data_c19602_2mgt ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID c19602_2mgt _Entry.Title ; Zinc induced dimer of the metal binding domain 1-16 of human amyloid beta-peptide with Alzheimer`s disease pathogenic English mutation H6R ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2013-11-06 _Entry.Accession_date 2013-11-06 _Entry.Last_release_date 2014-11-10 _Entry.Original_release_date 2014-11-10 _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype SOLUTION _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.Entry_ID 1 Vladimir Polshakov . . . c19602_2mgt 2 Andrey Istrate . . . c19602_2mgt 3 Sergey Kozin . . . c19602_2mgt stop_ loop_ _SG_project.SG_project_ID _SG_project.Project_name _SG_project.Full_name_of_center _SG_project.Initial_of_center _SG_project.Entry_ID 1 'not applicable' 'not applicable' . c19602_2mgt stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID 'Alzheimer`s disease' . c19602_2mgt 'Human amyloid -peptide' . c19602_2mgt 'Zinc binding' . c19602_2mgt stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 3 c19602_2mgt stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 157 c19602_2mgt '15N chemical shifts' 38 c19602_2mgt '1H chemical shifts' 331 c19602_2mgt 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 . . 2014-11-10 2013-11-06 original author . c19602_2mgt stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 2mgt 'BMRB Entry Tracking System' c19602_2mgt stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID c19602_2mgt _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 21290829 _Citation.Full_citation . _Citation.Title 'Optimization of the methods for small peptide solution structure determination by NMR spectroscopy' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Mol. Biol. (Mosk)' _Citation.Journal_name_full . _Citation.Journal_volume 44 _Citation.Journal_issue 6 _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD . _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 1075 _Citation.Page_last 1085 _Citation.Year 2010 _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.Entry_ID _Citation_author.Citation_ID 1 Andrey Istrate . N. . c19602_2mgt 1 2 Alexander Makarov . A. . c19602_2mgt 1 3 Sergey Kozin . A. . c19602_2mgt 1 4 Vladimir Polshakov . I. . c19602_2mgt 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID c19602_2mgt _Assembly.ID 1 _Assembly.Name 'dimer of the metal binding domain 1-16 of human amyloid beta-peptide in complex with Zinc' _Assembly.BMRB_code . _Assembly.Number_of_components 3 _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 Human-amyloid-peptide_1 1 $entity_1 A . yes native no no . . . c19602_2mgt 1 2 Human-amyloid-peptide_2 1 $entity_1 B . yes native no no . . . c19602_2mgt 1 3 'ZINC ION' 2 $entity_ZN C . no native no no . . . c19602_2mgt 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID c19602_2mgt _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,B _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code XDAEFRRDSGYEVHHQKX _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer yes _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 18 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method man _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 1977.121 _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 0 ACE . c19602_2mgt 1 2 1 ASP . c19602_2mgt 1 3 2 ALA . c19602_2mgt 1 4 3 GLU . c19602_2mgt 1 5 4 PHE . c19602_2mgt 1 6 5 ARG . c19602_2mgt 1 7 6 ARG . c19602_2mgt 1 8 7 ASP . c19602_2mgt 1 9 8 SER . c19602_2mgt 1 10 9 GLY . c19602_2mgt 1 11 10 TYR . c19602_2mgt 1 12 11 GLU . c19602_2mgt 1 13 12 VAL . c19602_2mgt 1 14 13 HIS . c19602_2mgt 1 15 14 HIS . c19602_2mgt 1 16 15 GLN . c19602_2mgt 1 17 16 LYS . c19602_2mgt 1 18 17 NH2 . c19602_2mgt 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 . ACE 1 1 c19602_2mgt 1 . ASP 2 2 c19602_2mgt 1 . ALA 3 3 c19602_2mgt 1 . GLU 4 4 c19602_2mgt 1 . PHE 5 5 c19602_2mgt 1 . ARG 6 6 c19602_2mgt 1 . ARG 7 7 c19602_2mgt 1 . ASP 8 8 c19602_2mgt 1 . SER 9 9 c19602_2mgt 1 . GLY 10 10 c19602_2mgt 1 . TYR 11 11 c19602_2mgt 1 . GLU 12 12 c19602_2mgt 1 . VAL 13 13 c19602_2mgt 1 . HIS 14 14 c19602_2mgt 1 . HIS 15 15 c19602_2mgt 1 . GLN 16 16 c19602_2mgt 1 . LYS 17 17 c19602_2mgt 1 . NH2 18 18 c19602_2mgt 1 stop_ save_ save_entity_ZN _Entity.Sf_category entity _Entity.Sf_framecode entity_ZN _Entity.Entry_ID c19602_2mgt _Entity.ID 2 _Entity.BMRB_code ZN _Entity.Name 'ZINC ION' _Entity.Type non-polymer _Entity.Polymer_common_type . _Entity.Polymer_type . _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code . _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states . _Entity.Ambiguous_chem_comp_sites . _Entity.Nstd_monomer . _Entity.Nstd_chirality . _Entity.Nstd_linkage . _Entity.Nonpolymer_comp_ID ZN _Entity.Nonpolymer_comp_label $chem_comp_ZN _Entity.Number_of_monomers . _Entity.Number_of_nonpolymer_components 1 _Entity.Paramagnetic . _Entity.Thiol_state . _Entity.Src_method . _Entity.Parent_entity_ID 2 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 65.409 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_common_name.Name _Entity_common_name.Type _Entity_common_name.Entry_ID _Entity_common_name.Entity_ID 'ZINC ION' BMRB c19602_2mgt 2 stop_ loop_ _Entity_systematic_name.Name _Entity_systematic_name.Naming_system _Entity_systematic_name.Entry_ID _Entity_systematic_name.Entity_ID 'ZINC ION' BMRB c19602_2mgt 2 ZN 'Three letter code' c19602_2mgt 2 stop_ loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 1 ZN $chem_comp_ZN c19602_2mgt 2 stop_ loop_ _Entity_atom_list.ID _Entity_atom_list.Comp_index_ID _Entity_atom_list.Comp_ID _Entity_atom_list.Atom_ID _Entity_atom_list.Entry_ID _Entity_atom_list.Entity_ID 1 1 ZN ZN c19602_2mgt 2 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 c19602_2mgt _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.Subvariant _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.Cellular_location _Entity_natural_src.Fragment _Entity_natural_src.Fraction _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Plasmid_details _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Dev_stage _Entity_natural_src.Details _Entity_natural_src.Citation_ID _Entity_natural_src.Citation_label _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $entity_1 . . 'no natural source' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . c19602_2mgt 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 c19602_2mgt _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_subvariant _Entity_experimental_src.Host_org_organ _Entity_experimental_src.Host_org_tissue _Entity_experimental_src.Host_org_tissue_fraction _Entity_experimental_src.Host_org_cell_line _Entity_experimental_src.Host_org_cell_type _Entity_experimental_src.Host_org_cellular_location _Entity_experimental_src.Host_org_organelle _Entity_experimental_src.Host_org_gene _Entity_experimental_src.Host_org_culture_collection _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.Host_org_dev_stage _Entity_experimental_src.Details _Entity_experimental_src.Citation_ID _Entity_experimental_src.Citation_label _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $entity_1 . 'chemical synthesis' . . . . . . . . . . . . . . . . . . . . . . . . . . 'purity > 98% checked by RP-HPLC, were purchased from Biopeptide Co., LLC (San Diego, CA, USA)' . . c19602_2mgt 1 2 2 $entity_ZN . 'chemical synthesis' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . c19602_2mgt 1 stop_ save_ ################################# # Polymer residues and ligands # ################################# save_chem_comp_NH2 _Chem_comp.Sf_category chem_comp _Chem_comp.Sf_framecode chem_comp_NH2 _Chem_comp.Entry_ID c19602_2mgt _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.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 c19602_2mgt NH2 N SMILES ACDLabs 10.04 c19602_2mgt NH2 [NH2] SMILES CACTVS 3.341 c19602_2mgt NH2 [NH2] SMILES 'OpenEye OEToolkits' 1.5.0 c19602_2mgt NH2 [NH2] SMILES_CANONICAL CACTVS 3.341 c19602_2mgt NH2 [NH2] SMILES_CANONICAL 'OpenEye OEToolkits' 1.5.0 c19602_2mgt NH2 QGZKDVFQNNGYKY-UHFFFAOYAF InChIKey InChI 1.02b c19602_2mgt 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 c19602_2mgt NH2 l^{2}-azane 'SYSTEMATIC NAME' 'OpenEye OEToolkits' 1.5.0 c19602_2mgt 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 . c19602_2mgt NH2 HN1 HN1 HN1 1HN . H . . N 0 . . . 1 no no . . . . 9.517 . 8.769 . -7.044 . -0.385 -0.545 -0.771 2 . c19602_2mgt NH2 HN2 HN2 HN2 2HN . H . . N 0 . . . 1 no no . . . . 10.323 . 9.890 . -8.082 . 1.020 0.000 0.000 3 . c19602_2mgt 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 . c19602_2mgt NH2 2 . SING N HN2 no N 2 . c19602_2mgt NH2 stop_ save_ save_chem_comp_ACE _Chem_comp.Sf_category chem_comp _Chem_comp.Sf_framecode chem_comp_ACE _Chem_comp.Entry_ID c19602_2mgt _Chem_comp.ID ACE _Chem_comp.Provenance PDB _Chem_comp.Name 'ACETYL GROUP' _Chem_comp.Type NON-POLYMER _Chem_comp.BMRB_code ACE _Chem_comp.PDB_code ACE _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 ACU _Chem_comp.One_letter_code . _Chem_comp.Three_letter_code ACE _Chem_comp.Number_atoms_all 7 _Chem_comp.Number_atoms_nh 3 _Chem_comp.PubChem_code . _Chem_comp.Subcomponent_list . _Chem_comp.InCHi_code InChI=1S/C2H4O/c1-2-3/h2H,1H3 _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 'C2 H4 O' _Chem_comp.Formula_weight 44.053 _Chem_comp.Formula_mono_iso_wt_nat . _Chem_comp.Formula_mono_iso_wt_13C . _Chem_comp.Formula_mono_iso_wt_15N . _Chem_comp.Formula_mono_iso_wt_13C_15N . _Chem_comp.Image_file_name . _Chem_comp.Image_file_format . _Chem_comp.Topo_file_name . _Chem_comp.Topo_file_format . _Chem_comp.Struct_file_name . _Chem_comp.Struct_file_format . _Chem_comp.Stereochem_param_file_name . _Chem_comp.Stereochem_param_file_format . _Chem_comp.Model_details . _Chem_comp.Model_erf . _Chem_comp.Model_source . _Chem_comp.Model_coordinates_details . _Chem_comp.Model_coordinates_missing_flag no _Chem_comp.Ideal_coordinates_details . _Chem_comp.Ideal_coordinates_missing_flag no _Chem_comp.Model_coordinates_db_code . _Chem_comp.Processing_site 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 CC=O SMILES CACTVS 3.341 c19602_2mgt ACE CC=O SMILES 'OpenEye OEToolkits' 1.5.0 c19602_2mgt ACE CC=O SMILES_CANONICAL CACTVS 3.341 c19602_2mgt ACE CC=O SMILES_CANONICAL 'OpenEye OEToolkits' 1.5.0 c19602_2mgt ACE IKHGUXGNUITLKF-UHFFFAOYSA-N InChIKey InChI 1.03 c19602_2mgt ACE InChI=1S/C2H4O/c1-2-3/h2H,1H3 InChI InChI 1.03 c19602_2mgt ACE O=CC SMILES ACDLabs 10.04 c19602_2mgt ACE 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 acetaldehyde 'SYSTEMATIC NAME' ACDLabs 10.04 c19602_2mgt ACE ethanal 'SYSTEMATIC NAME' 'OpenEye OEToolkits' 1.5.0 c19602_2mgt ACE 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 C C C C . C . . N 0 . . . 1 no no . . . . 0.772 . -10.072 . 6.578 . -0.133 0.453 0.000 1 . c19602_2mgt ACE O O O O . O . . N 0 . . . 1 no no . . . . 1.973 . -10.223 . 6.862 . -1.113 -0.252 0.000 2 . c19602_2mgt ACE CH3 CH3 CH3 CH3 . C . . N 0 . . . 1 no no . . . . -0.322 . -10.677 . 7.405 . 1.241 -0.167 0.000 3 . c19602_2mgt ACE H H H H . H . . N 0 . . . 1 no no . . . . 0.685 . -9.453 . 5.669 . -0.240 1.528 0.000 4 . c19602_2mgt ACE H1 H1 H1 1H . H . . N 0 . . . 1 no no . . . . -1.191 . -10.444 . 7.018 . 1.360 -0.785 0.890 5 . c19602_2mgt ACE H2 H2 H2 2H . H . . N 0 . . . 1 no no . . . . -0.269 . -10.331 . 8.320 . 1.360 -0.785 -0.890 6 . c19602_2mgt ACE H3 H3 H3 3H . H . . N 0 . . . 1 no no . . . . -0.221 . -11.652 . 7.418 . 1.995 0.620 0.000 7 . c19602_2mgt ACE 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 . DOUB C O no N 1 . c19602_2mgt ACE 2 . SING C CH3 no N 2 . c19602_2mgt ACE 3 . SING C H no N 3 . c19602_2mgt ACE 4 . SING CH3 H1 no N 4 . c19602_2mgt ACE 5 . SING CH3 H2 no N 5 . c19602_2mgt ACE 6 . SING CH3 H3 no N 6 . c19602_2mgt ACE stop_ save_ save_chem_comp_ZN _Chem_comp.Sf_category chem_comp _Chem_comp.Sf_framecode chem_comp_ZN _Chem_comp.Entry_ID c19602_2mgt _Chem_comp.ID ZN _Chem_comp.Provenance PDB _Chem_comp.Name 'ZINC ION' _Chem_comp.Type NON-POLYMER _Chem_comp.BMRB_code ZN _Chem_comp.PDB_code ZN _Chem_comp.Ambiguous_flag no _Chem_comp.Initial_date 2012-11-20 _Chem_comp.Modified_date 2012-11-20 _Chem_comp.Release_status REL _Chem_comp.Replaced_by . _Chem_comp.Replaces . _Chem_comp.One_letter_code . _Chem_comp.Three_letter_code ZN _Chem_comp.Number_atoms_all 1 _Chem_comp.Number_atoms_nh 1 _Chem_comp.PubChem_code . _Chem_comp.Subcomponent_list . _Chem_comp.InCHi_code InChI=1S/Zn/q+2 _Chem_comp.Mon_nstd_flag . _Chem_comp.Mon_nstd_class . _Chem_comp.Mon_nstd_details . _Chem_comp.Mon_nstd_parent . _Chem_comp.Mon_nstd_parent_comp_ID . _Chem_comp.Std_deriv_one_letter_code . _Chem_comp.Std_deriv_three_letter_code . _Chem_comp.Std_deriv_BMRB_code . _Chem_comp.Std_deriv_PDB_code . _Chem_comp.Std_deriv_chem_comp_name . _Chem_comp.Synonyms . _Chem_comp.Formal_charge 2 _Chem_comp.Paramagnetic . _Chem_comp.Aromatic no _Chem_comp.Formula Zn _Chem_comp.Formula_weight 65.409 _Chem_comp.Formula_mono_iso_wt_nat . _Chem_comp.Formula_mono_iso_wt_13C . _Chem_comp.Formula_mono_iso_wt_15N . _Chem_comp.Formula_mono_iso_wt_13C_15N . _Chem_comp.Image_file_name . _Chem_comp.Image_file_format . _Chem_comp.Topo_file_name . _Chem_comp.Topo_file_format . _Chem_comp.Struct_file_name . _Chem_comp.Struct_file_format . _Chem_comp.Stereochem_param_file_name . _Chem_comp.Stereochem_param_file_format . _Chem_comp.Model_details . _Chem_comp.Model_erf . _Chem_comp.Model_source . _Chem_comp.Model_coordinates_details . _Chem_comp.Model_coordinates_missing_flag no _Chem_comp.Ideal_coordinates_details . _Chem_comp.Ideal_coordinates_missing_flag no _Chem_comp.Model_coordinates_db_code . _Chem_comp.Processing_site RCSB _Chem_comp.Vendor . _Chem_comp.Vendor_product_code . _Chem_comp.Details . _Chem_comp.DB_query_date . _Chem_comp.DB_last_query_revised_last_date . loop_ _Chem_comp_descriptor.Descriptor _Chem_comp_descriptor.Type _Chem_comp_descriptor.Program _Chem_comp_descriptor.Program_version _Chem_comp_descriptor.Entry_ID _Chem_comp_descriptor.Comp_ID InChI=1S/Zn/q+2 InChI InChI 1.03 c19602_2mgt ZN PTFCDOFLOPIGGS-UHFFFAOYSA-N InChIKey InChI 1.03 c19602_2mgt ZN [Zn++] SMILES CACTVS 3.341 c19602_2mgt ZN [Zn++] SMILES_CANONICAL CACTVS 3.341 c19602_2mgt ZN [Zn+2] SMILES ACDLabs 10.04 c19602_2mgt ZN [Zn+2] SMILES 'OpenEye OEToolkits' 1.5.0 c19602_2mgt ZN [Zn+2] SMILES_CANONICAL 'OpenEye OEToolkits' 1.5.0 c19602_2mgt ZN stop_ loop_ _Chem_comp_identifier.Identifier _Chem_comp_identifier.Type _Chem_comp_identifier.Program _Chem_comp_identifier.Program_version _Chem_comp_identifier.Entry_ID _Chem_comp_identifier.Comp_ID zinc 'SYSTEMATIC NAME' ACDLabs 10.04 c19602_2mgt ZN 'zinc(+2) cation' 'SYSTEMATIC NAME' 'OpenEye OEToolkits' 1.5.0 c19602_2mgt ZN stop_ loop_ _Chem_comp_atom.Atom_ID _Chem_comp_atom.BMRB_code _Chem_comp_atom.PDB_atom_ID _Chem_comp_atom.Alt_atom_ID _Chem_comp_atom.Auth_atom_ID _Chem_comp_atom.Type_symbol _Chem_comp_atom.Isotope_number _Chem_comp_atom.Chirality _Chem_comp_atom.Stereo_config _Chem_comp_atom.Charge _Chem_comp_atom.Partial_charge _Chem_comp_atom.Oxidation_number _Chem_comp_atom.Unpaired_electron_number _Chem_comp_atom.Align _Chem_comp_atom.Aromatic_flag _Chem_comp_atom.Leaving_atom_flag _Chem_comp_atom.Substruct_code _Chem_comp_atom.Ionizable _Chem_comp_atom.Drawing_2D_coord_x _Chem_comp_atom.Drawing_2D_coord_y _Chem_comp_atom.Model_Cartn_x _Chem_comp_atom.Model_Cartn_x_esd _Chem_comp_atom.Model_Cartn_y _Chem_comp_atom.Model_Cartn_y_esd _Chem_comp_atom.Model_Cartn_z _Chem_comp_atom.Model_Cartn_z_esd _Chem_comp_atom.Model_Cartn_x_ideal _Chem_comp_atom.Model_Cartn_y_ideal _Chem_comp_atom.Model_Cartn_z_ideal _Chem_comp_atom.PDBX_ordinal _Chem_comp_atom.Details _Chem_comp_atom.Entry_ID _Chem_comp_atom.Comp_ID ZN ZN ZN ZN . ZN . . N 2 . . . 0 no no . . . . 0.000 . 0.000 . 0.000 . 0.000 0.000 0.000 1 . c19602_2mgt ZN stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID c19602_2mgt _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details 'pH 6.8' _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 entity_1 'natural abundance' . . 1 $entity_1 . . 2 . . mM . . . . c19602_2mgt 1 2 bis-Tris '[U-99% 2H]' . . . . . . 20 . . mM . . . . c19602_2mgt 1 3 TSP 'd4 (100%)' . . . . . . 40 . . uM . . . . c19602_2mgt 1 4 H2O 'natural abundance' . . . . . . 90 . . % . . . . c19602_2mgt 1 5 D2O 'natural abundance' . . . . . . 10 . . % . . . . c19602_2mgt 1 stop_ save_ save_sample_2 _Sample.Sf_category sample _Sample.Sf_framecode sample_2 _Sample.Entry_ID c19602_2mgt _Sample.ID 2 _Sample.Type solution _Sample.Sub_type . _Sample.Details 'pH 7.2' _Sample.Aggregate_sample_number . _Sample.Solvent_system '100% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 entity_1 'natural abundance' . . 1 $entity_1 . . 2 . . mM . . . . c19602_2mgt 2 2 bis-Tris '[U-99% 2H]' . . . . . . 20 . . mM . . . . c19602_2mgt 2 3 TSP 'd4 (100%)' . . . . . . 40 . . uM . . . . c19602_2mgt 2 4 D2O 'natural abundance' . . . . . . 100 . . % . . . . c19602_2mgt 2 stop_ save_ save_sample_3 _Sample.Sf_category sample _Sample.Sf_framecode sample_3 _Sample.Entry_ID c19602_2mgt _Sample.ID 3 _Sample.Type solution _Sample.Sub_type . _Sample.Details 'pH 6.8' _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 entity_1 'natural abundance' . . 1 $entity_1 . . 2 . . mM . . . . c19602_2mgt 3 2 'zinc cloride' 'natural abundance' . . . . . . 1 . . mM . . . . c19602_2mgt 3 3 bis-Tris '[U-99% 2H]' . . . . . . 20 . . mM . . . . c19602_2mgt 3 4 TSP 'd4 (100%)' . . . . . . 40 . . uM . . . . c19602_2mgt 3 5 H2O 'natural abundance' . . . . . . 90 . . % . . . . c19602_2mgt 3 6 D2O 'natural abundance' . . . . . . 10 . . % . . . . c19602_2mgt 3 stop_ save_ save_sample_4 _Sample.Sf_category sample _Sample.Sf_framecode sample_4 _Sample.Entry_ID c19602_2mgt _Sample.ID 4 _Sample.Type solution _Sample.Sub_type . _Sample.Details 'pD 7.2' _Sample.Aggregate_sample_number . _Sample.Solvent_system '100% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 entity_1 'natural abundance' . . 1 $entity_1 . . 2 . . mM . . . . c19602_2mgt 4 2 'zinc cloride' 'natural abundance' . . . . . . 1 . . mM . . . . c19602_2mgt 4 3 bis-Tris '[U-99% 2H]' . . . . . . 20 . . mM . . . . c19602_2mgt 4 4 TSP 'd4 (100%)' . . . . . . 40 . . uM . . . . c19602_2mgt 4 5 D2O 'natural abundance' . . . . . . 100 . . % . . . . c19602_2mgt 4 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 c19602_2mgt _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 pH 6.8 . pH c19602_2mgt 1 pressure 1 . atm c19602_2mgt 1 temperature 274 . K c19602_2mgt 1 stop_ save_ save_sample_conditions_2 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_2 _Sample_condition_list.Entry_ID c19602_2mgt _Sample_condition_list.ID 2 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID pD 7.2 . pH c19602_2mgt 2 pressure 1 . atm c19602_2mgt 2 temperature 278 . K c19602_2mgt 2 stop_ save_ ############################ # Computer software used # ############################ save_NMRPipe _Software.Sf_category software _Software.Sf_framecode NMRPipe _Software.Entry_ID c19602_2mgt _Software.ID 1 _Software.Name NMRPipe _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . c19602_2mgt 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing c19602_2mgt 1 stop_ save_ save_TOPSPIN _Software.Sf_category software _Software.Sf_framecode TOPSPIN _Software.Entry_ID c19602_2mgt _Software.ID 2 _Software.Name TOPSPIN _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Bruker Biospin' . . c19602_2mgt 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID collection c19602_2mgt 2 stop_ save_ save_SPARKY _Software.Sf_category software _Software.Sf_framecode SPARKY _Software.Entry_ID c19602_2mgt _Software.ID 3 _Software.Name SPARKY _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Goddard . . c19602_2mgt 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' c19602_2mgt 3 stop_ save_ save_NMRest _Software.Sf_category software _Software.Sf_framecode NMRest _Software.Entry_ID c19602_2mgt _Software.ID 4 _Software.Name NMRest _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Polshakov V. I.' . . c19602_2mgt 4 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' c19602_2mgt 4 stop_ save_ save_GROMACS _Software.Sf_category software _Software.Sf_framecode GROMACS _Software.Entry_ID c19602_2mgt _Software.ID 5 _Software.Name GROMACS _Software.Version 4.5.4 _Software.Details 'In house modified source code' loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Van Der Spoel, Lindahl Hess, Groenhof, Mark and Berendsen' . . c19602_2mgt 5 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID refinement c19602_2mgt 5 stop_ save_ save_CPMD _Software.Sf_category software _Software.Sf_framecode CPMD _Software.Entry_ID c19602_2mgt _Software.ID 6 _Software.Name CPMD _Software.Version . _Software.Details 'Used with GROMACS for QM/MM calculations' loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'CPMD consortium' . http://www.cpmd.org/ c19602_2mgt 6 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'geometry optimization' c19602_2mgt 6 stop_ save_ save_PyMol _Software.Sf_category software _Software.Sf_framecode PyMol _Software.Entry_ID c19602_2mgt _Software.ID 7 _Software.Name PyMol _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID DeLano . . c19602_2mgt 7 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' c19602_2mgt 7 stop_ save_ save_InsightII _Software.Sf_category software _Software.Sf_framecode InsightII _Software.Entry_ID c19602_2mgt _Software.ID 8 _Software.Name InsightII _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Accelrys Software Inc.' . . c19602_2mgt 8 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' c19602_2mgt 8 stop_ save_ save_ProcheckNMR _Software.Sf_category software _Software.Sf_framecode ProcheckNMR _Software.Entry_ID c19602_2mgt _Software.ID 9 _Software.Name ProcheckNMR _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Laskowski and MacArthur' . . c19602_2mgt 9 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' c19602_2mgt 9 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_1 _NMR_spectrometer.Entry_ID c19602_2mgt _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 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 c19602_2mgt _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 spectrometer_1 Bruker Avance . 