 1 130 1 . . 1 1 4 4 CYS H H . . . 1 1 3 3 LYS H H . . . . . 2.660 1.776 3.544 . . . . . A . 4 CYS H . . A . 3 LYS H . . . 4 . HN . . . . . 3 . HN . . c30496_6e5h 1 131 1 . . 1 1 16 16 VAL MG1 H . . . 1 1 7 7 LEU HB3 H . . . . . 2.660 1.776 3.544 . . . . . A . 16 VAL MG1 . . A . 7 LEU HB3 . . . 16 . HG11 . . . . . 7 . HB2 . . c30496_6e5h 1 132 1 . . 1 1 15 15 GLU HA H . . . 1 1 15 15 GLU H H . . . . . 2.660 1.776 3.544 . . . . . A . 15 GLU HA . . A . 15 GLU H . . . 15 . HA . . . . . 15 . HN . . c30496_6e5h 1 133 1 OR . 1 1 24 24 GLU HA H . . . 1 1 24 24 GLU HG2 H . . . . . 2.662 1.776 3.548 . . . . . A . 24 GLU HA . . A . 24 GLU HG2 . . . 24 . HA . . . . . 24 . HG1 . . c30496_6e5h 1 133 2 OR . 1 1 24 24 GLU HA H . . . 1 1 24 24 GLU HG3 H . . . . . 2.662 1.776 3.548 . . . . . A . 24 GLU HA . . A . 24 GLU HG3 . . . 24 . HA . . . . . 24 . HG2 . . c30496_6e5h 1 134 1 . . 1 1 20 20 DPR HD3 H . . . 1 1 20 20 DPR HG3 H . . . . . 2.664 1.777 3.551 . . . . . A . 20 DPR HD3 . . A . 20 DPR HG3 . . . 20 . HD2 . . . . . 20 . HG2 . . c30496_6e5h 1 135 1 . . 1 1 7 7 LEU MD1 H . . . 1 1 7 7 LEU HB3 H . . . . . 2.664 1.777 3.551 . . . . . A . 7 LEU MD1 . . A . 7 LEU HB3 . . . 7 . HD11 . . . . . 7 . HB2 . . c30496_6e5h 1 136 1 . . 1 1 14 14 CYS HB2 H . . . 1 1 27 27 CYS HA H . . . . . 2.666 1.778 3.554 . . . . . A . 14 CYS HB2 . . A . 27 CYS HA . . . 14 . HB1 . . . . . 27 . HA . . c30496_6e5h 1 137 1 . . 1 1 8 8 LYS HA H . . . 1 1 8 8 LYS H H . . . . . 2.666 1.778 3.554 . . . . . A . 8 LYS HA . . A . 8 LYS H . . . 8 . HA . . . . . 8 . HN . . c30496_6e5h 1 138 1 OR . 1 1 5 5 LYS HA H . . . 1 1 5 5 LYS HD2 H . . . . . 2.666 1.778 3.554 . . . . . A . 5 LYS HA . . A . 5 LYS HD2 . . . 5 . HA . . . . . 5 . HD1 . . c30496_6e5h 1 138 2 OR . 1 1 5 5 LYS HD3 H . . . 1 1 5 5 LYS HA H . . . . . 2.666 1.778 3.554 . . . . . A . 5 LYS HD3 . . A . 5 LYS HA . . . 5 . HD2 . . . . . 5 . HA . . c30496_6e5h 1 139 1 . . 1 1 19 19 ASP HB3 H . . . 1 1 19 19 ASP H H . . . . . 2.666 1.778 3.554 . . . . . A . 19 ASP HB3 . . A . 19 ASP H . . . 19 . HB2 . . . . . 19 . HN . . c30496_6e5h 1 140 1 . . 1 1 16 16 VAL MG1 H . . . 1 1 7 7 LEU MD2 H . . . . . 2.668 1.778 3.558 . . . . . A . 16 VAL MG1 . . A . 7 LEU MD2 . . . 16 . HG11 . . . . . 7 . HD21 . . c30496_6e5h 1 141 1 . . 1 1 4 4 CYS H H . . . 1 1 4 4 CYS HA H . . . . . 2.674 1.780 3.568 . . . . . A . 4 CYS H . . A . 4 CYS HA . . . 4 . HN . . . . . 4 . HA . . c30496_6e5h 1 142 1 . . 1 1 27 27 CYS HB3 H . . . 1 1 27 27 CYS H H . . . . . 2.685 1.784 3.586 . . . . . A . 27 CYS HB3 . . A . 27 CYS H . . . 27 . HB2 . . . . . 27 . HN . . c30496_6e5h 1 143 1 . . 1 1 9 9 LYS H H . . . 1 1 8 8 LYS H H . . . . . 2.687 1.785 3.589 . . . . . A . 9 LYS H . . A . 8 LYS H . . . 9 . HN . . . . . 8 . HN . . c30496_6e5h 1 144 1 . . 1 1 25 25 VAL HA H . . . 1 1 25 25 VAL HB H . . . . . 2.689 1.785 3.593 . . . . . A . 25 VAL HA . . A . 25 VAL HB . . . 25 . HA . . . . . 25 . HB . . c30496_6e5h 1 145 1 OR . 1 1 24 24 GLU H H . . . 1 1 24 24 GLU HB2 H . . . . . 2.691 1.786 3.596 . . . . . A . 24 GLU H . . A . 24 GLU HB2 . . . 24 . HN . . . . . 24 . HB1 . . c30496_6e5h 1 145 2 OR . 1 1 24 24 GLU H H . . . 1 1 24 24 GLU HB3 H . . . . . 2.691 1.786 3.596 . . . . . A . 24 GLU H . . A . 24 GLU HB3 . . . 24 . HN . . . . . 24 . HB2 . . c30496_6e5h 1 146 1 . . 1 1 16 16 VAL H H . . . 1 1 16 16 VAL MG2 H . . . . . 2.691 1.786 3.596 . . . . . A . 16 VAL H . . A . 16 VAL MG2 . . . 16 . HN . . . . . 16 . HG21 . . c30496_6e5h 1 147 1 OR . 1 1 11 11 TYR HE2 H . . . 1 1 7 7 LEU HA H . . . . . 2.691 1.786 3.596 . . . . . A . 11 TYR HE2 . . A . 7 LEU HA . . . 11 . HE2 . . . . . 7 . HA . . c30496_6e5h 1 147 2 OR . 1 1 11 11 TYR HE1 H . . . 1 1 7 7 LEU HA H . . . . . 2.691 1.786 3.596 . . . . . A . 11 TYR HE1 . . A . 7 LEU HA . . . 11 . HE1 . . . . . 7 . HA . . c30496_6e5h 1 148 1 . . 1 1 27 27 CYS H H . . . 1 1 27 27 CYS HA H . . . . . 2.694 1.787 3.601 . . . . . A . 27 CYS H . . A . 27 CYS HA . . . 27 . HN . . . . . 27 . HA . . c30496_6e5h 1 149 1 . . 1 1 22 22 ARG HA H . . . 1 1 22 22 ARG H H . . . . . 2.694 1.787 3.601 . . . . . A . 22 ARG HA . . A . 22 ARG H . . . 22 . HA . . . . . 22 . HN . . c30496_6e5h 1 150 1 OR . 1 1 11 11 TYR HE1 H . . . 1 1 25 25 VAL MG2 H . . . . . 2.696 1.788 3.604 . . . . . A . 11 TYR HE1 . . A . 25 VAL MG2 . . . 11 . HE1 . . . . . 25 . HG21 . . c30496_6e5h 1 150 2 OR . 1 1 11 11 TYR HE2 H . . . 1 1 25 25 VAL MG2 H . . . . . 2.696 1.788 3.604 . . . . . A . 11 TYR HE2 . . A . 25 VAL MG2 . . . 11 . HE2 . . . . . 25 . HG21 . . c30496_6e5h 1 151 1 . . 1 1 24 24 GLU H H . . . 1 1 23 23 TYR HB2 H . . . . . 2.698 1.788 3.608 . . . . . A . 24 GLU H . . A . 23 TYR HB2 . . . 24 . HN . . . . . 23 . HB1 . . c30496_6e5h 1 152 1 . . 1 1 14 14 CYS HA H . . . 1 1 14 14 CYS H H . . . . . 2.702 1.789 3.615 . . . . . A . 14 CYS HA . . A . 14 CYS H . . . 14 . HA . . . . . 14 . HN . . c30496_6e5h 1 153 1 . . 1 1 11 11 TYR HB2 H . . . 1 1 11 11 TYR HA H . . . . . 2.707 1.791 3.623 . . . . . A . 11 TYR HB2 . . A . 11 TYR HA . . . 11 . HB1 . . . . . 11 . HA . . c30496_6e5h 1 154 1 . . 1 1 19 19 ASP HB2 H . . . 1 1 19 19 ASP H H . . . . . 2.709 1.792 3.626 . . . . . A . 19 ASP HB2 . . A . 19 ASP H . . . 19 . HB1 . . . . . 19 . HN . . c30496_6e5h 1 155 1 OR . 1 1 15 15 GLU HB2 H . . . 1 1 26 26 HIS HB2 H . . . . . 2.709 1.792 3.626 . . . . . A . 15 GLU HB2 . . A . 26 HIS HB2 . . . 15 . HB1 . . . . . 26 . HB1 . . c30496_6e5h 1 155 2 OR . 1 1 15 15 GLU HB3 H . . . 1 1 26 26 HIS HB2 H . . . . . 2.709 1.792 3.626 . . . . . A . 15 GLU HB3 . . A . 26 HIS HB2 . . . 15 . HB2 . . . . . 26 . HB1 . . c30496_6e5h 1 156 1 OR . 1 1 23 23 TYR HD2 H . . . 1 1 23 23 TYR HA H . . . . . 2.709 1.792 3.626 . . . . . A . 23 TYR HD2 . . A . 23 TYR HA . . . 23 . HD2 . . . . . 23 . HA . . c30496_6e5h 1 156 2 OR . 1 1 23 23 TYR HD1 H . . . 1 1 23 23 TYR HA H . . . . . 2.709 1.792 3.626 . . . . . A . 23 TYR HD1 . . A . 23 TYR HA . . . 23 . HD1 . . . . . 23 . HA . . c30496_6e5h 1 157 1 . . 1 1 25 25 VAL H H . . . 1 1 25 25 VAL MG2 H . . . . . 2.709 1.792 3.626 . . . . . A . 25 VAL H . . A . 25 VAL MG2 . . . 25 . HN . . . . . 25 . HG21 . . c30496_6e5h 1 158 1 . . 1 1 5 5 LYS H H . . . 1 1 5 5 LYS HA H . . . . . 2.712 1.793 3.631 . . . . . A . 5 LYS H . . A . 5 LYS HA . . . 5 . HN . . . . . 5 . HA . . c30496_6e5h 1 159 1 . . 1 1 25 25 VAL MG2 H . . . 1 1 16 16 VAL MG1 H . . . . . 2.716 1.794 3.638 . . . . . A . 25 VAL MG2 . . A . 16 VAL MG1 . . . 25 . HG21 . . . . . 16 . HG11 . . c30496_6e5h 1 160 1 . . 1 1 26 26 HIS H H . . . 1 1 26 26 HIS HB3 H . . . . . 2.719 1.795 3.643 . . . . . A . 26 HIS H . . A . 26 HIS HB3 . . . 26 . HN . . . . . 26 . HB2 . . c30496_6e5h 1 161 1 . . 1 1 16 16 VAL MG1 H . . . 1 1 7 7 LEU HB2 H . . . . . 2.719 1.795 3.643 . . . . . A . 16 VAL MG1 . . A . 7 LEU HB2 . . . 16 . HG11 . . . . . 7 . HB1 . . c30496_6e5h 1 162 1 . . 1 1 17 17 ARG H H . . . 1 1 16 16 VAL HB H . . . . . 2.730 1.798 3.662 . . . . . A . 17 ARG H . . A . 16 VAL HB . . . 17 . HN . . . . . 16 . HB . . c30496_6e5h 1 163 1 . . 1 1 3 3 LYS H H . . . 1 1 3 3 LYS HA H . . . . . 2.730 1.798 3.662 . . . . . A . 3 LYS H . . A . 3 LYS HA . . . 3 . HN . . . . . 3 . HA . . c30496_6e5h 1 164 1 . . 1 1 26 26 HIS H H . . . 1 1 26 26 HIS HA H . . . . . 2.735 1.800 3.670 . . . . . A . 26 HIS H . . A . 26 HIS HA . . . 26 . HN . . . . . 26 . HA . . c30496_6e5h 1 165 1 . . 1 1 16 16 VAL MG2 H . . . 1 1 7 7 LEU HB2 H . . . . . 2.735 1.800 3.670 . . . . . A . 16 VAL MG2 . . A . 7 LEU HB2 . . . 16 . HG21 . . . . . 7 . HB1 . . c30496_6e5h 1 166 1 OR . 1 1 8 8 LYS HA H . . . 1 1 8 8 LYS HD2 H . . . . . 2.735 1.800 3.670 . . . . . A . 8 LYS HA . . A . 8 LYS HD2 . . . 8 . HA . . . . . 8 . HD1 . . c30496_6e5h 1 166 2 OR . 1 1 8 8 LYS HA H . . . 1 1 8 8 LYS HD3 H . . . . . 2.735 1.800 3.670 . . . . . A . 8 LYS HA . . A . 8 LYS HD3 . . . 8 . HA . . . . . 8 . HD2 . . c30496_6e5h 1 167 1 . . 1 1 17 17 ARG HA H . . . 1 1 17 17 ARG HG3 H . . . . . 2.735 1.800 3.670 . . . . . A . 17 ARG HA . . A . 17 ARG HG3 . . . 17 . HA . . . . . 17 . HG2 . . c30496_6e5h 1 168 1 OR . 1 1 15 15 GLU HB2 H . . . 1 1 26 26 HIS HB3 H . . . . . 2.745 1.803 3.687 . . . . . A . 15 GLU HB2 . . A . 26 HIS HB3 . . . 15 . HB1 . . . . . 26 . HB2 . . c30496_6e5h 1 168 2 OR . 1 1 15 15 GLU HB3 H . . . 1 1 26 26 HIS HB3 H . . . . . 2.745 1.803 3.687 . . . . . A . 15 GLU HB3 . . A . 26 HIS HB3 . . . 15 . HB2 . . . . . 26 . HB2 . . c30496_6e5h 1 169 1 OR . 1 1 23 23 TYR HD2 H . . . 1 1 23 23 TYR H H . . . . . 2.745 1.803 3.687 . . . . . A . 23 TYR HD2 . . A . 23 TYR H . . . 23 . HD2 . . . . . 23 . HN . . c30496_6e5h 1 169 2 OR . 1 1 23 23 TYR HD1 H . . . 1 1 23 23 TYR H H . . . . . 2.745 1.803 3.687 . . . . . A . 23 TYR HD1 . . A . 23 TYR H . . . 23 . HD1 . . . . . 23 . HN . . c30496_6e5h 1 170 1 . . 1 1 17 17 ARG HA H . . . 1 1 17 17 ARG HG2 H . . . . . 2.750 1.804 3.696 . . . . . A . 17 ARG HA . . A . 17 ARG HG2 . . . 17 . HA . . . . . 17 . HG1 . . c30496_6e5h 1 171 1 . . 1 1 23 23 TYR H H . . . 1 1 23 23 TYR HB2 H . . . . . 2.753 1.806 3.700 . . . . . A . 23 TYR H . . A . 23 TYR HB2 . . . 23 . HN . . . . . 23 . HB1 . . c30496_6e5h 1 172 1 . . 1 1 9 9 LYS HA H . . . 1 1 9 9 LYS H H . . . . . 2.753 1.806 3.700 . . . . . A . 9 LYS HA . . A . 9 LYS H . . . 9 . HA . . . . . 9 . HN . . c30496_6e5h 1 173 1 . . 1 1 11 11 TYR HA H . . . 1 1 11 11 TYR H H . . . . . 2.753 1.806 3.700 . . . . . A . 11 TYR HA . . A . 11 TYR H . . . 11 . HA . . . . . 11 . HN . . c30496_6e5h 1 174 1 . . 1 1 27 27 CYS HB2 H . . . 1 1 27 27 CYS HA H . . . . . 2.755 1.806 3.704 . . . . . A . 27 CYS HB2 . . A . 27 CYS HA . . . 27 . HB1 . . . . . 27 . HA . . c30496_6e5h 1 175 1 . . 1 1 11 11 TYR H H . . . 1 1 10 10 ARG HB3 H . . . . . 2.755 1.806 3.704 . . . . . A . 11 TYR H . . A . 10 ARG HB3 . . . 11 . HN . . . . . 10 . HB2 . . c30496_6e5h 1 176 1 OR . 1 1 22 22 ARG H H . . . 1 1 22 22 ARG HG2 H . . . . . 2.761 1.808 3.714 . . . . . A . 22 ARG H . . A . 22 ARG HG2 . . . 22 . HN . . . . . 22 . HG1 . . c30496_6e5h 1 176 2 OR . 1 1 22 22 ARG H H . . . 1 1 22 22 ARG HG3 H . . . . . 2.761 1.808 3.714 . . . . . A . 22 ARG H . . A . 22 ARG HG3 . . . 22 . HN . . . . . 22 . HG2 . . c30496_6e5h 1 177 1 . . 1 1 5 5 LYS HA H . . . 1 1 5 5 LYS HG2 H . . . . . 2.763 1.809 3.717 . . . . . A . 5 LYS HA . . A . 5 LYS HG2 . . . 5 . HA . . . . . 5 . HG1 . . c30496_6e5h 1 178 1 OR . 1 1 4 4 CYS H H . . . 1 1 3 3 LYS HB2 H . . . . . 2.769 1.811 3.727 . . . . . A . 4 CYS H . . A . 3 LYS HB2 . . . 4 . HN . . . . . 3 . HB1 . . c30496_6e5h 1 178 2 OR . 1 1 4 4 CYS H H . . . 1 1 3 3 LYS HB3 H . . . . . 2.769 1.811 3.727 . . . . . A . 4 CYS H . . A . 3 LYS HB3 . . . 4 . HN . . . . . 3 . HB2 . . c30496_6e5h 1 179 1 . . 1 1 18 18 CYS HB2 H . . . 1 1 19 19 ASP H H . . . . . 2.769 1.811 3.727 . . . . . A . 18 CYS HB2 . . A . 19 ASP H . . . 18 . HB1 . . . . . 19 . HN . . c30496_6e5h 1 180 1 . . 1 1 1 1 ASN HA H . . . 1 1 2 2 ASP H H . . . . . 2.782 1.814 3.750 . . . . . A . 1 ASN HA . . A . 2 ASP H . . . 1 . HA . . . . . 2 . HN . . c30496_6e5h 1 181 1 . . 1 1 21 21 PRO HD2 H . . . 1 1 21 21 PRO HB3 H . . . . . 2.785 1.816 3.754 . . . . . A . 21 PRO HD2 . . A . 21 PRO HB3 . . . 21 . HD1 . . . . . 21 . HB2 . . c30496_6e5h 1 182 1 . . 1 1 16 16 VAL H H . . . 1 1 16 16 VAL HA H . . . . . 2.788 1.817 3.759 . . . . . A . 16 VAL H . . A . 16 VAL HA . . . 16 . HN . . . . . 16 . HA . . c30496_6e5h 1 183 1 OR . 1 1 11 11 TYR HD1 H . . . 1 1 16 16 VAL MG2 H . . . . . 2.790 1.817 3.763 . . . . . A . 11 TYR HD1 . . A . 16 VAL MG2 . . . 11 . HD1 . . . . . 16 . HG21 . . c30496_6e5h 1 183 2 OR . 1 1 11 11 TYR HD2 H . . . 1 1 16 16 VAL MG2 H . . . . . 2.790 1.817 3.763 . . . . . A . 11 TYR HD2 . . A . 16 VAL MG2 . . . 11 . HD2 . . . . . 16 . HG21 . . c30496_6e5h 1 184 1 . . 1 1 21 21 PRO HD3 H . . . 1 1 22 22 ARG H H . . . . . 2.799 1.820 3.778 . . . . . A . 21 PRO HD3 . . A . 22 ARG H . . . 21 . HD2 . . . . . 22 . HN . . c30496_6e5h 1 185 1 . . 1 1 23 23 TYR H H . . . 1 1 23 23 TYR HA H . . . . . 2.799 1.820 3.778 . . . . . A . 23 TYR H . . A . 23 TYR HA . . . 23 . HN . . . . . 23 . HA . . c30496_6e5h 1 186 1 . . 1 1 23 23 TYR HB3 H . . . 1 1 7 7 LEU MD1 H . . . . . 2.805 1.822 3.788 . . . . . A . 23 TYR HB3 . . A . 7 LEU MD1 . . . 23 . HB2 . . . . . 7 . HD11 . . c30496_6e5h 1 187 1 . . 1 1 7 7 LEU H H . . . 1 1 7 7 LEU HB2 H . . . . . 2.817 1.825 3.809 . . . . . A . 7 LEU H . . A . 7 LEU HB2 . . . 7 . HN . . . . . 7 . HB1 . . c30496_6e5h 1 188 1 . . 1 1 16 16 VAL HA H . . . 1 1 16 16 VAL HB H . . . . . 2.823 1.827 3.819 . . . . . A . 16 VAL HA . . A . 16 VAL HB . . . 16 . HA . . . . . 16 . HB . . c30496_6e5h 1 189 1 OR . 1 1 11 11 TYR HD2 H . . . 1 1 7 7 LEU HA H . . . . . 2.823 1.827 3.819 . . . . . A . 11 TYR HD2 . . A . 7 LEU HA . . . 11 . HD2 . . . . . 7 . HA . . c30496_6e5h 1 189 2 OR . 1 1 11 11 TYR HD1 H . . . 1 1 7 7 LEU HA H . . . . . 2.823 1.827 3.819 . . . . . A . 11 TYR HD1 . . A . 7 LEU HA . . . 11 . HD1 . . . . . 7 . HA . . c30496_6e5h 1 190 1 . . 1 1 26 26 HIS HB2 H . . . 1 1 26 26 HIS HD2 H . . . . . 2.826 1.828 3.824 . . . . . A . 26 HIS HB2 . . A . 26 HIS HD2 . . . 26 . HB1 . . . . . 26 . HD2 . . c30496_6e5h 1 191 1 OR . 1 1 23 23 TYR HD1 H . . . 1 1 7 7 LEU MD1 H . . . . . 2.832 1.829 3.835 . . . . . A . 23 TYR HD1 . . A . 7 LEU MD1 . . . 23 . HD1 . . . . . 7 . HD11 . . c30496_6e5h 1 191 2 OR . 1 1 23 23 TYR HD2 H . . . 1 1 7 7 LEU MD1 H . . . . . 2.832 1.829 3.835 . . . . . A . 23 TYR HD2 . . A . 7 LEU MD1 . . . 23 . HD2 . . . . . 7 . HD11 . . c30496_6e5h 1 192 1 . . 1 1 26 26 HIS H H . . . 1 1 25 25 VAL MG1 H . . . . . 2.835 1.830 3.840 . . . . . A . 26 HIS H . . A . 25 VAL MG1 . . . 26 . HN . . . . . 25 . HG11 . . c30496_6e5h 1 193 1 . . 1 1 14 14 CYS H H . . . 1 1 13 13 GLY HA3 H . . . . . 2.838 1.831 3.845 . . . . . A . 14 CYS H . . A . 13 GLY HA3 . . . 14 . HN . . . . . 13 . HA2 . . c30496_6e5h 1 194 1 . . 1 1 16 16 VAL MG2 H . . . 1 1 25 25 VAL MG1 H . . . . . 2.841 1.832 3.850 . . . . . A . 16 VAL MG2 . . A . 25 VAL MG1 . . . 16 . HG21 . . . . . 25 . HG11 . . c30496_6e5h 1 195 1 OR . 1 1 18 18 CYS HB3 H . . . 1 1 4 4 CYS HB2 H . . . . . 2.845 1.833 3.857 . . . . . A . 18 CYS HB3 . . A . 4 CYS HB2 . . . 18 . HB2 . . . . . 4 . HB1 . . c30496_6e5h 1 195 2 OR . 1 1 18 18 CYS HB3 H . . . 1 1 4 4 CYS HB3 H . . . . . 2.845 1.833 3.857 . . . . . A . 18 CYS HB3 . . A . 4 CYS HB3 . . . 18 . HB2 . . . . . 4 . HB2 . . c30496_6e5h 1 196 1 OR . 1 1 16 16 VAL H H . . . 1 1 15 15 GLU HB2 H . . . . . 2.861 1.838 3.884 . . . . . A . 16 VAL H . . A . 15 GLU HB2 . . . 16 . HN . . . . . 15 . HB1 . . c30496_6e5h 1 196 2 OR . 1 1 16 16 VAL H H . . . 1 1 15 15 GLU HB3 H . . . . . 2.861 1.838 3.884 . . . . . A . 16 VAL H . . A . 15 GLU HB3 . . . 16 . HN . . . . . 15 . HB2 . . c30496_6e5h 1 197 1 . . 1 1 23 23 TYR HA H . . . 