600 . . . c19602_2mgt 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 c19602_2mgt _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-1H NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . c19602_2mgt 1 2 '2D 1H-1H TOCSY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . c19602_2mgt 1 3 '2D DQF-COSY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . c19602_2mgt 1 4 '2D 1H-15N HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . c19602_2mgt 1 5 '2D 1H-13C HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . c19602_2mgt 1 6 '2D 1H-1H NOESY' no . . . . . . . . . . 2 $sample_2 isotropic . . 2 $sample_conditions_2 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . c19602_2mgt 1 7 '2D 1H-1H TOCSY' no . . . . . . . . . . 2 $sample_2 isotropic . . 2 $sample_conditions_2 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . c19602_2mgt 1 8 '2D 1H-1H NOESY' no . . . . . . . . . . 3 $sample_3 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . c19602_2mgt 1 9 '2D 1H-1H TOCSY' no . . . . . . . . . . 3 $sample_3 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . c19602_2mgt 1 10 '2D 1H-15N HSQC' no . . . . . . . . . . 3 $sample_3 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . c19602_2mgt 1 11 '2D 1H-13C HSQC' no . . . . . . . . . . 3 $sample_3 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . c19602_2mgt 1 12 '2D 1H-1H NOESY' no . . . . . . . . . . 4 $sample_4 isotropic . . 2 $sample_conditions_2 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . c19602_2mgt 1 13 '2D 1H-1H TOCSY' no . . . . . . . . . . 4 $sample_4 isotropic . . 2 $sample_conditions_2 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . c19602_2mgt 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_reference_1 _Chem_shift_reference.Entry_ID c19602_2mgt _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.Indirect_shift_ratio_cit_ID _Chem_shift_ref.Indirect_shift_ratio_cit_label _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Correction_val_cit_ID _Chem_shift_ref.Correction_val_cit_label _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 TMS 'methyl carbon' . . . . ppm 0 internal indirect 0.251449530 . . . . . . . . . c19602_2mgt 1 H 1 TSP 'methyl protons' . . . . ppm 0 internal direct 1.000000000 . . . . . . . . . c19602_2mgt 1 N 15 'liquid anhydrous ammonia' nitrogen . . . . ppm 0 internal indirect 0.101329118 . . . . . . . . . c19602_2mgt 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_chem_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID c19602_2mgt _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 $chemical_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 'Metal binding domain 1-16 of human amyloid beta-peptide, H6R mutant, free peptide' _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-1H NOESY' 1 $sample_1 . c19602_2mgt 1 2 '2D 1H-1H TOCSY' 1 $sample_1 . c19602_2mgt 1 3 '2D DQF-COSY' 1 $sample_1 . c19602_2mgt 1 4 '2D 1H-15N HSQC' 1 $sample_1 . c19602_2mgt 1 5 '2D 1H-13C HSQC' 1 $sample_1 . c19602_2mgt 1 6 '2D 1H-1H NOESY' 2 $sample_2 . c19602_2mgt 1 7 '2D 1H-1H TOCSY' 2 $sample_2 . c19602_2mgt 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 1 1 ACE CH3 C 13 24.400 0.020 . 1 . . . B 0 ACE CH3 . c19602_2mgt 1 2 . 1 1 1 1 ACE H1 H 1 2.037 0.003 . 2 . . . B 0 ACE H1 . c19602_2mgt 1 3 . 1 1 1 1 ACE H2 H 1 2.037 0.003 . 2 . . . B 0 ACE H2 . c19602_2mgt 1 4 . 1 1 1 1 ACE H3 H 1 2.037 0.003 . 2 . . . B 0 ACE H3 . c19602_2mgt 1 5 . 1 1 2 2 ASP H H 1 8.370 0.005 . 1 . . . B 1 ASP H . c19602_2mgt 1 6 . 1 1 2 2 ASP HA H 1 4.549 0.006 . 1 . . . B 1 ASP HA . c19602_2mgt 1 7 . 1 1 2 2 ASP HB2 H 1 2.700 0.006 . 2 . . . B 1 ASP HB2 . c19602_2mgt 1 8 . 1 1 2 2 ASP HB3 H 1 2.633 0.002 . 2 . . . B 1 ASP HB3 . c19602_2mgt 1 9 . 1 1 2 2 ASP CA C 13 54.579 0.020 . 1 . . . B 1 ASP CA . c19602_2mgt 1 10 . 1 1 2 2 ASP CB C 13 41.276 0.008 . 1 . . . B 1 ASP CB . c19602_2mgt 1 11 . 1 1 2 2 ASP N N 15 126.72 0.020 . 1 . . . B 1 ASP N . c19602_2mgt 1 12 . 1 1 3 3 ALA H H 1 8.496 0.007 . 1 . . . B 2 ALA H . c19602_2mgt 1 13 . 1 1 3 3 ALA HA H 1 4.231 0.005 . 1 . . . B 2 ALA HA . c19602_2mgt 1 14 . 1 1 3 3 ALA HB1 H 1 1.384 0.003 . 1 . . . B 2 ALA HB1 . c19602_2mgt 1 15 . 1 1 3 3 ALA HB2 H 1 1.384 0.003 . 1 . . . B 2 ALA HB2 . c19602_2mgt 1 16 . 1 1 3 3 ALA HB3 H 1 1.384 0.003 . 1 . . . B 2 ALA HB3 . c19602_2mgt 1 17 . 1 1 3 3 ALA CA C 13 53.021 0.020 . 1 . . . B 2 ALA CA . c19602_2mgt 1 18 . 1 1 3 3 ALA CB C 13 18.906 0.020 . 1 . . . B 2 ALA CB . c19602_2mgt 1 19 . 1 1 3 3 ALA N N 15 123.82 0.020 . 1 . . . B 2 ALA N . c19602_2mgt 1 20 . 1 1 4 4 GLU H H 1 8.369 0.009 . 1 . . . B 3 GLU H . c19602_2mgt 1 21 . 1 1 4 4 GLU HA H 1 4.143 0.005 . 1 . . . B 3 GLU HA . c19602_2mgt 1 22 . 1 1 4 4 GLU HB2 H 1 1.914 0.004 . 2 . . . B 3 GLU HB2 . c19602_2mgt 1 23 . 1 1 4 4 GLU HB3 H 1 1.914 0.008 . 2 . . . B 3 GLU HB3 . c19602_2mgt 1 24 . 1 1 4 4 GLU HG2 H 1 2.186 0.020 . 2 . . . B 3 GLU HG2 . c19602_2mgt 1 25 . 1 1 4 4 GLU HG3 H 1 2.097 0.020 . 2 . . . B 3 GLU HG3 . c19602_2mgt 1 26 . 1 1 4 4 GLU CA C 13 56.891 0.020 . 1 . . . B 3 GLU CA . c19602_2mgt 1 27 . 1 1 4 4 GLU CB C 13 29.893 0.020 . 1 . . . B 3 GLU CB . c19602_2mgt 1 28 . 1 1 4 4 GLU CG C 13 36.145 0.020 . 1 . . . B 3 GLU CG . c19602_2mgt 1 29 . 1 1 4 4 GLU N N 15 119.34 0.020 . 1 . . . B 3 GLU N . c19602_2mgt 1 30 . 1 1 5 5 PHE H H 1 8.183 0.005 . 1 . . . B 4 PHE H . c19602_2mgt 1 31 . 1 1 5 5 PHE HA H 1 4.558 0.005 . 1 . . . B 4 PHE HA . c19602_2mgt 1 32 . 1 1 5 5 PHE HB2 H 1 3.114 0.003 . 2 . . . B 4 PHE HB2 . c19602_2mgt 1 33 . 1 1 5 5 PHE HB3 H 1 3.069 0.003 . 2 . . . B 4 PHE HB3 . c19602_2mgt 1 34 . 1 1 5 5 PHE HD1 H 1 7.230 0.005 . 3 . . . B 4 PHE HD1 . c19602_2mgt 1 35 . 1 1 5 5 PHE HD2 H 1 7.230 0.005 . 3 . . . B 4 PHE HD2 . c19602_2mgt 1 36 . 1 1 5 5 PHE HE1 H 1 7.331 0.008 . 3 . . . B 4 PHE HE1 . c19602_2mgt 1 37 . 1 1 5 5 PHE HE2 H 1 7.331 0.008 . 3 . . . B 4 PHE HE2 . c19602_2mgt 1 38 . 1 1 5 5 PHE HZ H 1 7.283 0.004 . 1 . . . B 4 PHE HZ . c19602_2mgt 1 39 . 1 1 5 5 PHE CA C 13 57.911 0.020 . 1 . . . B 4 PHE CA . c19602_2mgt 1 40 . 1 1 5 5 PHE CB C 13 39.269 0.020 . 1 . . . B 4 PHE CB . c19602_2mgt 1 41 . 1 1 5 5 PHE CD1 C 13 131.74 0.020 . 3 . . . B 4 PHE CD1 . c19602_2mgt 1 42 . 1 1 5 5 PHE CD2 C 13 131.74 0.020 . 3 . . . B 4 PHE CD2 . c19602_2mgt 1 43 . 1 1 5 5 PHE CE1 C 13 131.318 0.020 . 3 . . . B 4 PHE CE1 . c19602_2mgt 1 44 . 1 1 5 5 PHE CE2 C 13 131.318 0.020 . 3 . . . B 4 PHE CE2 . c19602_2mgt 1 45 . 1 1 5 5 PHE CZ C 13 129.844 0.020 . 1 . . . B 4 PHE CZ . c19602_2mgt 1 46 . 1 1 5 5 PHE N N 15 121.00 0.020 . 1 . . . B 4 PHE N . c19602_2mgt 1 47 . 1 1 6 6 ARG H H 1 8.202 0.003 . 1 . . . B 5 ARG H . c19602_2mgt 1 48 . 1 1 6 6 ARG HA H 1 4.222 0.008 . 1 . . . B 5 ARG HA . c19602_2mgt 1 49 . 1 1 6 6 ARG HB2 H 1 1.783 0.009 . 2 . . . B 5 ARG HB2 . c19602_2mgt 1 50 . 1 1 6 6 ARG HB3 H 1 1.694 0.009 . 2 . . . B 5 ARG HB3 . c19602_2mgt 1 51 . 1 1 6 6 ARG HG2 H 1 1.573 0.009 . 2 . . . B 5 ARG HG2 . c19602_2mgt 1 52 . 1 1 6 6 ARG HG3 H 1 1.520 0.009 . 2 . . . B 5 ARG HG3 . c19602_2mgt 1 53 . 1 1 6 6 ARG HD2 H 1 3.147 0.006 . 2 . . . B 5 ARG HD2 . c19602_2mgt 1 54 . 1 1 6 6 ARG HD3 H 1 3.147 0.006 . 2 . . . B 5 ARG HD3 . c19602_2mgt 1 55 . 1 1 6 6 ARG HE H 1 7.386 0.006 . 1 . . . B 5 ARG HE . c19602_2mgt 1 56 . 1 1 6 6 ARG CA C 13 55.941 0.011 . 1 . . . B 5 ARG CA . c19602_2mgt 1 57 . 1 1 6 6 ARG CB C 13 30.726 0.011 . 1 . . . B 5 ARG CB . c19602_2mgt 1 58 . 1 1 6 6 ARG CG C 13 27.099 0.011 . 1 . . . B 5 ARG CG . c19602_2mgt 1 59 . 1 1 6 6 ARG CD C 13 43.114 0.011 . 1 . . . B 5 ARG CD . c19602_2mgt 1 60 . 1 1 6 6 ARG N N 15 123.14 0.011 . 1 . . . B 5 ARG N . c19602_2mgt 1 61 . 1 1 7 7 ARG H H 1 8.114 0.005 . 1 . . . B 6 ARG H . c19602_2mgt 1 62 . 1 1 7 7 ARG HA H 1 4.248 0.007 . 1 . . . B 6 ARG HA . c19602_2mgt 1 63 . 1 1 7 7 ARG HB2 H 1 1.844 0.004 . 2 . . . B 6 ARG HB2 . c19602_2mgt 1 64 . 1 1 7 7 ARG HB3 H 1 1.768 0.004 . 2 . . . B 6 ARG HB3 . c19602_2mgt 1 65 . 1 1 7 7 ARG HG2 H 1 1.641 0.006 . 2 . . . B 6 ARG HG2 . c19602_2mgt 1 66 . 1 1 7 7 ARG HG3 H 1 1.587 0.006 . 2 . . . B 6 ARG HG3 . c19602_2mgt 1 67 . 1 1 7 7 ARG HD2 H 1 3.148 0.006 . 2 . . . B 6 ARG HD2 . c19602_2mgt 1 68 . 1 1 7 7 ARG HD3 H 1 3.148 0.006 . 2 . . . B 6 ARG HD3 . c19602_2mgt 1 69 . 1 1 7 7 ARG HE H 1 7.278 0.006 . 1 . . . B 6 ARG HE . c19602_2mgt 1 70 . 1 1 7 7 ARG CA C 13 56.035 0.011 . 1 . . . B 6 ARG CA . c19602_2mgt 1 71 . 1 1 7 7 ARG CB C 13 30.604 0.011 . 1 . . . B 6 ARG CB . c19602_2mgt 1 72 . 1 1 7 7 ARG CG C 13 27.029 0.011 . 1 . . . B 6 ARG CG . c19602_2mgt 1 73 . 1 1 7 7 ARG CD C 13 43.114 0.011 . 1 . . . B 6 ARG CD . c19602_2mgt 1 74 . 1 1 7 7 ARG N N 15 122.83 0.011 . 1 . . . B 6 ARG N . c19602_2mgt 1 75 . 1 1 8 8 ASP H H 1 8.500 0.004 . 1 . . . B 7 ASP H . c19602_2mgt 1 76 . 1 1 8 8 ASP HA H 1 4.635 0.006 . 1 . . . B 7 ASP HA . c19602_2mgt 1 77 . 1 1 8 8 ASP HB2 H 1 2.742 0.004 . 2 . . . B 7 ASP HB2 . c19602_2mgt 1 78 . 1 1 8 8 ASP HB3 H 1 2.697 0.004 . 2 . . . B 7 ASP HB3 . c19602_2mgt 1 79 . 1 1 8 8 ASP CA C 13 54.216 0.020 . 1 . . . B 7 ASP CA . c19602_2mgt 1 80 . 1 1 8 8 ASP CB C 13 41.181 0.020 . 1 . . . B 7 ASP CB . c19602_2mgt 1 81 . 1 1 8 8 ASP N N 15 121.19 0.020 . 1 . . . B 7 ASP N . c19602_2mgt 1 82 . 1 1 9 9 SER H H 1 8.436 0.015 . 1 . . . B 8 SER H . c19602_2mgt 1 83 . 1 1 9 9 SER HA H 1 4.377 0.006 . 1 . . . B 8 SER HA . c19602_2mgt 1 84 . 1 1 9 9 SER HB2 H 1 3.900 0.005 . 2 . . . B 8 SER HB2 . c19602_2mgt 1 85 . 1 1 9 9 SER HB3 H 1 3.850 0.005 . 2 . . . B 8 SER HB3 . c19602_2mgt 1 86 . 1 1 9 9 SER CA C 13 58.958 0.020 . 1 . . . B 8 SER CA . c19602_2mgt 1 87 . 1 1 9 9 SER CB C 13 63.528 0.008 . 1 . . . B 8 SER CB . c19602_2mgt 1 88 . 1 1 9 9 SER N N 15 116.37 0.008 . 1 . . . B 8 SER N . c19602_2mgt 1 89 . 1 1 10 10 GLY H H 1 8.586 0.004 . 1 . . . B 9 GLY H . c19602_2mgt 1 90 . 1 1 10 10 GLY HA2 H 1 3.947 0.006 . 2 . . . B 9 GLY HA2 . c19602_2mgt 1 91 . 1 1 10 10 GLY HA3 H 1 3.895 0.004 . 2 . . . B 9 GLY HA3 . c19602_2mgt 1 92 . 1 1 10 10 GLY CA C 13 45.253 0.020 . 1 . . . B 9 GLY CA . c19602_2mgt 1 93 . 1 1 10 10 GLY N N 15 110.69 0.020 . 1 . . . B 9 GLY N . c19602_2mgt 1 94 . 1 1 11 11 TYR H H 1 8.042 0.003 . 1 . . . B 10 TYR H . c19602_2mgt 1 95 . 1 1 11 11 TYR HA H 1 4.501 0.010 . 1 . . . B 10 TYR HA . c19602_2mgt 1 96 . 1 1 11 11 TYR HB2 H 1 3.044 0.006 . 2 . . . B 10 TYR HB2 . c19602_2mgt 1 97 . 1 1 11 11 TYR HB3 H 1 2.972 0.005 . 2 . . . B 10 TYR HB3 . c19602_2mgt 1 98 . 1 1 11 11 TYR HD1 H 1 7.088 0.004 . 3 . . . B 10 TYR HD1 . c19602_2mgt 1 99 . 1 1 11 11 TYR HD2 H 1 7.088 0.004 . 3 . . . B 10 TYR HD2 . c19602_2mgt 1 100 . 1 1 11 11 TYR HE1 H 1 6.799 0.007 . 3 . . . B 10 TYR HE1 . c19602_2mgt 1 101 . 1 1 11 11 TYR HE2 H 1 6.799 0.007 . 3 . . . B 10 TYR HE2 . c19602_2mgt 1 102 . 1 1 11 11 TYR CA C 13 58.251 0.020 . 1 . . . B 10 TYR CA . c19602_2mgt 1 103 . 1 1 11 11 TYR CB C 13 38.750 0.016 . 1 . . . B 10 TYR CB . c19602_2mgt 1 104 . 1 1 11 11 TYR CD1 C 13 133.129 0.020 . 3 . . . B 10 TYR CD1 . c19602_2mgt 1 105 . 1 1 11 11 TYR CD2 C 13 133.129 0.020 . 3 . . . B 10 TYR CD2 . c19602_2mgt 1 106 . 1 1 11 11 TYR CE1 C 13 118.018 0.020 . 3 . . . B 10 TYR CE1 . c19602_2mgt 1 107 . 1 1 11 11 TYR CE2 C 13 118.018 0.020 . 3 . . . B 10 TYR CE2 . c19602_2mgt 1 108 . 1 1 11 11 TYR N N 15 120.18 0.020 . 1 . . . B 10 TYR N . c19602_2mgt 1 109 . 1 1 12 12 GLU H H 1 8.455 0.001 . 1 . . . B 11 GLU H . c19602_2mgt 1 110 . 1 1 12 12 GLU HA H 1 3.994 0.010 . 1 . . . B 11 GLU HA . c19602_2mgt 1 111 . 1 1 12 12 GLU HB2 H 1 1.934 0.004 . 2 . . . B 11 GLU HB2 . c19602_2mgt 1 112 . 1 1 12 12 GLU HB3 H 1 1.865 0.004 . 2 . . . B 11 GLU HB3 . c19602_2mgt 1 113 . 1 1 12 12 GLU HG2 H 1 2.210 0.004 . 2 . . . B 11 GLU HG2 . c19602_2mgt 1 114 . 1 1 12 12 GLU HG3 H 1 2.173 0.004 . 2 . . . B 11 GLU HG3 . c19602_2mgt 1 115 . 1 1 12 12 GLU CA C 13 56.472 0.020 . 1 . . . B 11 GLU CA . c19602_2mgt 1 116 . 1 1 12 12 GLU CB C 13 30.243 0.020 . 1 . . . B 11 GLU CB . c19602_2mgt 1 117 . 1 1 12 12 GLU CG C 13 36.145 0.020 . 1 . . . B 11 GLU CG . c19602_2mgt 1 118 . 1 1 12 12 GLU N N 15 122.60 0.020 . 1 . . . B 11 GLU N . c19602_2mgt 1 119 . 1 1 13 13 VAL H H 1 8.153 0.016 . 1 . . . B 12 VAL H . c19602_2mgt 1 120 . 1 1 13 13 VAL HA H 1 3.932 0.005 . 1 . . . B 12 VAL HA . c19602_2mgt 1 121 . 1 1 13 13 VAL HB H 1 1.950 0.002 . 1 . . . B 12 VAL HB . c19602_2mgt 1 122 . 1 1 13 13 VAL HG11 H 1 0.776 0.002 . 2 . . . B 12 VAL HG11 . c19602_2mgt 1 123 . 1 1 13 13 VAL HG12 H 1 0.776 0.002 . 2 . . . B 12 VAL HG12 . c19602_2mgt 1 124 . 1 1 13 13 VAL HG13 H 1 0.776 0.002 . 2 . . . B 12 VAL HG13 . c19602_2mgt 1 125 . 1 1 13 13 VAL HG21 H 1 0.884 0.003 . 2 . . . B 12 VAL HG21 . c19602_2mgt 1 126 . 1 1 13 13 VAL HG22 H 1 0.884 0.003 . 2 . . . B 12 VAL HG22 . c19602_2mgt 1 127 . 1 1 13 13 VAL HG23 H 1 0.884 0.003 . 2 . . . B 12 VAL HG23 . c19602_2mgt 1 128 . 1 1 13 13 VAL CA C 13 62.726 0.020 . 1 . . . B 12 VAL CA . c19602_2mgt 1 129 . 1 1 13 13 VAL CB C 13 32.461 0.020 . 1 . . . B 12 VAL CB . c19602_2mgt 1 130 . 1 1 13 13 VAL CG1 C 13 20.69 0.020 . 2 . . . B 12 VAL CG1 . c19602_2mgt 1 131 . 1 1 13 13 VAL N N 15 121.21 0.020 . 1 . . . B 12 VAL N . c19602_2mgt 1 132 . 1 1 14 14 HIS H H 1 8.406 0.008 . 1 . . . B 13 HIS H . c19602_2mgt 1 133 . 1 1 14 14 HIS HA H 1 4.629 0.008 . 1 . . . B 13 HIS HA . c19602_2mgt 1 134 . 1 1 14 14 HIS HB2 H 1 3.095 0.002 . 2 . . . B 13 HIS HB2 . c19602_2mgt 1 135 . 1 1 14 14 HIS HB3 H 1 3.036 0.002 . 2 . . . B 13 HIS HB3 . c19602_2mgt 1 136 . 1 1 14 14 HIS HD2 H 1 7.044 0.007 . 1 . . . B 13 HIS HD2 . c19602_2mgt 1 137 . 1 1 14 14 HIS HE1 H 1 8.070 0.005 . 1 . . . B 13 HIS HE1 . c19602_2mgt 1 138 . 1 1 14 14 HIS CA C 13 55.808 0.020 . 1 . . . B 13 HIS CA . c19602_2mgt 1 139 . 1 1 14 14 HIS CB C 13 30.251 0.020 . 1 . . . B 13 HIS CB . c19602_2mgt 1 140 . 1 1 14 14 HIS CD2 C 13 119.54 0.020 . 1 . . . B 13 HIS CD2 . c19602_2mgt 1 141 . 1 1 14 14 HIS CE1 C 13 137.64 0.020 . 1 . . . B 13 HIS CE1 . c19602_2mgt 1 142 . 1 1 14 14 HIS N N 15 122.23 0.020 . 1 . . . B 13 HIS N . c19602_2mgt 1 143 . 1 1 15 15 HIS H H 1 8.348 0.005 . 1 . . . B 14 HIS H . c19602_2mgt 1 144 . 1 1 15 15 HIS HA H 1 4.593 0.009 . 1 . . . B 14 HIS HA . c19602_2mgt 1 145 . 1 1 15 15 HIS HB2 H 1 3.123 0.004 . 2 . . . B 14 HIS HB2 . c19602_2mgt 1 146 . 1 1 15 15 HIS HB3 H 1 3.016 0.006 . 2 . . . B 14 HIS HB3 . c19602_2mgt 1 147 . 1 1 15 15 HIS HD2 H 1 7.038 0.005 . 1 . . . B 14 HIS HD2 . c19602_2mgt 1 148 . 1 1 15 15 HIS HE1 H 1 8.018 0.005 . 1 . . . B 14 HIS HE1 . c19602_2mgt 1 149 . 1 1 15 15 HIS CA C 13 56.055 0.020 . 1 . . . B 14 HIS CA . c19602_2mgt 1 150 . 1 1 15 15 HIS CB C 13 30.368 0.020 . 1 . . . B 14 HIS CB . c19602_2mgt 1 151 . 1 1 15 15 HIS CD2 C 13 119.54 0.020 . 1 . . . B 14 HIS CD2 . c19602_2mgt 1 152 . 1 1 15 15 HIS CE1 C 13 137.64 0.020 . 1 . . . B 14 HIS CE1 . c19602_2mgt 1 153 . 1 1 15 15 HIS N N 15 121.11 0.020 . 1 . . . B 14 HIS N . c19602_2mgt 1 154 . 1 1 16 16 GLN H H 1 8.573 0.007 . 1 . . . B 15 GLN H . c19602_2mgt 1 155 . 1 1 16 16 GLN HA H 1 4.307 0.004 . 1 . . . B 15 GLN HA . c19602_2mgt 1 156 . 1 1 16 16 GLN HB2 H 1 2.107 0.004 . 2 . . . B 15 GLN HB2 . c19602_2mgt 1 157 . 1 1 16 16 GLN HB3 H 1 1.987 0.004 . 2 . . . B 15 GLN HB3 . c19602_2mgt 1 158 . 1 1 16 16 GLN HG2 H 1 2.357 0.007 . 2 . . . B 15 GLN HG2 . c19602_2mgt 1 159 . 1 1 16 16 GLN HG3 H 1 2.357 0.007 . 2 . . . B 15 GLN HG3 . c19602_2mgt 1 160 . 1 1 16 16 GLN HE21 H 1 7.648 0.004 . 2 . . . B 15 GLN HE21 . c19602_2mgt 1 161 . 1 1 16 16 GLN HE22 H 1 6.972 0.004 . 2 . . . B 15 GLN HE22 . c19602_2mgt 1 162 . 1 1 16 16 GLN CA C 13 55.729 0.020 . 1 . . . B 15 GLN CA . c19602_2mgt 1 163 . 1 1 16 16 GLN CB C 13 29.224 0.020 . 1 . . . B 15 GLN CB . c19602_2mgt 1 164 . 1 1 16 16 GLN CG C 13 33.538 0.020 . 1 . . . B 15 GLN CG . c19602_2mgt 1 165 . 1 1 16 16 GLN N N 15 122.17 0.020 . 1 . . . B 15 GLN N . c19602_2mgt 1 166 . 1 1 17 17 LYS H H 1 8.588 0.006 . 1 . . . B 16 LYS H . c19602_2mgt 1 167 . 1 1 17 17 LYS HA H 1 4.262 0.004 . 1 . . . B 16 LYS HA . c19602_2mgt 1 168 . 1 1 17 17 LYS HB2 H 1 1.860 0.009 . 2 . . . B 16 LYS HB2 . c19602_2mgt 1 169 . 1 1 17 17 LYS HB3 H 1 1.785 0.010 . 2 . . . B 16 LYS HB3 . c19602_2mgt 1 170 . 1 1 17 17 LYS HG2 H 1 1.486 0.004 . 2 . . . B 16 LYS HG2 . c19602_2mgt 1 171 . 1 1 17 17 LYS HG3 H 1 1.439 0.005 . 2 . . . B 16 LYS HG3 . c19602_2mgt 1 172 . 1 1 17 17 LYS HD2 H 1 1.694 0.006 . 2 . . . B 16 LYS HD2 . c19602_2mgt 1 173 . 1 1 17 17 LYS HD3 H 1 1.694 0.006 . 2 . . . B 16 LYS HD3 . c19602_2mgt 1 174 . 1 1 17 17 LYS HE2 H 1 2.987 0.004 . 2 . . . B 16 LYS HE2 . c19602_2mgt 1 175 . 1 1 17 17 LYS HE3 H 1 2.987 0.004 . 2 . . . B 16 LYS HE3 . c19602_2mgt 1 176 . 1 1 17 17 LYS CA C 13 56.193 0.024 . 1 . . . B 16 LYS CA . c19602_2mgt 1 177 . 1 1 17 17 LYS CB C 13 32.953 0.024 . 1 . . . B 16 LYS CB . c19602_2mgt 1 178 . 1 1 17 17 LYS CG C 13 24.836 0.020 . 1 . . . B 16 LYS CG . c19602_2mgt 1 179 . 1 1 17 17 LYS CD C 13 28.928 0.020 . 1 . . . B 16 LYS CD . c19602_2mgt 1 180 . 1 1 17 17 LYS CE C 13 41.772 0.020 . 1 . . . B 16 LYS CE . c19602_2mgt 1 181 . 1 1 17 17 LYS N N 15 123.71 0.020 . 1 . . . B 16 LYS N . c19602_2mgt 1 stop_ save_ save_Assigned_chemical_shifts_2 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode Assigned_chemical_shifts_2 _Assigned_chem_shift_list.Entry_ID c19602_2mgt _Assigned_chem_shift_list.ID 2 _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 $chemical_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 'Metal binding domain 1-16 of human amyloid beta-peptide, H6R mutant, complex of peptide monomer with Zn' _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 8 '2D 1H-1H NOESY' 3 $sample_3 . c19602_2mgt 2 9 '2D 1H-1H TOCSY' 3 $sample_3 . c19602_2mgt 2 10 '2D 1H-15N HSQC' 3 $sample_3 . c19602_2mgt 2 11 '2D 1H-13C HSQC' 3 $sample_3 . c19602_2mgt 2 12 '2D 1H-1H NOESY' 4 $sample_4 . c19602_2mgt 2 13 '2D 1H-1H TOCSY' 4 $sample_4 . c19602_2mgt 2 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 1 1 ACE CH3 C 13 24.359 0.020 . 1 . . . B 0 ACE CH3 . c19602_2mgt 2 2 . 1 1 1 1 ACE H1 H 1 2.03 0.003 . 2 . . . B 0 ACE H1 . c19602_2mgt 2 3 . 1 1 1 1 ACE H2 H 1 2.03 0.003 . 2 . . . B 0 ACE H2 . c19602_2mgt 2 4 . 1 1 1 1 ACE H3 H 1 2.03 0.003 . 2 . . . B 0 ACE H3 . c19602_2mgt 2 5 . 1 1 2 2 ASP H H 1 8.414 0.005 . 1 . . . B 1 ASP H . c19602_2mgt 2 6 . 1 1 2 2 ASP HA H 1 4.556 0.006 . 1 . . . B 1 ASP HA . c19602_2mgt 2 7 . 1 1 2 2 ASP HB2 H 1 2.701 0.006 . 2 . . . B 1 ASP HB2 . c19602_2mgt 2 8 . 1 1 2 2 ASP HB3 H 1 2.651 0.002 . 2 . . . B 1 ASP HB3 . c19602_2mgt 2 9 . 1 1 2 2 ASP CA C 13 54.513 0.020 . 1 . . . B 1 ASP CA . c19602_2mgt 2 10 . 1 1 2 2 ASP CB C 13 41.166 0.008 . 1 . . . B 1 ASP CB . c19602_2mgt 2 11 . 1 1 2 2 ASP N N 15 126.92 0.008 . 1 . . . B 1 ASP N . c19602_2mgt 2 12 . 1 1 3 3 ALA H H 1 8.537 0.007 . 1 . . . B 2 ALA H . c19602_2mgt 2 13 . 1 1 3 3 ALA HA H 1 4.220 0.005 . 1 . . . B 2 ALA HA . c19602_2mgt 2 14 . 1 1 3 3 ALA HB1 H 1 1.388 0.003 . 1 . . . B 2 ALA HB1 . c19602_2mgt 2 15 . 1 1 3 3 ALA HB2 H 1 1.388 0.003 . 1 . . . B 2 ALA HB2 . c19602_2mgt 2 16 . 1 1 3 3 ALA HB3 H 1 1.388 0.003 . 1 . . . B 2 ALA HB3 . c19602_2mgt 2 17 . 1 1 3 3 ALA CA C 13 53.140 0.020 . 1 . . . B 2 ALA CA . c19602_2mgt 2 18 . 1 1 3 3 ALA CB C 13 18.923 0.020 . 1 . . . B 2 ALA CB . c19602_2mgt 2 19 . 1 1 3 3 ALA N N 15 123.84 0.020 . 1 . . . B 2 ALA N . c19602_2mgt 2 20 . 1 1 4 4 GLU H H 1 8.393 0.009 . 1 . . . B 3 GLU H . c19602_2mgt 2 21 . 1 1 4 4 GLU HA H 1 4.142 0.005 . 1 . . . B 3 GLU HA . c19602_2mgt 2 22 . 1 1 4 4 GLU HB2 H 1 1.920 0.004 . 2 . . . B 3 GLU HB2 . c19602_2mgt 2 23 . 1 1 4 4 GLU HB3 H 1 1.920 0.008 . 2 . . . B 3 GLU HB3 . c19602_2mgt 2 24 . 1 1 4 4 GLU HG2 H 1 2.197 0.020 . 2 . . . B 3 GLU HG2 . c19602_2mgt 2 25 . 1 1 4 4 GLU HG3 H 1 2.104 0.020 . 2 . . . B 3 GLU HG3 . c19602_2mgt 2 26 . 1 1 4 4 GLU CA C 13 56.954 0.020 . 1 . . . B 3 GLU CA . c19602_2mgt 2 27 . 1 1 4 4 GLU CB C 13 29.793 0.020 . 1 . . . B 3 GLU CB . c19602_2mgt 2 28 . 1 1 4 4 GLU CG C 13 36.028 0.020 . 1 . . . B 3 GLU CG . c19602_2mgt 2 29 . 1 1 4 4 GLU N N 15 119.47 0.020 . 1 . . . B 3 GLU N . c19602_2mgt 2 30 . 1 1 5 5 PHE H H 1 8.208 0.005 . 1 . . . B 4 PHE H . c19602_2mgt 2 31 . 1 1 5 5 PHE HA H 1 4.541 0.005 . 1 . . . B 4 PHE HA . c19602_2mgt 2 32 . 1 1 5 5 PHE HB2 H 1 3.119 0.003 . 2 . . . B 4 PHE HB2 . c19602_2mgt 2 33 . 1 1 5 5 PHE HB3 H 1 3.067 0.003 . 2 . . . B 4 PHE HB3 . c19602_2mgt 2 34 . 1 1 5 5 PHE HD1 H 1 7.212 0.005 . 3 . . . B 4 PHE HD1 . c19602_2mgt 2 35 . 1 1 5 5 PHE HD2 H 1 7.212 0.005 . 3 . . . B 4 PHE HD2 . c19602_2mgt 2 36 . 1 1 5 5 PHE HE1 H 1 7.303 0.008 . 3 . . . B 4 PHE HE1 . c19602_2mgt 2 37 . 1 1 5 5 PHE HE2 H 1 7.303 0.008 . 3 . . . B 4 PHE HE2 . c19602_2mgt 2 38 . 1 1 5 5 PHE HZ H 1 7.255 0.004 . 1 . . . B 4 PHE HZ . c19602_2mgt 2 39 . 1 1 5 5 PHE CA C 13 58.159 0.020 . 1 . . . B 4 PHE CA . c19602_2mgt 2 40 . 1 1 5 5 PHE CB C 13 39.177 0.020 . 1 . . . B 4 PHE CB . c19602_2mgt 2 41 . 1 1 5 5 PHE CD1 C 13 131.72 0.020 . 3 . . . B 4 PHE CD1 . c19602_2mgt 2 42 . 1 1 5 5 PHE CD2 C 13 131.72 0.020 . 3 . . . B 4 PHE CD2 . c19602_2mgt 2 43 . 1 1 5 5 PHE CE1 C 13 131.371 0.020 . 3 . . . B 4 PHE CE1 . c19602_2mgt 2 44 . 1 1 5 5 PHE CE2 C 13 131.371 0.020 . 3 . . . B 4 PHE CE2 . c19602_2mgt 2 45 . 1 1 5 5 PHE CZ C 13 129.798 0.020 . 1 . . . B 4 PHE CZ . c19602_2mgt 2 46 . 1 1 5 5 PHE N N 15 121.12 0.020 . 1 . . . B 4 PHE N . c19602_2mgt 2 47 . 1 1 6 6 ARG H H 1 8.201 0.003 . 1 . . . B 5 ARG H . c19602_2mgt 2 48 . 1 1 6 6 ARG HA H 1 4.201 0.008 . 1 . . . B 5 ARG HA . c19602_2mgt 2 49 . 1 1 6 6 ARG HB2 H 1 1.793 0.009 . 2 . . . B 5 ARG HB2 . c19602_2mgt 2 50 . 1 1 6 6 ARG HB3 H 1 1.701 0.009 . 2 . . . B 5 ARG HB3 . c19602_2mgt 2 51 . 1 1 6 6 ARG HG2 H 1 1.577 0.009 . 2 . . . B 5 ARG HG2 . c19602_2mgt 2 52 . 1 1 6 6 ARG HG3 H 1 1.515 0.009 . 2 . . . B 5 ARG HG3 . c19602_2mgt 2 53 . 1 1 6 6 ARG HD2 H 1 3.138 0.006 . 2 . . . B 5 ARG HD2 . c19602_2mgt 2 54 . 1 1 6 6 ARG HD3 H 1 3.138 0.006 . 2 . . . B 5 ARG HD3 . c19602_2mgt 2 55 . 1 1 6 6 ARG HE H 1 7.293 0.006 . 1 . . . B 5 ARG HE . c19602_2mgt 2 56 . 1 1 6 6 ARG CA C 13 56.36 0.011 . 1 . . . B 5 ARG CA . c19602_2mgt 2 57 . 1 1 6 6 ARG CB C 13 30.663 0.011 . 1 . . . B 5 ARG CB . c19602_2mgt 2 58 . 1 1 6 6 ARG CG C 13 27.321 0.011 . 1 . . . B 5 ARG CG . c19602_2mgt 2 59 . 1 1 6 6 ARG CD C 13 43.104 0.011 . 1 . . . B 5 ARG CD . c19602_2mgt 2 60 . 1 1 6 6 ARG N N 15 123.11 0.011 . 1 . . . B 5 ARG N . c19602_2mgt 2 61 . 1 1 7 7 ARG H H 1 8.39 0.005 . 1 . . . B 6 ARG H . c19602_2mgt 2 62 . 1 1 7 7 ARG HA H 1 4.226 0.007 . 1 . . . B 6 ARG HA . c19602_2mgt 2 63 . 1 1 7 7 ARG HB2 H 1 1.852 0.004 . 2 . . . B 6 ARG HB2 . c19602_2mgt 2 64 . 1 1 7 7 ARG HB3 H 1 1.782 0.004 . 2 . . . B 6 ARG HB3 . c19602_2mgt 2 65 . 1 1 7 7 ARG HG2 H 1 1.647 0.006 . 2 . . . B 6 ARG HG2 . c19602_2mgt 2 66 . 1 1 7 7 ARG HG3 H 1 1.577 0.006 . 2 . . . B 6 ARG HG3 . c19602_2mgt 2 67 . 1 1 7 7 ARG HD2 H 1 3.146 0.006 . 2 . . . B 6 ARG HD2 . c19602_2mgt 2 68 . 1 1 7 7 ARG HD3 H 1 3.146 0.006 . 2 . . . B 6 ARG HD3 . c19602_2mgt 2 69 . 1 1 7 7 ARG HE H 1 7.290 0.006 . 1 . . . B 6 ARG HE . c19602_2mgt 2 70 . 1 1 7 7 ARG CA C 13 56.112 0.011 . 1 . . . B 6 ARG CA . c19602_2mgt 2 71 . 1 1 7 7 ARG CB C 13 30.546 0.011 . 1 . . . B 6 ARG CB . c19602_2mgt 2 72 . 1 1 7 7 ARG CG C 13 27.132 0.011 . 1 . . . B 6 ARG CG . c19602_2mgt 2 73 . 1 1 7 7 ARG CD C 13 43.14 0.011 . 1 . . . B 6 ARG CD . c19602_2mgt 2 74 . 1 1 7 7 ARG N N 15 122.67 0.011 . 1 . . . B 6 ARG N . c19602_2mgt 2 75 . 1 1 8 8 ASP H H 1 8.494 0.004 . 1 . . . B 7 ASP H . c19602_2mgt 2 76 . 1 1 8 8 ASP HA H 1 4.649 0.006 . 1 . . . B 7 ASP HA . c19602_2mgt 2 77 . 1 1 8 8 ASP HB2 H 1 2.760 0.004 . 2 . . . B 7 ASP HB2 . c19602_2mgt 2 78 . 1 1 8 8 ASP HB3 H 1 2.701 0.004 . 2 . . . B 7 ASP HB3 . c19602_2mgt 2 79 . 1 1 8 8 ASP CA C 13 54.146 0.020 . 1 . . . B 7 ASP CA . c19602_2mgt 2 80 . 1 1 8 8 ASP N N 15 121.31 0.020 . 1 . . . B 7 ASP N . c19602_2mgt 2 81 . 1 1 9 9 SER H H 1 8.454 0.015 . 1 . . . B 8 SER H . c19602_2mgt 2 82 . 1 1 9 9 SER HA H 1 4.354 0.006 . 1 . . . B 8 SER HA . c19602_2mgt 2 83 . 1 1 9 9 SER HB2 H 1 3.908 0.005 . 2 . . . B 8 SER HB2 . c19602_2mgt 2 84 . 1 1 9 9 SER HB3 H 1 3.841 0.005 . 2 . . . B 8 SER HB3 . c19602_2mgt 2 85 . 1 1 9 9 SER CA C 13 58.856 0.020 . 1 . . . B 8 SER CA . c19602_2mgt 2 86 . 1 1 9 9 SER CB C 13 63.447 0.008 . 1 . . . B 8 SER CB . c19602_2mgt 2 87 . 1 1 9 9 SER N N 15 116.90 0.008 . 1 . . . B 8 SER N . c19602_2mgt 2 88 . 1 1 10 10 GLY H H 1 8.570 0.004 . 1 . . . B 9 GLY H . c19602_2mgt 2 89 . 1 1 10 10 GLY HA2 H 1 3.918 0.006 . 2 . . . B 9 GLY HA2 . c19602_2mgt 2 90 . 1 1 10 10 GLY HA3 H 1 3.918 0.004 . 2 . . . B 9 GLY HA3 . c19602_2mgt 2 91 . 1 1 10 10 GLY CA C 13 45.117 0.020 . 1 . . . B 9 GLY CA . c19602_2mgt 2 92 . 1 1 10 10 GLY N N 15 110.80 0.020 . 1 . . . B 9 GLY N . c19602_2mgt 2 93 . 1 1 11 11 TYR H H 1 8.058 0.003 . 1 . . . B 10 TYR H . c19602_2mgt 2 94 . 1 1 11 11 TYR HA H 1 4.485 0.010 . 1 . . . B 10 TYR HA . c19602_2mgt 2 95 . 1 1 11 11 TYR HB2 H 1 3.040 0.006 . 2 . . . B 10 TYR HB2 . c19602_2mgt 2 96 . 1 1 11 11 TYR HB3 H 1 2.954 0.005 . 2 . . . B 10 TYR HB3 . c19602_2mgt 2 97 . 1 1 11 11 TYR HD1 H 1 7.070 0.004 . 3 . . . B 10 TYR HD1 . c19602_2mgt 2 98 . 1 1 11 11 TYR HD2 H 1 7.070 0.004 . 3 . . . B 10 TYR HD2 . c19602_2mgt 2 99 . 1 1 11 11 TYR HE1 H 1 6.776 0.007 . 3 . . . B 10 TYR HE1 . c19602_2mgt 2 100 . 1 1 11 11 TYR HE2 H 1 6.776 0.007 . 3 . . . B 10 TYR HE2 . c19602_2mgt 2 101 . 1 1 11 11 TYR CA C 13 58.245 0.020 . 1 . . . B 10 TYR CA . c19602_2mgt 2 102 . 1 1 11 11 TYR CB C 13 38.924 0.016 . 1 . . . B 10 TYR CB . c19602_2mgt 2 103 . 1 1 11 11 TYR CD1 C 13 133.111 0.020 . 3 . . . B 10 TYR CD1 . c19602_2mgt 2 104 . 1 1 11 11 TYR CD2 C 13 133.111 0.020 . 3 . . . B 10 TYR CD2 . c19602_2mgt 2 105 . 1 1 11 11 TYR CE1 C 13 117.97 0.020 . 3 . . . B 10 TYR CE1 . c19602_2mgt 2 106 . 1 1 11 11 TYR CE2 C 13 117.97 0.020 . 3 . . . B 10 TYR CE2 . c19602_2mgt 2 107 . 1 1 11 11 TYR N N 15 120.23 0.020 . 1 . . . B 10 TYR N . c19602_2mgt 2 108 . 1 1 12 12 GLU H H 1 8.467 0.001 . 1 . . . B 11 GLU H . c19602_2mgt 2 109 . 1 1 12 12 GLU HA H 1 4.200 0.010 . 1 . . . B 11 GLU HA . c19602_2mgt 2 110 . 1 1 12 12 GLU HB2 H 1 1.920 0.004 . 2 . . . B 11 GLU HB2 . c19602_2mgt 2 111 . 1 1 12 12 GLU HB3 H 1 1.879 0.004 . 2 . . . B 11 GLU HB3 . c19602_2mgt 2 112 . 1 1 12 12 GLU HG2 H 1 2.206 0.004 . 2 . . . B 11 GLU HG2 . c19602_2mgt 2 113 . 1 1 12 12 GLU HG3 H 1 2.206 0.004 . 2 . . . B 11 GLU HG3 . c19602_2mgt 2 114 . 1 1 12 12 GLU CA C 13 55.98 0.020 . 1 . . . B 11 GLU CA . c19602_2mgt 2 115 . 1 1 12 12 GLU CB C 13 29.920 0.020 . 1 . . . B 11 GLU CB . c19602_2mgt 2 116 . 1 1 12 12 GLU CG C 13 35.78 0.020 . 1 . . . B 11 GLU CG . c19602_2mgt 2 117 . 1 1 13 13 VAL H H 1 8.210 0.016 . 1 . . . B 12 VAL H . c19602_2mgt 2 118 . 1 1 13 13 VAL HA H 1 3.931 0.005 . 1 . . . B 12 VAL HA . c19602_2mgt 2 119 . 1 1 13 13 VAL HB H 1 1.954 0.002 . 1 . . . B 12 VAL HB . c19602_2mgt 2 120 . 1 1 13 13 VAL HG11 H 1 0.759 0.002 . 2 . . . B 12 VAL HG11 . c19602_2mgt 2 121 . 1 1 13 13 VAL HG12 H 1 0.759 0.002 . 2 . . . B 12 VAL HG12 . c19602_2mgt 2 122 . 1 1 13 13 VAL HG13 H 1 0.759 0.002 . 2 . . . B 12 VAL HG13 . c19602_2mgt 2 123 . 1 1 13 13 VAL HG21 H 1 0.868 0.003 . 2 . . . B 12 VAL HG21 . c19602_2mgt 2 124 . 1 1 13 13 VAL HG22 H 1 0.868 0.003 . 2 . . . B 12 VAL HG22 . c19602_2mgt 2 125 . 1 1 13 13 VAL HG23 H 1 0.868 0.003 . 2 . . . B 12 VAL HG23 . c19602_2mgt 2 126 . 1 1 13 13 VAL CA C 13 62.619 0.020 . 1 . . . B 12 VAL CA . c19602_2mgt 2 127 . 1 1 13 13 VAL CB C 13 32.320 0.020 . 1 . . . B 12 VAL CB . c19602_2mgt 2 128 . 1 1 13 13 VAL CG1 C 13 20.63 0.020 . 2 . . . B 12 VAL CG1 . c19602_2mgt 2 129 . 1 1 13 13 VAL CG2 C 13 20.69 0.020 . 2 . . . B 12 VAL CG2 . c19602_2mgt 2 130 . 1 1 14 14 HIS H H 1 8.410 0.008 . 1 . . . B 13 HIS H . c19602_2mgt 2 131 . 1 1 14 14 HIS HA H 1 4.611 0.008 . 1 . . . B 13 HIS HA . c19602_2mgt 2 132 . 1 1 14 14 HIS HB2 H 1 3.125 0.002 . 2 . . . B 13 HIS HB2 . c19602_2mgt 2 133 . 1 1 14 14 HIS HB3 H 1 3.125 0.002 . 2 . . . B 13 HIS HB3 . c19602_2mgt 2 134 . 1 1 14 14 HIS HD2 H 1 6.969 0.007 . 1 . . . B 13 HIS HD2 . c19602_2mgt 2 135 . 1 1 14 14 HIS HE1 H 1 7.890 0.005 . 1 . . . B 13 HIS HE1 . c19602_2mgt 2 136 . 1 1 14 14 HIS CA C 13 55.94 0.020 . 1 . . . B 13 HIS CA . c19602_2mgt 2 137 . 1 1 15 15 HIS H H 1 8.420 0.005 . 1 . . . B 14 HIS H . c19602_2mgt 2 138 . 1 1 15 15 HIS HA H 1 4.571 0.009 . 1 . . . B 14 HIS HA . c19602_2mgt 2 139 . 1 1 15 15 HIS HB2 H 1 3.151 0.004 . 2 . . . B 14 HIS HB2 . c19602_2mgt 2 140 . 1 1 15 15 HIS HB3 H 1 3.099 0.006 . 2 . . . B 14 HIS HB3 . c19602_2mgt 2 141 . 1 1 15 15 HIS HD2 H 1 6.969 0.005 . 1 . . . B 14 HIS HD2 . c19602_2mgt 2 142 . 1 1 15 15 HIS HE1 H 1 7.890 0.005 . 1 . . . B 14 HIS HE1 . c19602_2mgt 2 143 . 1 1 15 15 HIS CA C 13 55.962 0.020 . 1 . . . B 14 HIS CA . c19602_2mgt 2 144 . 1 1 16 16 GLN H H 1 8.535 0.007 . 1 . . . B 15 GLN H . c19602_2mgt 2 145 . 1 1 16 16 GLN HA H 1 4.328 0.004 . 1 . . . B 15 GLN HA . c19602_2mgt 2 146 . 1 1 16 16 GLN HB2 H 1 2.116 0.004 . 2 . . . B 15 GLN HB2 . c19602_2mgt 2 147 . 1 1 16 16 GLN HB3 H 1 2.000 0.004 . 2 . . . B 15 GLN HB3 . c19602_2mgt 2 148 . 1 1 16 16 GLN HG2 H 1 2.368 0.007 . 2 . . . B 15 GLN HG2 . c19602_2mgt 2 149 . 1 1 16 16 GLN HG3 H 1 2.368 0.007 . 2 . . . B 15 GLN HG3 . c19602_2mgt 2 150 . 1 1 16 16 GLN HE21 H 1 7.668 0.004 . 2 . . . B 15 GLN HE21 . c19602_2mgt 2 151 . 1 1 16 16 GLN HE22 H 1 6.996 0.004 . 2 . . . B 15 GLN HE22 . c19602_2mgt 2 152 . 1 1 16 16 GLN CA C 13 55.690 0.020 . 1 . . . B 15 GLN CA . c19602_2mgt 2 153 . 1 1 16 16 GLN CB C 13 29.436 0.020 . 1 . . . B 15 GLN CB . c19602_2mgt 2 154 . 1 1 16 16 GLN CG C 13 33.549 0.020 . 1 . . . B 15 GLN CG . c19602_2mgt 2 155 . 1 1 17 17 LYS H H 1 8.630 0.006 . 1 . . . B 16 LYS H . c19602_2mgt 2 156 . 1 1 17 17 LYS HA H 1 4.252 0.004 . 1 . . . B 16 LYS HA . c19602_2mgt 2 157 . 1 1 17 17 LYS HB2 H 1 1.839 0.009 . 2 . . . B 16 LYS HB2 . c19602_2mgt 2 158 . 1 1 17 17 LYS HB3 H 1 1.792 0.010 . 2 . . . B 16 LYS HB3 . c19602_2mgt 2 159 . 1 1 17 17 LYS HG2 H 1 1.492 0.004 . 2 . . . B 16 LYS HG2 . c19602_2mgt 2 160 . 1 1 17 17 LYS HG3 H 1 1.443 0.005 . 2 . . . B 16 LYS HG3 . c19602_2mgt 2 161 . 1 1 17 17 LYS HD2 H 1 1.692 0.006 . 2 . . . B 16 LYS HD2 . c19602_2mgt 2 162 . 1 1 17 17 LYS HD3 H 1 1.692 0.006 . 2 . . . B 16 LYS HD3 . c19602_2mgt 2 163 . 1 1 17 17 LYS HE2 H 1 2.999 0.004 . 2 . . . B 16 LYS HE2 . c19602_2mgt 2 164 . 1 1 17 17 LYS HE3 H 1 2.999 0.004 . 2 . . . B 16 LYS HE3 . c19602_2mgt 2 165 . 1 1 17 17 LYS CA C 13 56.284 0.024 . 1 . . . B 16 LYS CA . c19602_2mgt 2 166 . 1 1 17 17 LYS CB C 13 32.944 0.024 . 1 . . . B 16 LYS CB . c19602_2mgt 2 167 . 1 1 17 17 LYS CG C 13 24.848 0.020 . 1 . . . B 16 LYS CG . c19602_2mgt 2 168 . 1 1 17 17 LYS CD C 13 28.891 0.020 . 1 . . . B 16 LYS CD . c19602_2mgt 2 169 . 1 1 17 17 LYS CE C 13 41.734 0.020 . 1 . . . B 16 LYS CE . c19602_2mgt 2 170 . 1 1 17 17 LYS N N 15 123.83 0.020 . 1 . . . B 16 LYS N . c19602_2mgt 2 171 . 1 1 18 18 NH2 HN1 H 1 7.833 0.002 . 2 . . . B 17 NH2 HN1 . c19602_2mgt 2 172 . 1 1 18 18 NH2 HN2 H 1 7.288 0.004 . 2 . . . B 17 NH2 HN2 . c19602_2mgt 2 stop_ save_ save_Assigned_chemical_shifts_3 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode Assigned_chemical_shifts_3 _Assigned_chem_shift_list.Entry_ID c19602_2mgt _Assigned_chem_shift_list.ID 3 _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 $chemical_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 'Metal binding domain 1-16 of human amyloid beta-peptide, H6R mutant, complex of peptide dimer with Zn ion' _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 8 '2D 1H-1H NOESY' 3 $sample_3 . c19602_2mgt 3 9 '2D 1H-1H TOCSY' 3 $sample_3 . c19602_2mgt 3 10 '2D 1H-15N HSQC' 3 $sample_3 . c19602_2mgt 3 11 '2D 1H-13C HSQC' 3 $sample_3 . c19602_2mgt 3 12 '2D 1H-1H NOESY' 4 $sample_4 . c19602_2mgt 3 13 '2D 1H-1H TOCSY' 4 $sample_4 . c19602_2mgt 3 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 1 1 ACE CH3 C 13 24.359 0.020 . 1 . . . B 0 ACE CH3 . c19602_2mgt 3 2 . 1 1 1 1 ACE H1 H 1 2.03 0.003 . 2 . . . B 0 ACE H1 . c19602_2mgt 3 3 . 1 1 1 1 ACE H2 H 1 2.03 0.003 . 2 . . . B 0 ACE H2 . c19602_2mgt 3 4 . 1 1 1 1 ACE H3 H 1 2.03 0.003 . 2 . . . B 0 ACE H3 . c19602_2mgt 3 5 . 1 1 2 2 ASP H H 1 8.414 0.005 . 1 . . . B 1 ASP H . c19602_2mgt 3 6 . 1 1 2 2 ASP HA H 1 4.556 0.006 . 1 . . . B 1 ASP HA . c19602_2mgt 3 7 . 1 1 2 2 ASP HB2 H 1 2.701 0.006 . 2 . . . B 1 ASP HB2 . c19602_2mgt 3 8 . 1 1 2 2 ASP HB3 H 1 2.651 0.002 . 2 . . . B 1 ASP HB3 . c19602_2mgt 3 9 . 1 1 2 2 ASP CA C 13 54.513 0.020 . 1 . . . B 1 ASP CA . c19602_2mgt 3 10 . 1 1 2 2 ASP CB C 13 41.166 0.008 . 1 . . . B 1 ASP CB . c19602_2mgt 3 11 . 1 1 2 2 ASP N N 15 126.92 0.008 . 1 . . . B 1 ASP N . c19602_2mgt 3 12 . 1 1 3 3 ALA H H 1 8.537 0.007 . 1 . . . B 2 ALA H . c19602_2mgt 3 13 . 1 1 3 3 ALA HA H 1 4.220 0.005 . 1 . . . B 2 ALA HA . c19602_2mgt 3 14 . 1 1 3 3 ALA HB1 H 1 1.388 0.003 . 1 . . . B 2 ALA HB1 . c19602_2mgt 3 15 . 1 1 3 3 ALA HB2 H 1 1.388 0.003 . 1 . . . B 2 ALA HB2 . c19602_2mgt 3 16 . 1 1 3 3 ALA HB3 H 1 1.388 0.003 . 1 . . . B 2 ALA HB3 . c19602_2mgt 3 17 . 1 1 3 3 ALA CA C 13 53.140 0.020 . 1 . . . B 2 ALA CA . c19602_2mgt 3 18 . 1 1 3 3 ALA CB C 13 18.923 0.020 . 1 . . . B 2 ALA CB . c19602_2mgt 3 19 . 1 1 3 3 ALA N N 15 123.84 0.020 . 1 . . . B 2 ALA N . c19602_2mgt 3 20 . 1 1 4 4 GLU H H 1 8.393 0.009 . 1 . . . B 3 GLU H . c19602_2mgt 3 21 . 1 1 4 4 GLU HA H 1 4.142 0.005 . 1 . . . B 3 GLU HA . c19602_2mgt 3 22 . 1 1 4 4 GLU HB2 H 1 1.920 0.004 . 2 . . . B 3 GLU HB2 . c19602_2mgt 3 23 . 1 1 4 4 GLU HB3 H 1 1.920 0.008 . 2 . . . B 3 GLU HB3 . c19602_2mgt 3 24 . 1 1 4 4 GLU HG2 H 1 2.197 0.020 . 2 . . . B 3 GLU HG2 . c19602_2mgt 3 25 . 1 1 4 4 GLU HG3 H 1 2.104 0.020 . 2 . . . B 3 GLU HG3 . c19602_2mgt 3 26 . 1 1 4 4 GLU CA C 13 56.954 0.020 . 1 . . . B 3 GLU CA . c19602_2mgt 3 27 . 1 1 4 4 GLU CB C 13 29.793 0.020 . 1 . . . B 3 GLU CB . c19602_2mgt 3 28 . 1 1 4 4 GLU CG C 13 36.028 0.020 . 1 . . . B 3 GLU CG . c19602_2mgt 3 29 . 1 1 4 4 GLU N N 15 119.47 0.020 . 1 . . . B 3 GLU N . c19602_2mgt 3 30 . 1 1 5 5 PHE H H 1 8.208 0.005 . 1 . . . B 4 PHE H . c19602_2mgt 3 31 . 1 1 5 5 PHE HA H 1 4.541 0.005 . 1 . . . B 4 PHE HA . c19602_2mgt 3 32 . 1 1 5 5 PHE HB2 H 1 3.119 0.003 . 2 . . . B 4 PHE HB2 . c19602_2mgt 3 33 . 1 1 5 5 PHE HB3 H 1 3.067 0.003 . 2 . . . B 4 PHE HB3 . c19602_2mgt 3 34 . 1 1 5 5 PHE HD1 H 1 7.212 0.005 . 3 . . . B 4 PHE HD1 . c19602_2mgt 3 35 . 1 1 5 5 PHE HD2 H 1 7.212 0.005 . 3 . . . B 4 PHE HD2 . c19602_2mgt 3 36 . 1 1 5 5 PHE HE1 H 1 7.303 0.008 . 3 . . . B 4 PHE HE1 . c19602_2mgt 3 37 . 1 1 5 5 PHE HE2 H 1 7.303 0.008 . 3 . . . B 4 PHE HE2 . c19602_2mgt 3 38 . 1 1 5 5 PHE HZ H 1 7.255 0.004 . 1 . . . B 4 PHE HZ . c19602_2mgt 3 39 . 1 1 5 5 PHE CA C 13 58.159 0.020 . 1 . . . B 4 PHE CA . c19602_2mgt 3 40 . 1 1 5 5 PHE CB C 13 39.177 0.020 . 1 . . . B 4 PHE CB . c19602_2mgt 3 41 . 1 1 5 5 PHE CD1 C 13 131.72 0.020 . 3 . . . B 4 PHE CD1 . c19602_2mgt 3 42 . 1 1 5 5 PHE CD2 C 13 131.72 0.020 . 3 . . . B 4 PHE CD2 . c19602_2mgt 3 43 . 1 1 5 5 PHE CE1 C 13 131.371 0.020 . 3 . . . B 4 PHE CE1 . c19602_2mgt 3 44 . 1 1 5 5 PHE CE2 C 13 131.371 0.020 . 3 . . . B 4 PHE CE2 . c19602_2mgt 3 45 . 1 1 5 5 PHE CZ C 13 129.798 0.020 . 1 . . . B 4 PHE CZ . c19602_2mgt 3 46 . 1 1 5 5 PHE N N 15 121.12 0.020 . 1 . . . B 4 PHE N . c19602_2mgt 3 47 . 1 1 6 6 ARG H H 1 8.201 0.003 . 1 . . . B 5 ARG H . c19602_2mgt 3 48 . 1 1 6 6 ARG HA H 1 4.201 0.008 . 1 . . . B 5 ARG HA . c19602_2mgt 3 49 . 1 1 6 6 ARG HB2 H 1 1.793 0.009 . 2 . . . B 5 ARG HB2 . c19602_2mgt 3 50 . 1 1 6 6 ARG HB3 H 1 1.701 0.009 . 2 . . . B 5 ARG HB3 . c19602_2mgt 3 51 . 1 1 6 6 ARG HG2 H 1 1.577 0.009 . 2 . . . B 5 ARG HG2 . c19602_2mgt 3 52 . 1 1 6 6 ARG HG3 H 1 1.515 0.009 . 2 . . . B 5 ARG HG3 . c19602_2mgt 3 53 . 1 1 6 6 ARG HD2 H 1 3.138 0.006 . 2 . . . B 5 ARG HD2 . c19602_2mgt 3 54 . 1 1 6 6 ARG HD3 H 1 3.138 0.006 . 2 . . . B 5 ARG HD3 . c19602_2mgt 3 55 . 1 1 6 6 ARG HE H 1 7.293 0.006 . 1 . . . B 5 ARG HE . c19602_2mgt 3 56 . 1 1 6 6 ARG CA C 13 56.36 0.011 . 1 . . . B 5 ARG CA . c19602_2mgt 3 57 . 1 1 6 6 ARG CB C 13 30.663 0.011 . 1 . . . B 5 ARG CB . c19602_2mgt 3 58 . 1 1 6 6 ARG CG C 13 27.321 0.011 . 1 . . . B 5 ARG CG . c19602_2mgt 3 59 . 1 1 6 6 ARG CD C 13 43.104 0.011 . 1 . . . B 5 ARG CD . c19602_2mgt 3 60 . 1 1 6 6 ARG N N 15 123.11 0.011 . 1 . . . B 5 ARG N . c19602_2mgt 3 61 . 1 1 7 7 ARG H H 1 8.39 0.005 . 1 . . . B 6 ARG H . c19602_2mgt 3 62 . 1 1 7 7 ARG HA H 1 4.226 0.007 . 1 . . . B 6 ARG HA . c19602_2mgt 3 63 . 1 1 7 7 ARG HB2 H 1 1.852 0.004 . 2 . . . B 6 ARG HB2 . c19602_2mgt 3 64 . 1 1 7 7 ARG HB3 H 1 1.782 0.004 . 2 . . . B 6 ARG HB3 . c19602_2mgt 3 65 . 1 1 7 7 ARG HG2 H 1 1.647 0.006 . 2 . . . B 6 ARG HG2 . c19602_2mgt 3 66 . 1 1 7 7 ARG HG3 H 1 1.577 0.006 . 2 . . . B 6 ARG HG3 . c19602_2mgt 3 67 . 1 1 7 7 ARG HD2 H 1 3.146 0.006 . 2 . . . B 6 ARG HD2 . c19602_2mgt 3 68 . 1 1 7 7 ARG HD3 H 1 3.146 0.006 . 2 . . . B 6 ARG HD3 . c19602_2mgt 3 69 . 1 1 7 7 ARG HE H 1 7.290 0.006 . 1 . . . B 6 ARG HE . c19602_2mgt 3 70 . 1 1 7 7 ARG CA C 13 56.112 0.011 . 1 . . . B 6 ARG CA . c19602_2mgt 3 71 . 1 1 7 7 ARG CB C 13 30.546 0.011 . 1 . . . B 6 ARG CB . c19602_2mgt 3 72 . 1 1 7 7 ARG CG C 13 27.132 0.011 . 1 . . . B 6 ARG CG . c19602_2mgt 3 73 . 1 1 7 7 ARG CD C 13 43.14 0.011 . 1 . . . B 6 ARG CD . c19602_2mgt 3 74 . 1 1 7 7 ARG N N 15 122.67 0.011 . 1 . . . B 6 ARG N . c19602_2mgt 3 75 . 1 1 8 8 ASP H H 1 8.494 0.004 . 1 . . . B 7 ASP H . c19602_2mgt 3 76 . 1 1 8 8 ASP HA H 1 4.649 0.006 . 1 . . . B 7 ASP HA . c19602_2mgt 3 77 . 1 1 8 8 ASP HB2 H 1 2.760 0.004 . 2 . . . B 7 ASP HB2 . c19602_2mgt 3 78 . 1 1 8 8 ASP HB3 H 1 2.701 0.004 . 2 . . . B 7 ASP HB3 . c19602_2mgt 3 79 . 1 1 8 8 ASP CA C 13 54.146 0.020 . 1 . . . B 7 ASP CA . c19602_2mgt 3 80 . 1 1 8 8 ASP N N 15 121.31 0.020 . 1 . . . B 7 ASP N . c19602_2mgt 3 81 . 1 1 9 9 SER H H 1 8.454 0.015 . 1 . . . B 8 SER H . c19602_2mgt 3 82 . 1 1 9 9 SER HA H 1 4.354 0.006 . 1 . . . B 8 SER HA . c19602_2mgt 3 83 . 1 1 9 9 SER HB2 H 1 3.908 0.005 . 2 . . . B 8 SER HB2 . c19602_2mgt 3 84 . 1 1 9 9 SER HB3 H 1 3.841 0.005 . 2 . . . B 8 SER HB3 . c19602_2mgt 3 85 . 1 1 9 9 SER CA C 13 58.856 0.020 . 1 . . . B 8 SER CA . c19602_2mgt 3 86 . 1 1 9 9 SER CB C 13 63.447 0.008 . 1 . . . B 8 SER CB . c19602_2mgt 3 87 . 1 1 9 9 SER N N 15 116.90 0.008 . 1 . . . B 8 SER N . c19602_2mgt 3 88 . 1 1 10 10 GLY H H 1 8.570 0.004 . 1 . . . B 9 GLY H . c19602_2mgt 3 89 . 1 1 10 10 GLY HA2 H 1 4.010 0.006 . 2 . . . B 9 GLY HA2 . c19602_2mgt 3 90 . 1 1 10 10 GLY HA3 H 1 4.010 0.004 . 2 . . . B 9 GLY HA3 . c19602_2mgt 3 91 . 1 1 10 10 GLY CA C 13 44.92 0.020 . 1 . . . B 9 GLY CA . c19602_2mgt 3 92 . 1 1 10 10 GLY N N 15 110.80 0.020 . 1 . . . B 9 GLY N . c19602_2mgt 3 93 . 1 1 11 11 TYR H H 1 8.184 0.003 . 1 . . . B 10 TYR H . c19602_2mgt 3 94 . 1 1 11 11 TYR HA H 1 4.754 0.010 . 1 . . . B 10 TYR HA . c19602_2mgt 3 95 . 1 1 11 11 TYR HB2 H 1 2.794 0.006 . 2 . . . B 10 TYR HB2 . c19602_2mgt 3 96 . 1 1 11 11 TYR HB3 H 1 2.794 0.005 . 2 . . . B 10 TYR HB3 . c19602_2mgt 3 97 . 1 1 11 11 TYR HD1 H 1 6.982 0.004 . 3 . . . B 10 TYR HD1 . c19602_2mgt 3 98 . 1 1 11 11 TYR HD2 H 1 6.982 0.004 . 3 . . . B 10 TYR HD2 . c19602_2mgt 3 99 . 1 1 11 11 TYR HE1 H 1 6.764 0.007 . 3 . . . B 10 TYR HE1 . c19602_2mgt 3 100 . 1 1 11 11 TYR HE2 H 1 6.764 0.007 . 3 . . . B 10 TYR HE2 . c19602_2mgt 3 101 . 1 1 11 11 TYR CA C 13 57.040 0.020 . 1 . . . B 10 TYR CA . c19602_2mgt 3 102 . 1 1 11 11 TYR CB C 13 38.966 0.016 . 1 . . . B 10 TYR CB . c19602_2mgt 3 103 . 1 1 11 11 TYR CD1 C 13 132.694 0.020 . 3 . . . B 10 TYR CD1 . c19602_2mgt 3 104 . 1 1 11 11 TYR CD2 C 13 132.694 0.020 . 3 . . . B 10 TYR CD2 . c19602_2mgt 3 105 . 