1 1 19 19 ASP H H . . . . . 2.868 1.840 3.896 . . . . . A . 23 TYR HA . . A . 19 ASP H . . . 23 . HA . . . . . 19 . HN . . c30496_6e5h 1 198 1 . . 1 1 24 24 GLU H H . . . 1 1 23 23 TYR HB3 H . . . . . 2.871 1.840 3.902 . . . . . A . 24 GLU H . . A . 23 TYR HB3 . . . 24 . HN . . . . . 23 . HB2 . . c30496_6e5h 1 199 1 OR . 1 1 11 11 TYR HE2 H . . . 1 1 10 10 ARG HD2 H . . . . . 2.871 1.840 3.902 . . . . . A . 11 TYR HE2 . . A . 10 ARG HD2 . . . 11 . HE2 . . . . . 10 . HD1 . . c30496_6e5h 1 199 2 OR . 1 1 11 11 TYR HE1 H . . . 1 1 10 10 ARG HD2 H . . . . . 2.871 1.840 3.902 . . . . . A . 11 TYR HE1 . . A . 10 ARG HD2 . . . 11 . HE1 . . . . . 10 . HD1 . . c30496_6e5h 1 200 1 OR . 1 1 11 11 TYR HD2 H . . . 1 1 10 10 ARG HB2 H . . . . . 2.878 1.842 3.914 . . . . . A . 11 TYR HD2 . . A . 10 ARG HB2 . . . 11 . HD2 . . . . . 10 . HB1 . . c30496_6e5h 1 200 2 OR . 1 1 11 11 TYR HD1 H . . . 1 1 10 10 ARG HB2 H . . . . . 2.878 1.842 3.914 . . . . . A . 11 TYR HD1 . . A . 10 ARG HB2 . . . 11 . HD1 . . . . . 10 . HB1 . . c30496_6e5h 1 201 1 OR . 1 1 11 11 TYR HD1 H . . . 1 1 25 25 VAL MG1 H . . . . . 2.878 1.842 3.914 . . . . . A . 11 TYR HD1 . . A . 25 VAL MG1 . . . 11 . HD1 . . . . . 25 . HG11 . . c30496_6e5h 1 201 2 OR . 1 1 11 11 TYR HD2 H . . . 1 1 25 25 VAL MG1 H . . . . . 2.878 1.842 3.914 . . . . . A . 11 TYR HD2 . . A . 25 VAL MG1 . . . 11 . HD2 . . . . . 25 . HG11 . . c30496_6e5h 1 202 1 . . 1 1 24 24 GLU HA H . . . 1 1 24 24 GLU H H . . . . . 2.896 1.848 3.944 . . . . . A . 24 GLU HA . . A . 24 GLU H . . . 24 . HA . . . . . 24 . HN . . c30496_6e5h 1 203 1 . . 1 1 4 4 CYS H H . . . 1 1 3 3 LYS HA H . . . . . 2.896 1.848 3.944 . . . . . A . 4 CYS H . . A . 3 LYS HA . . . 4 . HN . . . . . 3 . HA . . c30496_6e5h 1 204 1 . . 1 1 18 18 CYS HB3 H . . . 1 1 18 18 CYS H H . . . . . 2.896 1.848 3.944 . . . . . A . 18 CYS HB3 . . A . 18 CYS H . . . 18 . HB2 . . . . . 18 . HN . . c30496_6e5h 1 205 1 OR . 1 1 23 23 TYR HE2 H . . . 1 1 7 7 LEU MD1 H . . . . . 2.896 1.848 3.944 . . . . . A . 23 TYR HE2 . . A . 7 LEU MD1 . . . 23 . HE2 . . . . . 7 . HD11 . . c30496_6e5h 1 205 2 OR . 1 1 23 23 TYR HE1 H . . . 1 1 7 7 LEU MD1 H . . . . . 2.896 1.848 3.944 . . . . . A . 23 TYR HE1 . . A . 7 LEU MD1 . . . 23 . HE1 . . . . . 7 . HD11 . . c30496_6e5h 1 206 1 . . 1 1 20 20 DPR HA H . . . 1 1 20 20 DPR HG3 H . . . . . 2.896 1.848 3.944 . . . . . A . 20 DPR HA . . A . 20 DPR HG3 . . . 20 . HA . . . . . 20 . HG2 . . c30496_6e5h 1 207 1 . . 1 1 6 6 GLU HG2 H . . . 1 1 6 6 GLU HA H . . . . . 2.900 1.849 3.951 . . . . . A . 6 GLU HG2 . . A . 6 GLU HA . . . 6 . HG1 . . . . . 6 . HA . . c30496_6e5h 1 208 1 OR . 1 1 1 1 ASN HD22 H . . . 1 1 1 1 ASN HB2 H . . . . . 2.900 1.849 3.951 . . . . . A . 1 ASN HD22 . . A . 1 ASN HB2 . . . 1 . HD22 . . . . . 1 . HB1 . . c30496_6e5h 1 208 2 OR . 1 1 1 1 ASN HD22 H . . . 1 1 1 1 ASN HB3 H . . . . . 2.900 1.849 3.951 . . . . . A . 1 ASN HD22 . . A . 1 ASN HB3 . . . 1 . HD22 . . . . . 1 . HB2 . . c30496_6e5h 1 209 1 OR . 1 1 11 11 TYR HD2 H . . . 1 1 25 25 VAL MG2 H . . . . . 2.904 1.850 3.958 . . . . . A . 11 TYR HD2 . . A . 25 VAL MG2 . . . 11 . HD2 . . . . . 25 . HG21 . . c30496_6e5h 1 209 2 OR . 1 1 11 11 TYR HD1 H . . . 1 1 25 25 VAL MG2 H . . . . . 2.904 1.850 3.958 . . . . . A . 11 TYR HD1 . . A . 25 VAL MG2 . . . 11 . HD1 . . . . . 25 . HG21 . . c30496_6e5h 1 210 1 OR . 1 1 11 11 TYR HD2 H . . . 1 1 7 7 LEU HB2 H . . . . . 2.904 1.850 3.958 . . . . . A . 11 TYR HD2 . . A . 7 LEU HB2 . . . 11 . HD2 . . . . . 7 . HB1 . . c30496_6e5h 1 210 2 OR . 1 1 11 11 TYR HD1 H . . . 1 1 7 7 LEU HB2 H . . . . . 2.904 1.850 3.958 . . . . . A . 11 TYR HD1 . . A . 7 LEU HB2 . . . 11 . HD1 . . . . . 7 . HB1 . . c30496_6e5h 1 211 1 . . 1 1 11 11 TYR HB3 H . . . 1 1 16 16 VAL MG2 H . . . . . 2.907 1.850 3.964 . . . . . A . 11 TYR HB3 . . A . 16 VAL MG2 . . . 11 . HB2 . . . . . 16 . HG21 . . c30496_6e5h 1 212 1 OR . 1 1 17 17 ARG HE H . . . 1 1 17 17 ARG HD2 H . . . . . 2.911 1.852 3.970 . . . . . A . 17 ARG HE . . A . 17 ARG HD2 . . . 17 . HE . . . . . 17 . HD1 . . c30496_6e5h 1 212 2 OR . 1 1 17 17 ARG HD3 H . . . 1 1 17 17 ARG HE H . . . . . 2.911 1.852 3.970 . . . . . A . 17 ARG HD3 . . A . 17 ARG HE . . . 17 . HD2 . . . . . 17 . HE . . c30496_6e5h 1 213 1 . . 1 1 13 13 GLY HA2 H . . . 1 1 14 14 CYS H H . . . . . 2.915 1.853 3.977 . . . . . A . 13 GLY HA2 . . A . 14 CYS H . . . 13 . HA1 . . . . . 14 . HN . . c30496_6e5h 1 214 1 . . 1 1 20 20 DPR HB2 H . . . 1 1 20 20 DPR HD2 H . . . . . 2.915 1.853 3.977 . . . . . A . 20 DPR HB2 . . A . 20 DPR HD2 . . . 20 . HB1 . . . . . 20 . HD1 . . c30496_6e5h 1 215 1 . . 1 1 18 18 CYS HB3 H . . . 1 1 20 20 DPR HD2 H . . . . . 2.919 1.854 3.984 . . . . . A . 18 CYS HB3 . . A . 20 DPR HD2 . . . 18 . HB2 . . . . . 20 . HD1 . . c30496_6e5h 1 216 1 . . 1 1 22 22 ARG H H . . . 1 1 19 19 ASP H H . . . . . 2.927 1.856 3.998 . . . . . A . 22 ARG H . . A . 19 ASP H . . . 22 . HN . . . . . 19 . HN . . c30496_6e5h 1 217 1 . . 1 1 20 20 DPR HB3 H . . . 1 1 21 21 PRO HD2 H . . . . . 2.930 1.857 4.003 . . . . . A . 20 DPR HB3 . . A . 21 PRO HD2 . . . 20 . HB2 . . . . . 21 . HD1 . . c30496_6e5h 1 218 1 OR . 1 1 26 26 HIS H H . . . 1 1 15 15 GLU HB2 H . . . . . 2.930 1.857 4.003 . . . . . A . 26 HIS H . . A . 15 GLU HB2 . . . 26 . HN . . . . . 15 . HB1 . . c30496_6e5h 1 218 2 OR . 1 1 26 26 HIS H H . . . 1 1 15 15 GLU HB3 H . . . . . 2.930 1.857 4.003 . . . . . A . 26 HIS H . . A . 15 GLU HB3 . . . 26 . HN . . . . . 15 . HB2 . . c30496_6e5h 1 219 1 . . 1 1 5 5 LYS H H . . . 1 1 4 4 CYS HA H . . . . . 2.934 1.858 4.010 . . . . . A . 5 LYS H . . A . 4 CYS HA . . . 5 . HN . . . . . 4 . HA . . c30496_6e5h 1 220 1 . . 1 1 26 26 HIS H H . . . 1 1 15 15 GLU H H . . . . . 2.943 1.861 4.025 . . . . . A . 26 HIS H . . A . 15 GLU H . . . 26 . HN . . . . . 15 . HN . . c30496_6e5h 1 221 1 OR . 1 1 23 23 TYR HE2 H . . . 1 1 4 4 CYS HA H . . . . . 2.943 1.861 4.025 . . . . . A . 23 TYR HE2 . . A . 4 CYS HA . . . 23 . HE2 . . . . . 4 . HA . . c30496_6e5h 1 221 2 OR . 1 1 23 23 TYR HE1 H . . . 1 1 4 4 CYS HA H . . . . . 2.943 1.861 4.025 . . . . . A . 23 TYR HE1 . . A . 4 CYS HA . . . 23 . HE1 . . . . . 4 . HA . . c30496_6e5h 1 222 1 . . 1 1 14 14 CYS HB3 H . . . 1 1 15 15 GLU H H . . . . . 2.943 1.861 4.025 . . . . . A . 14 CYS HB3 . . A . 15 GLU H . . . 14 . HB2 . . . . . 15 . HN . . c30496_6e5h 1 223 1 . . 1 1 10 10 ARG HD2 H . . . 1 1 10 10 ARG HE H . . . . . 2.947 1.862 4.032 . . . . . A . 10 ARG HD2 . . A . 10 ARG HE . . . 10 . HD1 . . . . . 10 . HE . . c30496_6e5h 1 224 1 OR . 1 1 1 1 ASN HB2 H . . . 1 1 2 2 ASP H H . . . . . 2.947 1.862 4.032 . . . . . A . 1 ASN HB2 . . A . 2 ASP H . . . 1 . HB1 . . . . . 2 . HN . . c30496_6e5h 1 224 2 OR . 1 1 1 1 ASN HB3 H . . . 1 1 2 2 ASP H H . . . . . 2.947 1.862 4.032 . . . . . A . 1 ASN HB3 . . A . 2 ASP H . . . 1 . HB2 . . . . . 2 . HN . . c30496_6e5h 1 225 1 OR . 1 1 23 23 TYR HD2 H . . . 1 1 16 16 VAL MG1 H . . . . . 2.959 1.864 4.054 . . . . . A . 23 TYR HD2 . . A . 16 VAL MG1 . . . 23 . HD2 . . . . . 16 . HG11 . . c30496_6e5h 1 225 2 OR . 1 1 23 23 TYR HD1 H . . . 1 1 16 16 VAL MG1 H . . . . . 2.959 1.864 4.054 . . . . . A . 23 TYR HD1 . . A . 16 VAL MG1 . . . 23 . HD1 . . . . . 16 . HG11 . . c30496_6e5h 1 226 1 . . 1 1 10 10 ARG H H . . . 1 1 9 9 LYS HA H . . . . . 2.959 1.864 4.054 . . . . . A . 10 ARG H . . A . 9 LYS HA . . . 10 . HN . . . . . 9 . HA . . c30496_6e5h 1 227 1 . . 1 1 14 14 CYS HB3 H . . . 1 1 25 25 VAL MG1 H . . . . . 2.964 1.866 4.062 . . . . . A . 14 CYS HB3 . . A . 25 VAL MG1 . . . 14 . HB2 . . . . . 25 . HG11 . . c30496_6e5h 1 228 1 . . 1 1 7 7 LEU HA H . . . 1 1 10 10 ARG HB2 H . . . . . 2.964 1.866 4.062 . . . . . A . 7 LEU HA . . A . 10 ARG HB2 . . . 7 . HA . . . . . 10 . HB1 . . c30496_6e5h 1 229 1 . . 1 1 16 16 VAL MG1 H . . . 1 1 7 7 LEU MD1 H . . . . . 2.964 1.866 4.062 . . . . . A . 16 VAL MG1 . . A . 7 LEU MD1 . . . 16 . HG11 . . . . . 7 . HD11 . . c30496_6e5h 1 230 1 . . 1 1 7 7 LEU HG H . . . 1 1 16 16 VAL MG1 H . . . . . 2.968 1.867 4.069 . . . . . A . 7 LEU HG . . A . 16 VAL MG1 . . . 7 . HG . . . . . 16 . HG11 . . c30496_6e5h 1 231 1 OR . 1 1 23 23 TYR HE2 H . . . 1 1 18 18 CYS HB3 H . . . . . 2.972 1.868 4.076 . . . . . A . 23 TYR HE2 . . A . 18 CYS HB3 . . . 23 . HE2 . . . . . 18 . HB2 . . c30496_6e5h 1 231 2 OR . 1 1 23 23 TYR HE1 H . . . 1 1 18 18 CYS HB3 H . . . . . 2.972 1.868 4.076 . . . . . A . 23 TYR HE1 . . A . 18 CYS HB3 . . . 23 . HE1 . . . . . 18 . HB2 . . c30496_6e5h 1 232 1 . . 1 1 7 7 LEU HB2 H . . . 1 1 8 8 LYS H H . . . . . 2.972 1.868 4.076 . . . . . A . 7 LEU HB2 . . A . 8 LYS H . . . 7 . HB1 . . . . . 8 . HN . . c30496_6e5h 1 233 1 . . 1 1 16 16 VAL HB H . . . 1 1 8 8 LYS HA H . . . . . 2.981 1.870 4.092 . . . . . A . 16 VAL HB . . A . 8 LYS HA . . . 16 . HB . . . . . 8 . HA . . c30496_6e5h 1 234 1 . . 1 1 26 26 HIS H H . . . 1 1 16 16 VAL HA H . . . . . 2.981 1.870 4.092 . . . . . A . 26 HIS H . . A . 16 VAL HA . . . 26 . HN . . . . . 16 . HA . . c30496_6e5h 1 235 1 OR . 1 1 11 11 TYR HD1 H . . . 1 1 7 7 LEU MD2 H . . . . . 2.981 1.870 4.092 . . . . . A . 11 TYR HD1 . . A . 7 LEU MD2 . . . 11 . HD1 . . . . . 7 . HD21 . . c30496_6e5h 1 235 2 OR . 1 1 11 11 TYR HD2 H . . . 1 1 7 7 LEU MD2 H . . . . . 2.981 1.870 4.092 . . . . . A . 11 TYR HD2 . . A . 7 LEU MD2 . . . 11 . HD2 . . . . . 7 . HD21 . . c30496_6e5h 1 236 1 . . 1 1 2 2 ASP HB2 H . . . 1 1 2 2 ASP H H . . . . . 2.981 1.870 4.092 . . . . . A . 2 ASP HB2 . . A . 2 ASP H . . . 2 . HB1 . . . . . 2 . HN . . c30496_6e5h 1 237 1 . . 1 1 11 11 TYR HB3 H . . . 1 1 11 11 TYR H H . . . . . 2.986 1.872 4.100 . . . . . A . 11 TYR HB3 . . A . 11 TYR H . . . 11 . HB2 . . . . . 11 . HN . . c30496_6e5h 1 238 1 . . 1 1 6 6 GLU H H . . . 1 1 5 5 LYS HA H . . . . . 2.986 1.872 4.100 . . . . . A . 6 GLU H . . A . 5 LYS HA . . . 6 . HN . . . . . 5 . HA . . c30496_6e5h 1 239 1 . . 1 1 5 5 LYS H H . . . 1 1 5 5 LYS HG3 H . . . . . 2.990 1.872 4.108 . . . . . A . 5 LYS H . . A . 5 LYS HG3 . . . 5 . HN . . . . . 5 . HG2 . . c30496_6e5h 1 240 1 . . 1 1 4 4 CYS HA H . . . 1 1 7 7 LEU MD1 H . . . . . 2.990 1.872 4.108 . . . . . A . 4 CYS HA . . A . 7 LEU MD1 . . . 4 . HA . . . . . 7 . HD11 . . c30496_6e5h 1 241 1 . . 1 1 6 6 GLU H H . . . 1 1 6 6 GLU HG3 H . . . . . 2.990 1.872 4.108 . . . . . A . 6 GLU H . . A . 6 GLU HG3 . . . 6 . HN . . . . . 6 . HG2 . . c30496_6e5h 1 242 1 . . 1 1 14 14 CYS HB3 H . . . 1 1 16 16 VAL MG2 H . . . . . 2.990 1.872 4.108 . . . . . A . 14 CYS HB3 . . A . 16 VAL MG2 . . . 14 . HB2 . . . . . 16 . HG21 . . c30496_6e5h 1 243 1 . . 1 1 22 22 ARG H H . . . 1 1 21 21 PRO HA H . . . . . 2.995 1.874 4.116 . . . . . A . 22 ARG H . . A . 21 PRO HA . . . 22 . HN . . . . . 21 . HA . . c30496_6e5h 1 244 1 . . 1 1 15 15 GLU H H . . . 1 1 27 27 CYS HA H . . . . . 2.999 1.874 4.124 . . . . . A . 15 GLU H . . A . 27 CYS HA . . . 15 . HN . . . . . 27 . HA . . c30496_6e5h 1 245 1 . . 1 1 23 23 TYR H H . . . 1 1 23 23 TYR HB3 H . . . . . 3.004 1.876 4.132 . . . . . A . 23 TYR H . . A . 23 TYR HB3 . . . 23 . HN . . . . . 23 . HB2 . . c30496_6e5h 1 246 1 . . 1 1 25 25 VAL HA H . . . 1 1 17 17 ARG H H . . . . . 3.014 1.879 4.149 . . . . . A . 25 VAL HA . . A . 17 ARG H . . . 25 . HA . . . . . 17 . HN . . c30496_6e5h 1 247 1 . . 1 1 2 2 ASP HB3 H . . . 1 1 2 2 ASP H H . . . . . 3.018 1.879 4.157 . . . . . A . 2 ASP HB3 . . A . 2 ASP H . . . 2 . HB2 . . . . . 2 . HN . . c30496_6e5h 1 248 1 . . 1 1 18 18 CYS HB3 H . . . 1 1 19 19 ASP H H . . . . . 3.023 1.880 4.166 . . . . . A . 18 CYS HB3 . . A . 19 ASP H . . . 18 . HB2 . . . . . 19 . HN . . c30496_6e5h 1 249 1 . . 1 1 6 6 GLU H H . . . 1 1 6 6 GLU HG2 H . . . . . 3.033 1.883 4.183 . . . . . A . 6 GLU H . . A . 6 GLU HG2 . . . 6 . HN . . . . . 6 . HG1 . . c30496_6e5h 1 250 1 . . 1 1 4 4 CYS HA H . . . 1 1 7 7 LEU HB3 H . . . . . 3.033 1.883 4.183 . . . . . A . 4 CYS HA . . A . 7 LEU HB3 . . . 4 . HA . . . . . 7 . HB2 . . c30496_6e5h 1 251 1 OR . 1 1 24 24 GLU H H . . . 1 1 24 24 GLU HG2 H . . . . . 3.034 1.883 4.185 . . . . . A . 24 GLU H . . A . 24 GLU HG2 . . . 24 . HN . . . . . 24 . HG1 . . c30496_6e5h 1 251 2 OR . 1 1 24 24 GLU H H . . . 1 1 24 24 GLU HG3 H . . . . . 3.034 1.883 4.185 . . . . . A . 24 GLU H . . A . 24 GLU HG3 . . . 24 . HN . . . . . 24 . HG2 . . c30496_6e5h 1 252 1 OR . 1 1 16 16 VAL MG2 H . . . 1 1 8 8 LYS HG2 H . . . . . 3.036 1.884 4.188 . . . . . A . 16 VAL MG2 . . A . 8 LYS HG2 . . . 16 . HG21 . . . . . 8 . HG1 . . c30496_6e5h 1 252 2 OR . 1 1 16 16 VAL MG2 H . . . 1 1 8 8 LYS HG3 H . . . . . 3.036 1.884 4.188 . . . . . A . 16 VAL MG2 . . A . 8 LYS HG3 . . . 16 . HG21 . . . . . 8 . HG2 . . c30496_6e5h 1 253 1 . . 1 1 17 17 ARG H H . . . 1 1 16 16 VAL MG2 H . . . . . 3.036 1.884 4.188 . . . . . A . 17 ARG H . . A . 16 VAL MG2 . . . 17 . HN . . . . . 16 . HG21 . . c30496_6e5h 1 254 1 . . 1 1 24 24 GLU H H . . . 1 1 17 17 ARG HB2 H . . . . . 3.038 1.884 4.192 . . . . . A . 24 GLU H . . A . 17 ARG HB2 . . . 24 . HN . . . . . 17 . HB1 . . c30496_6e5h 1 255 1 . . 1 1 9 9 LYS HA H . . . 1 1 9 9 LYS HG3 H . . . . . 3.039 1.885 4.193 . . . . . A . 9 LYS HA . . A . 9 LYS HG3 . . . 9 . HA . . . . . 9 . HG2 . . c30496_6e5h 1 256 1 . . 1 1 11 11 TYR HB3 H . . . 1 1 14 14 CYS H H . . . . . 3.045 1.886 4.204 . . . . . A . 11 TYR HB3 . . A . 14 CYS H . . . 11 . HB2 . . . . . 14 . HN . . c30496_6e5h 1 257 1 . . 1 1 25 25 VAL HA H . . . 1 1 16 16 VAL MG1 H . . . . . 3.047 1.887 4.207 . . . . . A . 25 VAL HA . . A . 16 VAL MG1 . . . 25 . HA . . . . . 16 . HG11 . . c30496_6e5h 1 258 1 . . 1 1 25 25 VAL MG1 H . . . 1 1 16 16 VAL MG1 H . . . . . 3.047 1.886 4.208 . . . . . A . 25 VAL MG1 . . A . 16 VAL MG1 . . . 25 . HG11 . . . . . 16 . HG11 . . c30496_6e5h 1 259 1 OR . 1 1 21 21 PRO HD3 H . . . 1 1 22 22 ARG HG2 H . . . . . 3.073 1.893 4.253 . . . . . A . 21 PRO HD3 . . A . 22 ARG HG2 . . . 21 . HD2 . . . . . 22 . HG1 . . c30496_6e5h 1 259 2 OR . 1 1 21 21 PRO HD3 H . . . 1 1 22 22 ARG HG3 H . . . . . 3.073 1.893 4.253 . . . . . A . 21 PRO HD3 . . A . 22 ARG HG3 . . . 21 . HD2 . . . . . 22 . HG2 . . c30496_6e5h 1 260 1 . . 1 1 20 20 DPR HB3 H . . . 1 1 20 20 DPR HD3 H . . . . . 3.074 1.893 4.255 . . . . . A . 20 DPR HB3 . . A . 20 DPR HD3 . . . 20 . HB2 . . . . . 20 . HD2 . . c30496_6e5h 1 261 1 OR . 1 1 23 23 TYR HD1 H . . . 1 1 7 7 LEU MD2 H . . . . . 3.080 1.894 4.266 . . . . . A . 23 TYR HD1 . . A . 7 LEU MD2 . . . 23 . HD1 . . . . . 7 . HD21 . . c30496_6e5h 1 261 2 OR . 1 1 23 23 TYR HD2 H . . . 1 1 7 7 LEU MD2 H . . . . . 3.080 1.894 4.266 . . . . . A . 23 TYR HD2 . . A . 7 LEU MD2 . . . 23 . HD2 . . . . . 7 . HD21 . . c30496_6e5h 1 262 1 . . 1 1 20 20 DPR HA H . . . 1 1 22 22 ARG H H . . . . . 3.081 1.895 4.267 . . . . . A . 20 DPR HA . . A . 22 ARG H . . . 20 . HA . . . . . 22 . HN . . c30496_6e5h 1 263 1 . . 1 1 2 2 ASP HA H . . . 1 1 2 2 ASP H H . . . . . 3.083 1.895 4.271 . . . . . A . 2 ASP HA . . A . 2 ASP H . . . 2 . HA . . . . . 2 . HN . . c30496_6e5h 1 264 1 . . 1 1 10 10 ARG HG3 H . . . 1 1 10 10 ARG HE H . . . . . 3.092 1.897 4.287 . . . . . A . 10 ARG HG3 . . A . 10 ARG HE . . . 10 . HG2 . . . . . 10 . HE . . c30496_6e5h 1 265 1 OR . 1 1 16 16 VAL MG1 H . . . 1 1 8 8 LYS HG2 H . . . . . 3.096 1.898 4.294 . . . . . A . 16 VAL MG1 . . A . 8 LYS HG2 . . . 16 . HG11 . . . . . 8 . HG1 . . c30496_6e5h 1 265 2 OR . 1 1 16 16 VAL MG1 H . . . 1 1 8 8 LYS HG3 H . . . . . 3.096 1.898 4.294 . . . . . A . 16 VAL MG1 . . A . 8 LYS HG3 . . . 16 . HG11 . . . . . 8 . HG2 . . c30496_6e5h 1 266 1 . . 1 1 14 14 CYS HB2 H . . . 1 1 26 26 HIS H H . . . . . 3.100 1.898 4.302 . . . . . A . 14 CYS HB2 . . A . 26 HIS H . . . 14 . HB1 . . . . . 26 . HN . . c30496_6e5h 1 267 1 OR . 1 1 11 11 TYR HD2 H . . . 1 1 7 7 LEU HB3 H . . . . . 3.102 1.899 4.305 . . . . . A . 11 TYR HD2 . . A . 7 LEU HB3 . . . 11 . HD2 . . . . . 7 . HB2 . . c30496_6e5h 1 267 2 OR . 1 1 11 11 TYR HD1 H . . . 1 1 7 7 LEU HB3 H . . . . . 3.102 1.899 4.305 . . . . . A . 11 TYR HD1 . . A . 7 LEU HB3 . . . 11 . HD1 . . . . . 7 . HB2 . . c30496_6e5h 1 268 1 . . 1 1 16 16 VAL MG2 H . . . 1 1 7 7 LEU MD2 H . . . . . 3.103 1.900 4.306 . . . . . A . 16 VAL MG2 . . A . 7 LEU MD2 . . . 16 . HG21 . . . . . 7 . HD21 . . c30496_6e5h 1 269 1 . . 1 1 23 23 TYR HB2 H . . . 1 1 16 16 VAL MG1 H . . . . . 3.105 1.900 4.310 . . . . . A . 23 TYR HB2 . . A . 16 VAL MG1 . . . 23 . HB1 . . . . . 16 . HG11 . . c30496_6e5h 1 270 1 . . 1 1 19 19 ASP HA H . . . 1 1 19 19 ASP H H . . . . . 3.106 1.900 4.312 . . . . . A . 19 ASP HA . . A . 19 ASP H . . . 19 . HA . . . . . 19 . HN . . c30496_6e5h 1 271 1 . . 1 1 11 11 TYR HB3 H . . . 1 1 25 25 VAL MG1 H . . . . . 3.133 1.906 4.360 . . . . . A . 11 TYR HB3 . . A . 25 VAL MG1 . . . 11 . HB2 . . . . . 25 . HG11 . . c30496_6e5h 1 272 1 OR . 1 1 23 23 TYR HE2 H . . . 1 1 21 21 PRO HA H . . . . . 3.137 1.907 4.367 . . . . . A . 23 TYR HE2 . . A . 21 PRO HA . . . 23 . HE2 . . . . . 21 . HA . . c30496_6e5h 1 272 2 OR . 1 1 23 23 TYR HE1 H . . . 1 1 21 21 PRO HA H . . . . . 3.137 1.907 4.367 . . . . . A . 23 TYR HE1 . . A . 21 PRO HA . . . 23 . HE1 . . . . . 21 . HA . . c30496_6e5h 1 273 1 . . 1 1 16 16 VAL HA H . . . 1 1 25 25 VAL MG2 H . . . . . 3.139 1.908 4.370 . . . . . A . 16 VAL HA . . A . 25 VAL MG2 . . . 16 . HA . . . . . 25 . HG21 . . c30496_6e5h 1 274 1 . . 1 1 26 26 HIS H H . . . 1 1 25 25 VAL MG2 H . . . . . 3.140 1.908 4.372 . . . . . A . 26 HIS H . . A . 25 VAL MG2 . . . 26 . HN . . . . . 25 . HG21 . . c30496_6e5h 1 275 1 OR . 1 1 11 11 TYR HE1 H . . . 1 1 25 25 VAL MG1 H . . . . . 3.140 1.907 4.373 . . . . . A . 11 TYR HE1 . . A . 25 VAL MG1 . . . 11 . HE1 . . . . . 25 . HG11 . . c30496_6e5h 1 275 2 OR . 1 1 11 11 TYR HE2 H . . . 1 1 25 25 VAL MG1 H . . . . . 3.140 1.907 4.373 . . . . . A . 11 TYR HE2 . . A . 25 VAL MG1 . . . 11 . HE2 . . . . . 25 . HG11 . . c30496_6e5h 1 276 1 . . 1 1 15 15 GLU HA H . . . 1 1 15 15 GLU HG3 H . . . . . 3.146 1.909 4.383 . . . . . A . 15 GLU HA . . A . 15 GLU HG3 . . . 15 . HA . . . . . 15 . HG2 . . c30496_6e5h 1 277 1 . . 1 1 15 15 GLU HA H . . . 1 1 15 15 GLU HG2 H . . . . . 3.154 1.911 4.397 . . . . . A . 15 GLU HA . . A . 15 GLU HG2 . . . 15 . HA . . . . . 15 . HG1 . . c30496_6e5h 1 278 1 . . 1 1 25 25 VAL H H . . . 1 1 16 16 VAL HA H . . . . . 3.154 1.911 4.397 . . . . . A . 25 VAL H . . A . 16 VAL HA . . . 25 . HN . . . . . 16 . HA . . c30496_6e5h 1 279 1 . . 1 1 23 23 TYR HB2 H . . . 1 1 7 7 LEU MD1 H . . . . . 3.156 1.911 4.401 . . . . . A . 23 TYR HB2 . . A . 7 LEU MD1 . . . 23 . HB1 . . . . . 7 . HD11 . . c30496_6e5h 1 280 1 . . 1 1 8 8 LYS H H . . . 1 1 5 5 LYS HA H . . . . . 3.164 1.913 4.415 . . . . . A . 8 LYS H . . A . 5 LYS HA . . . 8 . HN . . . . . 5 . HA . . c30496_6e5h 1 281 1 . . 1 1 16 16 VAL H H . . . 1 1 16 16 VAL MG1 H . . . . . 3.166 1.913 4.419 . . . . . A . 16 VAL H . . A . 16 VAL MG1 . . . 16 . HN . . . . . 16 . HG11 . . c30496_6e5h 1 282 1 OR . 1 1 23 23 TYR HD2 H . . . 1 1 22 22 ARG HA H . . . . . 3.168 1.914 4.422 . . . . . A . 23 TYR HD2 . . A . 22 ARG HA . . . 23 . HD2 . . . . . 22 . HA . . c30496_6e5h 1 282 2 OR . 1 1 23 23 TYR HD1 H . . . 1 1 22 22 ARG HA H . . . . . 3.168 1.914 4.422 . . . . . A . 23 TYR HD1 . . A . 22 ARG HA . . . 23 . HD1 . . . . . 22 . HA . . c30496_6e5h 1 283 1 OR . 1 1 8 8 LYS HG2 H . . . 1 1 8 8 LYS H H . . . . . 3.173 1.914 4.432 . . . . . A . 8 LYS HG2 . . A . 8 LYS H . . . 8 . HG1 . . . . . 8 . HN . . c30496_6e5h 1 283 2 OR . 1 1 8 8 LYS HG3 H . . . 1 1 8 8 LYS H H . . . . . 3.173 1.914 4.432 . . . . . A . 8 LYS HG3 . . A . 8 LYS H . . . 8 . HG2 . . . . . 8 . HN . . c30496_6e5h 1 284 1 . . 1 1 3 3 LYS H H . . . 1 1 2 2 ASP HB2 H . . . . . 3.187 1.917 4.457 . . . . . A . 3 LYS H . . A . 2 ASP HB2 . . . 3 . HN . . . . . 2 . HB1 . . c30496_6e5h 1 285 1 . . 1 1 4 4 CYS HA H . . . 1 1 7 7 LEU H H . . . . . 3.193 1.919 4.467 . . . . . A . 4 CYS HA . . A . 7 LEU H . . . 4 . HA . . . . . 7 . HN . . c30496_6e5h 1 286 1 . . 1 1 20 20 DPR HB3 H . . . 1 1 21 21 PRO HD3 H . . . . . 3.194 1.919 4.469 . . . . . A . 20 DPR HB3 . . A . 21 PRO HD3 . . . 20 . HB2 . . . . . 21 . HD2 . . c30496_6e5h 1 287 1 . . 1 1 9 9 LYS HA H . . . 1 1 9 9 LYS HG2 H . . . . . 3.200 1.920 4.480 . . . . . A . 9 LYS HA . . A . 9 LYS HG2 . . . 9 . HA . . . . . 9 . HG1 . . c30496_6e5h 1 288 1 . . 1 1 16 16 VAL H H . . . 1 1 15 15 GLU H H . . . . . 3.201 1.920 4.482 . . . . . A . 16 VAL H . . A . 15 GLU H . . . 16 . HN . . . . . 15 . HN . . c30496_6e5h 1 289 1 OR . 1 1 23 23 TYR HD2 H . . . 1 1 24 24 GLU H H . . . . . 3.209 1.922 4.496 . . . . . A . 23 TYR HD2 . . A . 24 GLU H . . . 23 . HD2 . . . . . 24 . HN . . c30496_6e5h 1 289 2 OR . 1 1 23 23 TYR HD1 H . . . 1 1 24 24 GLU H H . . . . . 3.209 1.922 4.496 . . . . . A . 23 TYR HD1 . . A . 24 GLU H . . . 23 . HD1 . . . . . 24 . HN . . c30496_6e5h 1 290 1 . . 1 1 5 5 LYS H H . . . 1 1 7 7 LEU H H . . . . . 3.209 1.922 4.496 . . . . . A . 5 LYS H . . A . 7 LEU H . . . 5 . HN . . . . . 7 . HN . . c30496_6e5h 1 291 1 . . 1 1 5 5 LYS HA H . . . 1 1 5 5 LYS HG3 H . . . . . 3.229 1.926 4.532 . . . . . A . 5 LYS HA . . A . 5 LYS HG3 . . . 5 . HA . . . . . 5 . HG2 . . c30496_6e5h 1 292 1 . . 1 1 3 3 LYS H H . . . 1 1 3 3 LYS HG3 H . . . . . 3.232 1.927 4.537 . . . . . A . 3 LYS H . . A . 3 LYS HG3 . . . 3 . HN . . . . . 3 . HG2 . . c30496_6e5h 1 293 1 . . 1 1 8 8 LYS HA H . . . 1 1 11 11 TYR H H . . . . . 3.234 1.927 4.541 . . . . . A . 8 LYS HA . . A . 11 TYR H . . . 8 . HA . . . . . 11 . HN . . c30496_6e5h 1 294 1 . . 1 1 25 25 VAL H H . . . 1 1 25 25 VAL MG1 H . . . . . 3.262 1.932 4.592 . . . . . A . 25 VAL H . . A . 25 VAL MG1 . . . 25 . HN . . . . . 25 . HG11 . . c30496_6e5h 1 295 1 . . 1 1 20 20 DPR HD2 H . . . 1 1 19 19 ASP H H . . . . . 3.271 1.934 4.608 . . . . . A . 20 DPR HD2 . . A . 19 ASP H . . . 20 . HD1 . . . . . 19 . HN . . c30496_6e5h 1 296 1 . . 1 1 7 7 LEU MD2 H . . . 1 1 7 7 LEU HB3 H . . . . . 3.276 1.934 4.618 . . . . . A . 7 LEU MD2 . . A . 7 LEU HB3 . . . 7 . HD21 . . . . . 7 . HB2 . . c30496_6e5h 1 297 1 . . 1 1 24 24 GLU H H . . . 1 1 16 16 VAL MG1 H . . . . . 3.296 1.938 4.654 . . . . . A . 24 GLU H . . A . 16 VAL MG1 . . . 24 . HN . . . . . 16 . HG11 . . c30496_6e5h 1 298 1 OR . 1 1 23 23 TYR HD2 H . . . 1 1 19 19 ASP H H . . . . . 3.302 1.939 4.665 . . . . . A . 23 TYR HD2 . . A . 19 ASP H . . . 23 . HD2 . . . . . 19 . HN . . c30496_6e5h 1 298 2 OR . 1 1 23 23 TYR HD1 H . . . 1 1 19 19 ASP H H . . . . . 3.302 1.939 4.665 . . . . . A . 23 TYR HD1 . . A . 19 ASP H . . . 23 . HD1 . . . . . 19 . HN . . c30496_6e5h 1 299 1 OR . 1 1 23 23 TYR HE2 H . . . 1 1 23 23 TYR HB2 H . . . . . 3.305 1.940 4.670 . . . . . A . 23 TYR HE2 . . A . 23 TYR HB2 . . . 23 . HE2 . . . . . 23 . HB1 . . c30496_6e5h 1 299 2 OR . 1 1 23 23 TYR HE1 H . . . 1 1 23 23 TYR HB2 H . . . . . 3.305 1.940 4.670 . . . . . A . 23 TYR HE1 . . A . 23 TYR HB2 . . . 23 . HE1 . . . . . 23 . HB1 . . c30496_6e5h 1 300 1 . . 1 1 15 15 GLU H H . . . 1 1 26 26 HIS HB2 H . . . . . 3.309 1.940 4.678 . . . . . A . 15 GLU H . . A . 26 HIS HB2 . . . 15 . HN . . . . . 26 . HB1 . . c30496_6e5h 1 301 1 OR . 1 1 23 23 TYR HE2 H . . . 1 1 23 23 TYR HB3 H . . . . . 3.312 1.941 4.683 . . . . . A . 23 TYR HE2 . . A . 23 TYR HB3 . . . 23 . HE2 . . . . . 23 . HB2 . . c30496_6e5h 1 301 2 OR . 1 1 23 23 TYR HE1 H . . . 1 1 23 23 TYR HB3 H . . . . . 3.312 1.941 4.683 . . . . . A . 23 TYR HE1 . . A . 23 TYR HB3 . . . 23 . HE1 . . . . . 23 . HB2 . . c30496_6e5h 1 302 1 . . 1 1 21 21 PRO HD2 H . . . 1 1 22 22 ARG H H . . . . . 3.318 1.942 4.694 . . . . . A . 21 PRO HD2 . . A . 22 ARG H . . . 21 . HD1 . . . . . 22 . HN . . c30496_6e5h 1 303 1 . . 1 1 23 23 TYR HB3 H . . . 1 1 7 7 LEU MD2 H . . . . . 3.320 1.942 4.698 . . . . . A . 23 TYR HB3 . . A . 7 LEU MD2 . . . 23 . HB2 . . . . . 7 . HD21 . . c30496_6e5h 1 304 1 . . 1 1 10 10 ARG HG2 H . . . 1 1 10 10 ARG HE H . . . . . 3.333 1.944 4.722 . . . . . A . 10 ARG HG2 . . A . 10 ARG HE . . . 10 . HG1 . . . . . 10 . HE . . c30496_6e5h 1 305 1 . . 1 1 4 4 CYS HA H . . . 1 1 16 16 VAL MG1 H . . . . . 3.343 1.946 4.740 . . . . . A . 4 CYS HA . . A . 16 VAL MG1 . . . 4 . HA . . . . . 16 . HG11 . . c30496_6e5h 1 306 1 OR . 1 1 16 16 VAL MG2 H . . . 1 1 8 8 LYS HB2 H . . . . . 3.357 1.948 4.766 . . . . . A . 16 VAL MG2 . . A . 8 LYS HB2 . . . 16 . HG21 . . . . . 8 . HB1 . . c30496_6e5h 1 306 2 OR . 1 1 16 16 VAL MG2 H . . . 1 1 8 8 LYS HB3 H . . . . . 3.357 1.948 4.766 . . . . . A . 16 VAL MG2 . . A . 8 LYS HB3 . . . 16 . HG21 . . . . . 8 . HB2 . . c30496_6e5h 1 307 1 OR . 1 1 22 22 ARG HE H . . . 1 1 22 22 ARG HG2 H . . . . . 3.364 1.950 4.778 . . . . . A . 22 ARG HE . . A . 22 ARG HG2 . . . 22 . HE . . . . . 22 . HG1 . . c30496_6e5h 1 307 2 OR . 1 1 22 22 ARG HE H . . . 1 1 22 22 ARG HG3 H . . . . . 3.364 1.950 4.778 . . . . . A . 22 ARG HE . . A . 22 ARG HG3 . . . 22 . HE . . . . . 22 . HG2 . . c30496_6e5h 1 308 1 . . 1 1 15 15 GLU H H . . . 1 1 14 14 CYS H H . . . . . 3.369 1.950 4.788 . . . . . A . 15 GLU H . . A . 14 CYS H . . . 15 . HN . . . . . 14 . HN . . c30496_6e5h 1 309 1 . . 1 1 10 10 ARG HE H . . . 1 1 10 10 ARG HD3 H . . . . . 3.369 1.950 4.788 . . . . . A . 10 ARG HE . . A . 10 ARG HD3 . . . 10 . HE . . . . . 10 . HD2 . . c30496_6e5h 1 310 1 . . 1 1 26 26 HIS HB3 H . . . 1 1 26 26 HIS HD2 H . . . . . 3.371 1.951 4.791 . . . . . A . 26 HIS HB3 . . A . 26 HIS HD2 . . . 26 . HB2 . . . . . 26 . HD2 . . c30496_6e5h 1 311 1 . . 1 1 7 7 LEU MD2 H . . . 1 1 10 10 ARG HB2 H . . . . . 3.371 1.951 4.791 . . . . . A . 7 LEU MD2 . . A . 10 ARG HB2 . . . 7 . HD21 . . . . . 10 . HB1 . . c30496_6e5h 1 312 1 OR . 1 1 23 23 TYR HD2 H . . . 1 1 4 4 CYS HA H . . . . . 3.371 1.951 4.791 . . . . . A . 23 TYR HD2 . . A . 4 CYS HA . . . 23 . HD2 . . . . . 4 . HA . . c30496_6e5h 1 312 2 OR . 1 1 23 23 TYR HD1 H . . . 1 1 4 4 CYS HA H . . . . . 3.371 1.951 4.791 . . . . . A . 23 TYR HD1 . . A . 4 CYS HA . . . 23 . HD1 . . . . . 4 . HA . . c30496_6e5h 1 313 1 . . 1 1 16 16 VAL MG1 H . . . 1 1 8 8 LYS HA H . . . . . 3.375 1.951 4.799 . . . . . A . 16 VAL MG1 . . A . 8 LYS HA . . . 16 . HG11 . . . . . 8 . HA . . c30496_6e5h 1 314 1 . . 1 1 17 17 ARG HA H . . . 1 1 16 16 VAL MG1 H . . . . . 3.389 1.953 4.825 . . . . . A . 17 ARG HA . . A . 16 VAL MG1 . . . 17 . HA . . . . . 16 . HG11 . . c30496_6e5h 1 315 1 . . 1 1 6 6 GLU H H . . . 1 1 8 8 LYS H H . . . . . 3.412 1.957 4.867 . . . . . A . 6 GLU H . . A . 8 LYS H . . . 6 . HN . . . . . 8 . HN . . c30496_6e5h 1 316 1 . . 1 1 7 7 LEU HA H . . . 1 1 7 7 LEU HB3 H . . . . . 3.412 1.957 4.867 . . . . . A . 7 LEU HA . . A . 7 LEU HB3 . . . 7 . HA . . . . . 7 . HB2 . . c30496_6e5h 1 317 1 . . 1 1 3 3 LYS H H . . . 1 1 3 3 LYS HG2 H . . . . . 3.422 1.958 4.886 . . . . . A . 3 LYS H . . A . 3 LYS HG2 . . . 3 . HN . . . . . 3 . HG1 . . c30496_6e5h 1 318 1 . . 1 1 3 3 LYS H H . . . 1 1 2 2 ASP H H . . . . . 3.440 1.961 4.919 . . . . . A . 3 LYS H . . A . 2 ASP H . . . 3 . HN . . . . . 2 . HN . . c30496_6e5h 1 319 1 OR . 1 1 23 23 TYR HD2 H . . . 1 1 18 18 CYS HB3 H . . . . . 3.441 1.961 4.921 . . . . . A . 23 TYR HD2 . . A . 18 CYS HB3 . . . 23 . HD2 . . . . . 18 . HB2 . . c30496_6e5h 1 319 2 OR . 1 1 23 23 TYR HD1 H . . . 1 1 18 18 CYS HB3 H . . . . . 3.441 1.961 4.921 . . . . . A . 23 TYR HD1 . . A . 18 CYS HB3 . . . 23 . HD1 . . . . . 18 . HB2 . . c30496_6e5h 1 320 1 OR . 1 1 16 16 VAL MG2 H . . . 1 1 8 8 LYS HD3 H . . . . . 3.444 1.962 4.926 . . . . . A . 16 VAL MG2 . . A . 8 LYS HD3 . . . 16 . HG21 . . . . . 8 . HD2 . . c30496_6e5h 1 320 2 OR . 1 1 16 16 VAL MG2 H . . . 1 1 8 8 LYS HD2 H . . . . . 3.444 1.962 4.926 . . . . . A . 16 VAL MG2 . . A . 8 LYS HD2 . . . 16 . HG21 . . . . . 8 . HD1 . . c30496_6e5h 1 321 1 . . 1 1 26 26 HIS HA H . . . 1 1 26 26 HIS HD2 H . . . . . 3.459 1.964 4.954 . . . . . A . 26 HIS HA . . A . 26 HIS HD2 . . . 26 . HA . . . . . 26 . HD2 . . c30496_6e5h 1 322 1 . . 1 1 7 7 LEU MD1 H . . . 1 1 7 7 LEU H H . . . . . 3.474 1.965 4.983 . . . . . A . 7 LEU MD1 . . A . 7 LEU H . . . 7 . HD11 . . . . . 7 . HN . . c30496_6e5h 1 323 1 . . 1 1 23 23 TYR HB3 H . . . 1 1 16 16 VAL MG1 H . . . . . 3.491 1.967 5.015 . . . . . A . 23 TYR HB3 . . A . 16 VAL MG1 . . . 23 . HB2 . . . . . 16 . HG11 . . c30496_6e5h 1 324 1 . . 1 1 27 27 CYS H H . . . 1 1 25 25 VAL MG1 H . . . . . 3.494 1.968 5.020 . . . . . A . 27 CYS H . . A . 25 VAL MG1 . . . 27 . HN . . . . . 25 . HG11 . . c30496_6e5h 1 325 1 . . 1 1 7 7 LEU MD2 H . . . 1 1 7 7 LEU H H . . . . . 3.498 1.968 5.028 . . . . . A . 7 LEU MD2 . . A . 7 LEU H . . . 7 . HD21 . . . . . 7 . HN . . c30496_6e5h 1 326 1 . . 1 1 26 26 HIS HA H . . . 1 1 25 25 VAL MG1 H . . . . . 3.519 1.971 5.067 . . . . . A . 26 HIS HA . . A . 25 VAL MG1 . . . 26 . HA . . . . . 25 . HG11 . . c30496_6e5h 1 327 1 . . 1 1 4 4 CYS H H . . . 1 1 2 2 ASP HA H . . . . . 3.519 1.971 5.067 . . . . . A . 4 CYS H . . A . 2 ASP HA . . . 4 . HN . . . . . 2 . HA . . c30496_6e5h 1 328 1 . . 1 1 7 7 LEU MD2 H . . . 1 1 10 10 ARG HD2 H . . . . . 3.521 1.972 5.070 . . . . . A . 7 LEU MD2 . . A . 10 ARG HD2 . . . 7 . HD21 . . . . . 10 . HD1 . . c30496_6e5h 1 329 1 . . 1 1 9 9 LYS H H . . . 1 1 9 9 LYS HG3 H . . . . . 3.532 1.972 5.092 . . . . . A . 9 LYS H . . A . 9 LYS HG3 . . . 9 . HN . . . . . 9 . HG2 . . c30496_6e5h 1 330 1 OR . 1 1 11 11 TYR HE2 H . . . 1 1 11 11 TYR HA H . . . . . 3.540 1.974 5.106 . . . . . A . 11 TYR HE2 . . A . 11 TYR HA . . . 11 . HE2 . . . . . 11 . HA . . c30496_6e5h 1 330 2 OR . 1 1 11 11 TYR HE1 H . . . 1 1 11 11 TYR HA H . . . . . 3.540 1.974 5.106 . . . . . A . 11 TYR HE1 . . A . 11 TYR HA . . . 11 . HE1 . . . . . 11 . HA . . c30496_6e5h 1 331 1 . . 1 1 16 16 VAL MG2 H . . . 