1 1 11 11 TYR CE1 C 13 118.05 0.020 . 3 . . . B 10 TYR CE1 . c19602_2mgt 3 106 . 1 1 11 11 TYR CE2 C 13 118.05 0.020 . 3 . . . B 10 TYR CE2 . c19602_2mgt 3 107 . 1 1 11 11 TYR N N 15 120.23 0.020 . 1 . . . B 10 TYR N . c19602_2mgt 3 108 . 1 1 12 12 GLU H H 1 8.229 0.001 . 1 . . . B 11 GLU H . c19602_2mgt 3 109 . 1 1 12 12 GLU HA H 1 3.994 0.010 . 1 . . . B 11 GLU HA . c19602_2mgt 3 110 . 1 1 12 12 GLU HB2 H 1 1.917 0.004 . 2 . . . B 11 GLU HB2 . c19602_2mgt 3 111 . 1 1 12 12 GLU HB3 H 1 1.882 0.004 . 2 . . . B 11 GLU HB3 . c19602_2mgt 3 112 . 1 1 12 12 GLU HG2 H 1 2.204 0.004 . 2 . . . B 11 GLU HG2 . c19602_2mgt 3 113 . 1 1 12 12 GLU HG3 H 1 2.204 0.004 . 2 . . . B 11 GLU HG3 . c19602_2mgt 3 114 . 1 1 12 12 GLU CA C 13 56.372 0.020 . 1 . . . B 11 GLU CA . c19602_2mgt 3 115 . 1 1 12 12 GLU CB C 13 29.920 0.020 . 1 . . . B 11 GLU CB . c19602_2mgt 3 116 . 1 1 12 12 GLU CG C 13 35.78 0.020 . 1 . . . B 11 GLU CG . c19602_2mgt 3 117 . 1 1 13 13 VAL H H 1 7.781 0.016 . 1 . . . B 12 VAL H . c19602_2mgt 3 118 . 1 1 13 13 VAL HA H 1 4.614 0.005 . 1 . . . B 12 VAL HA . c19602_2mgt 3 119 . 1 1 13 13 VAL HB H 1 2.192 0.002 . 1 . . . B 12 VAL HB . c19602_2mgt 3 120 . 1 1 13 13 VAL HG11 H 1 0.232 0.002 . 2 . . . B 12 VAL HG11 . c19602_2mgt 3 121 . 1 1 13 13 VAL HG12 H 1 0.232 0.002 . 2 . . . B 12 VAL HG12 . c19602_2mgt 3 122 . 1 1 13 13 VAL HG13 H 1 0.232 0.002 . 2 . . . B 12 VAL HG13 . c19602_2mgt 3 123 . 1 1 13 13 VAL HG21 H 1 0.873 0.003 . 2 . . . B 12 VAL HG21 . c19602_2mgt 3 124 . 1 1 13 13 VAL HG22 H 1 0.873 0.003 . 2 . . . B 12 VAL HG22 . c19602_2mgt 3 125 . 1 1 13 13 VAL HG23 H 1 0.873 0.003 . 2 . . . B 12 VAL HG23 . c19602_2mgt 3 126 . 1 1 13 13 VAL CA C 13 60.901 0.020 . 1 . . . B 12 VAL CA . c19602_2mgt 3 127 . 1 1 13 13 VAL CB C 13 30.679 0.020 . 1 . . . B 12 VAL CB . c19602_2mgt 3 128 . 1 1 13 13 VAL CG1 C 13 20.63 0.020 . 2 . . . B 12 VAL CG1 . c19602_2mgt 3 129 . 1 1 14 14 HIS H H 1 8.410 0.008 . 1 . . . B 13 HIS H . c19602_2mgt 3 130 . 1 1 14 14 HIS HA H 1 4.611 0.008 . 1 . . . B 13 HIS HA . c19602_2mgt 3 131 . 1 1 14 14 HIS HB2 H 1 3.125 0.002 . 2 . . . B 13 HIS HB2 . c19602_2mgt 3 132 . 1 1 14 14 HIS HB3 H 1 3.125 0.002 . 2 . . . B 13 HIS HB3 . c19602_2mgt 3 133 . 1 1 14 14 HIS HD2 H 1 6.983 0.007 . 1 . . . B 13 HIS HD2 . c19602_2mgt 3 134 . 1 1 14 14 HIS HE1 H 1 7.940 0.005 . 1 . . . B 13 HIS HE1 . c19602_2mgt 3 135 . 1 1 14 14 HIS CA C 13 57.04 0.020 . 1 . . . B 13 HIS CA . c19602_2mgt 3 136 . 1 1 14 14 HIS CB C 13 30.249 0.020 . 1 . . . B 13 HIS CB . c19602_2mgt 3 137 . 1 1 15 15 HIS H H 1 9.535 0.005 . 1 . . . B 14 HIS H . c19602_2mgt 3 138 . 1 1 15 15 HIS HA H 1 4.611 0.009 . 1 . . . B 14 HIS HA . c19602_2mgt 3 139 . 1 1 15 15 HIS HB2 H 1 3.032 0.004 . 2 . . . B 14 HIS HB2 . c19602_2mgt 3 140 . 1 1 15 15 HIS HB3 H 1 3.032 0.006 . 2 . . . B 14 HIS HB3 . c19602_2mgt 3 141 . 1 1 15 15 HIS HD2 H 1 6.969 0.005 . 1 . . . B 14 HIS HD2 . c19602_2mgt 3 142 . 1 1 15 15 HIS HE1 H 1 7.890 0.005 . 1 . . . B 14 HIS HE1 . c19602_2mgt 3 143 . 1 1 15 15 HIS CA C 13 55.962 0.020 . 1 . . . B 14 HIS CA . c19602_2mgt 3 144 . 1 1 15 15 HIS CB C 13 30.736 0.020 . 1 . . . B 14 HIS CB . c19602_2mgt 3 145 . 1 1 16 16 GLN H H 1 8.794 0.007 . 1 . . . B 15 GLN H . c19602_2mgt 3 146 . 1 1 16 16 GLN HA H 1 4.363 0.004 . 1 . . . B 15 GLN HA . c19602_2mgt 3 147 . 1 1 16 16 GLN HB2 H 1 2.119 0.004 . 2 . . . B 15 GLN HB2 . c19602_2mgt 3 148 . 1 1 16 16 GLN HB3 H 1 1.990 0.004 . 2 . . . B 15 GLN HB3 . c19602_2mgt 3 149 . 1 1 16 16 GLN HG2 H 1 2.266 0.007 . 2 . . . B 15 GLN HG2 . c19602_2mgt 3 150 . 1 1 16 16 GLN HG3 H 1 2.200 0.007 . 2 . . . B 15 GLN HG3 . c19602_2mgt 3 151 . 1 1 16 16 GLN HE21 H 1 7.694 0.004 . 2 . . . B 15 GLN HE21 . c19602_2mgt 3 152 . 1 1 16 16 GLN HE22 H 1 7.013 0.004 . 2 . . . B 15 GLN HE22 . c19602_2mgt 3 153 . 1 1 16 16 GLN CA C 13 55.690 0.020 . 1 . . . B 15 GLN CA . c19602_2mgt 3 154 . 1 1 16 16 GLN CB C 13 29.436 0.020 . 1 . . . B 15 GLN CB . c19602_2mgt 3 155 . 1 1 16 16 GLN CG C 13 33.350 0.020 . 1 . . . B 15 GLN CG . c19602_2mgt 3 156 . 1 1 17 17 LYS H H 1 8.742 0.006 . 1 . . . B 16 LYS H . c19602_2mgt 3 157 . 1 1 17 17 LYS HA H 1 4.252 0.004 . 1 . . . B 16 LYS HA . c19602_2mgt 3 158 . 1 1 17 17 LYS HB2 H 1 1.839 0.009 . 2 . . . B 16 LYS HB2 . c19602_2mgt 3 159 . 1 1 17 17 LYS HB3 H 1 1.792 0.010 . 2 . . . B 16 LYS HB3 . c19602_2mgt 3 160 . 1 1 17 17 LYS HG2 H 1 1.492 0.004 . 2 . . . B 16 LYS HG2 . c19602_2mgt 3 161 . 1 1 17 17 LYS HG3 H 1 1.443 0.005 . 2 . . . B 16 LYS HG3 . c19602_2mgt 3 162 . 1 1 17 17 LYS HD2 H 1 1.692 0.006 . 2 . . . B 16 LYS HD2 . c19602_2mgt 3 163 . 1 1 17 17 LYS HD3 H 1 1.692 0.006 . 2 . . . B 16 LYS HD3 . c19602_2mgt 3 164 . 1 1 17 17 LYS HE2 H 1 2.999 0.004 . 2 . . . B 16 LYS HE2 . c19602_2mgt 3 165 . 1 1 17 17 LYS HE3 H 1 2.999 0.004 . 2 . . . B 16 LYS HE3 . c19602_2mgt 3 166 . 1 1 17 17 LYS CA C 13 56.293 0.024 . 1 . . . B 16 LYS CA . c19602_2mgt 3 167 . 1 1 17 17 LYS CB C 13 32.944 0.024 . 1 . . . B 16 LYS CB . c19602_2mgt 3 168 . 1 1 17 17 LYS CG C 13 24.848 0.020 . 1 . . . B 16 LYS CG . c19602_2mgt 3 169 . 1 1 17 17 LYS CD C 13 28.891 0.020 . 1 . . . B 16 LYS CD . c19602_2mgt 3 170 . 1 1 17 17 LYS CE C 13 41.734 0.020 . 1 . . . B 16 LYS CE . c19602_2mgt 3 171 . 1 1 17 17 LYS N N 15 123.83 0.020 . 1 . . . B 16 LYS N . c19602_2mgt 3 172 . 1 1 18 18 NH2 HN1 H 1 7.833 0.002 . 2 . . . B 17 NH2 HN1 . c19602_2mgt 3 173 . 1 1 18 18 NH2 HN2 H 1 7.288 0.004 . 2 . . . B 17 NH2 HN2 . c19602_2mgt 3 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 c19602_2mgt _Conformer_stat_list.ID 1 _Conformer_stat_list.Conf_family_coord_set_ID 1 _Conformer_stat_list.Conf_family_coord_set_label $Original_constraints_and_structures _Conformer_stat_list.Conformer_submitted_total_num 20 save_ ##################################### # Conformer family coordinate set # ##################################### save_ensemble_of_conformers _Conformer_family_coord_set.Sf_category conformer_family_coord_set _Conformer_family_coord_set.Sf_framecode ensemble_of_conformers _Conformer_family_coord_set.Entry_ID c19602_2mgt _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 . . . c19602_2mgt 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 . . . . c19602_2mgt 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 ACE C C -14.283 -4.680 -2.977 . . . 1.0 . . . . . . . . . . . . A . 0 ACE C . . . . . . . . . c19602_2mgt 1 . 1 . 2 . 1 1 1 ACE CH3 C -12.762 -4.746 -2.925 . . . 1.0 . . . . . . . . . . . . A . 0 ACE CH3 . . . . . . . . . c19602_2mgt 1 . 1 . 3 . 1 1 1 ACE H1 H -12.392 -4.498 -1.936 . . . 1.0 . . . . . . . . . . . . A . 0 ACE H1 . . . . . . . . . c19602_2mgt 1 . 1 . 4 . 1 1 1 ACE H2 H -12.455 -5.757 -3.177 . . . 1.0 . . . . . . . . . . . . A . 0 ACE H2 . . . . . . . . . c19602_2mgt 1 . 1 . 5 . 1 1 1 ACE H3 H -12.325 -4.030 -3.616 . . . 1.0 . . . . . . . . . . . . A . 0 ACE H3 . . . . . . . . . c19602_2mgt 1 . 1 . 6 . 1 1 1 ACE O O -14.874 -4.994 -4.008 . . . 1.0 . . . . . . . . . . . . A . 0 ACE O . . . . . . . . . c19602_2mgt 1 . 1 . 7 . 1 1 2 ASP C C -16.719 -2.918 -0.991 . . . 1.0 . . . . . . . . . . . . A . 1 ASP C . . . . . . . . . c19602_2mgt 1 . 1 . 8 . 1 1 2 ASP CA C -16.351 -4.208 -1.716 . . . 1.0 . . . . . . . . . . . . A . 1 ASP CA . . . . . . . . . c19602_2mgt 1 . 1 . 9 . 1 1 2 ASP CB C -16.873 -5.445 -0.976 . . . 1.0 . . . . . . . . . . . . A . 1 ASP CB . . . . . . . . . c19602_2mgt 1 . 1 . 10 . 1 1 2 ASP CG C -18.305 -5.759 -1.387 . . . 1.0 . . . . . . . . . . . . A . 1 ASP CG . . . . . . . . . c19602_2mgt 1 . 1 . 11 . 1 1 2 ASP H H -14.358 -4.052 -1.048 . . . 1.0 . . . . . . . . . . . . A . 1 ASP H . . . . . . . . . c19602_2mgt 1 . 1 . 12 . 1 1 2 ASP HA H -16.805 -4.181 -2.708 . . . 1.0 . . . . . . . . . . . . A . 1 ASP HA . . . . . . . . . c19602_2mgt 1 . 1 . 13 . 1 1 2 ASP HB2 H -16.250 -6.307 -1.219 . . . 1.0 . . . . . . . . . . . . A . 1 ASP HB2 . . . . . . . . . c19602_2mgt 1 . 1 . 14 . 1 1 2 ASP HB3 H -16.835 -5.279 0.100 . . . 1.0 . . . . . . . . . . . . A . 1 ASP HB3 . . . . . . . . . c19602_2mgt 1 . 1 . 15 . 1 1 2 ASP N N -14.906 -4.285 -1.864 . . . 1.0 . . . . . . . . . . . . A . 1 ASP N . . . . . . . . . c19602_2mgt 1 . 1 . 16 . 1 1 2 ASP O O -15.943 -2.392 -0.193 . . . 1.0 . . . . . . . . . . . . A . 1 ASP O . . . . . . . . . c19602_2mgt 1 . 1 . 17 . 1 1 2 ASP OD1 O -19.217 -5.170 -0.773 . . . 1.0 . . . . . . . . . . . . A . 1 ASP OD1 . . . . . . . . . c19602_2mgt 1 . 1 . 18 . 1 1 2 ASP OD2 O -18.455 -6.569 -2.327 . . . 1.0 . . . . . . . . . . . . A . 1 ASP OD2 . . . . . . . . . c19602_2mgt 1 . 1 . 19 . 1 1 3 ALA C C -18.118 -0.452 0.234 . . . 1.0 . . . . . . . . . . . . A . 2 ALA C . . . . . . . . . c19602_2mgt 1 . 1 . 20 . 1 1 3 ALA CA C -18.246 -0.997 -1.186 . . . 1.0 . . . . . . . . . . . . A . 2 ALA CA . . . . . . . . . c19602_2mgt 1 . 1 . 21 . 1 1 3 ALA CB C -19.660 -0.832 -1.710 . . . 1.0 . . . . . . . . . . . . A . 2 ALA CB . . . . . . . . . c19602_2mgt 1 . 1 . 22 . 1 1 3 ALA H H -18.520 -2.955 -1.899 . . . 1.0 . . . . . . . . . . . . A . 2 ALA H . . . . . . . . . c19602_2mgt 1 . 1 . 23 . 1 1 3 ALA HA H -17.592 -0.418 -1.830 . . . 1.0 . . . . . . . . . . . . A . 2 ALA HA . . . . . . . . . c19602_2mgt 1 . 1 . 24 . 1 1 3 ALA HB1 H -19.878 0.229 -1.777 . . . 1.0 . . . . . . . . . . . . A . 2 ALA HB1 . . . . . . . . . c19602_2mgt 1 . 1 . 25 . 1 1 3 ALA HB2 H -19.729 -1.271 -2.703 . . . 1.0 . . . . . . . . . . . . A . 2 ALA HB2 . . . . . . . . . c19602_2mgt 1 . 1 . 26 . 1 1 3 ALA HB3 H -20.359 -1.329 -1.036 . . . 1.0 . . . . . . . . . . . . A . 2 ALA HB3 . . . . . . . . . c19602_2mgt 1 . 1 . 27 . 1 1 3 ALA N N -17.903 -2.400 -1.323 . . . 1.0 . . . . . . . . . . . . A . 2 ALA N . . . . . . . . . c19602_2mgt 1 . 1 . 28 . 1 1 3 ALA O O -17.630 0.659 0.403 . . . 1.0 . . . . . . . . . . . . A . 2 ALA O . . . . . . . . . c19602_2mgt 1 . 1 . 29 . 1 1 4 GLU C C -17.178 -0.464 3.240 . . . 1.0 . . . . . . . . . . . . A . 3 GLU C . . . . . . . . . c19602_2mgt 1 . 1 . 30 . 1 1 4 GLU CA C -18.531 -0.859 2.648 . . . 1.0 . . . . . . . . . . . . A . 3 GLU CA . . . . . . . . . c19602_2mgt 1 . 1 . 31 . 1 1 4 GLU CB C -19.158 -1.997 3.454 . . . 1.0 . . . . . . . . . . . . A . 3 GLU CB . . . . . . . . . c19602_2mgt 1 . 1 . 32 . 1 1 4 GLU CD C -19.102 -4.441 4.010 . . . 1.0 . . . . . . . . . . . . A . 3 GLU CD . . . . . . . . . c19602_2mgt 1 . 1 . 33 . 1 1 4 GLU CG C -18.354 -3.295 3.344 . . . 1.0 . . . . . . . . . . . . A . 3 GLU CG . . . . . . . . . c19602_2mgt 1 . 1 . 34 . 1 1 4 GLU H H -18.856 -2.160 1.007 . . . 1.0 . . . . . . . . . . . . A . 3 GLU H . . . . . . . . . c19602_2mgt 1 . 1 . 35 . 1 1 4 GLU HA H -19.166 0.011 2.739 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HA . . . . . . . . . c19602_2mgt 1 . 1 . 36 . 1 1 4 GLU HB2 H -19.228 -1.705 4.502 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HB2 . . . . . . . . . c19602_2mgt 1 . 1 . 37 . 1 1 4 GLU HB3 H -20.161 -2.173 3.069 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HB3 . . . . . . . . . c19602_2mgt 1 . 1 . 38 . 1 1 4 GLU HG2 H -18.186 -3.518 2.286 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HG2 . . . . . . . . . c19602_2mgt 1 . 1 . 39 . 1 1 4 GLU HG3 H -17.392 -3.168 3.843 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HG3 . . . . . . . . . c19602_2mgt 1 . 1 . 40 . 1 1 4 GLU N N -18.505 -1.241 1.239 . . . 1.0 . . . . . . . . . . . . A . 3 GLU N . . . . . . . . . c19602_2mgt 1 . 1 . 41 . 1 1 4 GLU O O -17.154 0.327 4.179 . . . 1.0 . . . . . . . . . . . . A . 3 GLU O . . . . . . . . . c19602_2mgt 1 . 1 . 42 . 1 1 4 GLU OE1 O -20.056 -4.941 3.376 . . . 1.0 . . . . . . . . . . . . A . 3 GLU OE1 . . . . . . . . . c19602_2mgt 1 . 1 . 43 . 1 1 4 GLU OE2 O -18.729 -4.784 5.147 . . . 1.0 . . . . . . . . . . . . A . 3 GLU OE2 . . . . . . . . . c19602_2mgt 1 . 1 . 44 . 1 1 5 PHE C C -13.907 0.017 1.975 . . . 1.0 . . . . . . . . . . . . A . 4 PHE C . . . . . . . . . c19602_2mgt 1 . 1 . 45 . 1 1 5 PHE CA C -14.717 -0.642 3.087 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CA . . . . . . . . . c19602_2mgt 1 . 1 . 46 . 1 1 5 PHE CB C -14.030 -1.896 3.581 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CB . . . . . . . . . c19602_2mgt 1 . 1 . 47 . 1 1 5 PHE CD1 C -12.573 -2.743 1.738 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CD1 . . . . . . . . . c19602_2mgt 1 . 1 . 48 . 1 1 5 PHE CD2 C -14.615 -3.952 2.291 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CD2 . . . . . . . . . c19602_2mgt 1 . 1 . 49 . 1 1 5 PHE CE1 C -12.280 -3.689 0.748 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CE1 . . . . . . . . . c19602_2mgt 1 . 1 . 50 . 1 1 5 PHE CE2 C -14.289 -4.932 1.346 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CE2 . . . . . . . . . c19602_2mgt 1 . 1 . 51 . 1 1 5 PHE CG C -13.727 -2.896 2.513 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CG . . . . . . . . . c19602_2mgt 1 . 1 . 52 . 1 1 5 PHE CZ C -13.108 -4.816 0.595 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CZ . . . . . . . . . c19602_2mgt 1 . 1 . 53 . 1 1 5 PHE H H -16.179 -1.707 1.995 . . . 1.0 . . . . . . . . . . . . A . 4 PHE H . . . . . . . . . c19602_2mgt 1 . 1 . 54 . 1 1 5 PHE HA H -14.746 0.063 3.906 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HA . . . . . . . . . c19602_2mgt 1 . 1 . 55 . 1 1 5 PHE HB2 H -13.092 -1.592 4.032 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HB2 . . . . . . . . . c19602_2mgt 1 . 1 . 56 . 1 1 5 PHE HB3 H -14.662 -2.379 4.325 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HB3 . . . . . . . . . c19602_2mgt 1 . 1 . 57 . 1 1 5 PHE HD1 H -11.948 -1.876 1.899 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HD1 . . . . . . . . . c19602_2mgt 1 . 1 . 58 . 1 1 5 PHE HD2 H -15.537 -3.990 2.849 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HD2 . . . . . . . . . c19602_2mgt 1 . 1 . 59 . 1 1 5 PHE HE1 H -11.417 -3.556 0.116 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HE1 . . . . . . . . . c19602_2mgt 1 . 1 . 60 . 1 1 5 PHE HE2 H -14.952 -5.764 1.191 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HE2 . . . . . . . . . c19602_2mgt 1 . 1 . 61 . 1 1 5 PHE HZ H -12.856 -5.584 -0.119 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HZ . . . . . . . . . c19602_2mgt 1 . 1 . 62 . 1 1 5 PHE N N -16.075 -0.987 2.694 . . . 1.0 . . . . . . . . . . . . A . 4 PHE N . . . . . . . . . c19602_2mgt 1 . 1 . 63 . 1 1 5 PHE O O -12.852 0.586 2.257 . . . 1.0 . . . . . . . . . . . . A . 4 PHE O . . . . . . . . . c19602_2mgt 1 . 1 . 64 . 1 1 6 ARG C C -14.638 2.245 -0.066 . . . 1.0 . . . . . . . . . . . . A . 5 ARG C . . . . . . . . . c19602_2mgt 1 . 1 . 65 . 1 1 6 ARG CA C -14.031 0.874 -0.335 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CA . . . . . . . . . c19602_2mgt 1 . 1 . 66 . 1 1 6 ARG CB C -14.471 0.286 -1.674 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CB . . . . . . . . . c19602_2mgt 1 . 1 . 67 . 1 1 6 ARG CD C -12.136 -0.590 -2.209 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CD . . . . . . . . . c19602_2mgt 1 . 1 . 68 . 1 1 6 ARG CG C -13.621 -0.917 -2.106 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CG . . . . . . . . . c19602_2mgt 1 . 1 . 69 . 1 1 6 ARG CZ C -11.396 0.632 -4.266 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CZ . . . . . . . . . c19602_2mgt 1 . 1 . 70 . 1 1 6 ARG H H -15.234 -0.593 0.573 . . . 1.0 . . . . . . . . . . . . A . 5 ARG H . . . . . . . . . c19602_2mgt 1 . 1 . 71 . 1 1 6 ARG HA H -12.950 0.998 -0.324 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HA . . . . . . . . . c19602_2mgt 1 . 1 . 72 . 1 1 6 ARG HB2 H -15.510 -0.018 -1.593 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HB2 . . . . . . . . . c19602_2mgt 1 . 1 . 73 . 1 1 6 ARG HB3 H -14.405 1.060 -2.435 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HB3 . . . . . . . . . c19602_2mgt 1 . 1 . 74 . 1 1 6 ARG HD2 H -11.747 -0.426 -1.210 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HD2 . . . . . . . . . c19602_2mgt 1 . 1 . 75 . 1 1 6 ARG HD3 H -11.638 -1.461 -2.625 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HD3 . . . . . . . . . c19602_2mgt 1 . 1 . 76 . 1 1 6 ARG HE H -12.097 1.502 -2.587 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HE . . . . . . . . . c19602_2mgt 1 . 1 . 77 . 1 1 6 ARG HG2 H -13.738 -1.727 -1.388 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HG2 . . . . . . . . . c19602_2mgt 1 . 1 . 78 . 1 1 6 ARG HG3 H -13.959 -1.271 -3.077 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HG3 . . . . . . . . . c19602_2mgt 1 . 1 . 79 . 1 1 6 ARG HH11 H -11.263 -1.392 -4.444 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH11 . . . . . . . . . c19602_2mgt 1 . 1 . 80 . 1 1 6 ARG HH12 H -10.729 -0.481 -5.834 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH12 . . . . . . . . . c19602_2mgt 1 . 1 . 81 . 1 1 6 ARG HH21 H -11.392 2.668 -4.426 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH21 . . . . . . . . . c19602_2mgt 1 . 1 . 82 . 1 1 6 ARG HH22 H -10.792 1.800 -5.821 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH22 . . . . . . . . . c19602_2mgt 1 . 1 . 83 . 1 1 6 ARG N N -14.418 -0.021 0.739 . . . 1.0 . . . . . . . . . . . . A . 5 ARG N . . . . . . . . . c19602_2mgt 1 . 1 . 84 . 1 1 6 ARG NE N -11.873 0.616 -3.015 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NE . . . . . . . . . c19602_2mgt 1 . 1 . 85 . 1 1 6 ARG NH1 N -11.128 -0.505 -4.906 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NH1 . . . . . . . . . c19602_2mgt 1 . 1 . 86 . 1 1 6 ARG NH2 N -11.180 1.795 -4.887 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NH2 . . . . . . . . . c19602_2mgt 1 . 1 . 87 . 1 1 6 ARG O O -15.573 2.697 -0.725 . . . 1.0 . . . . . . . . . . . . A . 5 ARG O . . . . . . . . . c19602_2mgt 1 . 1 . 88 . 1 1 7 ARG C C -13.363 5.158 1.064 . . . 1.0 . . . . . . . . . . . . A . 6 ARG C . . . . . . . . . c19602_2mgt 1 . 1 . 89 . 1 1 7 ARG CA C -14.432 4.153 1.498 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CA . . . . . . . . . c19602_2mgt 1 . 1 . 90 . 1 1 7 ARG CB C -14.546 4.027 3.024 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CB . . . . . . . . . c19602_2mgt 1 . 1 . 91 . 1 1 7 ARG CD C -17.073 3.425 3.338 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CD . . . . . . . . . c19602_2mgt 1 . 1 . 92 . 1 1 7 ARG CG C -15.609 3.030 3.514 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CG . . . . . . . . . c19602_2mgt 1 . 1 . 93 . 1 1 7 ARG CZ C -18.183 3.853 1.157 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CZ . . . . . . . . . c19602_2mgt 1 . 1 . 94 . 1 1 7 ARG H H -13.357 2.408 1.474 . . . 1.0 . . . . . . . . . . . . A . 6 ARG H . . . . . . . . . c19602_2mgt 1 . 1 . 95 . 1 1 7 ARG HA H -15.391 4.427 1.094 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HA . . . . . . . . . c19602_2mgt 1 . 1 . 96 . 1 1 7 ARG HB2 H -13.594 3.648 3.393 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HB2 . . . . . . . . . c19602_2mgt 1 . 1 . 97 . 1 1 7 ARG HB3 H -14.744 5.005 3.464 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HB3 . . . . . . . . . c19602_2mgt 1 . 1 . 98 . 1 1 7 ARG HD2 H -17.674 2.871 4.055 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HD2 . . . . . . . . . c19602_2mgt 1 . 1 . 99 . 1 1 7 ARG HD3 H -17.194 4.489 3.535 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HD3 . . . . . . . . . c19602_2mgt 1 . 1 . 100 . 1 1 7 ARG HE H -17.495 2.062 1.783 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HE . . . . . . . . . c19602_2mgt 1 . 1 . 101 . 1 1 7 ARG HG2 H -15.430 2.068 3.038 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HG2 . . . . . . . . . c19602_2mgt 1 . 1 . 102 . 1 1 7 ARG HG3 H -15.466 2.914 4.581 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HG3 . . . . . . . . . c19602_2mgt 1 . 1 . 103 . 1 1 7 ARG HH11 H -18.128 5.524 2.311 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH11 . . . . . . . . . c19602_2mgt 1 . 1 . 104 . 1 1 7 ARG HH12 H -18.840 5.731 0.728 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH12 . . . . . . . . . c19602_2mgt 1 . 1 . 105 . 1 1 7 ARG HH21 H -18.393 2.394 -0.230 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH21 . . . . . . . . . c19602_2mgt 1 . 1 . 106 . 1 1 7 ARG HH22 H -19.000 3.973 -0.688 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH22 . . . . . . . . . c19602_2mgt 1 . 1 . 107 . 1 1 7 ARG N N -14.075 2.878 0.961 . . . 1.0 . . . . . . . . . . . . A . 6 ARG N . . . . . . . . . c19602_2mgt 1 . 1 . 108 . 1 1 7 ARG NE N -17.579 3.043 2.026 . . . 1.0 . . . . . . . . . . . . A . 6 ARG NE . . . . . . . . . c19602_2mgt 1 . 1 . 109 . 1 1 7 ARG NH1 N -18.439 5.130 1.434 . . . 1.0 . . . . . . . . . . . . A . 6 ARG NH1 . . . . . . . . . c19602_2mgt 1 . 1 . 110 . 1 1 7 ARG NH2 N -18.531 3.374 -0.028 . . . 