1 1 7 7 LEU HB3 H . . . . . 3.587 1.979 5.195 . . . . . A . 16 VAL MG2 . . A . 7 LEU HB3 . . . 16 . HG21 . . . . . 7 . HB2 . . c30496_6e5h 1 332 1 OR . 1 1 23 23 TYR HE2 H . . . 1 1 4 4 CYS H H . . . . . 3.633 1.983 5.283 . . . . . A . 23 TYR HE2 . . A . 4 CYS H . . . 23 . HE2 . . . . . 4 . HN . . c30496_6e5h 1 332 2 OR . 1 1 23 23 TYR HE1 H . . . 1 1 4 4 CYS H H . . . . . 3.633 1.983 5.283 . . . . . A . 23 TYR HE1 . . A . 4 CYS H . . . 23 . HE1 . . . . . 4 . HN . . c30496_6e5h 1 333 1 . . 1 1 16 16 VAL MG1 H . . . 1 1 8 8 LYS H H . . . . . 3.642 1.984 5.300 . . . . . A . 16 VAL MG1 . . A . 8 LYS H . . . 16 . HG11 . . . . . 8 . HN . . c30496_6e5h 1 334 1 OR . 1 1 9 9 LYS HA H . . . 1 1 9 9 LYS HD2 H . . . . . 3.662 1.986 5.338 . . . . . A . 9 LYS HA . . A . 9 LYS HD2 . . . 9 . HA . . . . . 9 . HD1 . . c30496_6e5h 1 334 2 OR . 1 1 9 9 LYS HA H . . . 1 1 9 9 LYS HD3 H . . . . . 3.662 1.986 5.338 . . . . . A . 9 LYS HA . . A . 9 LYS HD3 . . . 9 . HA . . . . . 9 . HD2 . . c30496_6e5h 1 335 1 . . 1 1 17 17 ARG H H . . . 1 1 25 25 VAL MG2 H . . . . . 3.675 1.986 5.364 . . . . . A . 17 ARG H . . A . 25 VAL MG2 . . . 17 . HN . . . . . 25 . HG21 . . c30496_6e5h 1 336 1 . . 1 1 26 26 HIS HD2 H . . . 1 1 26 26 HIS HE1 H . . . . . 3.683 1.987 5.379 . . . . . A . 26 HIS HD2 . . A . 26 HIS HE1 . . . 26 . HD2 . . . . . 26 . HE1 . . c30496_6e5h 1 337 1 . . 1 1 16 16 VAL MG2 H . . . 1 1 8 8 LYS H H . . . . . 3.695 1.988 5.402 . . . . . A . 16 VAL MG2 . . A . 8 LYS H . . . 16 . HG21 . . . . . 8 . HN . . c30496_6e5h 1 338 1 OR . 1 1 11 11 TYR HE2 H . . . 1 1 16 16 VAL MG2 H . . . . . 3.819 1.996 5.642 . . . . . A . 11 TYR HE2 . . A . 16 VAL MG2 . . . 11 . HE2 . . . . . 16 . HG21 . . c30496_6e5h 1 338 2 OR . 1 1 11 11 TYR HE1 H . . . 1 1 16 16 VAL MG2 H . . . . . 3.819 1.996 5.642 . . . . . A . 11 TYR HE1 . . A . 16 VAL MG2 . . . 11 . HE1 . . . . . 16 . HG21 . . c30496_6e5h 1 339 1 . . 1 1 25 25 VAL MG2 H . . . 1 1 23 23 TYR HB3 H . . . . . 3.829 1.996 5.662 . . . . . A . 25 VAL MG2 . . A . 23 TYR HB3 . . . 25 . HG21 . . . . . 23 . HB2 . . c30496_6e5h 1 340 1 . . 1 1 26 26 HIS HA H . . . 1 1 25 25 VAL MG2 H . . . . . 3.853 1.997 5.709 . . . . . A . 26 HIS HA . . A . 25 VAL MG2 . . . 26 . HA . . . . . 25 . HG21 . . c30496_6e5h 1 341 1 . . 1 1 16 16 VAL MG1 H . . . 1 1 7 7 LEU H H . . . . . 3.884 1.999 5.769 . . . . . A . 16 VAL MG1 . . A . 7 LEU H . . . 16 . HG11 . . . . . 7 . HN . . c30496_6e5h 1 342 1 . . 1 1 17 17 ARG HA H . . . 1 1 16 16 VAL MG2 H . . . . . 4.068 2.000 6.136 . . . . . A . 17 ARG HA . . A . 16 VAL MG2 . . . 17 . HA . . . . . 16 . HG21 . . c30496_6e5h 1 343 1 OR . 1 1 22 22 ARG HE H . . . 1 1 22 22 ARG HD2 H . . . . . 4.117 1.998 6.236 . . . . . A . 22 ARG HE . . A . 22 ARG HD2 . . . 22 . HE . . . . . 22 . HD1 . . c30496_6e5h 1 343 2 OR . 1 1 22 22 ARG HE H . . . 1 1 22 22 ARG HD3 H . . . . . 4.117 1.998 6.236 . . . . . A . 22 ARG HE . . A . 22 ARG HD3 . . . 22 . HE . . . . . 22 . HD2 . . c30496_6e5h 1 344 1 OR . 1 1 4 4 CYS HB2 H . . . 1 1 3 3 LYS H H . . . . . 4.121 1.998 6.244 . . . . . A . 4 CYS HB2 . . A . 3 LYS H . . . 4 . HB1 . . . . . 3 . HN . . c30496_6e5h 1 344 2 OR . 1 1 4 4 CYS HB3 H . . . 1 1 3 3 LYS H H . . . . . 4.121 1.998 6.244 . . . . . A . 4 CYS HB3 . . A . 3 LYS H . . . 4 . HB2 . . . . . 3 . HN . . c30496_6e5h 1 345 1 OR . 1 1 10 10 ARG HA H . . . 1 1 10 10 ARG HB3 H . . . . . 2.113 1.555 2.671 . . . . . A . 10 ARG HA . . A . 10 ARG HB3 . . . 10 . HA . . . . . 10 . HB2 . . c30496_6e5h 1 345 2 OR . 1 1 3 3 LYS HB2 H . . . 1 1 3 3 LYS HA H . . . . . 2.113 1.555 2.671 . . . . . A . 3 LYS HB2 . . A . 3 LYS HA . . . 3 . HB1 . . . . . 3 . HA . . c30496_6e5h 1 345 3 OR . 1 1 3 3 LYS HB3 H . . . 1 1 3 3 LYS HA H . . . . . 2.113 1.555 2.671 . . . . . A . 3 LYS HB3 . . A . 3 LYS HA . . . 3 . HB2 . . . . . 3 . HA . . c30496_6e5h 1 346 1 OR . 1 1 8 8 LYS HB2 H . . . 1 1 8 8 LYS H H . . . . . 2.154 1.574 2.734 . . . . . A . 8 LYS HB2 . . A . 8 LYS H . . . 8 . HB1 . . . . . 8 . HN . . c30496_6e5h 1 346 2 OR . 1 1 8 8 LYS HB3 H . . . 1 1 8 8 LYS H H . . . . . 2.154 1.574 2.734 . . . . . A . 8 LYS HB3 . . A . 8 LYS H . . . 8 . HB2 . . . . . 8 . HN . . c30496_6e5h 1 346 3 OR . 1 1 7 7 LEU HB3 H . . . 1 1 8 8 LYS H H . . . . . 2.154 1.574 2.734 . . . . . A . 7 LEU HB3 . . A . 8 LYS H . . . 7 . HB2 . . . . . 8 . HN . . c30496_6e5h 1 347 1 OR . 1 1 6 6 GLU HB2 H . . . 1 1 6 6 GLU HA H . . . . . 2.167 1.580 2.754 . . . . . A . 6 GLU HB2 . . A . 6 GLU HA . . . 6 . HB1 . . . . . 6 . HA . . c30496_6e5h 1 347 2 OR . 1 1 6 6 GLU HB3 H . . . 1 1 6 6 GLU HA H . . . . . 2.167 1.580 2.754 . . . . . A . 6 GLU HB3 . . A . 6 GLU HA . . . 6 . HB2 . . . . . 6 . HA . . c30496_6e5h 1 347 3 OR . 1 1 6 6 GLU HB2 H . . . 1 1 3 3 LYS HA H . . . . . 2.167 1.580 2.754 . . . . . A . 6 GLU HB2 . . A . 3 LYS HA . . . 6 . HB1 . . . . . 3 . HA . . c30496_6e5h 1 347 4 OR . 1 1 6 6 GLU HB3 H . . . 1 1 3 3 LYS HA H . . . . . 2.167 1.580 2.754 . . . . . A . 6 GLU HB3 . . A . 3 LYS HA . . . 6 . HB2 . . . . . 3 . HA . . c30496_6e5h 1 348 1 OR . 1 1 9 9 LYS HB2 H . . . 1 1 9 9 LYS H H . . . . . 2.205 1.597 2.813 . . . . . A . 9 LYS HB2 . . A . 9 LYS H . . . 9 . HB1 . . . . . 9 . HN . . c30496_6e5h 1 348 2 OR . 1 1 9 9 LYS HB3 H . . . 1 1 9 9 LYS H H . . . . . 2.205 1.597 2.813 . . . . . A . 9 LYS HB3 . . A . 9 LYS H . . . 9 . HB2 . . . . . 9 . HN . . c30496_6e5h 1 348 3 OR . 1 1 8 8 LYS HB2 H . . . 1 1 9 9 LYS H H . . . . . 2.205 1.597 2.813 . . . . . A . 8 LYS HB2 . . A . 9 LYS H . . . 8 . HB1 . . . . . 9 . HN . . c30496_6e5h 1 348 4 OR . 1 1 8 8 LYS HB3 H . . . 1 1 9 9 LYS H H . . . . . 2.205 1.597 2.813 . . . . . A . 8 LYS HB3 . . A . 9 LYS H . . . 8 . HB2 . . . . . 9 . HN . . c30496_6e5h 1 349 1 OR . 1 1 9 9 LYS HB2 H . . . 1 1 6 6 GLU HA H . . . . . 2.255 1.620 2.890 . . . . . A . 9 LYS HB2 . . A . 6 GLU HA . . . 9 . HB1 . . . . . 6 . HA . . c30496_6e5h 1 349 2 OR . 1 1 9 9 LYS HB3 H . . . 1 1 6 6 GLU HA H . . . . . 2.255 1.620 2.890 . . . . . A . 9 LYS HB3 . . A . 6 GLU HA . . . 9 . HB2 . . . . . 6 . HA . . c30496_6e5h 1 349 3 OR . 1 1 5 5 LYS HB2 H . . . 1 1 6 6 GLU HA H . . . . . 2.255 1.620 2.890 . . . . . A . 5 LYS HB2 . . A . 6 GLU HA . . . 5 . HB1 . . . . . 6 . HA . . c30496_6e5h 1 349 4 OR . 1 1 5 5 LYS HB3 H . . . 1 1 6 6 GLU HA H . . . . . 2.255 1.620 2.890 . . . . . A . 5 LYS HB3 . . A . 6 GLU HA . . . 5 . HB2 . . . . . 6 . HA . . c30496_6e5h 1 350 1 OR . 1 1 20 20 DPR HD2 H . . . 1 1 19 19 ASP HA H . . . . . 2.285 1.632 2.938 . . . . . A . 20 DPR HD2 . . A . 19 ASP HA . . . 20 . HD1 . . . . . 19 . HA . . c30496_6e5h 1 350 2 OR . 1 1 14 14 CYS HB3 H . . . 1 1 14 14 CYS HA H . . . . . 2.285 1.632 2.938 . . . . . A . 14 CYS HB3 . . A . 14 CYS HA . . . 14 . HB2 . . . . . 14 . HA . . c30496_6e5h 1 351 1 OR . 1 1 7 7 LEU HA H . . . 1 1 7 7 LEU HB2 H . . . . . 2.384 1.673 3.095 . . . . . A . 7 LEU HA . . A . 7 LEU HB2 . . . 7 . HA . . . . . 7 . HB1 . . c30496_6e5h 1 351 2 OR . 1 1 3 3 LYS HA H . . . 1 1 3 3 LYS HG3 H . . . . . 2.384 1.673 3.095 . . . . . A . 3 LYS HA . . A . 3 LYS HG3 . . . 3 . HA . . . . . 3 . HG2 . . c30496_6e5h 1 352 1 OR . 1 1 7 7 LEU H H . . . 1 1 6 6 GLU HA H . . . . . 2.463 1.705 3.221 . . . . . A . 7 LEU H . . A . 6 GLU HA . . . 7 . HN . . . . . 6 . HA . . c30496_6e5h 1 352 2 OR . 1 1 7 7 LEU HA H . . . 1 1 7 7 LEU H H . . . . . 2.463 1.705 3.221 . . . . . A . 7 LEU HA . . A . 7 LEU H . . . 7 . HA . . . . . 7 . HN . . c30496_6e5h 1 353 1 OR . 1 1 8 8 LYS HB2 H . . . 1 1 5 5 LYS HA H . . . . . 2.485 1.713 3.257 . . . . . A . 8 LYS HB2 . . A . 5 LYS HA . . . 8 . HB1 . . . . . 5 . HA . . c30496_6e5h 1 353 2 OR . 1 1 8 8 LYS HB3 H . . . 1 1 5 5 LYS HA H . . . . . 2.485 1.713 3.257 . . . . . A . 8 LYS HB3 . . A . 5 LYS HA . . . 8 . HB2 . . . . . 5 . HA . . c30496_6e5h 1 353 3 OR . 1 1 5 5 LYS HB2 H . . . 1 1 5 5 LYS HA H . . . . . 2.485 1.713 3.257 . . . . . A . 5 LYS HB2 . . A . 5 LYS HA . . . 5 . HB1 . . . . . 5 . HA . . c30496_6e5h 1 353 4 OR . 1 1 5 5 LYS HB3 H . . . 1 1 5 5 LYS HA H . . . . . 2.485 1.713 3.257 . . . . . A . 5 LYS HB3 . . A . 5 LYS HA . . . 5 . HB2 . . . . . 5 . HA . . c30496_6e5h 1 354 1 OR . 1 1 10 10 ARG HA H . . . 1 1 10 10 ARG H H . . . . . 2.492 1.716 3.268 . . . . . A . 10 ARG HA . . A . 10 ARG H . . . 10 . HA . . . . . 10 . HN . . c30496_6e5h 1 354 2 OR . 1 1 7 7 LEU HA H . . . 1 1 10 10 ARG H H . . . . . 2.492 1.716 3.268 . . . . . A . 7 LEU HA . . A . 10 ARG H . . . 7 . HA . . . . . 10 . HN . . c30496_6e5h 1 355 1 OR . 1 1 6 6 GLU H H . . . 1 1 6 6 GLU HA H . . . . . 2.499 1.719 3.279 . . . . . A . 6 GLU H . . A . 6 GLU HA . . . 6 . HN . . . . . 6 . HA . . c30496_6e5h 1 355 2 OR . 1 1 6 6 GLU H H . . . 1 1 3 3 LYS HA H . . . . . 2.499 1.719 3.279 . . . . . A . 6 GLU H . . A . 3 LYS HA . . . 6 . HN . . . . . 3 . HA . . c30496_6e5h 1 356 1 OR . 1 1 18 18 CYS H H . . . 1 1 17 17 ARG HB3 H . . . . . 2.595 1.753 3.437 . . . . . A . 18 CYS H . . A . 17 ARG HB3 . . . 18 . HN . . . . . 17 . HB2 . . c30496_6e5h 1 356 2 OR . 1 1 17 17 ARG H H . . . 1 1 17 17 ARG HB3 H . . . . . 2.595 1.753 3.437 . . . . . A . 17 ARG H . . A . 17 ARG HB3 . . . 17 . HN . . . . . 17 . HB2 . . c30496_6e5h 1 357 1 OR . 1 1 8 8 LYS HA H . . . 1 1 9 9 LYS H H . . . . . 2.694 1.787 3.601 . . . . . A . 8 LYS HA . . A . 9 LYS H . . . 8 . HA . . . . . 9 . HN . . c30496_6e5h 1 357 2 OR . 1 1 9 9 LYS H H . . . 1 1 6 6 GLU HA H . . . . . 2.694 1.787 3.601 . . . . . A . 9 LYS H . . A . 6 GLU HA . . . 9 . HN . . . . . 6 . HA . . c30496_6e5h 1 358 1 OR . 1 1 10 10 ARG HA H . . . 1 1 10 10 ARG HB2 H . . . . . 2.733 1.799 3.667 . . . . . A . 10 ARG HA . . A . 10 ARG HB2 . . . 10 . HA . . . . . 10 . HB1 . . c30496_6e5h 1 358 2 OR . 1 1 7 7 LEU HA H . . . 1 1 10 10 ARG HB2 H . . . . . 2.733 1.799 3.667 . . . . . A . 7 LEU HA . . A . 10 ARG HB2 . . . 7 . HA . . . . . 10 . HB1 . . c30496_6e5h 1 359 1 OR . 1 1 25 25 VAL HA H . . . 1 1 16 16 VAL MG2 H . . . . . 2.766 1.810 3.722 . . . . . A . 25 VAL HA . . A . 16 VAL MG2 . . . 25 . HA . . . . . 16 . HG21 . . c30496_6e5h 1 359 2 OR . 1 1 15 15 GLU HA H . . . 1 1 16 16 VAL MG2 H . . . . . 2.766 1.810 3.722 . . . . . A . 15 GLU HA . . A . 16 VAL MG2 . . . 15 . HA . . . . . 16 . HG21 . . c30496_6e5h 1 360 1 OR . 1 1 7 7 LEU HA H . . . 1 1 8 8 LYS H H . . . . . 2.851 1.835 3.867 . . . . . A . 7 LEU HA . . A . 8 LYS H . . . 7 . HA . . . . . 8 . HN . . c30496_6e5h 1 360 2 OR . 1 1 8 8 LYS H H . . . 1 1 6 6 GLU HA H . . . . . 2.851 1.835 3.867 . . . . . A . 8 LYS H . . A . 6 GLU HA . . . 8 . HN . . . . . 6 . HA . . c30496_6e5h 1 361 1 OR . 1 1 10 10 ARG HA H . . . 1 1 11 11 TYR H H . . . . . 2.854 1.835 3.873 . . . . . A . 10 ARG HA . . A . 11 TYR H . . . 10 . HA . . . . . 11 . HN . . c30496_6e5h 1 361 2 OR . 1 1 7 7 LEU HA H . . . 1 1 11 11 TYR H H . . . . . 2.854 1.835 3.873 . . . . . A . 7 LEU HA . . A . 11 TYR H . . . 7 . HA . . . . . 11 . HN . . c30496_6e5h 1 362 1 OR . 1 1 14 14 CYS HB2 H . . . 1 1 14 14 CYS H H . . . . . 2.927 1.856 3.998 . . . . . A . 14 CYS HB2 . . A . 14 CYS H . . . 14 . HB1 . . . . . 14 . HN . . c30496_6e5h 1 362 2 OR . 1 1 11 11 TYR HB2 H . . . 1 1 14 14 CYS H H . . . . . 2.927 1.856 3.998 . . . . . A . 11 TYR HB2 . . A . 14 CYS H . . . 11 . HB1 . . . . . 14 . HN . . c30496_6e5h 1 363 1 OR . 1 1 18 18 CYS H H . . . 1 1 17 17 ARG HG3 H . . . . . 2.930 1.857 4.003 . . . . . A . 18 CYS H . . A . 17 ARG HG3 . . . 18 . HN . . . . . 17 . HG2 . . c30496_6e5h 1 363 2 OR . 1 1 17 17 ARG H H . . . 1 1 17 17 ARG HG3 H . . . . . 2.930 1.857 4.003 . . . . . A . 17 ARG H . . A . 17 ARG HG3 . . . 17 . HN . . . . . 17 . HG2 . . c30496_6e5h 1 364 1 OR . 1 1 18 18 CYS H H . . . 1 1 17 17 ARG HG2 H . . . . . 2.981 1.870 4.092 . . . . . A . 18 CYS H . . A . 17 ARG HG2 . . . 18 . HN . . . . . 17 . HG1 . . c30496_6e5h 1 364 2 OR . 1 1 17 17 ARG H H . . . 1 1 17 17 ARG HG2 H . . . . . 2.981 1.870 4.092 . . . . . A . 17 ARG H . . A . 17 ARG HG2 . . . 17 . HN . . . . . 17 . HG1 . . c30496_6e5h 1 365 1 OR . 1 1 6 6 GLU HG3 H . . . 1 1 3 3 LYS HA H . . . . . 3.004 1.876 4.132 . . . . . A . 6 GLU HG3 . . A . 3 LYS HA . . . 6 . HG2 . . . . . 3 . HA . . c30496_6e5h 1 365 2 OR . 1 1 6 6 GLU HG3 H . . . 1 1 6 6 GLU HA H . . . . . 3.004 1.876 4.132 . . . . . A . 6 GLU HG3 . . A . 6 GLU HA . . . 6 . HG2 . . . . . 6 . HA . . c30496_6e5h 1 366 1 OR . 1 1 25 25 VAL HB H . . . 1 1 16 16 VAL MG1 H . . . . . 3.045 1.886 4.204 . . . . . A . 25 VAL HB . . A . 16 VAL MG1 . . . 25 . HB . . . . . 16 . HG11 . . c30496_6e5h 1 366 2 OR . 1 1 16 16 VAL MG1 H . . . 1 1 8 8 LYS HD2 H . . . . . 3.045 1.886 4.204 . . . . . A . 16 VAL MG1 . . A . 8 LYS HD2 . . . 16 . HG11 . . . . . 8 . HD1 . . c30496_6e5h 1 366 3 OR . 1 1 16 16 VAL MG1 H . . . 1 1 8 8 LYS HD3 H . . . . . 3.045 1.886 4.204 . . . . . A . 16 VAL MG1 . . A . 8 LYS HD3 . . . 16 . HG11 . . . . . 8 . HD2 . . c30496_6e5h 1 367 1 OR . 1 1 24 24 GLU H H . . . 1 1 17 17 ARG HB3 H . . . . . 3.132 1.906 4.358 . . . . . A . 24 GLU H . . A . 17 ARG HB3 . . . 24 . HN . . . . . 17 . HB2 . . c30496_6e5h 1 367 2 OR . 1 1 24 24 GLU H H . . . 1 1 22 22 ARG HB2 H . . . . . 3.132 1.906 4.358 . . . . . A . 24 GLU H . . A . 22 ARG HB2 . . . 24 . HN . . . . . 22 . HB1 . . c30496_6e5h 1 367 3 OR . 1 1 24 24 GLU H H . . . 1 1 22 22 ARG HB3 H . . . . . 3.132 1.906 4.358 . . . . . A . 24 GLU H . . A . 22 ARG HB3 . . . 24 . HN . . . . . 22 . HB2 . . c30496_6e5h 1 368 1 OR . 1 1 7 7 LEU HA H . . . 1 1 7 7 LEU MD1 H . . . . . 3.214 1.923 4.505 . . . . . A . 7 LEU HA . . A . 7 LEU MD1 . . . 7 . HA . . . . . 7 . HD11 . . c30496_6e5h 1 368 2 OR . 1 1 7 7 LEU MD1 H . . . 1 1 3 3 LYS HA H . . . . . 3.214 1.923 4.505 . . . . . A . 7 LEU MD1 . . A . 3 LYS HA . . . 7 . HD11 . . . . . 3 . HA . . c30496_6e5h 1 369 1 OR . 1 1 9 9 LYS H H . . . 1 1 9 9 LYS HD2 H . . . . . 3.226 1.925 4.527 . . . . . A . 9 LYS H . . A . 9 LYS HD2 . . . 9 . HN . . . . . 9 . HD1 . . c30496_6e5h 1 369 2 OR . 1 1 9 9 LYS H H . . . 1 1 9 9 LYS HD3 H . . . . . 3.226 1.925 4.527 . . . . . A . 9 LYS H . . A . 9 LYS HD3 . . . 9 . HN . . . . . 9 . HD2 . . c30496_6e5h 1 369 3 OR . 1 1 9 9 LYS H H . . . 1 1 8 8 LYS HD2 H . . . . . 3.226 1.925 4.527 . . . . . A . 9 LYS H . . A . 8 LYS HD2 . . . 9 . HN . . . . . 8 . HD1 . . c30496_6e5h 1 369 4 OR . 1 1 9 9 LYS H H . . . 1 1 8 8 LYS HD3 H . . . . . 3.226 1.925 4.527 . . . . . A . 9 LYS H . . A . 8 LYS HD3 . . . 9 . HN . . . . . 8 . HD2 . . c30496_6e5h 1 370 1 OR . 1 1 16 16 VAL MG2 H . . . 1 1 8 8 LYS HD2 H . . . . . 3.288 1.937 4.639 . . . . . A . 16 VAL MG2 . . A . 8 LYS HD2 . . . 16 . HG21 . . . . . 8 . HD1 . . c30496_6e5h 1 370 2 OR . 1 1 16 16 VAL MG2 H . . . 1 1 25 25 VAL HB H . . . . . 3.288 1.937 4.639 . . . . . A . 16 VAL MG2 . . A . 25 VAL HB . . . 16 . HG21 . . . . . 25 . HB . . c30496_6e5h 1 370 3 OR . 1 1 16 16 VAL MG2 H . . . 1 1 8 8 LYS HD3 H . . . . . 3.288 1.937 4.639 . . . . . A . 16 VAL MG2 . . A . 8 LYS HD3 . . . 16 . HG21 . . . . . 8 . HD2 . . c30496_6e5h 1 371 1 OR . 1 1 15 15 GLU H H . . . 1 1 26 26 HIS HB3 H . . . . . 3.323 1.943 4.703 . . . . . A . 15 GLU H . . A . 26 HIS HB3 . . . 15 . HN . . . . . 26 . HB2 . . c30496_6e5h 1 371 2 OR . 1 1 4 4 CYS HB2 H . . . 1 1 3 3 LYS H H . . . . . 3.323 1.943 4.703 . . . . . A . 4 CYS HB2 . . A . 3 LYS H . . . 4 . HB1 . . . . . 3 . HN . . c30496_6e5h 1 371 3 OR . 1 1 4 4 CYS HB3 H . . . 1 1 3 3 LYS H H . . . . . 3.323 1.943 4.703 . . . . . A . 4 CYS HB3 . . A . 3 LYS H . . . 4 . HB2 . . . . . 3 . HN . . c30496_6e5h 1 372 1 OR . 1 1 14 14 CYS HB2 H . . . 1 1 25 25 VAL MG2 H . . . . . 3.409 1.956 4.862 . . . . . A . 14 CYS HB2 . . A . 25 VAL MG2 . . . 14 . HB1 . . . . . 25 . HG21 . . c30496_6e5h 1 372 2 OR . 1 1 11 11 TYR HB2 H . . . 1 1 25 25 VAL MG2 H . . . . . 3.409 1.956 4.862 . . . . . A . 11 TYR HB2 . . A . 25 VAL MG2 . . . 11 . HB1 . . . . . 25 . HG21 . . c30496_6e5h 1 373 1 OR . 1 1 3 3 LYS H H . . . 1 1 3 3 LYS HE2 H . . . . . 3.472 1.966 4.978 . . . . . A . 3 LYS H . . A . 3 LYS HE2 . . . 3 . HN . . . . . 3 . HE1 . . c30496_6e5h 1 373 2 OR . 1 1 3 3 LYS H H . . . 1 1 3 3 LYS HE3 H . . . . . 3.472 1.966 4.978 . . . . . A . 3 LYS H . . A . 3 LYS HE3 . . . 3 . HN . . . . . 3 . HE2 . . c30496_6e5h 1 373 3 OR . 1 1 3 3 LYS H H . . . 1 1 2 2 ASP HB3 H . . . . . 3.472 1.966 4.978 . . . . . A . 3 LYS H . . A . 2 ASP HB3 . . . 3 . HN . . . . . 2 . HB2 . . c30496_6e5h 1 374 1 OR . 1 1 23 23 TYR HE2 H . . . 1 1 16 16 VAL MG1 H . . . . . 3.525 1.972 5.078 . . . . . A . 23 TYR HE2 . . A . 16 VAL MG1 . . . 23 . HE2 . . . . . 16 . HG11 . . c30496_6e5h 1 374 2 OR . 1 1 11 11 TYR HE1 H . . . 1 1 16 16 VAL MG1 H . . . . . 3.525 1.972 5.078 . . . . . A . 11 TYR HE1 . . A . 16 VAL MG1 . . . 11 . HE1 . . . . . 16 . HG11 . . c30496_6e5h 1 374 3 OR . 1 1 11 11 TYR HE2 H . . . 1 1 16 16 VAL MG1 H . . . . . 3.525 1.972 5.078 . . . . . A . 11 TYR HE2 . . A . 16 VAL MG1 . . . 11 . HE2 . . . . . 16 . HG11 . . c30496_6e5h 1 374 4 OR . 1 1 23 23 TYR HE1 H . . . 1 1 16 16 VAL MG1 H . . . . . 3.525 1.972 5.078 . . . . . A . 23 TYR HE1 . . A . 16 VAL MG1 . . . 23 . HE1 . . . . . 16 . HG11 . . c30496_6e5h 1 375 1 OR . 1 1 25 25 VAL MG1 H . . . 1 1 27 27 CYS HA H . . . . . 3.546 1.974 5.118 . . . . . A . 25 VAL MG1 . . A . 27 CYS HA . . . 25 . HG11 . . . . . 27 . HA . . c30496_6e5h 1 375 2 OR . 1 1 16 16 VAL HA H . . . 1 1 25 25 VAL MG1 H . . . . . 3.546 1.974 5.118 . . . . . A . 16 VAL HA . . A . 25 VAL MG1 . . . 16 . HA . . . . . 25 . HG11 . . c30496_6e5h 1 376 1 OR . 1 1 20 20 DPR HA H . . . 1 1 19 19 ASP H H . . . . . 3.755 1.993 5.517 . . . . . A . 20 DPR HA . . A . 19 ASP H . . . 20 . HA . . . . . 19 . HN . . c30496_6e5h 1 376 2 OR . 1 1 17 17 ARG HA H . . . 1 1 19 19 ASP H H . . . . . 3.755 1.993 5.517 . . . . . A . 17 ARG HA . . A . 19 ASP H . . . 17 . HA . . . . . 19 . HN . . c30496_6e5h 1 377 1 OR . 1 1 16 16 VAL H H . . . 1 1 25 25 VAL MG2 H . . . . . 3.916 1.999 5.833 . . . . . A . 16 VAL H . . A . 25 VAL MG2 . . . 16 . HN . . . . . 25 . HG21 . . c30496_6e5h 1 377 2 OR . 1 1 24 24 GLU H H . . . 1 1 25 25 VAL MG2 H . . . . . 3.916 1.999 5.833 . . . . . A . 24 GLU H . . A . 25 VAL MG2 . . . 24 . HN . . . . . 25 . HG21 . . c30496_6e5h 1 378 1 OR . 1 1 16 16 VAL MG1 H . . . 1 1 17 17 ARG HB3 H . . . . . 3.967 2.000 5.934 . . . . . A . 16 VAL MG1 . . A . 17 ARG HB3 . . . 16 . HG11 . . . . . 17 . HB2 . . c30496_6e5h 1 378 2 OR . 1 1 16 16 VAL MG1 H . . . 1 1 8 8 LYS HB2 H . . . . . 3.967 2.000 5.934 . . . . . A . 16 VAL MG1 . . A . 8 LYS HB2 . . . 16 . HG11 . . . . . 8 . HB1 . . c30496_6e5h 1 378 3 OR . 1 1 16 16 VAL MG1 H . . . 1 1 8 8 LYS HB3 H . . . . . 3.967 2.000 5.934 . . . . . A . 16 VAL MG1 . . A . 8 LYS HB3 . . . 16 . HG11 . . . . . 8 . HB2 . . c30496_6e5h 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: unambig.tbl' 1 1 1 32 c30496_6e5h 1 2 '# Restraints file 2: ambig.tbl' 724 1 724 30 c30496_6e5h 1 stop_ loop_ _Gen_dist_constraint_comment_org.ID _Gen_dist_constraint_comment_org.Comment_text _Gen_dist_constraint_comment_org.Comment_begin_line _Gen_dist_constraint_comment_org.Comment_begin_column _Gen_dist_constraint_comment_org.Comment_end_line _Gen_dist_constraint_comment_org.Comment_end_column _Gen_dist_constraint_comment_org.Entry_ID _Gen_dist_constraint_comment_org.Gen_dist_constraint_list_ID 1 'spec=NOESY, no=3, id=0, vol=2.600000e+08' 2 127 2 169 c30496_6e5h 1 2 'spec=NOESY, no=4, id=1, vol=2.530000e+08' 3 127 3 169 c30496_6e5h 1 3 'spec=NOESY, no=5, id=2, vol=2.360000e+08' 4 127 4 169 c30496_6e5h 1 4 'spec=NOESY, no=7, id=4, vol=2.300000e+08' 6 127 6 169 c30496_6e5h 1 5 'spec=NOESY, no=6, id=3, vol=2.350000e+08' 5 127 5 169 c30496_6e5h 1 6 'spec=NOESY, no=8, id=5, vol=2.300000e+08' 10 127 10 169 c30496_6e5h 1 7 'spec=NOESY, no=9, id=6, vol=2.290000e+08' 11 127 11 169 c30496_6e5h 1 8 'spec=NOESY, no=10, id=7, vol=2.290000e+08' 12 127 12 170 c30496_6e5h 1 9 'spec=NOESY, no=11, id=8, vol=2.040000e+08' 13 127 13 170 c30496_6e5h 1 10 'spec=NOESY, no=12, id=9, vol=1.950000e+08' 14 127 14 170 c30496_6e5h 1 11 'spec=NOESY, no=14, id=11, vol=1.280000e+08' 16 127 16 171 c30496_6e5h 1 12 'spec=NOESY, no=13, id=10, vol=1.910000e+08' 15 127 15 171 c30496_6e5h 1 13 'spec=NOESY, no=15, id=12, vol=1.190000e+08' 20 127 20 171 c30496_6e5h 1 14 'spec=NOESY, no=16, id=13, vol=1.170000e+08' 21 127 21 171 c30496_6e5h 1 15 'spec=NOESY, no=17, id=14, vol=1.090000e+08' 22 127 22 171 c30496_6e5h 1 16 'spec=NOESY, no=18, id=15, vol=1.020000e+08' 23 127 23 171 c30496_6e5h 1 17 'spec=NOESY, no=19, id=16, vol=8.980000e+07' 24 127 24 171 c30496_6e5h 1 18 'spec=NOESY, no=21, id=18, vol=8.410000e+07' 25 127 25 171 c30496_6e5h 1 19 'spec=NOESY, no=22, id=19, vol=8.300000e+07' 26 127 26 171 c30496_6e5h 1 20 'spec=NOESY, no=23, id=20, vol=8.270000e+07' 27 127 27 171 c30496_6e5h 1 21 'spec=NOESY, no=24, id=21, vol=8.170000e+07' 28 127 28 171 c30496_6e5h 1 22 'spec=NOESY, no=25, id=22, vol=8.070000e+07' 29 127 29 171 c30496_6e5h 1 23 'spec=NOESY, no=29, id=26, vol=7.250000e+07' 31 127 31 171 c30496_6e5h 1 24 'spec=NOESY, no=26, id=23, vol=7.940000e+07' 30 127 30 171 c30496_6e5h 1 25 'spec=NOESY, no=30, id=27, vol=7.130000e+07' 33 127 33 171 c30496_6e5h 1 26 'spec=NOESY, no=32, id=29, vol=6.130000e+07' 34 127 34 171 c30496_6e5h 1 27 'spec=NOESY, no=33, id=30, vol=6.040000e+07' 35 127 35 171 c30496_6e5h 1 28 'spec=NOESY, no=36, id=33, vol=5.890000e+07' 37 127 37 171 c30496_6e5h 1 29 'spec=NOESY, no=34, id=31, vol=5.940000e+07' 36 127 36 171 c30496_6e5h 1 30 'spec=NOESY, no=37, id=34, vol=5.760000e+07' 39 127 39 171 c30496_6e5h 1 31 'spec=NOESY, no=38, id=35, vol=5.690000e+07' 42 127 42 171 c30496_6e5h 1 32 'spec=NOESY, no=39, id=36, vol=5.630000e+07' 44 127 44 171 c30496_6e5h 1 33 'spec=NOESY, no=41, id=38, vol=5.350000e+07' 53 127 53 171 c30496_6e5h 1 34 'spec=NOESY, no=42, id=39, vol=5.230000e+07' 55 127 55 171 c30496_6e5h 1 35 'spec=NOESY, no=43, id=40, vol=5.180000e+07' 58 127 58 171 c30496_6e5h 1 36 'spec=NOESY, no=44, id=41, vol=5.170000e+07' 60 127 60 171 c30496_6e5h 1 37 'spec=NOESY, no=46, id=43, vol=5.110000e+07' 63 127 63 171 c30496_6e5h 1 38 'spec=NOESY, no=45, id=42, vol=5.130000e+07' 62 127 62 171 c30496_6e5h 1 39 'spec=NOESY, no=47, id=44, vol=5.070000e+07' 65 127 65 171 c30496_6e5h 1 40 'spec=NOESY, no=48, id=45, vol=5.050000e+07' 67 127 67 171 c30496_6e5h 1 41 'spec=NOESY, no=49, id=46, vol=5.010000e+07' 70 127 70 171 c30496_6e5h 1 42 'spec=NOESY, no=50, id=47, vol=4.870000e+07' 72 127 72 171 c30496_6e5h 1 43 'spec=NOESY, no=51, id=48, vol=4.800000e+07' 74 127 74 171 c30496_6e5h 1 44 'spec=NOESY, no=52, id=49, vol=4.770000e+07' 75 127 75 171 c30496_6e5h 1 45 'spec=NOESY, no=54, id=51, vol=4.690000e+07' 77 127 77 171 c30496_6e5h 1 46 'spec=NOESY, no=53, id=50, vol=4.700000e+07' 76 127 76 171 c30496_6e5h 1 47 'spec=NOESY, no=55, id=52, vol=4.680000e+07' 80 127 80 171 c30496_6e5h 1 48 'spec=NOESY, no=56, id=53, vol=4.560000e+07' 82 127 82 171 c30496_6e5h 1 49 'spec=NOESY, no=57, id=54, vol=4.550000e+07' 84 127 84 171 c30496_6e5h 1 50 'spec=NOESY, no=58, id=55, vol=4.540000e+07' 86 127 86 171 c30496_6e5h 1 51 'spec=NOESY, no=60, id=57, vol=4.500000e+07' 88 127 88 171 c30496_6e5h 1 52 'spec=NOESY, no=59, id=56, vol=4.510000e+07' 87 127 87 171 c30496_6e5h 1 53 'spec=NOESY, no=62, id=59, vol=4.390000e+07' 91 127 91 171 c30496_6e5h 1 54 'spec=NOESY, no=61, id=58, vol=4.480000e+07' 90 127 90 171 c30496_6e5h 1 55 'spec=NOESY, no=63, id=60, vol=4.280000e+07' 94 127 94 171 c30496_6e5h 1 56 'spec=NOESY, no=65, id=62, vol=4.260000e+07' 96 127 96 171 c30496_6e5h 1 57 'spec=NOESY, no=64, id=61, vol=4.260000e+07' 95 127 95 171 c30496_6e5h 1 58 'spec=NOESY, no=68, id=65, vol=4.090000e+07' 106 127 106 171 c30496_6e5h 1 59 'spec=NOESY, no=66, id=63, vol=4.250000e+07' 105 127 105 171 c30496_6e5h 1 60 'spec=NOESY, no=70, id=67, vol=3.980000e+07' 108 127 108 171 c30496_6e5h 1 61 'spec=NOESY, no=71, id=68, vol=3.920000e+07' 109 127 109 171 c30496_6e5h 1 62 'spec=NOESY, no=73, id=70, vol=3.880000e+07' 111 127 111 171 c30496_6e5h 1 63 'spec=NOESY, no=72, id=69, vol=3.900000e+07' 110 127 110 171 c30496_6e5h 1 64 'spec=NOESY, no=75, id=72, vol=3.870000e+07' 114 127 114 171 c30496_6e5h 1 65 'spec=NOESY, no=76, id=73, vol=3.850000e+07' 115 127 115 171 c30496_6e5h 1 66 'spec=NOESY, no=77, id=74, vol=3.830000e+07' 116 127 116 171 c30496_6e5h 1 67 'spec=NOESY, no=78, id=75, vol=3.760000e+07' 117 127 117 171 c30496_6e5h 1 68 'spec=NOESY, no=79, id=76, vol=3.760000e+07' 118 127 118 171 c30496_6e5h 1 69 'spec=NOESY, no=82, id=79, vol=3.730000e+07' 120 127 120 171 c30496_6e5h 1 70 'spec=NOESY, no=81, id=78, vol=3.760000e+07' 119 127 119 171 c30496_6e5h 1 71 'spec=NOESY, no=83, id=80, vol=3.730000e+07' 122 127 122 171 c30496_6e5h 1 72 'spec=NOESY, no=85, id=82, vol=3.660000e+07' 124 127 124 171 c30496_6e5h 1 73 'spec=NOESY, no=84, id=81, vol=3.680000e+07' 123 127 123 171 c30496_6e5h 1 74 'spec=NOESY, no=86, id=83, vol=3.650000e+07' 127 127 127 171 c30496_6e5h 1 75 'spec=NOESY, no=87, id=84, vol=3.610000e+07' 128 127 128 171 c30496_6e5h 1 76 'spec=NOESY, no=89, id=86, vol=3.510000e+07' 130 127 130 171 c30496_6e5h 1 77 'spec=NOESY, no=88, id=85, vol=3.570000e+07' 129 127 129 171 c30496_6e5h 1 78 'spec=NOESY, no=90, id=87, vol=3.500000e+07' 132 127 132 171 c30496_6e5h 1 79 'spec=NOESY, no=92, id=89, vol=3.430000e+07' 133 127 133 171 c30496_6e5h 1 80 'spec=NOESY, no=94, id=91, vol=3.370000e+07' 135 127 135 171 c30496_6e5h 1 81 'spec=NOESY, no=93, id=90, vol=3.390000e+07' 134 127 134 171 c30496_6e5h 1 82 'spec=NOESY, no=95, id=92, vol=3.340000e+07' 138 127 138 171 c30496_6e5h 1 83 'spec=NOESY, no=97, id=94, vol=3.300000e+07' 139 127 139 171 c30496_6e5h 1 84 'spec=NOESY, no=98, id=95, vol=3.290000e+07' 140 127 140 171 c30496_6e5h 1 85 'spec=NOESY, no=100, id=97, vol=3.260000e+07' 142 127 142 172 c30496_6e5h 1 86 'spec=NOESY, no=99, id=96, vol=3.260000e+07' 141 127 141 171 c30496_6e5h 1 87 'spec=NOESY, no=102, id=99, vol=3.240000e+07' 144 127 144 172 c30496_6e5h 1 88 'spec=NOESY, no=104, id=101, vol=3.210000e+07' 148 127 148 173 c30496_6e5h 1 89 'spec=NOESY, no=103, id=100, vol=3.210000e+07' 147 127 147 173 c30496_6e5h 1 90 'spec=NOESY, no=106, id=103, vol=3.200000e+07' 152 127 152 173 c30496_6e5h 1 91 'spec=NOESY, no=105, id=102, vol=3.210000e+07' 151 127 151 173 c30496_6e5h 1 92 'spec=NOESY, no=109, id=106, vol=3.180000e+07' 155 127 155 173 c30496_6e5h 1 93 'spec=NOESY, no=107, id=104, vol=3.200000e+07' 154 127 154 173 c30496_6e5h 1 94 'spec=NOESY, no=110, id=107, vol=3.160000e+07' 161 127 161 173 c30496_6e5h 1 95 'spec=NOESY, no=112, id=109, vol=3.150000e+07' 164 127 164 173 c30496_6e5h 1 96 'spec=NOESY, no=111, id=108, vol=3.150000e+07' 163 127 163 173 c30496_6e5h 1 97 'spec=NOESY, no=113, id=110, vol=3.060000e+07' 167 127 167 173 c30496_6e5h 1 98 'spec=NOESY, no=115, id=112, vol=2.920000e+07' 168 127 168 173 c30496_6e5h 1 99 'spec=NOESY, no=117, id=114, vol=2.800000e+07' 170 127 170 173 c30496_6e5h 1 100 'spec=NOESY, no=116, id=113, vol=2.850000e+07' 169 127 169 173 c30496_6e5h 1 101 'spec=NOESY, no=120, id=117, vol=2.720000e+07' 174 127 174 173 c30496_6e5h 1 102 'spec=NOESY, no=118, id=115, vol=2.780000e+07' 173 127 173 173 c30496_6e5h 1 103 'spec=NOESY, no=121, id=118, vol=2.610000e+07' 183 127 183 173 c30496_6e5h 1 104 'spec=NOESY, no=122, id=119, vol=2.580000e+07' 185 127 185 173 c30496_6e5h 1 105 'spec=NOESY, no=123, id=120, vol=2.580000e+07' 187 127 187 173 c30496_6e5h 1 106 'spec=NOESY, no=124, id=121, vol=2.580000e+07' 190 127 190 173 c30496_6e5h 1 107 'spec=NOESY, no=125, id=122, vol=2.570000e+07' 192 127 192 173 c30496_6e5h 1 108 'spec=NOESY, no=127, id=124, vol=2.540000e+07' 194 127 194 173 c30496_6e5h 1 109 'spec=NOESY, no=129, id=126, vol=2.520000e+07' 197 127 197 173 c30496_6e5h 1 110 'spec=NOESY, no=128, id=125, vol=2.530000e+07' 196 127 196 173 c30496_6e5h 1 111 'spec=NOESY, no=131, id=128, vol=2.480000e+07' 201 127 201 173 c30496_6e5h 1 112 'spec=NOESY, no=130, id=127, vol=2.490000e+07' 200 127 200 173 c30496_6e5h 1 113 'spec=NOESY, no=132, id=129, vol=2.470000e+07' 203 127 203 173 c30496_6e5h 1 114 'spec=NOESY, no=134, id=131, vol=2.450000e+07' 205 127 205 173 c30496_6e5h 1 115 'spec=NOESY, no=133, id=130, vol=2.470000e+07' 204 127 204 173 c30496_6e5h 1 116 'spec=NOESY, no=135, id=132, vol=2.450000e+07' 207 127 207 173 c30496_6e5h 1 117 'spec=NOESY, no=137, id=134, vol=2.380000e+07' 209 127 209 173 c30496_6e5h 1 118 'spec=NOESY, no=136, id=133, vol=2.410000e+07' 208 127 208 173 c30496_6e5h 1 119 'spec=NOESY, no=139, id=136, vol=2.360000e+07' 212 127 212 173 c30496_6e5h 1 120 'spec=NOESY, no=138, id=135, vol=2.360000e+07' 211 127 211 173 c30496_6e5h 1 121 'spec=NOESY, no=140, id=137, vol=2.330000e+07' 215 127 215 173 c30496_6e5h 1 122 'spec=NOESY, no=141, id=138, vol=2.330000e+07' 218 127 218 173 c30496_6e5h 1 123 'spec=NOESY, no=142, id=139, vol=2.290000e+07' 220 127 220 173 c30496_6e5h 1 124 'spec=NOESY, no=143, id=140, vol=2.290000e+07' 221 127 221 173 c30496_6e5h 1 125 'spec=NOESY, no=145, id=142, vol=2.280000e+07' 223 127 223 173 c30496_6e5h 1 126 'spec=NOESY, no=144, id=141, vol=2.280000e+07' 222 127 222 173 c30496_6e5h 1 127 'spec=NOESY, no=147, id=144, vol=2.260000e+07' 227 127 227 173 c30496_6e5h 1 128 'spec=NOESY, no=146, id=143, vol=2.280000e+07' 226 127 226 173 c30496_6e5h 1 129 'spec=NOESY, no=148, id=145, vol=2.240000e+07' 231 127 231 173 c30496_6e5h 1 130 'spec=NOESY, no=150, id=147, vol=2.220000e+07' 234 127 234 173 c30496_6e5h 1 131 'spec=NOESY, no=149, id=146, vol=2.230000e+07' 233 127 233 173 c30496_6e5h 1 132 'spec=NOESY, no=151, id=148, vol=2.220000e+07' 237 127 237 173 c30496_6e5h 1 133 'spec=NOESY, no=153, id=150, vol=2.200000e+07' 241 127 241 