1.0 . . . . . . . . . . . . A . 6 ARG NH2 . . . . . . . . . c19602_2mgt 1 . 1 . 111 . 1 1 7 ARG O O -12.187 4.832 0.902 . . . 1.0 . . . . . . . . . . . . A . 6 ARG O . . . . . . . . . c19602_2mgt 1 . 1 . 112 . 1 1 8 ASP C C -12.260 8.110 1.738 . . . 1.0 . . . . . . . . . . . . A . 7 ASP C . . . . . . . . . c19602_2mgt 1 . 1 . 113 . 1 1 8 ASP CA C -13.007 7.556 0.525 . . . 1.0 . . . . . . . . . . . . A . 7 ASP CA . . . . . . . . . c19602_2mgt 1 . 1 . 114 . 1 1 8 ASP CB C -13.972 8.632 0.017 . . . 1.0 . . . . . . . . . . . . A . 7 ASP CB . . . . . . . . . c19602_2mgt 1 . 1 . 115 . 1 1 8 ASP CG C -14.639 8.262 -1.318 . . . 1.0 . . . . . . . . . . . . A . 7 ASP CG . . . . . . . . . c19602_2mgt 1 . 1 . 116 . 1 1 8 ASP H H -14.782 6.567 1.057 . . . 1.0 . . . . . . . . . . . . A . 7 ASP H . . . . . . . . . c19602_2mgt 1 . 1 . 117 . 1 1 8 ASP HA H -12.290 7.296 -0.254 . . . 1.0 . . . . . . . . . . . . A . 7 ASP HA . . . . . . . . . c19602_2mgt 1 . 1 . 118 . 1 1 8 ASP HB2 H -14.735 8.821 0.772 . . . 1.0 . . . . . . . . . . . . A . 7 ASP HB2 . . . . . . . . . c19602_2mgt 1 . 1 . 119 . 1 1 8 ASP HB3 H -13.427 9.563 -0.069 . . . 1.0 . . . . . . . . . . . . A . 7 ASP HB3 . . . . . . . . . c19602_2mgt 1 . 1 . 120 . 1 1 8 ASP N N -13.809 6.393 0.875 . . . 1.0 . . . . . . . . . . . . A . 7 ASP N . . . . . . . . . c19602_2mgt 1 . 1 . 121 . 1 1 8 ASP O O -11.295 8.856 1.594 . . . 1.0 . . . . . . . . . . . . A . 7 ASP O . . . . . . . . . c19602_2mgt 1 . 1 . 122 . 1 1 8 ASP OD1 O -13.941 7.691 -2.187 . . . 1.0 . . . . . . . . . . . . A . 7 ASP OD1 . . . . . . . . . c19602_2mgt 1 . 1 . 123 . 1 1 8 ASP OD2 O -15.852 8.535 -1.441 . . . 1.0 . . . . . . . . . . . . A . 7 ASP OD2 . . . . . . . . . c19602_2mgt 1 . 1 . 124 . 1 1 9 SER C C -11.085 7.848 4.796 . . . 1.0 . . . . . . . . . . . . A . 8 SER C . . . . . . . . . c19602_2mgt 1 . 1 . 125 . 1 1 9 SER CA C -12.373 8.396 4.179 . . . 1.0 . . . . . . . . . . . . A . 8 SER CA . . . . . . . . . c19602_2mgt 1 . 1 . 126 . 1 1 9 SER CB C -13.561 8.243 5.125 . . . 1.0 . . . . . . . . . . . . A . 8 SER CB . . . . . . . . . c19602_2mgt 1 . 1 . 127 . 1 1 9 SER H H -13.547 7.182 2.978 . . . 1.0 . . . . . . . . . . . . A . 8 SER H . . . . . . . . . c19602_2mgt 1 . 1 . 128 . 1 1 9 SER HA H -12.236 9.450 3.968 . . . 1.0 . . . . . . . . . . . . A . 8 SER HA . . . . . . . . . c19602_2mgt 1 . 1 . 129 . 1 1 9 SER HB2 H -13.844 7.195 5.216 . . . 1.0 . . . . . . . . . . . . A . 8 SER HB2 . . . . . . . . . c19602_2mgt 1 . 1 . 130 . 1 1 9 SER HB3 H -13.297 8.609 6.112 . . . 1.0 . . . . . . . . . . . . A . 8 SER HB3 . . . . . . . . . c19602_2mgt 1 . 1 . 131 . 1 1 9 SER HG H -15.364 8.978 5.231 . . . 1.0 . . . . . . . . . . . . A . 8 SER HG . . . . . . . . . c19602_2mgt 1 . 1 . 132 . 1 1 9 SER N N -12.735 7.768 2.935 . . . 1.0 . . . . . . . . . . . . A . 8 SER N . . . . . . . . . c19602_2mgt 1 . 1 . 133 . 1 1 9 SER O O -10.837 8.135 5.963 . . . 1.0 . . . . . . . . . . . . A . 8 SER O . . . . . . . . . c19602_2mgt 1 . 1 . 134 . 1 1 9 SER OG O -14.633 8.999 4.608 . . . 1.0 . . . . . . . . . . . . A . 8 SER OG . . . . . . . . . c19602_2mgt 1 . 1 . 135 . 1 1 10 GLY C C -8.010 7.235 3.483 . . . 1.0 . . . . . . . . . . . . A . 9 GLY C . . . . . . . . . c19602_2mgt 1 . 1 . 136 . 1 1 10 GLY CA C -8.982 6.602 4.471 . . . 1.0 . . . . . . . . . . . . A . 9 GLY CA . . . . . . . . . c19602_2mgt 1 . 1 . 137 . 1 1 10 GLY H H -10.437 6.986 3.052 . . . 1.0 . . . . . . . . . . . . A . 9 GLY H . . . . . . . . . c19602_2mgt 1 . 1 . 138 . 1 1 10 GLY HA2 H -8.747 6.917 5.479 . . . 1.0 . . . . . . . . . . . . A . 9 GLY HA2 . . . . . . . . . c19602_2mgt 1 . 1 . 139 . 1 1 10 GLY HA3 H -8.967 5.514 4.431 . . . 1.0 . . . . . . . . . . . . A . 9 GLY HA3 . . . . . . . . . c19602_2mgt 1 . 1 . 140 . 1 1 10 GLY N N -10.285 7.067 4.051 . . . 1.0 . . . . . . . . . . . . A . 9 GLY N . . . . . . . . . c19602_2mgt 1 . 1 . 141 . 1 1 10 GLY O O -8.031 8.447 3.324 . . . 1.0 . . . . . . . . . . . . A . 9 GLY O . . . . . . . . . c19602_2mgt 1 . 1 . 142 . 1 1 11 TYR C C -5.776 4.663 2.020 . . . 1.0 . . . . . . . . . . . . A . 10 TYR C . . . . . . . . . c19602_2mgt 1 . 1 . 143 . 1 1 11 TYR CA C -7.015 5.057 2.818 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CA . . . . . . . . . c19602_2mgt 1 . 1 . 144 . 1 1 11 TYR CB C -8.246 4.397 2.179 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CB . . . . . . . . . c19602_2mgt 1 . 1 . 145 . 1 1 11 TYR CD1 C -8.120 2.344 3.656 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CD1 . . . . . . . . . c19602_2mgt 1 . 1 . 146 . 1 1 11 TYR CD2 C -10.273 3.380 3.248 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CD2 . . . . . . . . . c19602_2mgt 1 . 1 . 147 . 1 1 11 TYR CE1 C -8.735 1.343 4.410 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CE1 . . . . . . . . . c19602_2mgt 1 . 1 . 148 . 1 1 11 TYR CE2 C -10.899 2.374 3.989 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CE2 . . . . . . . . . c19602_2mgt 1 . 1 . 149 . 1 1 11 TYR CG C -8.888 3.347 3.046 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CG . . . . . . . . . c19602_2mgt 1 . 1 . 150 . 1 1 11 TYR CZ C -10.139 1.324 4.544 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CZ . . . . . . . . . c19602_2mgt 1 . 1 . 151 . 1 1 11 TYR H H -6.886 6.853 1.882 . . . 1.0 . . . . . . . . . . . . A . 10 TYR H . . . . . . . . . c19602_2mgt 1 . 1 . 152 . 1 1 11 TYR HA H -6.899 4.754 3.859 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HA . . . . . . . . . c19602_2mgt 1 . 1 . 153 . 1 1 11 TYR HB2 H -8.999 5.150 1.938 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HB2 . . . . . . . . . c19602_2mgt 1 . 1 . 154 . 1 1 11 TYR HB3 H -7.967 3.958 1.223 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HB3 . . . . . . . . . c19602_2mgt 1 . 1 . 155 . 1 1 11 TYR HD1 H -7.055 2.330 3.550 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HD1 . . . . . . . . . c19602_2mgt 1 . 1 . 156 . 1 1 11 TYR HD2 H -10.849 4.190 2.842 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HD2 . . . . . . . . . c19602_2mgt 1 . 1 . 157 . 1 1 11 TYR HE1 H -8.117 0.615 4.899 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HE1 . . . . . . . . . c19602_2mgt 1 . 1 . 158 . 1 1 11 TYR HE2 H -11.956 2.430 4.160 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HE2 . . . . . . . . . c19602_2mgt 1 . 1 . 159 . 1 1 11 TYR HH H -11.706 0.455 5.310 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HH . . . . . . . . . c19602_2mgt 1 . 1 . 160 . 1 1 11 TYR N N -7.192 6.478 2.753 . . . 1.0 . . . . . . . . . . . . A . 10 TYR N . . . . . . . . . c19602_2mgt 1 . 1 . 161 . 1 1 11 TYR O O -5.423 5.306 1.034 . . . 1.0 . . . . . . . . . . . . A . 10 TYR O . . . . . . . . . c19602_2mgt 1 . 1 . 162 . 1 1 11 TYR OH O -10.755 0.335 5.250 . . . 1.0 . . . . . . . . . . . . A . 10 TYR OH . . . . . . . . . c19602_2mgt 1 . 1 . 163 . 1 1 12 GLU C C -5.428 1.208 1.744 . . . 1.0 . . . . . . . . . . . . A . 11 GLU C . . . . . . . . . c19602_2mgt 1 . 1 . 164 . 1 1 12 GLU CA C -4.778 2.548 1.388 . . . 1.0 . . . . . . . . . . . . A . 11 GLU CA . . . . . . . . . c19602_2mgt 1 . 1 . 165 . 1 1 12 GLU CB C -3.271 2.487 1.462 . . . 1.0 . . . . . . . . . . . . A . 11 GLU CB . . . . . . . . . c19602_2mgt 1 . 1 . 166 . 1 1 12 GLU CD C -1.341 1.035 0.806 . . . 1.0 . . . . . . . . . . . . A . 11 GLU CD . . . . . . . . . c19602_2mgt 1 . 1 . 167 . 1 1 12 GLU CG C -2.685 1.577 0.391 . . . 1.0 . . . . . . . . . . . . A . 11 GLU CG . . . . . . . . . c19602_2mgt 1 . 1 . 168 . 1 1 12 GLU H H -5.393 3.125 3.281 . . . 1.0 . . . . . . . . . . . . A . 11 GLU H . . . . . . . . . c19602_2mgt 1 . 1 . 169 . 1 1 12 GLU HA H -5.081 2.871 0.390 . . . 1.0 . . . . . . . . . . . . A . 11 GLU HA . . . . . . . . . c19602_2mgt 1 . 1 . 170 . 1 1 12 GLU HB2 H -2.884 3.495 1.350 . . . 1.0 . . . . . . . . . . . . A . 11 GLU HB2 . . . . . . . . . c19602_2mgt 1 . 1 . 171 . 1 1 12 GLU HB3 H -2.990 2.141 2.459 . . . 1.0 . . . . . . . . . . . . A . 11 GLU HB3 . . . . . . . . . c19602_2mgt 1 . 1 . 172 . 1 1 12 GLU HG2 H -3.324 0.690 0.269 . . . 1.0 . . . . . . . . . . . . A . 11 GLU HG2 . . . . . . . . . c19602_2mgt 1 . 1 . 173 . 1 1 12 GLU HG3 H -2.633 2.055 -0.576 . . . 1.0 . . . . . . . . . . . . A . 11 GLU HG3 . . . . . . . . . c19602_2mgt 1 . 1 . 174 . 1 1 12 GLU N N -5.220 3.506 2.368 . . . 1.0 . . . . . . . . . . . . A . 11 GLU N . . . . . . . . . c19602_2mgt 1 . 1 . 175 . 1 1 12 GLU O O -5.005 0.531 2.684 . . . 1.0 . . . . . . . . . . . . A . 11 GLU O . . . . . . . . . c19602_2mgt 1 . 1 . 176 . 1 1 12 GLU OE1 O -0.532 1.916 1.423 . . . 1.0 . . . . . . . . . . . . A . 11 GLU OE1 . . . . . . . . . c19602_2mgt 1 . 1 . 177 . 1 1 12 GLU OE2 O -1.041 -0.050 0.590 . . . 1.0 . . . . . . . . . . . . A . 11 GLU OE2 . . . . . . . . . c19602_2mgt 1 . 1 . 178 . 1 1 13 VAL C C -6.591 -1.620 1.218 . . . 1.0 . . . . . . . . . . . . A . 12 VAL C . . . . . . . . . c19602_2mgt 1 . 1 . 179 . 1 1 13 VAL CA C -7.341 -0.299 1.239 . . . 1.0 . . . . . . . . . . . . A . 12 VAL CA . . . . . . . . . c19602_2mgt 1 . 1 . 180 . 1 1 13 VAL CB C -8.524 -0.294 0.252 . . . 1.0 . . . . . . . . . . . . A . 12 VAL CB . . . . . . . . . c19602_2mgt 1 . 1 . 181 . 1 1 13 VAL CG1 C -9.335 -1.596 0.275 . . . 1.0 . . . . . . . . . . . . A . 12 VAL CG1 . . . . . . . . . c19602_2mgt 1 . 1 . 182 . 1 1 13 VAL CG2 C -9.484 0.828 0.645 . . . 1.0 . . . . . . . . . . . . A . 12 VAL CG2 . . . . . . . . . c19602_2mgt 1 . 1 . 183 . 1 1 13 VAL H H -6.786 1.483 0.279 . . . 1.0 . . . . . . . . . . . . A . 12 VAL H . . . . . . . . . c19602_2mgt 1 . 1 . 184 . 1 1 13 VAL HA H -7.741 -0.193 2.233 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HA . . . . . . . . . c19602_2mgt 1 . 1 . 185 . 1 1 13 VAL HB H -8.157 -0.121 -0.762 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HB . . . . . . . . . c19602_2mgt 1 . 1 . 186 . 1 1 13 VAL HG11 H -10.211 -1.502 -0.353 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HG11 . . . . . . . . . c19602_2mgt 1 . 1 . 187 . 1 1 13 VAL HG12 H -8.738 -2.418 -0.118 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HG12 . . . . . . . . . c19602_2mgt 1 . 1 . 188 . 1 1 13 VAL HG13 H -9.648 -1.818 1.295 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HG13 . . . . . . . . . c19602_2mgt 1 . 1 . 189 . 1 1 13 VAL HG21 H -10.309 0.856 -0.062 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HG21 . . . . . . . . . c19602_2mgt 1 . 1 . 190 . 1 1 13 VAL HG22 H -9.858 0.645 1.650 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HG22 . . . . . . . . . c19602_2mgt 1 . 1 . 191 . 1 1 13 VAL HG23 H -8.957 1.778 0.605 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HG23 . . . . . . . . . c19602_2mgt 1 . 1 . 192 . 1 1 13 VAL N N -6.478 0.853 0.995 . . . 1.0 . . . . . . . . . . . . A . 12 VAL N . . . . . . . . . c19602_2mgt 1 . 1 . 193 . 1 1 13 VAL O O -7.091 -2.600 1.763 . . . 1.0 . . . . . . . . . . . . A . 12 VAL O . . . . . . . . . c19602_2mgt 1 . 1 . 194 . 1 1 14 HIS C C -4.248 -3.448 1.954 . . . 1.0 . . . . . . . . . . . . A . 13 HIS C . . . . . . . . . c19602_2mgt 1 . 1 . 195 . 1 1 14 HIS CA C -4.613 -2.863 0.577 . . . 1.0 . . . . . . . . . . . . A . 13 HIS CA . . . . . . . . . c19602_2mgt 1 . 1 . 196 . 1 1 14 HIS CB C -3.373 -2.557 -0.251 . . . 1.0 . . . . . . . . . . . . A . 13 HIS CB . . . . . . . . . c19602_2mgt 1 . 1 . 197 . 1 1 14 HIS CD2 C -1.292 -3.983 0.162 . . . 1.0 . . . . . . . . . . . . A . 13 HIS CD2 . . . . . . . . . c19602_2mgt 1 . 1 . 198 . 1 1 14 HIS CE1 C -1.728 -5.665 -1.162 . . . 1.0 . . . . . . . . . . . . A . 13 HIS CE1 . . . . . . . . . c19602_2mgt 1 . 1 . 199 . 1 1 14 HIS CG C -2.481 -3.738 -0.467 . . . 1.0 . . . . . . . . . . . . A . 13 HIS CG . . . . . . . . . c19602_2mgt 1 . 1 . 200 . 1 1 14 HIS H H -5.011 -0.823 0.211 . . . 1.0 . . . . . . . . . . . . A . 13 HIS H . . . . . . . . . c19602_2mgt 1 . 1 . 201 . 1 1 14 HIS HA H -5.270 -3.543 0.059 . . . 1.0 . . . . . . . . . . . . A . 13 HIS HA . . . . . . . . . c19602_2mgt 1 . 1 . 202 . 1 1 14 HIS HB2 H -3.683 -2.175 -1.223 . . . 1.0 . . . . . . . . . . . . A . 13 HIS HB2 . . . . . . . . . c19602_2mgt 1 . 1 . 203 . 1 1 14 HIS HB3 H -2.804 -1.789 0.266 . . . 1.0 . . . . . . . . . . . . A . 13 HIS HB3 . . . . . . . . . c19602_2mgt 1 . 1 . 204 . 1 1 14 HIS HD1 H -3.521 -4.888 -1.931 . . . 1.0 . . . . . . . . . . . . A . 13 HIS HD1 . . . . . . . . . c19602_2mgt 1 . 1 . 205 . 1 1 14 HIS HD2 H -0.825 -3.360 0.910 . . . 1.0 . . . . . . . . . . . . A . 13 HIS HD2 . . . . . . . . . c19602_2mgt 1 . 1 . 206 . 1 1 14 HIS HE1 H -1.659 -6.599 -1.700 . . . 1.0 . . . . . . . . . . . . A . 13 HIS HE1 . . . . . . . . . c19602_2mgt 1 . 1 . 207 . 1 1 14 HIS N N -5.389 -1.652 0.645 . . . 1.0 . . . . . . . . . . . . A . 13 HIS N . . . . . . . . . c19602_2mgt 1 . 1 . 208 . 1 1 14 HIS ND1 N -2.739 -4.798 -1.299 . . . 1.0 . . . . . . . . . . . . A . 13 HIS ND1 . . . . . . . . . c19602_2mgt 1 . 1 . 209 . 1 1 14 HIS NE2 N -0.804 -5.202 -0.305 . . . 1.0 . . . . . . . . . . . . A . 13 HIS NE2 . . . . . . . . . c19602_2mgt 1 . 1 . 210 . 1 1 14 HIS O O -3.931 -4.633 2.051 . . . 1.0 . . . . . . . . . . . . A . 13 HIS O . . . . . . . . . c19602_2mgt 1 . 1 . 211 . 1 1 15 HIS C C -5.331 -3.204 5.227 . . . 1.0 . . . . . . . . . . . . A . 14 HIS C . . . . . . . . . c19602_2mgt 1 . 1 . 212 . 1 1 15 HIS CA C -4.057 -3.013 4.387 . . . 1.0 . . . . . . . . . . . . A . 14 HIS CA . . . . . . . . . c19602_2mgt 1 . 1 . 213 . 1 1 15 HIS CB C -3.145 -1.956 5.007 . . . 1.0 . . . . . . . . . . . . A . 14 HIS CB . . . . . . . . . c19602_2mgt 1 . 1 . 214 . 1 1 15 HIS CD2 C -1.410 -0.911 3.484 . . . 1.0 . . . . . . . . . . . . A . 14 HIS CD2 . . . . . . . . . c19602_2mgt 1 . 1 . 215 . 1 1 15 HIS CE1 C 0.181 -2.401 3.553 . . . 1.0 . . . . . . . . . . . . A . 14 HIS CE1 . . . . . . . . . c19602_2mgt 1 . 1 . 216 . 1 1 15 HIS CG C -1.799 -1.893 4.341 . . . 1.0 . . . . . . . . . . . . A . 14 HIS CG . . . . . . . . . c19602_2mgt 1 . 1 . 217 . 1 1 15 HIS H H -4.601 -1.664 2.842 . . . 1.0 . . . . . . . . . . . . A . 14 HIS H . . . . . . . . . c19602_2mgt 1 . 1 . 218 . 1 1 15 HIS HA H -3.529 -3.967 4.382 . . . 1.0 . . . . . . . . . . . . A . 14 HIS HA . . . . . . . . . c19602_2mgt 1 . 1 . 219 . 1 1 15 HIS HB2 H -3.630 -0.981 4.948 . . . 1.0 . . . . . . . . . . . . A . 14 HIS HB2 . . . . . . . . . c19602_2mgt 1 . 1 . 220 . 1 1 15 HIS HB3 H -2.995 -2.176 6.052 . . . 1.0 . . . . . . . . . . . . A . 14 HIS HB3 . . . . . . . . . c19602_2mgt 1 . 1 . 221 . 1 1 15 HIS HD1 H -0.778 -3.683 4.919 . . . 1.0 . . . . . . . . . . . . A . 14 HIS HD1 . . . . . . . . . c19602_2mgt 1 . 1 . 222 . 1 1 15 HIS HD2 H -2.021 -0.068 3.211 . . . 1.0 . . . . . . . . . . . . A . 14 HIS HD2 . . . . . . . . . c19602_2mgt 1 . 1 . 223 . 1 1 15 HIS HE1 H 1.087 -2.934 3.329 . . . 1.0 . . . . . . . . . . . . A . 14 HIS HE1 . . . . . . . . . c19602_2mgt 1 . 1 . 224 . 1 1 15 HIS N N -4.322 -2.624 3.007 . . . 1.0 . . . . . . . . . . . . A . 14 HIS N . . . . . . . . . c19602_2mgt 1 . 1 . 225 . 1 1 15 HIS ND1 N -0.785 -2.825 4.387 . . . 1.0 . . . . . . . . . . . . A . 14 HIS ND1 . . . . . . . . . c19602_2mgt 1 . 1 . 226 . 1 1 15 HIS NE2 N -0.141 -1.237 2.991 . . . 1.0 . . . . . . . . . . . . A . 14 HIS NE2 . . . . . . . . . c19602_2mgt 1 . 1 . 227 . 1 1 15 HIS O O -5.230 -3.470 6.424 . . . 1.0 . . . . . . . . . . . . A . 14 HIS O . . . . . . . . . c19602_2mgt 1 . 1 . 228 . 1 1 16 GLN C C -8.508 -4.510 4.304 . . . 1.0 . . . . . . . . . . . . A . 15 GLN C . . . . . . . . . c19602_2mgt 1 . 1 . 229 . 1 1 16 GLN CA C -7.788 -3.490 5.184 . . . 1.0 . . . . . . . . . . . . A . 15 GLN CA . . . . . . . . . c19602_2mgt 1 . 1 . 230 . 1 1 16 GLN CB C -8.650 -2.259 5.475 . . . 1.0 . . . . . . . . . . . . A . 15 GLN CB . . . . . . . . . c19602_2mgt 1 . 1 . 231 . 1 1 16 GLN CD C -8.734 -2.507 8.029 . . . 1.0 . . . . . . . . . . . . A . 15 GLN CD . . . . . . . . . c19602_2mgt 1 . 1 . 232 . 1 1 16 GLN CG C -8.315 -1.633 6.838 . . . 1.0 . . . . . . . . . . . . A . 15 GLN CG . . . . . . . . . c19602_2mgt 1 . 1 . 233 . 1 1 16 GLN H H -6.564 -2.832 3.657 . . . 1.0 . . . . . . . . . . . . A . 15 GLN H . . . . . . . . . c19602_2mgt 1 . 1 . 234 . 1 1 16 GLN HA H -7.572 -3.999 6.102 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HA . . . . . . . . . c19602_2mgt 1 . 1 . 235 . 1 1 16 GLN HB2 H -8.520 -1.543 4.672 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HB2 . . . . . . . . . c19602_2mgt 1 . 1 . 236 . 1 1 16 GLN HB3 H -9.696 -2.533 5.477 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HB3 . . . . . . . . . c19602_2mgt 1 . 1 . 237 . 1 1 16 GLN HE21 H -8.525 -0.942 9.299 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HE21 . . . . . . . . . c19602_2mgt 1 . 1 . 238 . 1 1 16 GLN HE22 H -9.040 -2.450 10.029 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HE22 . . . . . . . . . c19602_2mgt 1 . 1 . 239 . 1 1 16 GLN HG2 H -7.246 -1.425 6.900 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HG2 . . . . . . . . . c19602_2mgt 1 . 1 . 240 . 1 1 16 GLN HG3 H -8.834 -0.678 6.916 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HG3 . . . . . . . . . c19602_2mgt 1 . 1 . 241 . 1 1 16 GLN N N -6.520 -3.089 4.621 . . . 1.0 . . . . . . . . . . . . A . 15 GLN N . . . . . . . . . c19602_2mgt 1 . 1 . 242 . 1 1 16 GLN NE2 N -8.763 -1.920 9.216 . . . 1.0 . . . . . . . . . . . . A . 15 GLN NE2 . . . . . . . . . c19602_2mgt 1 . 1 . 243 . 1 1 16 GLN O O -8.085 -4.808 3.190 . . . 1.0 . . . . . . . . . . . . A . 15 GLN O . . . . . . . . . c19602_2mgt 1 . 1 . 244 . 1 1 16 GLN OE1 O -9.038 -3.691 7.908 . . . 1.0 . . . . . . . . . . . . A . 15 GLN OE1 . . . . . . . . . c19602_2mgt 1 . 1 . 245 . 1 1 17 LYS C C -11.630 -6.049 3.831 . . . 1.0 . . . . . . . . . . . . A . 16 LYS C . . . . . . . . . c19602_2mgt 1 . 1 . 246 . 1 1 17 LYS CA C -10.199 -6.300 4.318 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CA . . . . . . . . . c19602_2mgt 1 . 1 . 247 . 1 1 17 LYS CB C -10.168 -7.410 5.383 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CB . . . . . . . . . c19602_2mgt 1 . 1 . 248 . 1 1 17 LYS CD C -8.706 -9.014 6.696 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CD . . . . . . . . . c19602_2mgt 1 . 1 . 249 . 1 1 17 LYS CE C -7.270 -9.343 7.103 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CE . . . . . . . . . c19602_2mgt 1 . 1 . 250 . 1 1 17 LYS CG C -8.740 -7.746 5.831 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CG . . . . . . . . . c19602_2mgt 1 . 1 . 251 . 1 1 17 LYS H H -9.891 -4.750 5.755 . . . 1.0 . . . . . . . . . . . . A . 16 LYS H . . . . . . . . . c19602_2mgt 1 . 1 . 252 . 1 1 17 LYS HA H -9.621 -6.650 3.465 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HA . . . . . . . . . c19602_2mgt 1 . 1 . 253 . 1 1 17 LYS HB2 H -10.758 -7.108 6.249 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HB2 . . . . . . . . . c19602_2mgt 1 . 1 . 254 . 1 1 17 LYS HB3 H -10.608 -8.309 4.955 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HB3 . . . . . . . . . c19602_2mgt 1 . 1 . 255 . 1 1 17 LYS HD2 H -9.315 -8.889 7.591 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HD2 . . . . . . . . . c19602_2mgt 1 . 1 . 256 . 1 1 17 LYS HD3 H -9.106 -9.852 6.126 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HD3 . . . . . . . . . c19602_2mgt 1 . 1 . 257 . 1 1 17 LYS HE2 H -7.265 -10.291 7.643 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HE2 . . . . . . . . . c19602_2mgt 1 . 1 . 258 . 1 1 17 LYS HE3 H -6.657 -9.440 6.208 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HE3 . . . . . . . . . c19602_2mgt 1 . 1 . 259 . 1 1 17 LYS HG2 H -8.117 -7.910 4.952 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HG2 . . . . . . . . . c19602_2mgt 1 . 1 . 260 . 1 1 17 LYS HG3 H -8.332 -6.905 6.393 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HG3 . . . . . . . . . c19602_2mgt 1 . 1 . 261 . 1 1 17 LYS HZ1 H -5.771 -8.577 8.260 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HZ1 . . . . . . . . . c19602_2mgt 1 . 1 . 262 . 1 1 17 LYS HZ2 H -6.615 -7.432 7.441 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HZ2 . . . . . . . . . c19602_2mgt 1 . 1 . 263 . 1 1 17 LYS HZ3 H -7.282 -8.152 8.766 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HZ3 . . . . . . . . . c19602_2mgt 1 . 1 . 264 . 1 1 17 LYS N N -9.578 -5.092 4.857 . . . 1.0 . . . . . . . . . . . . A . 16 LYS N . . . . . . . . . c19602_2mgt 1 . 1 . 265 . 1 1 17 LYS NZ N -6.693 -8.297 7.958 . . . 1.0 . . . . . . . . . . . . A . 16 LYS NZ . . . . . . . . . c19602_2mgt 1 . 1 . 266 . 1 1 17 LYS O O -12.047 -6.613 2.825 . . . 1.0 . . . . . . . . . . . . A . 16 LYS O . . . . . . . . . c19602_2mgt 1 . 1 . 267 . 1 1 18 NH2 HN1 H -13.349 -5.048 4.213 . . . 1.0 . . . . . . . . . . . . A . 17 NH2 HN1 . . . . . . . . . c19602_2mgt 1 . 1 . 268 . 1 1 18 NH2 HN2 H -12.060 -4.773 5.361 . . . 1.0 . . . . . . . . . . . . A . 17 NH2 HN2 . . . . . . . . . c19602_2mgt 1 . 1 . 269 . 1 1 18 NH2 N N -12.397 -5.202 4.513 . . . 1.0 . . . . . . . . . . . . A . 17 NH2 N . . . . . . . . . c19602_2mgt 1 . 1 . 270 . 2 1 1 ACE C C 11.846 5.890 -5.893 . . . 1.0 . . . . . . . . . . . . B . 0 ACE C . . . . . . . . . c19602_2mgt 1 . 1 . 271 . 2 1 1 ACE CH3 C 10.796 5.852 -4.787 . . . 1.0 . . . . . . . . . . . . B . 0 ACE CH3 . . . . . . . . . c19602_2mgt 1 . 1 . 272 . 2 1 1 ACE H1 H 11.268 5.866 -3.810 . . . 1.0 . . . . . . . . . . . . B . 0 ACE H1 . . . . . . . . . c19602_2mgt 1 . 1 . 273 . 2 1 1 ACE H2 H 10.147 6.721 -4.863 . . . 1.0 . . . . . . . . . . . . B . 0 ACE H2 . . . . . . . . . c19602_2mgt 1 . 1 . 274 . 2 1 1 ACE H3 H 10.196 4.948 -4.878 . . . 1.0 . . . . . . . . . . . . B . 0 ACE H3 . . . . . . . . . c19602_2mgt 1 . 1 . 275 . 2 1 1 ACE O O 11.481 5.952 -7.066 . . . 1.0 . . . . . . . . . . . . B . 0 ACE O . . . . . . . . . c19602_2mgt 1 . 1 . 276 . 2 1 2 ASP C C 14.705 4.327 -6.696 . . . 1.0 . . . . . . . . . . . . B . 1 ASP C . . . . . . . . . c19602_2mgt 1 . 1 . 277 . 2 1 2 ASP CA C 14.262 5.770 -6.445 . . . 1.0 . . . . . . . . . . . . B . 1 ASP CA . . . . . . . . . c19602_2mgt 1 . 1 . 278 . 2 1 2 ASP CB C 15.447 6.561 -5.880 . . . 1.0 . . . . . . . . . . . . B . 1 ASP CB . . . . . . . . . c19602_2mgt 1 . 1 . 279 . 2 1 2 ASP CG C 16.532 6.777 -6.924 . . . 1.0 . . . . . . . . . . . . B . 1 ASP CG . . . . . . . . . c19602_2mgt 1 . 1 . 280 . 2 1 2 ASP H H 13.355 5.769 -4.535 . . . 1.0 . . . . . . . . . . . . B . 1 ASP H . . . . . . . . . c19602_2mgt 1 . 1 . 281 . 2 1 2 ASP HA H 13.958 6.217 -7.392 . . . 1.0 . . . . . . . . . . . . B . 1 ASP HA . . . . . . . . . c19602_2mgt 1 . 1 . 282 . 2 1 2 ASP HB2 H 15.119 7.531 -5.530 . . . 1.0 . . . . . . . . . . . . B . 1 ASP HB2 . . . . . . . . . c19602_2mgt 1 . 1 . 283 . 2 1 2 ASP HB3 H 15.869 6.016 -5.040 . . . 1.0 . . . . . . . . . . . . B . 1 ASP HB3 . . . . . . . . . c19602_2mgt 1 . 1 . 284 . 2 1 2 ASP N N 13.133 5.830 -5.518 . . . 1.0 . . . . . . . . . . . . B . 1 ASP N . . . . . . . . . c19602_2mgt 1 . 1 . 285 . 2 1 2 ASP O O 14.427 3.453 -5.882 . . . 1.0 . . . . . . . . . . . . B . 1 ASP O . . . . . . . . . c19602_2mgt 1 . 1 . 286 . 2 1 2 ASP OD1 O 16.202 6.989 -8.092 . . . 1.0 . . . . . . . . . . . . B . 1 ASP OD1 . . . . . . . . . c19602_2mgt 1 . 1 . 287 . 2 1 2 ASP OD2 O 17.718 6.675 -6.494 . . . 1.0 . . . . . . . . . . . . B . 1 ASP OD2 . . . . . . . . . c19602_2mgt 1 . 1 . 288 . 2 1 3 ALA C C 16.379 1.816 -7.419 . . . 1.0 . . . . . . . . . . . . B . 2 ALA C . . . . . . . . . c19602_2mgt 1 . 1 . 289 . 2 1 3 ALA CA C 15.742 2.801 -8.383 . . . 1.0 . . . . . . . . . . . . B . 2 ALA CA . . . . . . . . . c19602_2mgt 1 . 1 . 290 . 2 1 3 ALA CB C 16.687 3.016 -9.557 . . . 1.0 . . . . . . . . . . . . B . 2 ALA CB . . . . . . . . . c19602_2mgt 1 . 1 . 291 . 2 1 3 ALA H H 15.676 4.910 -8.366 . . . 1.0 . . . . . . . . . . . . B . 2 ALA H . . . . . . . . . c19602_2mgt 1 . 1 . 292 . 2 1 3 ALA HA H 14.838 2.339 -8.764 . . . 1.0 . . . . . . . . . . . . B . 2 ALA HA . . . . . . . . . c19602_2mgt 1 . 1 . 293 . 2 1 3 ALA HB1 H 16.932 2.045 -9.978 . . . 1.0 . . . . . . . . . . . . B . 2 ALA HB1 . . . . . . . . . c19602_2mgt 1 . 1 . 294 . 2 1 3 ALA HB2 H 16.201 3.632 -10.309 . . . 1.0 . . . . . . . . . . . . B . 2 ALA HB2 . . . . . . . . . c19602_2mgt 1 . 1 . 295 . 2 1 3 ALA HB3 H 17.597 3.505 -9.214 . . . 1.0 . . . . . . . . . . . . B . 2 ALA HB3 . . . . . . . . . c19602_2mgt 1 . 1 . 296 . 2 1 3 ALA N N 15.423 4.105 -7.807 . . . 1.0 . . . . . . . . . . . . B . 2 ALA N . . . . . . . . . c19602_2mgt 1 . 1 . 297 . 2 1 3 ALA O O 16.134 0.622 -7.531 . . . 1.0 . . . . . . . . . . . . B . 2 ALA O . . . . . . . . . c19602_2mgt 1 . 1 . 298 . 2 1 4 GLU C C 17.146 0.710 -4.612 . . . 1.0 . . . . . . . . . . . . B . 3 GLU C . . . . . . . . . c19602_2mgt 1 . 1 . 299 . 2 1 4 GLU CA C 18.001 1.505 -5.594 . . . 1.0 . . . . . . . . . . . . B . 3 GLU CA . . . . . . . . . c19602_2mgt 1 . 1 . 300 . 2 1 4 GLU CB C 18.912 2.442 -4.809 . . . 1.0 . . . . . . . . . . . . B . 3 GLU CB . . . . . . . . . c19602_2mgt 1 . 1 . 301 . 2 1 4 GLU CD C 20.676 4.222 -4.928 . . . 1.0 . . . . . . . . . . . . B . 3 GLU CD . . . . . . . . . c19602_2mgt 1 . 1 . 302 . 2 1 4 GLU CG C 19.581 3.489 -5.692 . . . 1.0 . . . . . . . . . . . . B . 3 GLU CG . . . . . . . . . c19602_2mgt 1 . 1 . 303 . 2 1 4 GLU H H 17.289 3.315 -6.426 . . . 1.0 . . . . . . . . . . . . B . 3 GLU H . . . . . . . . . c19602_2mgt 1 . 1 . 304 . 2 1 4 GLU HA H 18.606 0.822 -6.189 . . . 1.0 . . . . . . . . . . . . B . 3 GLU HA . . . . . . . . . c19602_2mgt 1 . 1 . 305 . 2 1 4 GLU HB2 H 18.300 2.978 -4.086 . . . 1.0 . . . . . . . . . . . . B . 3 GLU HB2 . . . . . . . . . c19602_2mgt 1 . 1 . 306 . 2 1 4 GLU HB3 H 19.665 1.851 -4.288 . . . 1.0 . . . . . . . . . . . . B . 3 GLU HB3 . . . . . . . . . c19602_2mgt 1 . 1 . 307 . 2 1 4 GLU HG2 H 19.994 2.994 -6.573 . . . 1.0 . . . . . . . . . . . . B . 3 GLU HG2 . . . . . . . . . c19602_2mgt 1 . 1 . 308 . 2 1 4 GLU HG3 H 18.809 4.198 -5.995 . . . 1.0 . . . . . . . . . . . . B . 3 GLU HG3 . . . . . . . . . c19602_2mgt 1 . 1 . 309 . 2 1 4 GLU N N 17.183 2.312 -6.484 . . . 1.0 . . . . . . . . . . . . B . 3 GLU N . . . . . . . . . c19602_2mgt 1 . 1 . 310 . 2 1 4 GLU O O 17.514 -0.404 -4.250 . . . 1.0 . . . . . . . . . . . . B . 3 GLU O . . . . . . . . . c19602_2mgt 1 . 1 . 311 . 2 1 4 GLU OE1 O 20.308 4.962 -3.984 . . . 1.0 . . . . . . . . . . . . B . 3 GLU OE1 . . . . . . . . . c19602_2mgt 1 . 1 . 312 . 2 1 4 GLU OE2 O 21.852 3.998 -5.267 . . . 1.0 . . . . . . . . . . . . B . 3 GLU OE2 . . . . . . . . . c19602_2mgt 1 . 1 . 313 . 2 1 5 PHE C C 13.643 0.533 -3.854 . . . 1.0 . . . . . . . . . . . . B . 4 PHE C . . . . . . . . . c19602_2mgt 1 . 1 . 314 . 2 1 5 PHE CA C 15.050 0.726 -3.274 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CA . . . . . . . . . c19602_2mgt 1 . 1 . 315 . 2 1 5 PHE CB C 15.067 1.546 -1.995 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CB . . . . . . . . . c19602_2mgt 1 . 1 . 316 . 2 1 5 PHE CD1 C 13.174 3.179 -1.937 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CD1 . . . . . . . . . c19602_2mgt 1 . 1 . 317 . 2 1 5 PHE CD2 C 15.405 3.987 -2.471 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CD2 . . . . . . . . . c19602_2mgt 1 . 1 . 318 . 2 1 5 PHE CE1 C 12.673 4.488 -2.020 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CE1 . . . . . . . . . c19602_2mgt 1 . 1 . 319 . 2 1 5 PHE CE2 C 14.908 5.297 -2.564 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CE2 . . . . . . . . . c19602_2mgt 1 . 1 . 320 . 2 1 5 PHE CG C 14.536 2.941 -2.141 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CG . . . . . . . . . c19602_2mgt 1 . 1 . 321 . 2 1 5 PHE CZ C 13.545 5.549 -2.328 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CZ . . . . . . . . . c19602_2mgt 1 . 1 . 322 . 2 1 5 PHE H H 15.883 2.266 -4.475 . . . 1.0 . . . . . . . . . . . . B . 4 PHE H . . . . . . . . . c19602_2mgt 1 . 1 . 323 . 2 1 5 PHE HA H 15.384 -0.265 -3.007 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HA . . . . . . . . . c19602_2mgt 1 . 1 . 324 . 2 1 5 PHE HB2 H 14.484 1.021 -1.245 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HB2 . . . . . . . . . c19602_2mgt 1 . 1 . 325 . 2 1 5 PHE HB3 H 16.095 1.609 -1.645 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HB3 . . . . . . . . . c19602_2mgt 1 . 1 . 326 . 2 1 5 PHE HD1 H 12.539 2.333 -1.723 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HD1 . . . . . . . . . c19602_2mgt 1 . 1 . 327 . 2 1 5 PHE HD2 H 16.444 3.760 -2.657 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HD2 . . . . . . . . . c19602_2mgt 1 . 1 . 328 . 2 1 5 PHE HE1 H 11.623 4.678 -1.855 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HE1 . . . . . . . . . c19602_2mgt 1 . 1 . 329 . 2 1 5 PHE HE2 H 15.570 6.111 -2.816 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HE2 . . . . . . . . . c19602_2mgt 1 . 1 . 330 . 2 1 5 PHE HZ H 13.168 6.558 -2.406 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HZ . . . . . . . . . c19602_2mgt 1 . 1 . 331 . 2 1 5 PHE N N 16.017 1.302 -4.201 . . . 1.0 . . . . . . . . . . . . B . 4 PHE N . . . . . . . . . c19602_2mgt 1 . 1 . 332 . 2 1 5 PHE O O 12.799 -0.068 -3.193 . . . 1.0 . . . . . . . . . . . . B . 4 PHE O . . . . . . . . . c19602_2mgt 1 . 1 . 333 . 2 1 6 ARG C C 12.876 -0.971 -6.477 . . . 1.0 . . . . . . . . . . . . B . 5 ARG C . . . . . . . . . c19602_2mgt 1 . 1 . 334 . 2 1 6 ARG CA C 12.406 0.402 -5.998 . . . 1.0 . . . . . . . . . . . . B . 5 ARG CA . . . . . . . . . c19602_2mgt 1 . 1 . 335 . 2 1 6 ARG CB C 12.142 1.378 -7.146 . . . 1.0 . . . . . . . . . . . . B . 5 ARG CB . . . . . . . . . c19602_2mgt 1 . 1 . 336 . 2 1 6 ARG CD C 9.850 2.213 -6.232 . . . 1.0 . . . . . . . . . . . . B . 5 ARG CD . . . . . . . . . c19602_2mgt 1 . 1 . 337 . 2 1 6 ARG CG C 11.258 2.571 -6.725 . . . 1.0 . . . . . . . . . . . . B . 5 ARG CG . . . . . . . . . c19602_2mgt 1 . 1 . 338 . 2 1 6 ARG CZ C 8.730 1.339 -8.266 . . . 1.0 . . . . . . . . . . . . B . 5 ARG CZ . . . . . . . . . c19602_2mgt 1 . 1 . 339 . 2 1 6 ARG H H 14.122 1.528 -5.543 . . . 1.0 . . . . . . . . . . . . B . 5 ARG H . . . . . . . . . c19602_2mgt 1 . 1 . 340 . 2 1 6 ARG HA H 11.481 0.257 -5.456 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HA . . . . . . . . . c19602_2mgt 1 . 1 . 341 . 2 1 6 ARG HB2 H 13.100 1.742 -7.510 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HB2 . . . . . . . . . c19602_2mgt 1 . 1 . 342 . 2 1 6 ARG HB3 H 11.665 0.849 -7.971 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HB3 . . . . . . . . . c19602_2mgt 1 . 1 . 343 . 2 1 6 ARG HD2 H 9.903 1.828 -5.225 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HD2 . . . . . . . . . c19602_2mgt 1 . 1 . 344 . 2 1 6 ARG HD3 H 9.225 3.106 -6.221 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HD3 . . . . . . . . . c19602_2mgt 1 . 1 . 345 . 2 1 6 ARG HE H 9.298 0.225 -6.698 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HE . . . . . . . . . c19602_2mgt 1 . 1 . 346 . 2 1 6 ARG HG2 H 11.763 3.130 -5.940 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HG2 . . . . . . . . . c19602_2mgt 1 . 1 . 347 . 2 1 6 ARG HG3 H 11.132 3.227 -7.581 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HG3 . . . . . . . . . c19602_2mgt 1 . 1 . 348 . 2 1 6 ARG HH11 H 8.918 3.367 -8.349 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HH11 . . . . . . . . . c19602_2mgt 1 . 1 . 349 . 2 1 6 ARG HH12 H 8.194 2.616 -9.751 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HH12 . . . . . . . . . c19602_2mgt 1 . 1 . 350 . 2 1 6 ARG HH21 H 8.492 -0.656 -8.535 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HH21 . . . . . . . . . c19602_2mgt 1 . 1 . 351 . 2 1 6 ARG HH22 H 8.022 0.347 -9.885 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HH22 . . . . . . . . . c19602_2mgt 1 . 1 . 352 . 2 1 6 ARG N N 13.421 0.946 -5.107 . . . 1.0 . . . . . . . . . . . . B . 5 ARG N . . . . . . . . . c19602_2mgt 1 . 1 . 353 . 2 1 6 ARG NE N 9.231 1.171 -7.045 . . . 1.0 . . . . . . . . . . . . B . 5 ARG NE . . . . . . . . . c19602_2mgt 1 . 1 . 354 . 2 1 6 ARG NH1 N 8.595 2.539 -8.825 . . . 1.0 . . . . . . . . . . . . B . 5 ARG NH1 . . . . . . . . . c19602_2mgt 1 . 1 . 355 . 2 1 6 ARG NH2 N 8.377 0.260 -8.943 . . . 1.0 . . . . . . . . . . . . B . 5 ARG NH2 . . . . . . . . . c19602_2mgt 1 . 1 . 356 . 2 1 6 ARG O O 13.382 -1.136 -7.586 . . . 1.0 . . . . . . . . . . . . B . 5 ARG O . . . . . . . . . c19602_2mgt 1 . 1 . 357 . 2 1 7 ARG C C 11.988 -4.242 -5.459 . . . 1.0 . . . . . . . . . . . . B . 6 ARG C . . . . . . . . . c19602_2mgt 1 . 1 . 358 . 2 1 7 ARG CA C 13.181 -3.300 -5.637 . . . 1.0 . . . . . . . . . . . . B . 6 ARG CA . . . . . . . . . c19602_2mgt 1 . 1 . 359 . 2 1 7 ARG CB C 14.191 -3.525 -4.501 . . . 1.0 . . . . . . . . . . . . B . 6 ARG CB . . . . . . . . . c19602_2mgt 1 . 1 . 360 . 2 1 7 ARG CD C 16.431 -3.023 -5.712 . . . 1.0 . . . . . . . . . . . . B . 6 ARG CD . . . . . . . . . c19602_2mgt 1 . 1 . 361 . 2 1 7 ARG CG C 15.453 -2.663 -4.586 . . . 1.0 . . . . . . . . . . . . B . 6 ARG CG . . . . . . . . . c19602_2mgt 1 . 1 . 362 . 2 1 7 ARG CZ C 16.229 -2.631 -8.176 . . . 1.0 . . . . . . . . . . . . B . 6 ARG CZ . . . . . . . . . c19602_2mgt 1 . 1 . 363 . 2 1 7 ARG H H 12.407 -1.673 -4.659 . . . 1.0 . . . . . . . . . . . . B . 6 ARG H . . . . . . . . . c19602_2mgt 1 . 1 . 364 . 2 1 7 ARG HA H 13.653 -3.458 -6.591 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HA . . . . . . . . . c19602_2mgt 1 . 1 . 365 . 2 1 7 ARG HB2 H 13.708 -3.245 -3.563 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HB2 . . . . . . . . . c19602_2mgt 1 . 1 . 366 . 2 1 7 ARG HB3 H 14.475 -4.578 -4.462 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HB3 . . . . . . . . . c19602_2mgt 1 . 1 . 367 . 2 1 7 ARG HD2 H 17.446 -2.853 -5.354 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HD2 . . . . . . . . . c19602_2mgt 1 . 1 . 368 . 2 1 7 ARG HD3 H 16.322 -4.074 -5.962 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HD3 . . . . . . . . . c19602_2mgt 1 . 1 . 369 . 2 1 7 ARG HE H 16.224 -1.192 -6.750 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HE . . . . . . . . . c19602_2mgt 1 . 1 . 370 . 2 1 7 ARG HG2 H 15.140 -1.625 -4.682 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HG2 . . . . . . . . . c19602_2mgt 1 . 1 . 371 . 2 1 7 ARG HG3 H 15.983 -2.774 -3.639 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HG3 . . . . . . . . . c19602_2mgt 1 . 1 . 372 . 2 1 7 ARG HH11 H 16.482 -4.604 -7.738 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HH11 . . . . . . . . . c19602_2mgt 1 . 1 . 373 . 2 1 7 ARG HH12 H 16.368 -4.227 -9.434 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HH12 . . . . . . . . . c19602_2mgt 1 . 1 . 374 . 2 1 7 ARG HH21 H 16.006 -0.775 -8.960 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HH21 . . . . . . . . . c19602_2mgt 1 . 1 . 375 . 2 1 7 ARG HH22 H 16.098 -2.069 -10.134 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HH22 . . . . . . . . . c19602_2mgt 1 . 1 . 376 . 2 1 7 ARG N N 12.726 -1.936 -5.568 . . . 1.0 . . . . . . . . . . . . B . 6 ARG N . . . . . . . . . c19602_2mgt 1 . 1 . 377 . 2 1 7 ARG NE N 16.254 -2.193 -6.907 . . . 1.0 . . . . . . . . . . . . B . 6 ARG NE . . . . . . . . . c19602_2mgt 1 . 1 . 378 . 2 1 7 ARG NH1 N 16.341 -3.925 -8.473 . . . 1.0 . . . . . . . . . . . . B . 6 ARG NH1 . . . . . . . . . c19602_2mgt 1 . 1 . 379 . 2 1 7 ARG NH2 N 16.097 -1.758 -9.176 . . . 1.0 . . . . . . . . . . . . B . 6 ARG NH2 . . . . . . . . . c19602_2mgt 1 . 1 . 380 . 2 1 7 ARG O O 11.032 -3.920 -4.753 . . . 1.0 . . . . . . . . . . . . B . 6 ARG O . . . . . . . . . c19602_2mgt 1 . 1 . 381 . 2 1 8 ASP C C 11.515 -7.259 -4.432 . . . 1.0 . . . . . . . . . . . . B . 7 ASP C . . . . . . . . . c19602_2mgt 1 . 1 . 382 . 2 1 8 ASP CA C 11.198 -6.561 -5.763 . . . 1.0 . . . . . . . . . . . . B . 7 ASP CA . . . . . . . . . c19602_2mgt 1 . 1 . 383 . 2 1 8 ASP CB C 11.318 -7.580 -6.886 . . . 1.0 . . . . . . . . . . . . B . 7 ASP CB . . . . . . . . . c19602_2mgt 1 . 1 . 384 . 2 1 8 ASP CG C 10.727 -7.032 -8.176 . . . 1.0 . . . . . . . . . . . . B . 7 ASP CG . . . . . . . . . c19602_2mgt 1 . 1 . 385 . 2 1 8 ASP H H 12.857 -5.607 -6.683 . . . 1.0 . . . . . . . . . . . . B . 7 ASP H . . . . . . . . . c19602_2mgt 1 . 1 . 386 . 2 1 8 ASP HA H 10.175 -6.194 -5.745 . . . 1.0 . . . . . . . . . . . . B . 7 ASP HA . . . . . . . . . c19602_2mgt 1 . 1 . 387 . 2 1 8 ASP HB2 H 12.372 -7.826 -7.030 . . . 1.0 . . . . . . . . . . . . B . 7 ASP HB2 . . . . . . . . . c19602_2mgt 1 . 1 . 388 . 2 1 8 ASP HB3 H 10.789 -8.489 -6.602 . . . 1.0 . . . . . . . . . . . . B . 7 ASP HB3 . . . . . . . . . c19602_2mgt 1 . 1 . 389 . 2 1 8 ASP N N 12.093 -5.438 -6.045 . . . 1.0 . . . . . . . . . . . . B . 7 ASP N . . . . . . . . . c19602_2mgt 1 . 1 . 390 . 2 1 8 ASP O O 10.784 -8.156 -4.014 . . . 1.0 . . . . . . . . . . . . B . 7 ASP O . . . . . . . . . c19602_2mgt 1 . 1 . 391 . 2 1 8 ASP OD1 O 11.486 -6.344 -8.884 . . . 1.0 . . . . . . . . . . . . B . 7 ASP OD1 . . . . . . . . . c19602_2mgt 1 . 1 . 392 . 2 1 8 ASP OD2 O 9.531 -7.310 -8.430 . . . 1.0 . . . . . . . . . . . . B . 7 ASP OD2 . . . . . . . . . c19602_2mgt 1 . 1 . 393 . 2 1 9 SER C C 12.432 -7.131 -1.309 . . . 1.0 . . . . . . . . . . . . B . 8 SER C . . . . . . . . . c19602_2mgt 1 . 1 . 394 . 2 1 9 SER CA C 13.176 -7.498 -2.603 . . . 1.0 . . . . . . . . . . . . B . 8 SER CA . . . . . . . . . c19602_2mgt 1 . 1 . 395 . 2 1 9 SER CB C 14.668 -7.168 -2.498 . . . 1.0 . . . . . . . . . . . . B . 8 SER CB . . . . . . . . . c19602_2mgt 1 . 1 . 396 . 2 1 9 SER H H 13.231 -6.231 -4.264 . . . 1.0 . . . . . . . . . . . . B . 8 SER H . . . . . . . . . c19602_2mgt 1 . 1 . 397 . 2 1 9 SER HA H 13.090 -8.564 -2.759 . . . 1.0 . . . . . . . . . . . . B . 8 SER HA . . . . . . . . . c19602_2mgt 1 . 1 . 398 . 2 1 9 SER HB2 H 14.795 -6.100 -2.319 . . . 1.0 . . . . . . . . . . . . B . 8 SER HB2 . . . . . . . . . c19602_2mgt 1 . 1 . 399 . 2 1 9 SER HB3 H 15.103 -7.725 -1.670 . . . 1.0 . . . . . . . . . . . . B . 8 SER HB3 . . . . . . . . . c19602_2mgt 1 . 1 . 400 . 2 1 9 SER HG H 16.227 -7.173 -3.649 . . . 1.0 . . . . . . . . . . . . B . 8 SER HG . . . . . . . . . c19602_2mgt 1 . 1 . 401 . 2 1 9 SER N N 12.629 -6.881 -3.797 . . . 1.0 . . . . . . . . . . . . B . 8 SER N . . . . . . . . . c19602_2mgt 1 . 1 . 402 . 2 1 9 SER O O 12.977 -7.349 -0.230 . . . 1.0 . . . . . . . . . . . . B . 8 SER O . . . . . . . . . c19602_2mgt 1 . 1 . 403 . 2 1 9 SER OG O 15.337 -7.533 -3.684 . . . 1.0 . . . . . . . . . . . . B . 8 SER OG . . . . . . . . . c19602_2mgt 1 . 1 . 404 . 2 1 10 GLY C C 8.942 -6.823 -0.806 . . . 1.0 . . . . . . . . . . . . B . 9 GLY C . . . . . . . . . c19602_2mgt 1 . 1 . 405 . 2 1 10 GLY CA C 10.303 -6.327 -0.309 . . . 1.0 . . . . . . . . . . . . B . 9 GLY CA . . . . . . . . . c19602_2mgt 1 . 1 . 406 . 2 1 10 GLY H H 10.809 -6.434 -2.323 . . . 1.0 . . . . . . . . . . . . B . 9 GLY H . . . . . . . . . c19602_2mgt 1 . 1 . 407 . 2 1 10 GLY HA2 H 10.604 -6.848 0.589 . . . 1.0 . . . . . . . . . . . . B . 9 GLY HA2 . . . . . . . . . c19602_2mgt 1 . 1 . 408 . 2 1 10 GLY HA3 H 10.296 -5.265 -0.072 . . . 1.0 . . . . . . . . . . . . B . 9 GLY HA3 . . . . . . . . . c19602_2mgt 1 . 1 . 409 . 2 1 10 GLY N N 11.219 -6.568 -1.406 . . . 1.0 . . . . . . . . . . . . B . 9 GLY N . . . . . . . . . c19602_2mgt 1 . 1 . 410 . 2 1 10 GLY O O 8.767 -8.023 -0.986 . . . 1.0 . . . . . . . . . . . . B . 9 GLY O . . . . . . . . . c19602_2mgt 1 . 1 . 411 . 2 1 11 TYR C C 6.620 -3.960 -1.291 . . . 1.0 . . . . . . . . . . . . B . 10 TYR C . . . . . . . . . c19602_2mgt 1 . 1 . 412 . 2 1 11 TYR CA C 7.987 -4.528 -0.934 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CA . . . . . . . . . c19602_2mgt 1 . 1 . 413 . 2 1 11 TYR CB C 9.021 -3.899 -1.871 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CB . . . . . . . . . c19602_2mgt 1 . 1 . 414 . 2 1 11 TYR CD1 C 9.623 -2.128 -0.171 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CD1 . . . . . . . . . c19602_2mgt 1 . 1 . 415 . 2 1 11 TYR CD2 C 11.375 -3.101 -1.545 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CD2 . . . . . . . . . c19602_2mgt 1 . 1 . 416 . 2 1 11 TYR CE1 C 10.545 -1.241 0.392 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CE1 . . . . . . . . . c19602_2mgt 1 . 1 . 417 . 2 1 11 TYR CE2 C 12.304 -2.215 -0.987 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CE2 . . . . . . . . . c19602_2mgt 1 . 1 . 418 . 2 1 11 TYR CG C 10.027 -3.024 -1.173 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CG . . . . . . . . . c19602_2mgt 1 . 1 . 419 . 2 1 11 TYR CZ C 11.886 -1.247 -0.046 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CZ . . . . . . . . . c19602_2mgt 1 . 1 . 420 . 2 1 11 TYR H H 7.247 -6.234 -1.719 . . . 1.0 . . . . . . . . . . . . B . 10 TYR H . . . . . . . . . c19602_2mgt 1 . 1 . 421 . 2 1 11 TYR HA H 8.219 -4.314 0.109 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HA . . . . . . . . . c19602_2mgt 1 . 1 . 422 . 2 1 11 TYR HB2 H 9.562 -4.662 -2.420 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HB2 . . . . . . . . . c19602_2mgt 1 . 1 . 423 . 2 1 11 TYR HB3 H 8.501 -3.331 -2.637 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HB3 . . . . . . . . . c19602_2mgt 1 . 1 . 424 . 2 1 11 TYR HD1 H 8.597 -2.094 0.143 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HD1 . . . . . . . . . c19602_2mgt 1 . 1 . 425 . 2 1 11 TYR HD2 H 11.689 -3.846 -2.259 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HD2 . . . . . . . . . c19602_2mgt 1 . 1 . 426 . 2 1 11 TYR HE1 H 10.216 -0.559 1.149 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HE1 . . . . . . . . . c19602_2mgt 1 . 