173 c30496_6e5h 1 134 'spec=NOESY, no=152, id=149, vol=2.200000e+07' 240 127 240 173 c30496_6e5h 1 135 'spec=NOESY, no=155, id=152, vol=2.190000e+07' 245 127 245 173 c30496_6e5h 1 136 'spec=NOESY, no=154, id=151, vol=2.200000e+07' 244 127 244 173 c30496_6e5h 1 137 'spec=NOESY, no=157, id=154, vol=2.180000e+07' 248 127 248 173 c30496_6e5h 1 138 'spec=NOESY, no=156, id=153, vol=2.180000e+07' 247 127 247 173 c30496_6e5h 1 139 'spec=NOESY, no=158, id=155, vol=2.170000e+07' 251 127 251 173 c30496_6e5h 1 140 'spec=NOESY, no=160, id=157, vol=2.170000e+07' 253 127 253 173 c30496_6e5h 1 141 'spec=NOESY, no=159, id=156, vol=2.170000e+07' 252 127 252 173 c30496_6e5h 1 142 'spec=NOESY, no=162, id=159, vol=2.160000e+07' 256 127 256 173 c30496_6e5h 1 143 'spec=NOESY, no=161, id=158, vol=2.170000e+07' 255 127 255 173 c30496_6e5h 1 144 'spec=NOESY, no=163, id=160, vol=2.130000e+07' 265 127 265 173 c30496_6e5h 1 145 'spec=NOESY, no=164, id=161, vol=2.080000e+07' 266 127 266 173 c30496_6e5h 1 146 'spec=NOESY, no=165, id=162, vol=2.070000e+07' 267 127 267 173 c30496_6e5h 1 147 'spec=NOESY, no=167, id=164, vol=2.050000e+07' 269 127 269 173 c30496_6e5h 1 148 'spec=NOESY, no=166, id=163, vol=2.060000e+07' 268 127 268 173 c30496_6e5h 1 149 'spec=NOESY, no=168, id=165, vol=2.050000e+07' 271 127 271 173 c30496_6e5h 1 150 'spec=NOESY, no=169, id=166, vol=2.050000e+07' 274 127 274 173 c30496_6e5h 1 151 'spec=NOESY, no=170, id=167, vol=2.040000e+07' 276 127 276 173 c30496_6e5h 1 152 'spec=NOESY, no=173, id=170, vol=2.030000e+07' 278 127 278 173 c30496_6e5h 1 153 'spec=NOESY, no=171, id=168, vol=2.040000e+07' 277 127 277 173 c30496_6e5h 1 154 'spec=NOESY, no=174, id=171, vol=2.020000e+07' 284 127 284 173 c30496_6e5h 1 155 'spec=NOESY, no=175, id=172, vol=2.000000e+07' 285 127 285 173 c30496_6e5h 1 156 'spec=NOESY, no=176, id=173, vol=1.990000e+07' 286 127 286 173 c30496_6e5h 1 157 'spec=NOESY, no=177, id=174, vol=1.980000e+07' 287 127 287 173 c30496_6e5h 1 158 'spec=NOESY, no=179, id=176, vol=1.970000e+07' 289 127 289 173 c30496_6e5h 1 159 'spec=NOESY, no=178, id=175, vol=1.970000e+07' 288 127 288 173 c30496_6e5h 1 160 'spec=NOESY, no=180, id=177, vol=1.970000e+07' 291 127 291 173 c30496_6e5h 1 161 'spec=NOESY, no=181, id=178, vol=1.970000e+07' 293 127 293 173 c30496_6e5h 1 162 'spec=NOESY, no=183, id=180, vol=1.940000e+07' 297 127 297 173 c30496_6e5h 1 163 'spec=NOESY, no=182, id=179, vol=1.960000e+07' 296 127 296 173 c30496_6e5h 1 164 'spec=NOESY, no=185, id=182, vol=1.930000e+07' 307 127 307 173 c30496_6e5h 1 165 'spec=NOESY, no=184, id=181, vol=1.930000e+07' 306 127 306 173 c30496_6e5h 1 166 'spec=NOESY, no=186, id=183, vol=1.880000e+07' 310 127 310 173 c30496_6e5h 1 167 'spec=NOESY, no=187, id=184, vol=1.880000e+07' 311 127 311 173 c30496_6e5h 1 168 'spec=NOESY, no=190, id=187, vol=1.860000e+07' 313 127 313 173 c30496_6e5h 1 169 'spec=NOESY, no=189, id=186, vol=1.860000e+07' 312 127 312 173 c30496_6e5h 1 170 'spec=NOESY, no=191, id=188, vol=1.860000e+07' 316 127 316 173 c30496_6e5h 1 171 'spec=NOESY, no=193, id=190, vol=1.820000e+07' 319 127 319 173 c30496_6e5h 1 172 'spec=NOESY, no=192, id=189, vol=1.860000e+07' 318 127 318 173 c30496_6e5h 1 173 'spec=NOESY, no=194, id=191, vol=1.820000e+07' 321 127 321 173 c30496_6e5h 1 174 'spec=NOESY, no=195, id=192, vol=1.800000e+07' 323 127 323 173 c30496_6e5h 1 175 'spec=NOESY, no=196, id=193, vol=1.790000e+07' 324 127 324 173 c30496_6e5h 1 176 'spec=NOESY, no=197, id=194, vol=1.790000e+07' 325 127 325 173 c30496_6e5h 1 177 'spec=NOESY, no=198, id=195, vol=1.790000e+07' 326 127 326 173 c30496_6e5h 1 178 'spec=NOESY, no=199, id=196, vol=1.780000e+07' 327 127 327 173 c30496_6e5h 1 179 'spec=NOESY, no=201, id=198, vol=1.760000e+07' 329 127 329 173 c30496_6e5h 1 180 'spec=NOESY, no=200, id=197, vol=1.780000e+07' 328 127 328 173 c30496_6e5h 1 181 'spec=NOESY, no=204, id=201, vol=1.730000e+07' 332 127 332 173 c30496_6e5h 1 182 'spec=NOESY, no=202, id=199, vol=1.750000e+07' 331 127 331 173 c30496_6e5h 1 183 'spec=NOESY, no=205, id=202, vol=1.730000e+07' 334 127 334 173 c30496_6e5h 1 184 'spec=NOESY, no=206, id=203, vol=1.680000e+07' 335 127 335 173 c30496_6e5h 1 185 'spec=NOESY, no=207, id=204, vol=1.670000e+07' 336 127 336 173 c30496_6e5h 1 186 'spec=NOESY, no=209, id=206, vol=1.650000e+07' 338 127 338 173 c30496_6e5h 1 187 'spec=NOESY, no=208, id=205, vol=1.660000e+07' 337 127 337 173 c30496_6e5h 1 188 'spec=NOESY, no=211, id=208, vol=1.620000e+07' 344 127 344 173 c30496_6e5h 1 189 'spec=NOESY, no=213, id=210, vol=1.600000e+07' 346 127 346 173 c30496_6e5h 1 190 'spec=NOESY, no=212, id=209, vol=1.620000e+07' 345 127 345 173 c30496_6e5h 1 191 'spec=NOESY, no=215, id=212, vol=1.560000e+07' 349 127 349 173 c30496_6e5h 1 192 'spec=NOESY, no=218, id=215, vol=1.540000e+07' 351 127 351 173 c30496_6e5h 1 193 'spec=NOESY, no=217, id=214, vol=1.540000e+07' 350 127 350 173 c30496_6e5h 1 194 'spec=NOESY, no=220, id=217, vol=1.510000e+07' 354 127 354 173 c30496_6e5h 1 195 'spec=NOESY, no=219, id=216, vol=1.530000e+07' 353 127 353 173 c30496_6e5h 1 196 'spec=NOESY, no=221, id=218, vol=1.500000e+07' 360 127 360 173 c30496_6e5h 1 197 'spec=NOESY, no=223, id=220, vol=1.480000e+07' 364 127 364 173 c30496_6e5h 1 198 'spec=NOESY, no=222, id=219, vol=1.490000e+07' 363 127 363 173 c30496_6e5h 1 199 'spec=NOESY, no=224, id=221, vol=1.470000e+07' 373 127 373 173 c30496_6e5h 1 200 'spec=NOESY, no=225, id=222, vol=1.470000e+07' 375 127 375 173 c30496_6e5h 1 201 'spec=NOESY, no=228, id=225, vol=1.420000e+07' 378 127 378 173 c30496_6e5h 1 202 'spec=NOESY, no=229, id=226, vol=1.400000e+07' 380 127 380 173 c30496_6e5h 1 203 'spec=NOESY, no=231, id=228, vol=1.390000e+07' 382 127 382 173 c30496_6e5h 1 204 'spec=NOESY, no=230, id=227, vol=1.390000e+07' 381 127 381 173 c30496_6e5h 1 205 'spec=NOESY, no=232, id=229, vol=1.370000e+07' 384 127 384 173 c30496_6e5h 1 206 'spec=NOESY, no=233, id=230, vol=1.370000e+07' 386 127 386 173 c30496_6e5h 1 207 'spec=NOESY, no=234, id=231, vol=1.320000e+07' 392 127 392 173 c30496_6e5h 1 208 'spec=NOESY, no=235, id=232, vol=1.320000e+07' 393 127 393 173 c30496_6e5h 1 209 'spec=NOESY, no=237, id=234, vol=1.320000e+07' 395 127 395 173 c30496_6e5h 1 210 'spec=NOESY, no=236, id=233, vol=1.320000e+07' 394 127 394 173 c30496_6e5h 1 211 'spec=NOESY, no=238, id=235, vol=1.320000e+07' 401 127 401 173 c30496_6e5h 1 212 'spec=NOESY, no=240, id=237, vol=1.310000e+07' 403 127 403 173 c30496_6e5h 1 213 'spec=NOESY, no=239, id=236, vol=1.310000e+07' 402 127 402 173 c30496_6e5h 1 214 'spec=NOESY, no=241, id=238, vol=1.300000e+07' 405 127 405 173 c30496_6e5h 1 215 'spec=NOESY, no=242, id=239, vol=1.300000e+07' 411 127 411 173 c30496_6e5h 1 216 'spec=NOESY, no=243, id=240, vol=1.290000e+07' 413 127 413 173 c30496_6e5h 1 217 'spec=NOESY, no=244, id=241, vol=1.280000e+07' 416 127 416 173 c30496_6e5h 1 218 'spec=NOESY, no=245, id=242, vol=1.270000e+07' 418 127 418 173 c30496_6e5h 1 219 'spec=NOESY, no=246, id=243, vol=1.270000e+07' 419 127 419 173 c30496_6e5h 1 220 'spec=NOESY, no=247, id=244, vol=1.260000e+07' 420 127 420 173 c30496_6e5h 1 221 'spec=NOESY, no=249, id=246, vol=1.240000e+07' 421 127 421 173 c30496_6e5h 1 222 'spec=NOESY, no=252, id=249, vol=1.230000e+07' 423 127 423 173 c30496_6e5h 1 223 'spec=NOESY, no=251, id=248, vol=1.230000e+07' 422 127 422 173 c30496_6e5h 1 224 'spec=NOESY, no=253, id=250, vol=1.220000e+07' 425 127 425 173 c30496_6e5h 1 225 'spec=NOESY, no=255, id=252, vol=1.200000e+07' 427 127 427 173 c30496_6e5h 1 226 'spec=NOESY, no=254, id=251, vol=1.200000e+07' 426 127 426 173 c30496_6e5h 1 227 'spec=NOESY, no=256, id=253, vol=1.200000e+07' 429 127 429 173 c30496_6e5h 1 228 'spec=NOESY, no=258, id=255, vol=1.190000e+07' 431 127 431 173 c30496_6e5h 1 229 'spec=NOESY, no=257, id=254, vol=1.190000e+07' 430 127 430 173 c30496_6e5h 1 230 'spec=NOESY, no=259, id=256, vol=1.160000e+07' 433 127 433 173 c30496_6e5h 1 231 'spec=NOESY, no=261, id=258, vol=1.150000e+07' 440 127 440 173 c30496_6e5h 1 232 'spec=NOESY, no=260, id=257, vol=1.160000e+07' 439 127 439 173 c30496_6e5h 1 233 'spec=NOESY, no=263, id=260, vol=1.150000e+07' 444 127 444 173 c30496_6e5h 1 234 'spec=NOESY, no=262, id=259, vol=1.150000e+07' 443 127 443 173 c30496_6e5h 1 235 'spec=NOESY, no=264, id=261, vol=1.140000e+07' 453 127 453 173 c30496_6e5h 1 236 'spec=NOESY, no=265, id=262, vol=1.130000e+07' 456 127 456 173 c30496_6e5h 1 237 'spec=NOESY, no=267, id=264, vol=1.110000e+07' 459 127 459 173 c30496_6e5h 1 238 'spec=NOESY, no=266, id=263, vol=1.130000e+07' 458 127 458 173 c30496_6e5h 1 239 'spec=NOESY, no=269, id=266, vol=1.110000e+07' 462 127 462 173 c30496_6e5h 1 240 'spec=NOESY, no=271, id=268, vol=1.110000e+07' 464 127 464 173 c30496_6e5h 1 241 'spec=NOESY, no=270, id=267, vol=1.110000e+07' 463 127 463 173 c30496_6e5h 1 242 'spec=NOESY, no=272, id=269, vol=1.110000e+07' 470 127 470 173 c30496_6e5h 1 243 'spec=NOESY, no=273, id=270, vol=1.100000e+07' 471 127 471 173 c30496_6e5h 1 244 'spec=NOESY, no=274, id=271, vol=1.100000e+07' 472 127 472 173 c30496_6e5h 1 245 'spec=NOESY, no=276, id=273, vol=1.090000e+07' 474 127 474 173 c30496_6e5h 1 246 'spec=NOESY, no=275, id=272, vol=1.090000e+07' 473 127 473 173 c30496_6e5h 1 247 'spec=NOESY, no=278, id=275, vol=1.090000e+07' 478 127 478 173 c30496_6e5h 1 248 'spec=NOESY, no=277, id=274, vol=1.090000e+07' 477 127 477 173 c30496_6e5h 1 249 'spec=NOESY, no=279, id=276, vol=1.080000e+07' 481 127 481 173 c30496_6e5h 1 250 'spec=NOESY, no=280, id=277, vol=1.070000e+07' 482 127 482 173 c30496_6e5h 1 251 'spec=NOESY, no=281, id=278, vol=1.060000e+07' 483 127 483 173 c30496_6e5h 1 252 'spec=NOESY, no=283, id=280, vol=1.040000e+07' 484 127 484 173 c30496_6e5h 1 253 'spec=NOESY, no=284, id=281, vol=1.030000e+07' 485 127 485 173 c30496_6e5h 1 254 'spec=NOESY, no=285, id=282, vol=1.020000e+07' 486 127 486 173 c30496_6e5h 1 255 'spec=NOESY, no=286, id=283, vol=1.000000e+07' 487 127 487 173 c30496_6e5h 1 256 'spec=NOESY, no=288, id=285, vol=9.980000e+06' 489 127 489 173 c30496_6e5h 1 257 'spec=NOESY, no=287, id=284, vol=1.000000e+07' 488 127 488 173 c30496_6e5h 1 258 'spec=NOESY, no=289, id=286, vol=9.940000e+06' 491 127 491 173 c30496_6e5h 1 259 'spec=NOESY, no=290, id=287, vol=9.940000e+06' 497 127 497 173 c30496_6e5h 1 260 'spec=NOESY, no=291, id=288, vol=9.900000e+06' 500 127 500 173 c30496_6e5h 1 261 'spec=NOESY, no=292, id=289, vol=9.890000e+06' 501 127 501 173 c30496_6e5h 1 262 'spec=NOESY, no=293, id=290, vol=9.850000e+06' 502 127 502 173 c30496_6e5h 1 263 'spec=NOESY, no=296, id=293, vol=9.750000e+06' 504 127 504 173 c30496_6e5h 1 264 'spec=NOESY, no=294, id=291, vol=9.780000e+06' 503 127 503 173 c30496_6e5h 1 265 'spec=NOESY, no=297, id=294, vol=9.740000e+06' 507 127 507 173 c30496_6e5h 1 266 'spec=NOESY, no=298, id=295, vol=9.730000e+06' 510 127 510 173 c30496_6e5h 1 267 'spec=NOESY, no=299, id=296, vol=9.250000e+06' 519 127 519 173 c30496_6e5h 1 268 'spec=NOESY, no=301, id=298, vol=9.130000e+06' 522 127 522 173 c30496_6e5h 1 269 'spec=NOESY, no=300, id=297, vol=9.240000e+06' 521 127 521 173 c30496_6e5h 1 270 'spec=NOESY, no=302, id=299, vol=9.110000e+06' 528 127 528 173 c30496_6e5h 1 271 'spec=NOESY, no=303, id=300, vol=9.070000e+06' 529 127 529 173 c30496_6e5h 1 272 'spec=NOESY, no=306, id=303, vol=8.840000e+06' 531 127 531 173 c30496_6e5h 1 273 'spec=NOESY, no=305, id=302, vol=8.910000e+06' 530 127 530 173 c30496_6e5h 1 274 'spec=NOESY, no=308, id=305, vol=8.750000e+06' 538 127 538 173 c30496_6e5h 1 275 'spec=NOESY, no=307, id=304, vol=8.770000e+06' 537 127 537 173 c30496_6e5h 1 276 'spec=NOESY, no=309, id=306, vol=8.730000e+06' 540 127 540 173 c30496_6e5h 1 277 'spec=NOESY, no=310, id=307, vol=8.690000e+06' 549 127 549 173 c30496_6e5h 1 278 'spec=NOESY, no=314, id=311, vol=8.230000e+06' 553 127 553 173 c30496_6e5h 1 279 'spec=NOESY, no=311, id=308, vol=8.670000e+06' 552 127 552 173 c30496_6e5h 1 280 'spec=NOESY, no=315, id=312, vol=8.180000e+06' 556 127 556 173 c30496_6e5h 1 281 'spec=NOESY, no=316, id=313, vol=8.150000e+06' 558 127 558 173 c30496_6e5h 1 282 'spec=NOESY, no=317, id=314, vol=8.130000e+06' 561 127 561 173 c30496_6e5h 1 283 'spec=NOESY, no=318, id=315, vol=8.120000e+06' 564 127 564 173 c30496_6e5h 1 284 'spec=NOESY, no=319, id=316, vol=8.100000e+06' 570 127 570 173 c30496_6e5h 1 285 'spec=NOESY, no=320, id=317, vol=8.040000e+06' 571 127 571 173 c30496_6e5h 1 286 'spec=NOESY, no=322, id=319, vol=7.920000e+06' 572 127 572 173 c30496_6e5h 1 287 'spec=NOESY, no=324, id=321, vol=7.880000e+06' 574 127 574 173 c30496_6e5h 1 288 'spec=NOESY, no=323, id=320, vol=7.920000e+06' 573 127 573 173 c30496_6e5h 1 289 'spec=NOESY, no=327, id=324, vol=7.730000e+06' 578 127 578 173 c30496_6e5h 1 290 'spec=NOESY, no=325, id=322, vol=7.770000e+06' 577 127 577 173 c30496_6e5h 1 291 'spec=NOESY, no=328, id=325, vol=7.710000e+06' 581 127 581 173 c30496_6e5h 1 292 'spec=NOESY, no=329, id=326, vol=7.650000e+06' 583 127 583 173 c30496_6e5h 1 293 'spec=NOESY, no=330, id=327, vol=7.630000e+06' 586 127 586 173 c30496_6e5h 1 294 'spec=NOESY, no=331, id=328, vol=7.430000e+06' 588 127 588 173 c30496_6e5h 1 295 'spec=NOESY, no=332, id=329, vol=7.350000e+06' 589 127 589 173 c30496_6e5h 1 296 'spec=NOESY, no=333, id=330, vol=7.340000e+06' 590 127 590 173 c30496_6e5h 1 297 'spec=NOESY, no=334, id=331, vol=7.250000e+06' 591 127 591 173 c30496_6e5h 1 298 'spec=NOESY, no=336, id=333, vol=7.140000e+06' 593 127 593 173 c30496_6e5h 1 299 'spec=NOESY, no=335, id=332, vol=7.240000e+06' 592 127 592 173 c30496_6e5h 1 300 'spec=NOESY, no=337, id=334, vol=7.140000e+06' 595 127 595 173 c30496_6e5h 1 301 'spec=NOESY, no=340, id=337, vol=6.890000e+06' 596 127 596 173 c30496_6e5h 1 302 'spec=NOESY, no=341, id=338, vol=6.870000e+06' 597 127 597 173 c30496_6e5h 1 303 'spec=NOESY, no=342, id=339, vol=6.840000e+06' 598 127 598 173 c30496_6e5h 1 304 'spec=NOESY, no=344, id=341, vol=6.470000e+06' 600 127 600 173 c30496_6e5h 1 305 'spec=NOESY, no=343, id=340, vol=6.810000e+06' 599 127 599 173 c30496_6e5h 1 306 'spec=NOESY, no=346, id=343, vol=6.300000e+06' 604 127 604 173 c30496_6e5h 1 307 'spec=NOESY, no=345, id=342, vol=6.360000e+06' 603 127 603 173 c30496_6e5h 1 308 'spec=NOESY, no=348, id=345, vol=6.080000e+06' 607 127 607 173 c30496_6e5h 1 309 'spec=NOESY, no=349, id=346, vol=6.010000e+06' 610 127 610 173 c30496_6e5h 1 310 'spec=NOESY, no=350, id=347, vol=5.980000e+06' 612 127 612 173 c30496_6e5h 1 311 'spec=NOESY, no=353, id=350, vol=5.900000e+06' 615 127 615 173 c30496_6e5h 1 312 'spec=NOESY, no=352, id=349, vol=5.930000e+06' 614 127 614 173 c30496_6e5h 1 313 'spec=NOESY, no=355, id=352, vol=5.820000e+06' 618 127 618 173 c30496_6e5h 1 314 'spec=NOESY, no=354, id=351, vol=5.840000e+06' 617 127 617 173 c30496_6e5h 1 315 