1 . 427 . 2 1 11 TYR HE2 H 13.337 -2.300 -1.265 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HE2 . . . . . . . . . c19602_2mgt 1 . 1 . 428 . 2 1 11 TYR HH H 13.659 -0.448 0.097 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HH . . . . . . . . . c19602_2mgt 1 . 1 . 429 . 2 1 11 TYR N N 7.977 -5.948 -1.104 . . . 1.0 . . . . . . . . . . . . B . 10 TYR N . . . . . . . . . c19602_2mgt 1 . 1 . 430 . 2 1 11 TYR O O 5.926 -4.450 -2.183 . . . 1.0 . . . . . . . . . . . . B . 10 TYR O . . . . . . . . . c19602_2mgt 1 . 1 . 431 . 2 1 11 TYR OH O 12.776 -0.346 0.459 . . . 1.0 . . . . . . . . . . . . B . 10 TYR OH . . . . . . . . . c19602_2mgt 1 . 1 . 432 . 2 1 12 GLU C C 6.052 -0.468 -0.817 . . . 1.0 . . . . . . . . . . . . B . 11 GLU C . . . . . . . . . c19602_2mgt 1 . 1 . 433 . 2 1 12 GLU CA C 5.425 -1.827 -1.156 . . . 1.0 . . . . . . . . . . . . B . 11 GLU CA . . . . . . . . . c19602_2mgt 1 . 1 . 434 . 2 1 12 GLU CB C 4.085 -2.057 -0.477 . . . 1.0 . . . . . . . . . . . . B . 11 GLU CB . . . . . . . . . c19602_2mgt 1 . 1 . 435 . 2 1 12 GLU CD C 2.004 -0.808 -0.131 . . . 1.0 . . . . . . . . . . . . B . 11 GLU CD . . . . . . . . . c19602_2mgt 1 . 1 . 436 . 2 1 12 GLU CG C 2.992 -1.256 -1.186 . . . 1.0 . . . . . . . . . . . . B . 11 GLU CG . . . . . . . . . c19602_2mgt 1 . 1 . 437 . 2 1 12 GLU H H 6.871 -2.560 0.139 . . . 1.0 . . . . . . . . . . . . B . 11 GLU H . . . . . . . . . c19602_2mgt 1 . 1 . 438 . 2 1 12 GLU HA H 5.329 -1.959 -2.233 . . . 1.0 . . . . . . . . . . . . B . 11 GLU HA . . . . . . . . . c19602_2mgt 1 . 1 . 439 . 2 1 12 GLU HB2 H 3.841 -3.118 -0.502 . . . 1.0 . . . . . . . . . . . . B . 11 GLU HB2 . . . . . . . . . c19602_2mgt 1 . 1 . 440 . 2 1 12 GLU HB3 H 4.167 -1.747 0.562 . . . 1.0 . . . . . . . . . . . . B . 11 GLU HB3 . . . . . . . . . c19602_2mgt 1 . 1 . 441 . 2 1 12 GLU HG2 H 3.430 -0.433 -1.727 . . . 1.0 . . . . . . . . . . . . B . 11 GLU HG2 . . . . . . . . . c19602_2mgt 1 . 1 . 442 . 2 1 12 GLU HG3 H 2.482 -1.925 -1.876 . . . 1.0 . . . . . . . . . . . . B . 11 GLU HG3 . . . . . . . . . c19602_2mgt 1 . 1 . 443 . 2 1 12 GLU N N 6.330 -2.824 -0.666 . . . 1.0 . . . . . . . . . . . . B . 11 GLU N . . . . . . . . . c19602_2mgt 1 . 1 . 444 . 2 1 12 GLU O O 5.758 0.139 0.213 . . . 1.0 . . . . . . . . . . . . B . 11 GLU O . . . . . . . . . c19602_2mgt 1 . 1 . 445 . 2 1 12 GLU OE1 O 1.502 -1.511 0.610 . . . 1.0 . . . . . . . . . . . . B . 11 GLU OE1 . . . . . . . . . c19602_2mgt 1 . 1 . 446 . 2 1 12 GLU OE2 O 1.772 0.531 -0.168 . . . 1.0 . . . . . . . . . . . . B . 11 GLU OE2 . . . . . . . . . c19602_2mgt 1 . 1 . 447 . 2 1 13 VAL C C 7.391 2.318 -1.042 . . . 1.0 . . . . . . . . . . . . B . 12 VAL C . . . . . . . . . c19602_2mgt 1 . 1 . 448 . 2 1 13 VAL CA C 7.987 0.991 -1.474 . . . 1.0 . . . . . . . . . . . . B . 12 VAL CA . . . . . . . . . c19602_2mgt 1 . 1 . 449 . 2 1 13 VAL CB C 8.836 1.170 -2.752 . . . 1.0 . . . . . . . . . . . . B . 12 VAL CB . . . . . . . . . c19602_2mgt 1 . 1 . 450 . 2 1 13 VAL CG1 C 9.897 2.270 -2.586 . . . 1.0 . . . . . . . . . . . . B . 12 VAL CG1 . . . . . . . . . c19602_2mgt 1 . 1 . 451 . 2 1 13 VAL CG2 C 9.594 -0.120 -3.060 . . . 1.0 . . . . . . . . . . . . B . 12 VAL CG2 . . . . . . . . . c19602_2mgt 1 . 1 . 452 . 2 1 13 VAL H H 7.082 -0.564 -2.527 . . . 1.0 . . . . . . . . . . . . B . 12 VAL H . . . . . . . . . c19602_2mgt 1 . 1 . 453 . 2 1 13 VAL HA H 8.644 0.637 -0.699 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HA . . . . . . . . . c19602_2mgt 1 . 1 . 454 . 2 1 13 VAL HB H 8.186 1.417 -3.594 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HB . . . . . . . . . c19602_2mgt 1 . 1 . 455 . 2 1 13 VAL HG11 H 10.629 2.254 -3.390 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HG11 . . . . . . . . . c19602_2mgt 1 . 1 . 456 . 2 1 13 VAL HG12 H 9.427 3.246 -2.595 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HG12 . . . . . . . . . c19602_2mgt 1 . 1 . 457 . 2 1 13 VAL HG13 H 10.415 2.122 -1.641 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HG13 . . . . . . . . . c19602_2mgt 1 . 1 . 458 . 2 1 13 VAL HG21 H 10.124 -0.016 -3.994 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HG21 . . . . . . . . . c19602_2mgt 1 . 1 . 459 . 2 1 13 VAL HG22 H 10.295 -0.320 -2.256 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HG22 . . . . . . . . . c19602_2mgt 1 . 1 . 460 . 2 1 13 VAL HG23 H 8.905 -0.954 -3.157 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HG23 . . . . . . . . . c19602_2mgt 1 . 1 . 461 . 2 1 13 VAL N N 6.974 -0.039 -1.685 . . . 1.0 . . . . . . . . . . . . B . 12 VAL N . . . . . . . . . c19602_2mgt 1 . 1 . 462 . 2 1 13 VAL O O 8.066 3.115 -0.391 . . . 1.0 . . . . . . . . . . . . B . 12 VAL O . . . . . . . . . c19602_2mgt 1 . 1 . 463 . 2 1 14 HIS C C 5.401 4.342 0.118 . . . 1.0 . . . . . . . . . . . . B . 13 HIS C . . . . . . . . . c19602_2mgt 1 . 1 . 464 . 2 1 14 HIS CA C 5.505 3.838 -1.320 . . . 1.0 . . . . . . . . . . . . B . 13 HIS CA . . . . . . . . . c19602_2mgt 1 . 1 . 465 . 2 1 14 HIS CB C 4.141 3.807 -1.999 . . . 1.0 . . . . . . . . . . . . B . 13 HIS CB . . . . . . . . . c19602_2mgt 1 . 1 . 466 . 2 1 14 HIS CD2 C 3.368 1.883 -3.499 . . . 1.0 . . . . . . . . . . . . B . 13 HIS CD2 . . . . . . . . . c19602_2mgt 1 . 1 . 467 . 2 1 14 HIS CE1 C 4.766 2.109 -5.172 . . . 1.0 . . . . . . . . . . . . B . 13 HIS CE1 . . . . . . . . . c19602_2mgt 1 . 1 . 468 . 2 1 14 HIS CG C 4.128 2.994 -3.266 . . . 1.0 . . . . . . . . . . . . B . 13 HIS CG . . . . . . . . . c19602_2mgt 1 . 1 . 469 . 2 1 14 HIS H H 5.613 1.813 -1.880 . . . 1.0 . . . . . . . . . . . . B . 13 HIS H . . . . . . . . . c19602_2mgt 1 . 1 . 470 . 2 1 14 HIS HA H 6.164 4.482 -1.887 . . . 1.0 . . . . . . . . . . . . B . 13 HIS HA . . . . . . . . . c19602_2mgt 1 . 1 . 471 . 2 1 14 HIS HB2 H 3.397 3.404 -1.308 . . . 1.0 . . . . . . . . . . . . B . 13 HIS HB2 . . . . . . . . . c19602_2mgt 1 . 1 . 472 . 2 1 14 HIS HB3 H 3.893 4.834 -2.240 . . . 1.0 . . . . . . . . . . . . B . 13 HIS HB3 . . . . . . . . . c19602_2mgt 1 . 1 . 473 . 2 1 14 HIS HD1 H 5.673 3.860 -4.455 . . . 1.0 . . . . . . . . . . . . B . 13 HIS HD1 . . . . . . . . . c19602_2mgt 1 . 1 . 474 . 2 1 14 HIS HD2 H 2.619 1.478 -2.833 . . . 1.0 . . . . . . . . . . . . B . 13 HIS HD2 . . . . . . . . . c19602_2mgt 1 . 1 . 475 . 2 1 14 HIS HE1 H 5.279 1.955 -6.109 . . . 1.0 . . . . . . . . . . . . B . 13 HIS HE1 . . . . . . . . . c19602_2mgt 1 . 1 . 476 . 2 1 14 HIS N N 6.128 2.544 -1.408 . . . 1.0 . . . . . . . . . . . . B . 13 HIS N . . . . . . . . . c19602_2mgt 1 . 1 . 477 . 2 1 14 HIS ND1 N 5.000 3.120 -4.324 . . . 1.0 . . . . . . . . . . . . B . 13 HIS ND1 . . . . . . . . . c19602_2mgt 1 . 1 . 478 . 2 1 14 HIS NE2 N 3.781 1.327 -4.711 . . . 1.0 . . . . . . . . . . . . B . 13 HIS NE2 . . . . . . . . . c19602_2mgt 1 . 1 . 479 . 2 1 14 HIS O O 5.312 5.543 0.337 . . . 1.0 . . . . . . . . . . . . B . 13 HIS O . . . . . . . . . c19602_2mgt 1 . 1 . 480 . 2 1 15 HIS C C 6.387 2.783 3.329 . . . 1.0 . . . . . . . . . . . . B . 14 HIS C . . . . . . . . . c19602_2mgt 1 . 1 . 481 . 2 1 15 HIS CA C 5.625 3.815 2.496 . . . 1.0 . . . . . . . . . . . . B . 14 HIS CA . . . . . . . . . c19602_2mgt 1 . 1 . 482 . 2 1 15 HIS CB C 4.249 4.122 3.073 . . . 1.0 . . . . . . . . . . . . B . 14 HIS CB . . . . . . . . . c19602_2mgt 1 . 1 . 483 . 2 1 15 HIS CD2 C 2.581 2.424 2.151 . . . 1.0 . . . . . . . . . . . . B . 14 HIS CD2 . . . . . . . . . c19602_2mgt 1 . 1 . 484 . 2 1 15 HIS CE1 C 2.378 1.104 3.885 . . . 1.0 . . . . . . . . . . . . B . 14 HIS CE1 . . . . . . . . . c19602_2mgt 1 . 1 . 485 . 2 1 15 HIS CG C 3.377 2.905 3.149 . . . 1.0 . . . . . . . . . . . . B . 14 HIS CG . . . . . . . . . c19602_2mgt 1 . 1 . 486 . 2 1 15 HIS H H 5.552 2.454 0.842 . . . 1.0 . . . . . . . . . . . . B . 14 HIS H . . . . . . . . . c19602_2mgt 1 . 1 . 487 . 2 1 15 HIS HA H 6.217 4.725 2.530 . . . 1.0 . . . . . . . . . . . . B . 14 HIS HA . . . . . . . . . c19602_2mgt 1 . 1 . 488 . 2 1 15 HIS HB2 H 4.377 4.529 4.074 . . . 1.0 . . . . . . . . . . . . B . 14 HIS HB2 . . . . . . . . . c19602_2mgt 1 . 1 . 489 . 2 1 15 HIS HB3 H 3.752 4.879 2.465 . . . 1.0 . . . . . . . . . . . . B . 14 HIS HB3 . . . . . . . . . c19602_2mgt 1 . 1 . 490 . 2 1 15 HIS HD1 H 3.705 2.174 5.124 . . . 1.0 . . . . . . . . . . . . B . 14 HIS HD1 . . . . . . . . . c19602_2mgt 1 . 1 . 491 . 2 1 15 HIS HD2 H 2.456 2.850 1.167 . . . 1.0 . . . . . . . . . . . . B . 14 HIS HD2 . . . . . . . . . c19602_2mgt 1 . 1 . 492 . 2 1 15 HIS HE1 H 2.033 0.312 4.531 . . . 1.0 . . . . . . . . . . . . B . 14 HIS HE1 . . . . . . . . . c19602_2mgt 1 . 1 . 493 . 2 1 15 HIS N N 5.485 3.436 1.096 . . . 1.0 . . . . . . . . . . . . B . 14 HIS N . . . . . . . . . c19602_2mgt 1 . 1 . 494 . 2 1 15 HIS ND1 N 3.252 2.062 4.228 . . . 1.0 . . . . . . . . . . . . B . 14 HIS ND1 . . . . . . . . . c19602_2mgt 1 . 1 . 495 . 2 1 15 HIS NE2 N 1.954 1.275 2.633 . . . 1.0 . . . . . . . . . . . . B . 14 HIS NE2 . . . . . . . . . c19602_2mgt 1 . 1 . 496 . 2 1 15 HIS O O 6.416 2.884 4.555 . . . 1.0 . . . . . . . . . . . . B . 14 HIS O . . . . . . . . . c19602_2mgt 1 . 1 . 497 . 2 1 16 GLN C C 9.376 1.311 2.907 . . . 1.0 . . . . . . . . . . . . B . 15 GLN C . . . . . . . . . c19602_2mgt 1 . 1 . 498 . 2 1 16 GLN CA C 7.954 0.891 3.250 . . . 1.0 . . . . . . . . . . . . B . 15 GLN CA . . . . . . . . . c19602_2mgt 1 . 1 . 499 . 2 1 16 GLN CB C 7.722 -0.518 2.725 . . . 1.0 . . . . . . . . . . . . B . 15 GLN CB . . . . . . . . . c19602_2mgt 1 . 1 . 500 . 2 1 16 GLN CD C 6.198 -2.524 2.609 . . . 1.0 . . . . . . . . . . . . B . 15 GLN CD . . . . . . . . . c19602_2mgt 1 . 1 . 501 . 2 1 16 GLN CG C 6.361 -1.093 3.116 . . . 1.0 . . . . . . . . . . . . B . 15 GLN CG . . . . . . . . . c19602_2mgt 1 . 1 . 502 . 2 1 16 GLN H H 6.919 1.728 1.676 . . . 1.0 . . . . . . . . . . . . B . 15 GLN H . . . . . . . . . c19602_2mgt 1 . 1 . 503 . 2 1 16 GLN HA H 7.820 0.900 4.320 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HA . . . . . . . . . c19602_2mgt 1 . 1 . 504 . 2 1 16 GLN HB2 H 7.826 -0.509 1.644 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HB2 . . . . . . . . . c19602_2mgt 1 . 1 . 505 . 2 1 16 GLN HB3 H 8.496 -1.163 3.132 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HB3 . . . . . . . . . c19602_2mgt 1 . 1 . 506 . 2 1 16 GLN HE21 H 4.215 -2.493 3.019 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HE21 . . . . . . . . . c19602_2mgt 1 . 1 . 507 . 2 1 16 GLN HE22 H 4.836 -3.995 2.355 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HE22 . . . . . . . . . c19602_2mgt 1 . 1 . 508 . 2 1 16 GLN HG2 H 6.277 -1.079 4.199 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HG2 . . . . . . . . . c19602_2mgt 1 . 1 . 509 . 2 1 16 GLN HG3 H 5.555 -0.476 2.718 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HG3 . . . . . . . . . c19602_2mgt 1 . 1 . 510 . 2 1 16 GLN N N 7.006 1.801 2.668 . . . 1.0 . . . . . . . . . . . . B . 15 GLN N . . . . . . . . . c19602_2mgt 1 . 1 . 511 . 2 1 16 GLN NE2 N 4.983 -3.046 2.673 . . . 1.0 . . . . . . . . . . . . B . 15 GLN NE2 . . . . . . . . . c19602_2mgt 1 . 1 . 512 . 2 1 16 GLN O O 9.625 2.037 1.942 . . . 1.0 . . . . . . . . . . . . B . 15 GLN O . . . . . . . . . c19602_2mgt 1 . 1 . 513 . 2 1 16 GLN OE1 O 7.142 -3.157 2.148 . . . 1.0 . . . . . . . . . . . . B . 15 GLN OE1 . . . . . . . . . c19602_2mgt 1 . 1 . 514 . 2 1 17 LYS C C 12.521 -0.289 3.802 . . . 1.0 . . . . . . . . . . . . B . 16 LYS C . . . . . . . . . c19602_2mgt 1 . 1 . 515 . 2 1 17 LYS CA C 11.739 1.003 3.556 . . . 1.0 . . . . . . . . . . . . B . 16 LYS CA . . . . . . . . . c19602_2mgt 1 . 1 . 516 . 2 1 17 LYS CB C 12.184 2.112 4.521 . . . 1.0 . . . . . . . . . . . . B . 16 LYS CB . . . . . . . . . c19602_2mgt 1 . 1 . 517 . 2 1 17 LYS CD C 12.139 4.599 4.949 . . . 1.0 . . . . . . . . . . . . B . 16 LYS CD . . . . . . . . . c19602_2mgt 1 . 1 . 518 . 2 1 17 LYS CE C 11.513 5.889 4.460 . . . 1.0 . . . . . . . . . . . . B . 16 LYS CE . . . . . . . . . c19602_2mgt 1 . 1 . 519 . 2 1 17 LYS CG C 11.510 3.446 4.177 . . . 1.0 . . . . . . . . . . . . B . 16 LYS CG . . . . . . . . . c19602_2mgt 1 . 1 . 520 . 2 1 17 LYS H H 10.010 0.164 4.438 . . . 1.0 . . . . . . . . . . . . B . 16 LYS H . . . . . . . . . c19602_2mgt 1 . 1 . 521 . 2 1 17 LYS HA H 11.951 1.328 2.537 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HA . . . . . . . . . c19602_2mgt 1 . 1 . 522 . 2 1 17 LYS HB2 H 11.941 1.830 5.546 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HB2 . . . . . . . . . c19602_2mgt 1 . 1 . 523 . 2 1 17 LYS HB3 H 13.263 2.234 4.436 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HB3 . . . . . . . . . c19602_2mgt 1 . 1 . 524 . 2 1 17 LYS HD2 H 11.974 4.479 6.020 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HD2 . . . . . . . . . c19602_2mgt 1 . 1 . 525 . 2 1 17 LYS HD3 H 13.202 4.640 4.729 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HD3 . . . . . . . . . c19602_2mgt 1 . 1 . 526 . 2 1 17 LYS HE2 H 11.676 5.962 3.385 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HE2 . . . . . . . . . c19602_2mgt 1 . 1 . 527 . 2 1 17 LYS HE3 H 10.443 5.879 4.663 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HE3 . . . . . . . . . c19602_2mgt 1 . 1 . 528 . 2 1 17 LYS HG2 H 11.624 3.638 3.109 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HG2 . . . . . . . . . c19602_2mgt 1 . 1 . 529 . 2 1 17 LYS HG3 H 10.448 3.399 4.421 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HG3 . . . . . . . . . c19602_2mgt 1 . 1 . 530 . 2 1 17 LYS HZ1 H 11.726 7.894 4.729 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HZ1 . . . . . . . . . c19602_2mgt 1 . 1 . 531 . 2 1 17 LYS HZ2 H 11.911 7.011 6.109 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HZ2 . . . . . . . . . c19602_2mgt 1 . 1 . 532 . 2 1 17 LYS HZ3 H 13.116 7.024 4.986 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HZ3 . . . . . . . . . c19602_2mgt 1 . 1 . 533 . 2 1 17 LYS N N 10.310 0.776 3.694 . . . 1.0 . . . . . . . . . . . . B . 16 LYS N . . . . . . . . . c19602_2mgt 1 . 1 . 534 . 2 1 17 LYS NZ N 12.115 7.046 5.120 . . . 1.0 . . . . . . . . . . . . B . 16 LYS NZ . . . . . . . . . c19602_2mgt 1 . 1 . 535 . 2 1 17 LYS O O 12.005 -1.277 4.321 . . . 1.0 . . . . . . . . . . . . B . 16 LYS O . . . . . . . . . c19602_2mgt 1 . 1 . 536 . 2 1 18 NH2 HN1 H 14.377 -1.087 3.566 . . . 1.0 . . . . . . . . . . . . B . 17 NH2 HN1 . . . . . . . . . c19602_2mgt 1 . 1 . 537 . 2 1 18 NH2 HN2 H 14.189 0.563 3.019 . . . 1.0 . . . . . . . . . . . . B . 17 NH2 HN2 . . . . . . . . . c19602_2mgt 1 . 1 . 538 . 2 1 18 NH2 N N 13.797 -0.271 3.434 . . . 1.0 . . . . . . . . . . . . B . 17 NH2 N . . . . . . . . . c19602_2mgt 1 . 1 . 539 . 3 2 1 ZN ZN Zn 0.635 0.115 1.636 . . . 1.0 . . . . . . . . . . . . A . 101 ZN ZN . . . . . . . . . c19602_2mgt 1 . 2 . 540 . 1 1 1 ACE C C -13.034 -3.932 -2.525 . . . 1.0 . . . . . . . . . . . . A . 0 ACE C . . . . . . . . . c19602_2mgt 1 . 2 . 541 . 1 1 1 ACE CH3 C -11.545 -3.859 -2.813 . . . 1.0 . . . . . . . . . . . . A . 0 ACE CH3 . . . . . . . . . c19602_2mgt 1 . 2 . 542 . 1 1 1 ACE H1 H -11.365 -3.131 -3.600 . . . 1.0 . . . . . . . . . . . . A . 0 ACE H1 . . . . . . . . . c19602_2mgt 1 . 2 . 543 . 1 1 1 ACE H2 H -10.995 -3.567 -1.919 . . . 1.0 . . . . . . . . . . . . A . 0 ACE H2 . . . . . . . . . c19602_2mgt 1 . 2 . 544 . 1 1 1 ACE H3 H -11.204 -4.837 -3.146 . . . 1.0 . . . . . . . . . . . . A . 0 ACE H3 . . . . . . . . . c19602_2mgt 1 . 2 . 545 . 1 1 1 ACE O O -13.840 -3.667 -3.408 . . . 1.0 . . . . . . . . . . . . A . 0 ACE O . . . . . . . . . c19602_2mgt 1 . 2 . 546 . 1 1 2 ASP C C -15.408 -2.951 -0.817 . . . 1.0 . . . . . . . . . . . . A . 1 ASP C . . . . . . . . . c19602_2mgt 1 . 2 . 547 . 1 1 2 ASP CA C -14.799 -4.351 -0.876 . . . 1.0 . . . . . . . . . . . . A . 1 ASP CA . . . . . . . . . c19602_2mgt 1 . 2 . 548 . 1 1 2 ASP CB C -14.884 -5.013 0.498 . . . 1.0 . . . . . . . . . . . . A . 1 ASP CB . . . . . . . . . c19602_2mgt 1 . 2 . 549 . 1 1 2 ASP CG C -16.289 -5.519 0.755 . . . 1.0 . . . . . . . . . . . . A . 1 ASP CG . . . . . . . . . c19602_2mgt 1 . 2 . 550 . 1 1 2 ASP H H -12.708 -4.513 -0.611 . . . 1.0 . . . . . . . . . . . . A . 1 ASP H . . . . . . . . . c19602_2mgt 1 . 2 . 551 . 1 1 2 ASP HA H -15.346 -4.961 -1.594 . . . 1.0 . . . . . . . . . . . . A . 1 ASP HA . . . . . . . . . c19602_2mgt 1 . 2 . 552 . 1 1 2 ASP HB2 H -14.190 -5.852 0.546 . . . 1.0 . . . . . . . . . . . . A . 1 ASP HB2 . . . . . . . . . c19602_2mgt 1 . 2 . 553 . 1 1 2 ASP HB3 H -14.622 -4.289 1.267 . . . 1.0 . . . . . . . . . . . . A . 1 ASP HB3 . . . . . . . . . c19602_2mgt 1 . 2 . 554 . 1 1 2 ASP N N -13.411 -4.287 -1.297 . . . 1.0 . . . . . . . . . . . . A . 1 ASP N . . . . . . . . . c19602_2mgt 1 . 2 . 555 . 1 1 2 ASP O O -14.712 -1.991 -0.506 . . . 1.0 . . . . . . . . . . . . A . 1 ASP O . . . . . . . . . c19602_2mgt 1 . 2 . 556 . 1 1 2 ASP OD1 O -17.174 -4.707 1.045 . . . 1.0 . . . . . . . . . . . . A . 1 ASP OD1 . . . . . . . . . c19602_2mgt 1 . 2 . 557 . 1 1 2 ASP OD2 O -16.476 -6.748 0.623 . . . 1.0 . . . . . . . . . . . . A . 1 ASP OD2 . . . . . . . . . c19602_2mgt 1 . 2 . 558 . 1 1 3 ALA C C -17.296 -0.926 0.360 . . . 1.0 . . . . . . . . . . . . A . 2 ALA C . . . . . . . . . c19602_2mgt 1 . 2 . 559 . 1 1 3 ALA CA C -17.503 -1.639 -0.974 . . . 1.0 . . . . . . . . . . . . A . 2 ALA CA . . . . . . . . . c19602_2mgt 1 . 2 . 560 . 1 1 3 ALA CB C -18.977 -2.003 -1.156 . . . 1.0 . . . . . . . . . . . . A . 2 ALA CB . . . . . . . . . c19602_2mgt 1 . 2 . 561 . 1 1 3 ALA H H -17.218 -3.705 -1.295 . . . 1.0 . . . . . . . . . . . . A . 2 ALA H . . . . . . . . . c19602_2mgt 1 . 2 . 562 . 1 1 3 ALA HA H -17.199 -0.970 -1.776 . . . 1.0 . . . . . . . . . . . . A . 2 ALA HA . . . . . . . . . c19602_2mgt 1 . 2 . 563 . 1 1 3 ALA HB1 H -19.129 -2.456 -2.134 . . . 1.0 . . . . . . . . . . . . A . 2 ALA HB1 . . . . . . . . . c19602_2mgt 1 . 2 . 564 . 1 1 3 ALA HB2 H -19.288 -2.699 -0.376 . . . 1.0 . . . . . . . . . . . . A . 2 ALA HB2 . . . . . . . . . c19602_2mgt 1 . 2 . 565 . 1 1 3 ALA HB3 H -19.581 -1.104 -1.080 . . . 1.0 . . . . . . . . . . . . A . 2 ALA HB3 . . . . . . . . . c19602_2mgt 1 . 2 . 566 . 1 1 3 ALA N N -16.719 -2.861 -1.061 . . . 1.0 . . . . . . . . . . . . A . 2 ALA N . . . . . . . . . c19602_2mgt 1 . 2 . 567 . 1 1 3 ALA O O -17.033 0.273 0.365 . . . 1.0 . . . . . . . . . . . . A . 2 ALA O . . . . . . . . . c19602_2mgt 1 . 2 . 568 . 1 1 4 GLU C C -15.814 -0.656 3.164 . . . 1.0 . . . . . . . . . . . . A . 3 GLU C . . . . . . . . . c19602_2mgt 1 . 2 . 569 . 1 1 4 GLU CA C -17.227 -1.111 2.815 . . . 1.0 . . . . . . . . . . . . A . 3 GLU CA . . . . . . . . . c19602_2mgt 1 . 2 . 570 . 1 1 4 GLU CB C -17.705 -2.129 3.846 . . . 1.0 . . . . . . . . . . . . A . 3 GLU CB . . . . . . . . . c19602_2mgt 1 . 2 . 571 . 1 1 4 GLU CD C -17.440 -4.477 4.679 . . . 1.0 . . . . . . . . . . . . A . 3 GLU CD . . . . . . . . . c19602_2mgt 1 . 2 . 572 . 1 1 4 GLU CG C -16.749 -3.316 3.995 . . . 1.0 . . . . . . . . . . . . A . 3 GLU CG . . . . . . . . . c19602_2mgt 1 . 2 . 573 . 1 1 4 GLU H H -17.505 -2.660 1.393 . . . 1.0 . . . . . . . . . . . . A . 3 GLU H . . . . . . . . . c19602_2mgt 1 . 2 . 574 . 1 1 4 GLU HA H -17.880 -0.243 2.879 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HA . . . . . . . . . c19602_2mgt 1 . 2 . 575 . 1 1 4 GLU HB2 H -17.782 -1.635 4.813 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HB2 . . . . . . . . . c19602_2mgt 1 . 2 . 576 . 1 1 4 GLU HB3 H -18.694 -2.475 3.560 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HB3 . . . . . . . . . c19602_2mgt 1 . 2 . 577 . 1 1 4 GLU HG2 H -16.380 -3.624 3.024 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HG2 . . . . . . . . . c19602_2mgt 1 . 2 . 578 . 1 1 4 GLU HG3 H -15.896 -3.014 4.595 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HG3 . . . . . . . . . c19602_2mgt 1 . 2 . 579 . 1 1 4 GLU N N -17.355 -1.664 1.474 . . . 1.0 . . . . . . . . . . . . A . 3 GLU N . . . . . . . . . c19602_2mgt 1 . 2 . 580 . 1 1 4 GLU O O -15.658 0.022 4.168 . . . 1.0 . . . . . . . . . . . . A . 3 GLU O . . . . . . . . . c19602_2mgt 1 . 2 . 581 . 1 1 4 GLU OE1 O -18.023 -4.257 5.747 . . . 1.0 . . . . . . . . . . . . A . 3 GLU OE1 . . . . . . . . . c19602_2mgt 1 . 2 . 582 . 1 1 4 GLU OE2 O -17.392 -5.595 4.113 . . . 1.0 . . . . . . . . . . . . A . 3 GLU OE2 . . . . . . . . . c19602_2mgt 1 . 2 . 583 . 1 1 5 PHE C C -13.042 0.505 1.525 . . . 1.0 . . . . . . . . . . . . A . 4 PHE C . . . . . . . . . c19602_2mgt 1 . 2 . 584 . 1 1 5 PHE CA C -13.436 -0.518 2.576 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CA . . . . . . . . . c19602_2mgt 1 . 2 . 585 . 1 1 5 PHE CB C -12.454 -1.682 2.617 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CB . . . . . . . . . c19602_2mgt 1 . 