'spec=NOESY, no=358, id=355, vol=5.580000e+06' 622 127 622 173 c30496_6e5h 1 316 'spec=NOESY, no=357, id=354, vol=5.680000e+06' 621 127 621 173 c30496_6e5h 1 317 'spec=NOESY, no=359, id=356, vol=5.440000e+06' 625 127 625 173 c30496_6e5h 1 318 'spec=NOESY, no=360, id=357, vol=5.380000e+06' 631 127 631 173 c30496_6e5h 1 319 'spec=NOESY, no=361, id=358, vol=5.330000e+06' 633 127 633 173 c30496_6e5h 1 320 'spec=NOESY, no=362, id=359, vol=5.330000e+06' 634 127 634 173 c30496_6e5h 1 321 'spec=NOESY, no=364, id=361, vol=5.310000e+06' 636 127 636 173 c30496_6e5h 1 322 'spec=NOESY, no=363, id=360, vol=5.310000e+06' 635 127 635 173 c30496_6e5h 1 323 'spec=NOESY, no=365, id=362, vol=5.310000e+06' 639 127 639 173 c30496_6e5h 1 324 'spec=NOESY, no=366, id=363, vol=5.270000e+06' 641 127 641 173 c30496_6e5h 1 325 'spec=NOESY, no=368, id=365, vol=5.140000e+06' 644 127 644 173 c30496_6e5h 1 326 'spec=NOESY, no=370, id=367, vol=4.940000e+06' 647 127 647 173 c30496_6e5h 1 327 'spec=NOESY, no=371, id=368, vol=4.940000e+06' 648 127 648 173 c30496_6e5h 1 328 'spec=NOESY, no=372, id=369, vol=4.850000e+06' 649 127 649 173 c30496_6e5h 1 329 'spec=NOESY, no=374, id=371, vol=4.690000e+06' 651 127 651 173 c30496_6e5h 1 330 'spec=NOESY, no=373, id=370, vol=4.700000e+06' 650 127 650 173 c30496_6e5h 1 331 'spec=NOESY, no=376, id=373, vol=4.670000e+06' 653 127 653 173 c30496_6e5h 1 332 'spec=NOESY, no=379, id=376, vol=4.430000e+06' 660 127 660 173 c30496_6e5h 1 333 'spec=NOESY, no=377, id=374, vol=4.550000e+06' 659 127 659 173 c30496_6e5h 1 334 'spec=NOESY, no=380, id=377, vol=4.300000e+06' 663 127 663 173 c30496_6e5h 1 335 'spec=NOESY, no=381, id=378, vol=4.280000e+06' 666 127 666 173 c30496_6e5h 1 336 'spec=NOESY, no=382, id=379, vol=4.250000e+06' 669 127 669 173 c30496_6e5h 1 337 'spec=NOESY, no=383, id=380, vol=4.100000e+06' 672 127 672 173 c30496_6e5h 1 338 'spec=NOESY, no=385, id=382, vol=4.090000e+06' 676 127 676 173 c30496_6e5h 1 339 'spec=NOESY, no=384, id=381, vol=4.100000e+06' 675 127 675 173 c30496_6e5h 1 340 'spec=NOESY, no=388, id=385, vol=3.960000e+06' 680 127 680 173 c30496_6e5h 1 341 'spec=NOESY, no=387, id=384, vol=4.010000e+06' 679 127 679 173 c30496_6e5h 1 342 'spec=NOESY, no=390, id=387, vol=3.660000e+06' 682 127 682 173 c30496_6e5h 1 343 'spec=NOESY, no=391, id=388, vol=3.390000e+06' 685 127 685 173 c30496_6e5h 1 344 'spec=NOESY, no=392, id=389, vol=3.340000e+06' 687 127 687 173 c30496_6e5h 1 345 'spec=NOESY, no=393, id=390, vol=3.230000e+06' 690 127 690 173 c30496_6e5h 1 346 'spec=NOESY, no=394, id=391, vol=3.160000e+06' 692 127 692 173 c30496_6e5h 1 347 'spec=NOESY, no=397, id=394, vol=3.060000e+06' 696 127 696 173 c30496_6e5h 1 348 'spec=NOESY, no=395, id=392, vol=3.120000e+06' 695 127 695 173 c30496_6e5h 1 349 'spec=NOESY, no=398, id=395, vol=2.800000e+06' 699 127 699 173 c30496_6e5h 1 350 'spec=NOESY, no=402, id=398, vol=2.510000e+06' 702 127 702 173 c30496_6e5h 1 351 'spec=NOESY, no=403, id=399, vol=2.470000e+06' 708 127 708 173 c30496_6e5h 1 352 'spec=NOESY, no=404, id=400, vol=2.380000e+06' 711 127 711 173 c30496_6e5h 1 353 'spec=NOESY, no=405, id=401, vol=2.270000e+06' 714 127 714 173 c30496_6e5h 1 354 'spec=NOESY, no=408, id=404, vol=1.720000e+06' 717 127 717 173 c30496_6e5h 1 355 'spec=NOESY, no=409, id=405, vol=1.600000e+06' 720 127 720 173 c30496_6e5h 1 356 'spec=NOESY, no=411, id=407, vol=1.590000e+06' 722 127 722 173 c30496_6e5h 1 357 'spec=NOESY, no=20, id=17, vol=8.750000e+07' 725 127 725 171 c30496_6e5h 1 358 'spec=NOESY, no=27, id=24, vol=7.810000e+07' 728 127 728 171 c30496_6e5h 1 359 'spec=NOESY, no=28, id=25, vol=7.520000e+07' 731 127 731 171 c30496_6e5h 1 360 'spec=NOESY, no=31, id=28, vol=6.770000e+07' 735 127 735 171 c30496_6e5h 1 361 'spec=NOESY, no=35, id=32, vol=5.930000e+07' 739 127 739 171 c30496_6e5h 1 362 'spec=NOESY, no=40, id=37, vol=5.470000e+07' 743 127 743 171 c30496_6e5h 1 363 'spec=NOESY, no=67, id=64, vol=4.240000e+07' 745 127 745 171 c30496_6e5h 1 364 'spec=NOESY, no=91, id=88, vol=3.490000e+07' 747 127 747 171 c30496_6e5h 1 365 'spec=NOESY, no=96, id=93, vol=3.310000e+07' 749 127 749 171 c30496_6e5h 1 366 'spec=NOESY, no=101, id=98, vol=3.250000e+07' 753 127 753 172 c30496_6e5h 1 367 'spec=NOESY, no=108, id=105, vol=3.200000e+07' 755 127 755 173 c30496_6e5h 1 368 'spec=NOESY, no=126, id=123, vol=2.550000e+07' 757 127 757 173 c30496_6e5h 1 369 'spec=NOESY, no=172, id=169, vol=2.040000e+07' 759 127 759 173 c30496_6e5h 1 370 'spec=NOESY, no=188, id=185, vol=1.870000e+07' 761 127 761 173 c30496_6e5h 1 371 'spec=NOESY, no=203, id=200, vol=1.740000e+07' 763 127 763 173 c30496_6e5h 1 372 'spec=NOESY, no=226, id=223, vol=1.450000e+07' 769 127 769 173 c30496_6e5h 1 373 'spec=NOESY, no=227, id=224, vol=1.440000e+07' 771 127 771 173 c30496_6e5h 1 374 'spec=NOESY, no=248, id=245, vol=1.240000e+07' 773 127 773 173 c30496_6e5h 1 375 'spec=NOESY, no=250, id=247, vol=1.230000e+07' 775 127 775 173 c30496_6e5h 1 376 'spec=NOESY, no=268, id=265, vol=1.110000e+07' 777 127 777 173 c30496_6e5h 1 377 'spec=NOESY, no=282, id=279, vol=1.060000e+07' 779 127 779 173 c30496_6e5h 1 378 'spec=NOESY, no=295, id=292, vol=9.770000e+06' 781 127 781 173 c30496_6e5h 1 379 'spec=NOESY, no=313, id=310, vol=8.260000e+06' 790 127 790 173 c30496_6e5h 1 380 'spec=NOESY, no=338, id=335, vol=7.070000e+06' 793 127 793 173 c30496_6e5h 1 381 'spec=NOESY, no=339, id=336, vol=6.910000e+06' 799 127 799 173 c30496_6e5h 1 382 'spec=NOESY, no=347, id=344, vol=6.170000e+06' 803 127 803 173 c30496_6e5h 1 383 'spec=NOESY, no=356, id=353, vol=5.790000e+06' 812 127 812 173 c30496_6e5h 1 384 'spec=NOESY, no=369, id=366, vol=4.960000e+06' 815 127 815 173 c30496_6e5h 1 385 'spec=NOESY, no=378, id=375, vol=4.450000e+06' 821 127 821 173 c30496_6e5h 1 386 'spec=NOESY, no=386, id=383, vol=4.060000e+06' 824 127 824 173 c30496_6e5h 1 387 'spec=NOESY, no=389, id=386, vol=3.920000e+06' 836 127 836 173 c30496_6e5h 1 388 'spec=NOESY, no=400, id=396, vol=2.780000e+06' 842 127 842 173 c30496_6e5h 1 389 'spec=NOESY, no=401, id=397, vol=2.580000e+06' 844 127 844 173 c30496_6e5h 1 390 'spec=NOESY, no=406, id=402, vol=2.160000e+06' 848 127 848 173 c30496_6e5h 1 391 'spec=NOESY, no=407, id=403, vol=2.000000e+06' 854 127 854 173 c30496_6e5h 1 stop_ loop_ _Gen_dist_constraint_conv_err.ID _Gen_dist_constraint_conv_err.Gen_dist_constraint_parse_file_ID _Gen_dist_constraint_conv_err.Parse_file_constraint_ID _Gen_dist_constraint_conv_err.Conv_error_type _Gen_dist_constraint_conv_err.Conv_error_note _Gen_dist_constraint_conv_err.Entry_ID _Gen_dist_constraint_conv_err.Gen_dist_constraint_list_ID 1 2 1 1 "Not handling restraint 1, item 1, resonance(s) ' .28.HN2' (nmrStar names),' .28.HN1' (nmrStar names) not linked" c30496_6e5h 1 2 2 40 1 "Not handling restraint 40, item 2, resonance(s) ' .12.HB22' (nmrStar names) not linked" c30496_6e5h 1 3 2 40 1 "Not handling restraint 40, item 3, resonance(s) ' .12.HB21' (nmrStar names) not linked" c30496_6e5h 1 4 2 40 1 "Not handling restraint 40, item 4, resonance(s) ' .12.HB23' (nmrStar names) not linked" c30496_6e5h 1 5 2 126 1 "Not handling restraint 126, item 2, resonance(s) ' .12.HB12' (nmrStar names) not linked" c30496_6e5h 1 6 2 126 1 "Not handling restraint 126, item 3, resonance(s) ' .12.HB11' (nmrStar names) not linked" c30496_6e5h 1 7 2 126 1 "Not handling restraint 126, item 4, resonance(s) ' .12.HB13' (nmrStar names) not linked" c30496_6e5h 1 8 2 156 1 "Not handling restraint 156, item 1, resonance(s) ' .28.HN2' (nmrStar names) not linked" c30496_6e5h 1 9 2 200 1 "Not handling restraint 200, item 2, resonance(s) ' .12.HB12' (nmrStar names) not linked" c30496_6e5h 1 10 2 200 1 "Not handling restraint 200, item 3, resonance(s) ' .12.HB11' (nmrStar names) not linked" c30496_6e5h 1 11 2 200 1 "Not handling restraint 200, item 4, resonance(s) ' .12.HB13' (nmrStar names) not linked" c30496_6e5h 1 12 2 238 1 "Not handling restraint 238, item 2, resonance(s) ' .12.HB22' (nmrStar names) not linked" c30496_6e5h 1 13 2 238 1 "Not handling restraint 238, item 3, resonance(s) ' .12.HB21' (nmrStar names) not linked" c30496_6e5h 1 14 2 238 1 "Not handling restraint 238, item 4, resonance(s) ' .12.HB23' (nmrStar names) not linked" c30496_6e5h 1 15 2 262 1 "Not handling restraint 262, item 1, resonance(s) ' .28.HN2' (nmrStar names) not linked" c30496_6e5h 1 16 2 264 1 "Not handling restraint 264, item 2, resonance(s) ' .12.HB22' (nmrStar names) not linked" c30496_6e5h 1 17 2 264 1 "Not handling restraint 264, item 3, resonance(s) ' .12.HB21' (nmrStar names) not linked" c30496_6e5h 1 18 2 264 1 "Not handling restraint 264, item 4, resonance(s) ' .12.HB23' (nmrStar names) not linked" c30496_6e5h 1 19 2 284 1 "Not handling restraint 284, item 1, resonance(s) ' .28.HN1' (nmrStar names) not linked" c30496_6e5h 1 20 2 292 1 "Not handling restraint 292, item 2, resonance(s) ' .12.HB22' (nmrStar names) not linked" c30496_6e5h 1 21 2 292 1 "Not handling restraint 292, item 3, resonance(s) ' .12.HB21' (nmrStar names) not linked" c30496_6e5h 1 22 2 292 1 "Not handling restraint 292, item 4, resonance(s) ' .12.HB23' (nmrStar names) not linked" c30496_6e5h 1 23 2 301 1 "Not handling restraint 301, item 1, resonance(s) ' .28.HN1' (nmrStar names) not linked" c30496_6e5h 1 24 2 349 1 "Not handling restraint 349, item 2, resonance(s) ' .12.HB22' (nmrStar names) not linked" c30496_6e5h 1 25 2 349 1 "Not handling restraint 349, item 3, resonance(s) ' .12.HB21' (nmrStar names) not linked" c30496_6e5h 1 26 2 349 1 "Not handling restraint 349, item 4, resonance(s) ' .12.HB23' (nmrStar names) not linked" c30496_6e5h 1 27 2 389 1 "Not handling restraint 389, item 2, resonance(s) ' .12.HB22' (nmrStar names) not linked" c30496_6e5h 1 28 2 389 1 "Not handling restraint 389, item 3, resonance(s) ' .12.HB21' (nmrStar names) not linked" c30496_6e5h 1 29 2 389 1 "Not handling restraint 389, item 4, resonance(s) ' .12.HB23' (nmrStar names) not linked" c30496_6e5h 1 stop_ save_ save_CNS/XPLOR_distance_constraints_3 _Gen_dist_constraint_list.Sf_category general_distance_constraints _Gen_dist_constraint_list.Sf_framecode CNS/XPLOR_distance_constraints_3 _Gen_dist_constraint_list.Entry_ID c30496_6e5h _Gen_dist_constraint_list.ID 2 _Gen_dist_constraint_list.Constraint_type 'hydrogen bond' _Gen_dist_constraint_list.Details 'Generated by Wattos' _Gen_dist_constraint_list.Constraint_file_ID 1 _Gen_dist_constraint_list.Block_ID 3 loop_ _Gen_dist_constraint_software.Software_ID _Gen_dist_constraint_software.Software_label _Gen_dist_constraint_software.Method_ID _Gen_dist_constraint_software.Method_label _Gen_dist_constraint_software.Entry_ID _Gen_dist_constraint_software.Gen_dist_constraint_list_ID . . . . c30496_6e5h 2 stop_ loop_ _Gen_dist_constraint.ID _Gen_dist_constraint.Member_ID _Gen_dist_constraint.Member_logic_code _Gen_dist_constraint.Assembly_atom_ID_1 _Gen_dist_constraint.Entity_assembly_ID_1 _Gen_dist_constraint.Entity_ID_1 _Gen_dist_constraint.Comp_index_ID_1 _Gen_dist_constraint.Seq_ID_1 _Gen_dist_constraint.Comp_ID_1 _Gen_dist_constraint.Atom_ID_1 _Gen_dist_constraint.Atom_type_1 _Gen_dist_constraint.Atom_isotope_number_1 _Gen_dist_constraint.Resonance_ID_1 _Gen_dist_constraint.Assembly_atom_ID_2 _Gen_dist_constraint.Entity_assembly_ID_2 _Gen_dist_constraint.Entity_ID_2 _Gen_dist_constraint.Comp_index_ID_2 _Gen_dist_constraint.Seq_ID_2 _Gen_dist_constraint.Comp_ID_2 _Gen_dist_constraint.Atom_ID_2 _Gen_dist_constraint.Atom_type_2 _Gen_dist_constraint.Atom_isotope_number_2 _Gen_dist_constraint.Resonance_ID_2 _Gen_dist_constraint.Intensity_val _Gen_dist_constraint.Intensity_lower_val_err _Gen_dist_constraint.Intensity_upper_val_err _Gen_dist_constraint.Distance_val _Gen_dist_constraint.Distance_lower_bound_val _Gen_dist_constraint.Distance_upper_bound_val _Gen_dist_constraint.Contribution_fractional_val _Gen_dist_constraint.Spectral_peak_ID _Gen_dist_constraint.Spectral_peak_list_ID _Gen_dist_constraint.PDB_record_ID_1 _Gen_dist_constraint.PDB_model_num_1 _Gen_dist_constraint.PDB_strand_ID_1 _Gen_dist_constraint.PDB_ins_code_1 _Gen_dist_constraint.PDB_residue_no_1 _Gen_dist_constraint.PDB_residue_name_1 _Gen_dist_constraint.PDB_atom_name_1 _Gen_dist_constraint.PDB_record_ID_2 _Gen_dist_constraint.PDB_model_num_2 _Gen_dist_constraint.PDB_strand_ID_2 _Gen_dist_constraint.PDB_ins_code_2 _Gen_dist_constraint.PDB_residue_no_2 _Gen_dist_constraint.PDB_residue_name_2 _Gen_dist_constraint.PDB_atom_name_2 _Gen_dist_constraint.Auth_entity_assembly_ID_1 _Gen_dist_constraint.Auth_asym_ID_1 _Gen_dist_constraint.Auth_chain_ID_1 _Gen_dist_constraint.Auth_seq_ID_1 _Gen_dist_constraint.Auth_comp_ID_1 _Gen_dist_constraint.Auth_atom_ID_1 _Gen_dist_constraint.Auth_alt_ID_1 _Gen_dist_constraint.Auth_atom_name_1 _Gen_dist_constraint.Auth_entity_assembly_ID_2 _Gen_dist_constraint.Auth_asym_ID_2 _Gen_dist_constraint.Auth_chain_ID_2 _Gen_dist_constraint.Auth_seq_ID_2 _Gen_dist_constraint.Auth_comp_ID_2 _Gen_dist_constraint.Auth_atom_ID_2 _Gen_dist_constraint.Auth_alt_ID_2 _Gen_dist_constraint.Auth_atom_name_2 _Gen_dist_constraint.Entry_ID _Gen_dist_constraint.Gen_dist_constraint_list_ID 1 1 . . 1 1 6 6 GLU H H . . . 1 1 2 2 ASP O O . . . . . 1.9 1.8 2.0 . . . . . A . 6 GLU H . . A . 2 ASP O . . . 6 . HN . . . . . 2 . O . . c30496_6e5h 2 2 1 . . 1 1 2 2 ASP O O . . . 1 1 6 6 GLU N N . . . . . 2.9 2.7 3.1 . . . . . A . 2 ASP O . . A . 6 GLU N . . . 2 . O . . . . . 6 . N . . c30496_6e5h 2 3 1 . . 1 1 7 7 LEU H H . . . 1 1 3 3 LYS O O . . . . . 1.9 1.8 2.0 . . . . . A . 7 LEU H . . A . 3 LYS O . . . 7 . HN . . . . . 3 . O . . c30496_6e5h 2 4 1 . . 1 1 3 3 LYS O O . . . 1 1 7 7 LEU N N . . . . . 2.9 2.7 3.1 . . . . . A . 3 LYS O . . A . 7 LEU N . . . 3 . O . . . . . 7 . N . . c30496_6e5h 2 5 1 . . 1 1 8 8 LYS H H . . . 1 1 4 4 CYS O O . . . . . 1.9 1.8 2.0 . . . . . A . 8 LYS H . . A . 4 CYS O . . . 8 . HN . . . . . 4 . O . . c30496_6e5h 2 6 1 . . 1 1 4 4 CYS O O . . . 1 1 8 8 LYS N N . . . . . 2.9 2.7 3.1 . . . . . A . 4 CYS O . . A . 8 LYS N . . . 4 . O . . . . . 8 . N . . c30496_6e5h 2 7 1 . . 1 1 9 9 LYS H H . . . 1 1 5 5 LYS O O . . . . . 1.9 1.8 2.0 . . . . . A . 9 LYS H . . A . 5 LYS O . . . 9 . HN . . . . . 5 . O . . c30496_6e5h 2 8 1 . . 1 1 5 5 LYS O O . . . 1 1 9 9 LYS N N . . . . . 2.9 2.7 3.1 . . . . . A . 5 LYS O . . A . 9 LYS N . . . 5 . O . . . . . 9 . N . . c30496_6e5h 2 9 1 . . 1 1 10 10 ARG H H . . . 1 1 6 6 GLU O O . . . . . 1.9 1.8 2.0 . . . . . A . 10 ARG H . . A . 6 GLU O . . . 10 . HN . . . . . 6 . O . . c30496_6e5h 2 10 1 . . 1 1 6 6 GLU O O . . . 1 1 10 10 ARG N N . . . . . 2.9 2.7 3.1 . . . . . A . 6 GLU O . . A . 10 ARG N . . . 6 . O . . . . . 10 . N . . c30496_6e5h 2 11 1 . . 1 1 11 11 TYR H H . . . 1 1 7 7 LEU O O . . . . . 1.9 1.8 2.0 . . . . . A . 11 TYR H . . A . 7 LEU O . . . 11 . HN . . . . . 7 . O . . c30496_6e5h 2 12 1 . . 1 1 7 7 LEU O O . . . 1 1 11 11 TYR N N . . . . . 2.9 2.7 3.1 . . . . . A . 7 LEU O . . A . 11 TYR N . . . 7 . O . . . . . 11 . N . . c30496_6e5h 2 13 1 . . 1 1 14 14 CYS H H . . . 1 1 11 11 TYR O O . . . . . 1.9 1.8 2.0 . . . . . A . 14 CYS H . . A . 11 TYR O . . . 14 . HN . . . . . 11 . O . . c30496_6e5h 2 14 1 . . 1 1 11 11 TYR O O . . . 1 1 14 14 CYS N N . . . . . 2.9 2.7 3.1 . . . . . A . 11 TYR O . . A . 14 CYS N . . . 11 . O . . . . . 14 . N . . c30496_6e5h 2 15 1 . . 1 1 22 22 ARG H H . . . 1 1 19 19 ASP O O . . . . . 1.9 1.8 2.0 . . . . . A . 22 ARG H . . A . 19 ASP O . . . 22 . HN . . . . . 19 . O . . c30496_6e5h 2 16 1 . . 1 1 19 19 ASP O O . . . 1 1 22 22 ARG N N . . . . . 2.9 2.7 3.1 . . . . . A . 19 ASP O . . A . 22 ARG N . . . 19 . O . . . . . 22 . N . . c30496_6e5h 2 17 1 . . 1 1 19 19 ASP H H . . . 1 1 22 22 ARG O O . . . . . 1.9 1.8 2.0 . . . . . A . 19 ASP H . . A . 22 ARG O . . . 19 . HN . . . . . 22 . O . . c30496_6e5h 2 18 1 . . 1 1 22 22 ARG O O . . . 1 1 19 19 ASP N N . . . . . 2.9 2.7 3.1 . . . . . A . 22 ARG O . . A . 19 ASP N . . . 22 . O . . . . . 19 . N . . c30496_6e5h 2 19 1 . . 1 1 24 24 GLU H H . . . 1 1 17 17 ARG O O . . . . . 1.9 1.8 2.0 . . . . . A . 24 GLU H . . A . 17 ARG O . . . 24 . HN . . . . . 17 . O . . c30496_6e5h 2 20 1 . . 1 1 17 17 ARG O O . . . 1 1 24 24 GLU N N . . . . . 2.9 2.7 3.1 . . . . . A . 17 ARG O . . A . 24 GLU N . . . 17 . O . . . . . 24 . N . . c30496_6e5h 2 21 1 . . 1 1 17 17 ARG H H . . . 1 1 24 24 GLU O O . . . . . 1.9 1.8 2.0 . . . . . A . 17 ARG H . . A . 24 GLU O . . . 17 . HN . . . . . 24 . O . . c30496_6e5h 2 22 1 . . 1 1 24 24 GLU O O . . . 1 1 17 17 ARG N N . . . . . 2.9 2.7 3.1 . . . . . A . 24 GLU O . . A . 17 ARG N . . . 24 . O . . . . . 17 . N . . c30496_6e5h 2 23 1 . . 1 1 26 26 HIS H H . . . 1 1 15 15 GLU O O . . . . . 1.9 1.8 2.0 . . . . . A . 26 HIS H . . A . 15 GLU O . . . 26 . HN . . . . . 15 . O . . c30496_6e5h 2 24 1 . . 1 1 15 15 GLU O O . . . 1 1 26 26 HIS N N . . . . . 2.9 2.7 3.1 . . . . . A . 15 GLU O . . A . 26 HIS N . . . 15 . O . . . . . 26 . N . . c30496_6e5h 2 25 1 . . 1 1 15 15 GLU H H . . . 1 1 26 26 HIS O O . . . . . 1.9 1.8 2.0 . . . . . A . 15 GLU H . . A . 26 HIS O . . . 15 . HN . . . . . 26 . O . . c30496_6e5h 2 26 1 . . 1 1 26 26 HIS O O . . . 1 1 15 15 GLU N N . . . . . 2.9 2.7 3.1 . . . . . A . 26 HIS O . . A . 15 GLU N . . . 26 . O . . . . . 15 . N . . c30496_6e5h 2 stop_ loop_ _Gen_dist_constraint_comment_org.ID _Gen_dist_constraint_comment_org.Comment_text _Gen_dist_constraint_comment_org.Comment_begin_line _Gen_dist_constraint_comment_org.Comment_begin_column _Gen_dist_constraint_comment_org.Comment_end_line _Gen_dist_constraint_comment_org.Comment_end_column _Gen_dist_constraint_comment_org.Entry_ID _Gen_dist_constraint_comment_org.Gen_dist_constraint_list_ID 1 helix 2 1 2 7 c30496_6e5h 2 2 turn 15 1 15 6 c30496_6e5h 2 3 hairpin 18 1 18 9 c30496_6e5h 2 stop_ loop_ _Gen_dist_constraint_parse_err.ID _Gen_dist_constraint_parse_err.Content _Gen_dist_constraint_parse_err.Begin_line _Gen_dist_constraint_parse_err.Begin_column _Gen_dist_constraint_parse_err.End_line _Gen_dist_constraint_parse_err.End_column _Gen_dist_constraint_parse_err.Entry_ID _Gen_dist_constraint_parse_err.Gen_dist_constraint_list_ID 1 '# Restraints file 3: wsh2004_Hbonds_final.tbl' 1 1 1 45 c30496_6e5h 2 stop_ save_ save_CNS/XPLOR_dihedral_4 _Torsion_angle_constraint_list.Sf_category torsion_angle_constraints _Torsion_angle_constraint_list.Sf_framecode CNS/XPLOR_dihedral_4 _Torsion_angle_constraint_list.Entry_ID c30496_6e5h _Torsion_angle_constraint_list.ID 1 _Torsion_angle_constraint_list.Details 'Generated by Wattos' _Torsion_angle_constraint_list.Constraint_file_ID 1 _Torsion_angle_constraint_list.Block_ID 4 loop_ _Torsion_angle_constraint_software.Software_ID _Torsion_angle_constraint_software.Software_label _Torsion_angle_constraint_software.Method_ID _Torsion_angle_constraint_software.Method_label _Torsion_angle_constraint_software.Entry_ID _Torsion_angle_constraint_software.Torsion_angle_constraint_list_ID . . . . c30496_6e5h 1 stop_ loop_ _Torsion_angle_constraint.ID _Torsion_angle_constraint.Torsion_angle_name _Torsion_angle_constraint.Assembly_atom_ID_1 _Torsion_angle_constraint.Entity_assembly_ID_1 _Torsion_angle_constraint.Entity_ID_1 _Torsion_angle_constraint.Comp_index_ID_1 _Torsion_angle_constraint.Seq_ID_1 _Torsion_angle_constraint.Comp_ID_1 _Torsion_angle_constraint.Atom_ID_1 _Torsion_angle_constraint.Atom_type_1 _Torsion_angle_constraint.Resonance_ID_1 _Torsion_angle_constraint.Assembly_atom_ID_2 _Torsion_angle_constraint.Entity_assembly_ID_2 _Torsion_angle_constraint.Entity_ID_2 _Torsion_angle_constraint.Comp_index_ID_2 _Torsion_angle_constraint.Seq_ID_2 _Torsion_angle_constraint.Comp_ID_2 _Torsion_angle_constraint.Atom_ID_2 _Torsion_angle_constraint.Atom_type_2 _Torsion_angle_constraint.Resonance_ID_2 _Torsion_angle_constraint.Assembly_atom_ID_3 _Torsion_angle_constraint.Entity_assembly_ID_3 _Torsion_angle_constraint.Entity_ID_3 _Torsion_angle_constraint.Comp_index_ID_3 _Torsion_angle_constraint.Seq_ID_3 _Torsion_angle_constraint.Comp_ID_3 _Torsion_angle_constraint.Atom_ID_3 _Torsion_angle_constraint.Atom_type_3 _Torsion_angle_constraint.Resonance_ID_3 _Torsion_angle_constraint.Assembly_atom_ID_4 _Torsion_angle_constraint.Entity_assembly_ID_4 _Torsion_angle_constraint.Entity_ID_4 _Torsion_angle_constraint.Comp_index_ID_4 _Torsion_angle_constraint.Seq_ID_4 _Torsion_angle_constraint.Comp_ID_4 _Torsion_angle_constraint.Atom_ID_4 _Torsion_angle_constraint.Atom_type_4 _Torsion_angle_constraint.Resonance_ID_4 _Torsion_angle_constraint.Angle_lower_bound_val _Torsion_angle_constraint.Angle_upper_bound_val _Torsion_angle_constraint.Source_experiment_ID _Torsion_angle_constraint.PDB_record_ID_1 _Torsion_angle_constraint.PDB_model_num_1 _Torsion_angle_constraint.PDB_strand_ID_1 _Torsion_angle_constraint.PDB_ins_code_1 _Torsion_angle_constraint.PDB_residue_no_1 _Torsion_angle_constraint.PDB_residue_name_1 _Torsion_angle_constraint.PDB_atom_name_1 _Torsion_angle_constraint.PDB_record_ID_2 _Torsion_angle_constraint.PDB_model_num_2 _Torsion_angle_constraint.PDB_strand_ID_2 _Torsion_angle_constraint.PDB_ins_code_2 _Torsion_angle_constraint.PDB_residue_no_2 _Torsion_angle_constraint.PDB_residue_name_2 _Torsion_angle_constraint.PDB_atom_name_2 _Torsion_angle_constraint.PDB_record_ID_3 _Torsion_angle_constraint.PDB_model_num_3 _Torsion_angle_constraint.PDB_strand_ID_3 _Torsion_angle_constraint.PDB_ins_code_3 _Torsion_angle_constraint.PDB_residue_no_3 _Torsion_angle_constraint.PDB_residue_name_3 _Torsion_angle_constraint.PDB_atom_name_3 _Torsion_angle_constraint.PDB_record_ID_4 _Torsion_angle_constraint.PDB_model_num_4 _Torsion_angle_constraint.PDB_strand_ID_4 _Torsion_angle_constraint.PDB_ins_code_4 _Torsion_angle_constraint.PDB_residue_no_4 _Torsion_angle_constraint.PDB_residue_name_4 _Torsion_angle_constraint.PDB_atom_name_4 _Torsion_angle_constraint.Auth_entity_assembly_ID_1 _Torsion_angle_constraint.Auth_asym_ID_1 _Torsion_angle_constraint.Auth_chain_ID_1 _Torsion_angle_constraint.Auth_seq_ID_1 _Torsion_angle_constraint.Auth_comp_ID_1 _Torsion_angle_constraint.Auth_atom_ID_1 _Torsion_angle_constraint.Auth_alt_ID_1 _Torsion_angle_constraint.Auth_atom_name_1 _Torsion_angle_constraint.Auth_entity_assembly_ID_2 _Torsion_angle_constraint.Auth_asym_ID_2 _Torsion_angle_constraint.Auth_chain_ID_2 _Torsion_angle_constraint.Auth_seq_ID_2 _Torsion_angle_constraint.Auth_comp_ID_2 _Torsion_angle_constraint.Auth_atom_ID_2 _Torsion_angle_constraint.Auth_alt_ID_2 _Torsion_angle_constraint.Auth_atom_name_2 _Torsion_angle_constraint.Auth_entity_assembly_ID_3 _Torsion_angle_constraint.Auth_asym_ID_3 _Torsion_angle_constraint.Auth_chain_ID_3 _Torsion_angle_constraint.Auth_seq_ID_3 _Torsion_angle_constraint.Auth_comp_ID_3 _Torsion_angle_constraint.Auth_atom_ID_3 _Torsion_angle_constraint.Auth_alt_ID_3 _Torsion_angle_constraint.Auth_atom_name_3 _Torsion_angle_constraint.Auth_entity_assembly_ID_4 _Torsion_angle_constraint.Auth_asym_ID_4 _Torsion_angle_constraint.Auth_chain_ID_4 _Torsion_angle_constraint.Auth_seq_ID_4 _Torsion_angle_constraint.Auth_comp_ID_4 _Torsion_angle_constraint.Auth_atom_ID_4 _Torsion_angle_constraint.Auth_alt_ID_4 _Torsion_angle_constraint.Auth_atom_name_4 _Torsion_angle_constraint.Entry_ID _Torsion_angle_constraint.Torsion_angle_constraint_list_ID 1 . . 1 1 1 1 ASN C C . . 1 1 2 2 ASP N N . . 1 1 2 2 ASP CA C . . 1 1 2 2 ASP C C . -90.0 -40.0 . . . A . 1 ASN C . . A . 2 ASP N . . A . 2 ASP CA . . A . 2 ASP C . . . 1 . C . . . . . 2 . N . . . . . 2 . CA . . . . . 2 . C . . c30496_6e5h 1 2 . . 1 1 2 2 ASP C C . . 1 1 3 3 LYS N N . . 1 1 3 3 LYS CA C . . 1 1 3 3 LYS C C . -90.0 -40.0 . . . A . 2 ASP C . . A . 3 LYS N . . A . 3 LYS CA . . A . 3 LYS C . . . 2 . C . . . . . 3 . N . . . . . 3 . CA . . . . . 3 . C . . c30496_6e5h 1 3 . . 1 1 3 3 LYS C C . . 1 1 4 4 CYS N N . . 1 1 4 4 CYS CA C . . 1 1 4 4 CYS C C . -90.0 -40.0 . . . A . 3 LYS C . . A . 4 CYS N . . A . 4 CYS CA . . A . 4 CYS C . . . 3 . C . . . . . 4 . N . . . . . 4 . CA . . . . . 4 . C . . c30496_6e5h 1 4 . . 1 1 4 4 CYS C C . . 1 1 5 5 LYS N N . . 1 1 5 5 LYS CA C . . 1 1 5 5 LYS C C . -90.0 -40.0 . . . A . 4 CYS C . . A . 5 LYS N . . A . 5 LYS CA . . A . 5 LYS C . . . 4 . C . . . . . 5 . N . . . . . 5 . CA . . . . . 5 . C . . c30496_6e5h 1 5 . . 1 1 5 5 LYS C C . . 1 1 6 6 GLU N N . . 1 1 6 6 GLU CA C . . 1 1 6 6 GLU C C . -90.0 -40.0 . . . A . 5 LYS C . . A . 6 GLU N . . A . 6 GLU CA . . A . 6 GLU C . . . 5 . C . . . . . 6 . N . . . . . 6 . CA . . . . . 6 . C . . c30496_6e5h 1 6 . . 1 1 6 6 GLU C C . . 1 1 7 7 LEU N N . . 1 1 7 7 LEU CA C . . 1 1 7 7 LEU C C . -90.0 -40.0 . . . A . 6 GLU C . . A . 7 LEU N . . A . 7 LEU CA . . A . 7 LEU C . . . 6 . C . . . . . 7 . N . . . . . 7 . CA . . . . . 7 . C . . c30496_6e5h 1 7 . . 1 1 7 7 LEU C C . . 1 1 8 8 LYS N N . . 1 1 8 8 LYS CA C . . 1 1 8 8 LYS C C . -90.0 -40.0 . . . A . 7 LEU C . . A . 8 LYS N . . A . 8 LYS CA . . A . 8 LYS C . . . 7 . C . . . . . 8 . N . . . . . 8 . CA . . . . . 8 . C . . c30496_6e5h 1 8 . . 1 1 13 13 GLY C C . . 1 1 14 14 CYS N N . . 1 1 14 14 CYS CA C . . 1 1 14 14 CYS C C . -160.0 -80.0 . . . A . 13 GLY C . . A . 14 CYS N . . A . 14 CYS CA . . A . 14 CYS C . . . 13 . C . . . . . 14 . N . . . . . 14 . CA . . . . . 14 . C . . c30496_6e5h 1 9 . . 1 1 14 14 CYS C C . . 1 1 15 15 GLU N N . . 1 1 15 15 GLU CA C . . 1 1 15 15 GLU C C . -160.0 -80.0 . . . A . 14 CYS C . . A . 15 GLU N . . A . 15 GLU CA . . A . 15 GLU C . . . 14 . C . . . . . 15 . N . . . . . 15 . CA . . . . . 15 . C . . c30496_6e5h 1 10 . . 1 1 15 15 GLU C C . . 1 1 16 16 VAL N N . . 1 1 16 16 VAL CA C . . 1 1 16 16 VAL C C . -160.0 -80.0 . . . A . 15 GLU C . . A . 16 VAL N . . A . 16 VAL CA . . A . 16 VAL C . . . 15 . C . . . . . 16 . N . . . . . 16 . CA . . . . . 16 . C . . c30496_6e5h 1 11 . . 1 1 16 16 VAL C C . . 1 1 17 17 ARG N N . . 1 1 17 17 ARG CA C . . 1 1 17 17 ARG C C . -160.0 -80.0 . . . A . 16 VAL C . . A . 17 ARG N . . A . 17 ARG CA . . A . 17 ARG C . . . 16 . C . . . . . 17 . N . . . . . 17 . CA . . . . . 17 . C . . c30496_6e5h 1 12 . . 1 1 17 17 ARG C C . . 1 1 18 18 CYS N N . . 1 1 18 18 CYS CA C . . 1 1 18 18 CYS C C . -160.0 -80.0 . . . A . 17 ARG C . . A . 18 CYS N . . A . 18 CYS CA . . A . 18 CYS C . . . 17 . C . . . . . 18 . N . . . . . 18 . CA . . . . . 18 . C . . c30496_6e5h 1 13 . . 1 1 21 21 PRO C C . . 1 1 22 22 ARG N N . . 1 1 22 22 ARG CA C . . 1 1 22 22 ARG C C . -160.0 -80.0 . . . A . 21 PRO C . . A . 22 ARG N . . A . 22 ARG CA . . A . 22 ARG C . . . 21 . C . . . . . 22 . N . . . . . 22 . CA . . . . . 22 . C . . c30496_6e5h 1 14 . . 1 1 22 22 ARG C C . . 1 1 23 23 TYR N N . . 1 1 23 23 TYR CA C . . 1 1 23 23 TYR C C . -160.0 -80.0 . . . A . 22 ARG C . . A . 23 TYR N . . A . 23 TYR CA . . A . 23 TYR C . . . 22 . C . . . . . 23 . N . . . . . 23 . CA . . . . . 23 . C . . c30496_6e5h 1 15 . . 1 1 23 23 TYR C C . . 1 1 24 24 GLU N N . . 1 1 24 24 GLU CA C . . 1 1 24 24 GLU C C . -160.0 -80.0 . . . A . 23 TYR C . . A . 24 GLU N . . A . 24 GLU CA . . A . 24 GLU C . . . 23 . C . . . . . 24 . N . . . . . 24 . CA . . . . . 24 . C . . c30496_6e5h 1 16 . . 1 1 25 25 VAL C C . . 1 1 26 26 HIS N N . . 1 1 26 26 HIS CA C . . 1 1 26 26 HIS C C . -160.0 -80.0 . . . A . 25 VAL C . . A . 26 HIS N . . A . 26 HIS CA . . A . 26 HIS C . . . 25 . C . . . . . 26 . N . . . . . 26 . CA . . . . . 26 . C . . c30496_6e5h 1 17 . . 1 1 26 26 HIS C C . . 1 1 27 27 CYS N N . . 1 1 27 27 CYS CA C . . 1 1 27 27 CYS C C . -160.0 -80.0 . . . A . 26 HIS C . . A . 27 CYS N . . A . 27 CYS CA . . A . 27 CYS C . . . 26 . C . . . . . 27 . N . . . . . 27 . CA . . . . . 27 . C . . c30496_6e5h 1 stop_ loop_ _TA_constraint_comment_org.ID _TA_constraint_comment_org.Comment_text _TA_constraint_comment_org.Comment_begin_line _TA_constraint_comment_org.Comment_begin_column _TA_constraint_comment_org.Comment_end_line _TA_constraint_comment_org.Comment_end_column _TA_constraint_comment_org.Entry_ID _TA_constraint_comment_org.Torsion_angle_constraint_list_ID 1 ; Phi angle constraints D2 ; 2 1 3 4 c30496_6e5h 1 2 K3 6 1 6 4 c30496_6e5h 1 3 C4 9 1 9 4 c30496_6e5h 1 4 K5 12 1 12 4 c30496_6e5h 1 5 E6 15 1 15 4 c30496_6e5h 1 6 L7 18 1 18 4 c30496_6e5h 1 7 K8 21 1 21 4 c30496_6e5h 1 8 C14 25 1 25 5 c30496_6e5h 1 9 E15 28 1 28 5 c30496_6e5h 1 10 V16 31 1 31 5 c30496_6e5h 1 11 R17 34 1 34 5 c30496_6e5h 1 12 C18 37 1 37 5 c30496_6e5h 1 13 R22 40 1 40 5 c30496_6e5h 1 14 Y23 43 1 43 5 c30496_6e5h 1 15 E24 46 1 46 5 c30496_6e5h 1 16 H26 49 1 49 5 c30496_6e5h 1 17 C27 52 1 52 5 c30496_6e5h 1 stop_ loop_ _TA_constraint_parse_err.ID _TA_constraint_parse_err.Content _TA_constraint_parse_err.Begin_line _TA_constraint_parse_err.Begin_column _TA_constraint_parse_err.End_line _TA_constraint_parse_err.End_column _TA_constraint_parse_err.Entry_ID _TA_constraint_parse_err.Torsion_angle_constraint_list_ID 1 '# Restraints file 4: wsh2004_dihedrals_final.tbl' 1 1 1 48 c30496_6e5h 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 c30496_6e5h _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 DE NOVO PROTEIN 20-JUL-18 6E5H *TITLE HETEROGENEOUS-BACKBONE MIMICS OF A DESIGNED DISULFIDE-RICH PROTEIN: *TITLE 2 AIB TURN *COMPND MOL_ID: 1; *COMPND 2 MOLECULE: DESIGNED PEPTIDE NC_HEE_D1: AIB TURN MUTANT; *COMPND 3 CHAIN: A; *COMPND 4 ENGINEERED: YES *SOURCE MOL_ID: 1; *SOURCE 2 SYNTHETIC: YES; *SOURCE 3 ORGANISM_SCIENTIFIC: SYNTHETIC CONSTRUCT; *SOURCE 4 ORGANISM_TAXID: 32630 *KEYWDS HETEROGENEOUS BACKBONE FOLDAMER, DE NOVO PROTEIN *EXPDTA SOLUTION NMR *NUMMDL 10 *AUTHOR C.C.CABALTEJA,D.S.MIHALKO,W.S.HORNE *REVDAT 1 21-NOV-18 6E5H 0' save_