2 . 586 . 1 1 5 PHE CD1 C -13.224 -2.379 4.940 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CD1 . . . . . . . . . c19602_2mgt 1 . 2 . 587 . 1 1 5 PHE CD2 C -12.762 -4.090 3.273 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CD2 . . . . . . . . . c19602_2mgt 1 . 2 . 588 . 1 1 5 PHE CE1 C -13.566 -3.378 5.867 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CE1 . . . . . . . . . c19602_2mgt 1 . 2 . 589 . 1 1 5 PHE CE2 C -13.119 -5.089 4.191 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CE2 . . . . . . . . . c19602_2mgt 1 . 2 . 590 . 1 1 5 PHE CG C -12.819 -2.738 3.638 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CG . . . . . . . . . c19602_2mgt 1 . 2 . 591 . 1 1 5 PHE CZ C -13.520 -4.733 5.490 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CZ . . . . . . . . . c19602_2mgt 1 . 2 . 592 . 1 1 5 PHE H H -14.958 -1.671 1.631 . . . 1.0 . . . . . . . . . . . . A . 4 PHE H . . . . . . . . . c19602_2mgt 1 . 2 . 593 . 1 1 5 PHE HA H -13.371 -0.001 3.530 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HA . . . . . . . . . c19602_2mgt 1 . 2 . 594 . 1 1 5 PHE HB2 H -12.408 -2.134 1.625 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HB2 . . . . . . . . . c19602_2mgt 1 . 2 . 595 . 1 1 5 PHE HB3 H -11.466 -1.296 2.866 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HB3 . . . . . . . . . c19602_2mgt 1 . 2 . 596 . 1 1 5 PHE HD1 H -13.269 -1.338 5.231 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HD1 . . . . . . . . . c19602_2mgt 1 . 2 . 597 . 1 1 5 PHE HD2 H -12.463 -4.354 2.273 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HD2 . . . . . . . . . c19602_2mgt 1 . 2 . 598 . 1 1 5 PHE HE1 H -13.887 -3.102 6.859 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HE1 . . . . . . . . . c19602_2mgt 1 . 2 . 599 . 1 1 5 PHE HE2 H -13.094 -6.124 3.890 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HE2 . . . . . . . . . c19602_2mgt 1 . 2 . 600 . 1 1 5 PHE HZ H -13.807 -5.498 6.196 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HZ . . . . . . . . . c19602_2mgt 1 . 2 . 601 . 1 1 5 PHE N N -14.792 -1.021 2.385 . . . 1.0 . . . . . . . . . . . . A . 4 PHE N . . . . . . . . . c19602_2mgt 1 . 2 . 602 . 1 1 5 PHE O O -12.182 1.325 1.819 . . . 1.0 . . . . . . . . . . . . A . 4 PHE O . . . . . . . . . c19602_2mgt 1 . 2 . 603 . 1 1 6 ARG C C -14.348 2.824 -0.143 . . . 1.0 . . . . . . . . . . . . A . 5 ARG C . . . . . . . . . c19602_2mgt 1 . 2 . 604 . 1 1 6 ARG CA C -13.573 1.592 -0.627 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CA . . . . . . . . . c19602_2mgt 1 . 2 . 605 . 1 1 6 ARG CB C -14.045 1.096 -2.007 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CB . . . . . . . . . c19602_2mgt 1 . 2 . 606 . 1 1 6 ARG CD C -11.642 0.282 -2.616 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CD . . . . . . . . . c19602_2mgt 1 . 2 . 607 . 1 1 6 ARG CG C -13.155 0.046 -2.698 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CG . . . . . . . . . c19602_2mgt 1 . 2 . 608 . 1 1 6 ARG CZ C -10.066 1.979 -3.576 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CZ . . . . . . . . . c19602_2mgt 1 . 2 . 609 . 1 1 6 ARG H H -14.405 -0.170 0.182 . . . 1.0 . . . . . . . . . . . . A . 5 ARG H . . . . . . . . . c19602_2mgt 1 . 2 . 610 . 1 1 6 ARG HA H -12.525 1.880 -0.695 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HA . . . . . . . . . c19602_2mgt 1 . 2 . 611 . 1 1 6 ARG HB2 H -15.051 0.687 -1.903 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HB2 . . . . . . . . . c19602_2mgt 1 . 2 . 612 . 1 1 6 ARG HB3 H -14.109 1.955 -2.671 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HB3 . . . . . . . . . c19602_2mgt 1 . 2 . 613 . 1 1 6 ARG HD2 H -11.321 0.136 -1.590 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HD2 . . . . . . . . . c19602_2mgt 1 . 2 . 614 . 1 1 6 ARG HD3 H -11.144 -0.470 -3.223 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HD3 . . . . . . . . . c19602_2mgt 1 . 2 . 615 . 1 1 6 ARG HE H -11.920 2.367 -2.880 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HE . . . . . . . . . c19602_2mgt 1 . 2 . 616 . 1 1 6 ARG HG2 H -13.350 -0.930 -2.266 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HG2 . . . . . . . . . c19602_2mgt 1 . 2 . 617 . 1 1 6 ARG HG3 H -13.445 0.000 -3.747 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HG3 . . . . . . . . . c19602_2mgt 1 . 2 . 618 . 1 1 6 ARG HH11 H -9.300 0.094 -3.695 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH11 . . . . . . . . . c19602_2mgt 1 . 2 . 619 . 1 1 6 ARG HH12 H -8.249 1.374 -4.253 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH12 . . . . . . . . . c19602_2mgt 1 . 2 . 620 . 1 1 6 ARG HH21 H -10.500 3.968 -3.610 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH21 . . . . . . . . . c19602_2mgt 1 . 2 . 621 . 1 1 6 ARG HH22 H -8.922 3.535 -4.223 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH22 . . . . . . . . . c19602_2mgt 1 . 2 . 622 . 1 1 6 ARG N N -13.701 0.532 0.360 . . . 1.0 . . . . . . . . . . . . A . 5 ARG N . . . . . . . . . c19602_2mgt 1 . 2 . 623 . 1 1 6 ARG NE N -11.249 1.631 -3.051 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NE . . . . . . . . . c19602_2mgt 1 . 2 . 624 . 1 1 6 ARG NH1 N -9.128 1.075 -3.858 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NH1 . . . . . . . . . c19602_2mgt 1 . 2 . 625 . 1 1 6 ARG NH2 N -9.811 3.263 -3.827 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NH2 . . . . . . . . . c19602_2mgt 1 . 2 . 626 . 1 1 6 ARG O O -15.332 3.235 -0.752 . . . 1.0 . . . . . . . . . . . . A . 5 ARG O . . . . . . . . . c19602_2mgt 1 . 2 . 627 . 1 1 7 ARG C C -13.662 5.787 1.338 . . . 1.0 . . . . . . . . . . . . A . 6 ARG C . . . . . . . . . c19602_2mgt 1 . 2 . 628 . 1 1 7 ARG CA C -14.437 4.522 1.697 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CA . . . . . . . . . c19602_2mgt 1 . 2 . 629 . 1 1 7 ARG CB C -14.326 4.270 3.209 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CB . . . . . . . . . c19602_2mgt 1 . 2 . 630 . 1 1 7 ARG CD C -16.488 2.911 3.614 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CD . . . . . . . . . c19602_2mgt 1 . 2 . 631 . 1 1 7 ARG CG C -14.963 2.964 3.706 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CG . . . . . . . . . c19602_2mgt 1 . 2 . 632 . 1 1 7 ARG CZ C -17.886 3.302 1.575 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CZ . . . . . . . . . c19602_2mgt 1 . 2 . 633 . 1 1 7 ARG H H -13.111 2.931 1.435 . . . 1.0 . . . . . . . . . . . . A . 6 ARG H . . . . . . . . . c19602_2mgt 1 . 2 . 634 . 1 1 7 ARG HA H -15.481 4.643 1.433 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HA . . . . . . . . . c19602_2mgt 1 . 2 . 635 . 1 1 7 ARG HB2 H -13.271 4.231 3.471 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HB2 . . . . . . . . . c19602_2mgt 1 . 2 . 636 . 1 1 7 ARG HB3 H -14.763 5.108 3.751 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HB3 . . . . . . . . . c19602_2mgt 1 . 2 . 637 . 1 1 7 ARG HD2 H -16.859 2.142 4.290 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HD2 . . . . . . . . . c19602_2mgt 1 . 2 . 638 . 1 1 7 ARG HD3 H -16.888 3.853 3.958 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HD3 . . . . . . . . . c19602_2mgt 1 . 2 . 639 . 1 1 7 ARG HE H -16.661 1.725 1.863 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HE . . . . . . . . . c19602_2mgt 1 . 2 . 640 . 1 1 7 ARG HG2 H -14.540 2.125 3.165 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HG2 . . . . . . . . . c19602_2mgt 1 . 2 . 641 . 1 1 7 ARG HG3 H -14.692 2.845 4.753 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HG3 . . . . . . . . . c19602_2mgt 1 . 2 . 642 . 1 1 7 ARG HH11 H -18.038 4.853 2.889 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH11 . . . . . . . . . c19602_2mgt 1 . 2 . 643 . 1 1 7 ARG HH12 H -19.038 4.976 1.457 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH12 . . . . . . . . . c19602_2mgt 1 . 2 . 644 . 1 1 7 ARG HH21 H -17.983 1.958 0.048 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH21 . . . . . . . . . c19602_2mgt 1 . 2 . 645 . 1 1 7 ARG HH22 H -19.013 3.361 -0.115 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH22 . . . . . . . . . c19602_2mgt 1 . 2 . 646 . 1 1 7 ARG N N -13.889 3.385 0.981 . . . 1.0 . . . . . . . . . . . . A . 6 ARG N . . . . . . . . . c19602_2mgt 1 . 2 . 647 . 1 1 7 ARG NE N -16.979 2.596 2.266 . . . 1.0 . . . . . . . . . . . . A . 6 ARG NE . . . . . . . . . c19602_2mgt 1 . 2 . 648 . 1 1 7 ARG NH1 N -18.364 4.469 2.015 . . . 1.0 . . . . . . . . . . . . A . 6 ARG NH1 . . . . . . . . . c19602_2mgt 1 . 2 . 649 . 1 1 7 ARG NH2 N -18.329 2.835 0.410 . . . 1.0 . . . . . . . . . . . . A . 6 ARG NH2 . . . . . . . . . c19602_2mgt 1 . 2 . 650 . 1 1 7 ARG O O -12.478 5.726 1.012 . . . 1.0 . . . . . . . . . . . . A . 6 ARG O . . . . . . . . . c19602_2mgt 1 . 2 . 651 . 1 1 8 ASP C C -12.675 8.527 2.446 . . . 1.0 . . . . . . . . . . . . A . 7 ASP C . . . . . . . . . c19602_2mgt 1 . 2 . 652 . 1 1 8 ASP CA C -13.709 8.260 1.344 . . . 1.0 . . . . . . . . . . . . A . 7 ASP CA . . . . . . . . . c19602_2mgt 1 . 2 . 653 . 1 1 8 ASP CB C -14.807 9.337 1.344 . . . 1.0 . . . . . . . . . . . . A . 7 ASP CB . . . . . . . . . c19602_2mgt 1 . 2 . 654 . 1 1 8 ASP CG C -15.621 9.457 2.637 . . . 1.0 . . . . . . . . . . . . A . 7 ASP CG . . . . . . . . . c19602_2mgt 1 . 2 . 655 . 1 1 8 ASP H H -15.293 6.913 1.747 . . . 1.0 . . . . . . . . . . . . A . 7 ASP H . . . . . . . . . c19602_2mgt 1 . 2 . 656 . 1 1 8 ASP HA H -13.199 8.309 0.385 . . . 1.0 . . . . . . . . . . . . A . 7 ASP HA . . . . . . . . . c19602_2mgt 1 . 2 . 657 . 1 1 8 ASP HB2 H -14.334 10.298 1.145 . . . 1.0 . . . . . . . . . . . . A . 7 ASP HB2 . . . . . . . . . c19602_2mgt 1 . 2 . 658 . 1 1 8 ASP HB3 H -15.497 9.129 0.532 . . . 1.0 . . . . . . . . . . . . A . 7 ASP HB3 . . . . . . . . . c19602_2mgt 1 . 2 . 659 . 1 1 8 ASP N N -14.323 6.940 1.467 . . . 1.0 . . . . . . . . . . . . A . 7 ASP N . . . . . . . . . c19602_2mgt 1 . 2 . 660 . 1 1 8 ASP O O -11.608 9.064 2.165 . . . 1.0 . . . . . . . . . . . . A . 7 ASP O . . . . . . . . . c19602_2mgt 1 . 2 . 661 . 1 1 8 ASP OD1 O -15.873 8.418 3.287 . . . 1.0 . . . . . . . . . . . . A . 7 ASP OD1 . . . . . . . . . c19602_2mgt 1 . 2 . 662 . 1 1 8 ASP OD2 O -16.014 10.583 2.970 . . . 1.0 . . . . . . . . . . . . A . 7 ASP OD2 . . . . . . . . . c19602_2mgt 1 . 2 . 663 . 1 1 9 SER C C -11.058 7.443 5.078 . . . 1.0 . . . . . . . . . . . . A . 8 SER C . . . . . . . . . c19602_2mgt 1 . 2 . 664 . 1 1 9 SER CA C -12.204 8.439 4.880 . . . 1.0 . . . . . . . . . . . . A . 8 SER CA . . . . . . . . . c19602_2mgt 1 . 2 . 665 . 1 1 9 SER CB C -13.148 8.494 6.087 . . . 1.0 . . . . . . . . . . . . A . 8 SER CB . . . . . . . . . c19602_2mgt 1 . 2 . 666 . 1 1 9 SER H H -13.913 7.785 3.839 . . . 1.0 . . . . . . . . . . . . A . 8 SER H . . . . . . . . . c19602_2mgt 1 . 2 . 667 . 1 1 9 SER HA H -11.764 9.426 4.759 . . . 1.0 . . . . . . . . . . . . A . 8 SER HA . . . . . . . . . c19602_2mgt 1 . 2 . 668 . 1 1 9 SER HB2 H -13.663 7.541 6.206 . . . 1.0 . . . . . . . . . . . . A . 8 SER HB2 . . . . . . . . . c19602_2mgt 1 . 2 . 669 . 1 1 9 SER HB3 H -12.578 8.704 6.990 . . . 1.0 . . . . . . . . . . . . A . 8 SER HB3 . . . . . . . . . c19602_2mgt 1 . 2 . 670 . 1 1 9 SER HG H -14.647 9.575 6.688 . . . 1.0 . . . . . . . . . . . . A . 8 SER HG . . . . . . . . . c19602_2mgt 1 . 2 . 671 . 1 1 9 SER N N -12.984 8.143 3.688 . . . 1.0 . . . . . . . . . . . . A . 8 SER N . . . . . . . . . c19602_2mgt 1 . 2 . 672 . 1 1 9 SER O O -11.057 6.664 6.023 . . . 1.0 . . . . . . . . . . . . A . 8 SER O . . . . . . . . . c19602_2mgt 1 . 2 . 673 . 1 1 9 SER OG O -14.098 9.517 5.898 . . . 1.0 . . . . . . . . . . . . A . 8 SER OG . . . . . . . . . c19602_2mgt 1 . 2 . 674 . 1 1 10 GLY C C -7.938 7.132 3.171 . . . 1.0 . . . . . . . . . . . . A . 9 GLY C . . . . . . . . . c19602_2mgt 1 . 2 . 675 . 1 1 10 GLY CA C -8.852 6.681 4.303 . . . 1.0 . . . . . . . . . . . . A . 9 GLY CA . . . . . . . . . c19602_2mgt 1 . 2 . 676 . 1 1 10 GLY H H -10.098 8.087 3.394 . . . 1.0 . . . . . . . . . . . . A . 9 GLY H . . . . . . . . . c19602_2mgt 1 . 2 . 677 . 1 1 10 GLY HA2 H -8.376 6.837 5.271 . . . 1.0 . . . . . . . . . . . . A . 9 GLY HA2 . . . . . . . . . c19602_2mgt 1 . 2 . 678 . 1 1 10 GLY HA3 H -9.110 5.627 4.233 . . . 1.0 . . . . . . . . . . . . A . 9 GLY HA3 . . . . . . . . . c19602_2mgt 1 . 2 . 679 . 1 1 10 GLY N N -10.062 7.468 4.193 . . . 1.0 . . . . . . . . . . . . A . 9 GLY N . . . . . . . . . c19602_2mgt 1 . 2 . 680 . 1 1 10 GLY O O -7.841 8.317 2.878 . . . 1.0 . . . . . . . . . . . . A . 9 GLY O . . . . . . . . . c19602_2mgt 1 . 2 . 681 . 1 1 11 TYR C C -6.078 4.331 1.672 . . . 1.0 . . . . . . . . . . . . A . 10 TYR C . . . . . . . . . c19602_2mgt 1 . 2 . 682 . 1 1 11 TYR CA C -7.190 4.816 2.588 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CA . . . . . . . . . c19602_2mgt 1 . 2 . 683 . 1 1 11 TYR CB C -8.506 4.177 2.128 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CB . . . . . . . . . c19602_2mgt 1 . 2 . 684 . 1 1 11 TYR CD1 C -8.370 2.155 3.672 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CD1 . . . . . . . . . c19602_2mgt 1 . 2 . 685 . 1 1 11 TYR CD2 C -10.483 3.333 3.408 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CD2 . . . . . . . . . c19602_2mgt 1 . 2 . 686 . 1 1 11 TYR CE1 C -8.978 1.240 4.546 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CE1 . . . . . . . . . c19602_2mgt 1 . 2 . 687 . 1 1 11 TYR CE2 C -11.097 2.426 4.279 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CE2 . . . . . . . . . c19602_2mgt 1 . 2 . 688 . 1 1 11 TYR CG C -9.124 3.197 3.097 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CG . . . . . . . . . c19602_2mgt 1 . 2 . 689 . 1 1 11 TYR CZ C -10.357 1.364 4.834 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CZ . . . . . . . . . c19602_2mgt 1 . 2 . 690 . 1 1 11 TYR H H -6.845 6.608 1.619 . . . 1.0 . . . . . . . . . . . . A . 10 TYR H . . . . . . . . . c19602_2mgt 1 . 2 . 691 . 1 1 11 TYR HA H -6.978 4.552 3.624 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HA . . . . . . . . . c19602_2mgt 1 . 2 . 692 . 1 1 11 TYR HB2 H -9.237 4.957 1.923 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HB2 . . . . . . . . . c19602_2mgt 1 . 2 . 693 . 1 1 11 TYR HB3 H -8.343 3.666 1.183 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HB3 . . . . . . . . . c19602_2mgt 1 . 2 . 694 . 1 1 11 TYR HD1 H -7.327 2.042 3.440 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HD1 . . . . . . . . . c19602_2mgt 1 . 2 . 695 . 1 1 11 TYR HD2 H -11.056 4.135 2.970 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HD2 . . . . . . . . . c19602_2mgt 1 . 2 . 696 . 1 1 11 TYR HE1 H -8.385 0.459 4.992 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HE1 . . . . . . . . . c19602_2mgt 1 . 2 . 697 . 1 1 11 TYR HE2 H -12.137 2.538 4.527 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HE2 . . . . . . . . . c19602_2mgt 1 . 2 . 698 . 1 1 11 TYR HH H -10.395 -0.169 6.033 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HH . . . . . . . . . c19602_2mgt 1 . 2 . 699 . 1 1 11 TYR N N -7.258 6.249 2.458 . . . 1.0 . . . . . . . . . . . . A . 10 TYR N . . . . . . . . . c19602_2mgt 1 . 2 . 700 . 1 1 11 TYR O O -5.799 4.930 0.637 . . . 1.0 . . . . . . . . . . . . A . 10 TYR O . . . . . . . . . c19602_2mgt 1 . 2 . 701 . 1 1 11 TYR OH O -10.988 0.492 5.665 . . . 1.0 . . . . . . . . . . . . A . 10 TYR OH . . . . . . . . . c19602_2mgt 1 . 2 . 702 . 1 1 12 GLU C C -5.534 0.867 1.482 . . . 1.0 . . . . . . . . . . . . A . 11 GLU C . . . . . . . . . c19602_2mgt 1 . 2 . 703 . 1 1 12 GLU CA C -5.036 2.235 1.029 . . . 1.0 . . . . . . . . . . . . A . 11 GLU CA . . . . . . . . . c19602_2mgt 1 . 2 . 704 . 1 1 12 GLU CB C -3.523 2.338 0.984 . . . 1.0 . . . . . . . . . . . . A . 11 GLU CB . . . . . . . . . c19602_2mgt 1 . 2 . 705 . 1 1 12 GLU CD C -1.571 1.103 0.031 . . . 1.0 . . . . . . . . . . . . A . 11 GLU CD . . . . . . . . . c19602_2mgt 1 . 2 . 706 . 1 1 12 GLU CG C -2.979 1.595 -0.238 . . . 1.0 . . . . . . . . . . . . A . 11 GLU CG . . . . . . . . . c19602_2mgt 1 . 2 . 707 . 1 1 12 GLU H H -5.733 2.783 2.910 . . . 1.0 . . . . . . . . . . . . A . 11 GLU H . . . . . . . . . c19602_2mgt 1 . 2 . 708 . 1 1 12 GLU HA H -5.440 2.472 0.047 . . . 1.0 . . . . . . . . . . . . A . 11 GLU HA . . . . . . . . . c19602_2mgt 1 . 2 . 709 . 1 1 12 GLU HB2 H -3.226 3.385 0.934 . . . 1.0 . . . . . . . . . . . . A . 11 GLU HB2 . . . . . . . . . c19602_2mgt 1 . 2 . 710 . 1 1 12 GLU HB3 H -3.125 1.909 1.898 . . . 1.0 . . . . . . . . . . . . A . 11 GLU HB3 . . . . . . . . . c19602_2mgt 1 . 2 . 711 . 1 1 12 GLU HG2 H -3.610 0.735 -0.460 . . . 1.0 . . . . . . . . . . . . A . 11 GLU HG2 . . . . . . . . . c19602_2mgt 1 . 2 . 712 . 1 1 12 GLU HG3 H -2.982 2.264 -1.096 . . . 1.0 . . . . . . . . . . . . A . 11 GLU HG3 . . . . . . . . . c19602_2mgt 1 . 2 . 713 . 1 1 12 GLU N N -5.546 3.164 1.997 . . . 1.0 . . . . . . . . . . . . A . 11 GLU N . . . . . . . . . c19602_2mgt 1 . 2 . 714 . 1 1 12 GLU O O -5.012 0.269 2.426 . . . 1.0 . . . . . . . . . . . . A . 11 GLU O . . . . . . . . . c19602_2mgt 1 . 2 . 715 . 1 1 12 GLU OE1 O -0.827 1.801 0.734 . . . 1.0 . . . . . . . . . . . . A . 11 GLU OE1 . . . . . . . . . c19602_2mgt 1 . 2 . 716 . 1 1 12 GLU OE2 O -1.249 -0.013 -0.419 . . . 1.0 . . . . . . . . . . . . A . 11 GLU OE2 . . . . . . . . . c19602_2mgt 1 . 2 . 717 . 1 1 13 VAL C C -6.682 -2.034 1.206 . . . 1.0 . . . . . . . . . . . . A . 12 VAL C . . . . . . . . . c19602_2mgt 1 . 2 . 718 . 1 1 13 VAL CA C -7.433 -0.706 1.225 . . . 1.0 . . . . . . . . . . . . A . 12 VAL CA . . . . . . . . . c19602_2mgt 1 . 2 . 719 . 1 1 13 VAL CB C -8.713 -0.702 0.364 . . . 1.0 . . . . . . . . . . . . A . 12 VAL CB . . . . . . . . . c19602_2mgt 1 . 2 . 720 . 1 1 13 VAL CG1 C -9.550 -1.988 0.432 . . . 1.0 . . . . . . . . . . . . A . 12 VAL CG1 . . . . . . . . . c19602_2mgt 1 . 2 . 721 . 1 1 13 VAL CG2 C -9.583 0.443 0.879 . . . 1.0 . . . . . . . . . . . . A . 12 VAL CG2 . . . . . . . . . c19602_2mgt 1 . 2 . 722 . 1 1 13 VAL H H -6.962 0.983 0.064 . . . 1.0 . . . . . . . . . . . . A . 12 VAL H . . . . . . . . . c19602_2mgt 1 . 2 . 723 . 1 1 13 VAL HA H -7.730 -0.536 2.255 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HA . . . . . . . . . c19602_2mgt 1 . 2 . 724 . 1 1 13 VAL HB H -8.459 -0.515 -0.679 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HB . . . . . . . . . c19602_2mgt 1 . 2 . 725 . 1 1 13 VAL HG11 H -9.013 -2.806 -0.044 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HG11 . . . . . . . . . c19602_2mgt 1 . 2 . 726 . 1 1 13 VAL HG12 H -9.749 -2.246 1.472 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HG12 . . . . . . . . . c19602_2mgt 1 . 2 . 727 . 1 1 13 VAL HG13 H -10.494 -1.846 -0.093 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HG13 . . . . . . . . . c19602_2mgt 1 . 2 . 728 . 1 1 13 VAL HG21 H -9.048 1.387 0.835 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HG21 . . . . . . . . . c19602_2mgt 1 . 2 . 729 . 1 1 13 VAL HG22 H -10.463 0.522 0.253 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HG22 . . . . . . . . . c19602_2mgt 1 . 2 . 730 . 1 1 13 VAL HG23 H -9.868 0.241 1.911 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HG23 . . . . . . . . . c19602_2mgt 1 . 2 . 731 . 1 1 13 VAL N N -6.604 0.421 0.822 . . . 1.0 . . . . . . . . . . . . A . 12 VAL N . . . . . . . . . c19602_2mgt 1 . 2 . 732 . 1 1 13 VAL O O -7.137 -2.976 1.848 . . . 1.0 . . . . . . . . . . . . A . 12 VAL O . . . . . . . . . c19602_2mgt 1 . 2 . 733 . 1 1 14 HIS C C -4.303 -3.765 1.981 . . . 1.0 . . . . . . . . . . . . A . 13 HIS C . . . . . . . . . c19602_2mgt 1 . 2 . 734 . 1 1 14 HIS CA C -4.699 -3.309 0.571 . . . 1.0 . . . . . . . . . . . . A . 13 HIS CA . . . . . . . . . c19602_2mgt 1 . 2 . 735 . 1 1 14 HIS CB C -3.392 -3.097 -0.190 . . . 1.0 . . . . . . . . . . . . A . 13 HIS CB . . . . . . . . . c19602_2mgt 1 . 2 . 736 . 1 1 14 HIS CD2 C -4.272 -3.161 -2.599 . . . 1.0 . . . . . . . . . . . . A . 13 HIS CD2 . . . . . . . . . c19602_2mgt 1 . 2 . 737 . 1 1 14 HIS CE1 C -3.118 -1.515 -3.466 . . . 1.0 . . . . . . . . . . . . A . 13 HIS CE1 . . . . . . . . . c19602_2mgt 1 . 2 . 738 . 1 1 14 HIS CG C -3.510 -2.617 -1.608 . . . 1.0 . . . . . . . . . . . . A . 13 HIS CG . . . . . . . . . c19602_2mgt 1 . 2 . 739 . 1 1 14 HIS H H -5.178 -1.311 0.034 . . . 1.0 . . . . . . . . . . . . A . 13 HIS H . . . . . . . . . c19602_2mgt 1 . 2 . 740 . 1 1 14 HIS HA H -5.303 -4.075 0.095 . . . 1.0 . . . . . . . . . . . . A . 13 HIS HA . . . . . . . . . c19602_2mgt 1 . 2 . 741 . 1 1 14 HIS HB2 H -2.769 -2.393 0.363 . . . 1.0 . . . . . . . . . . . . A . 13 HIS HB2 . . . . . . . . . c19602_2mgt 1 . 2 . 742 . 1 1 14 HIS HB3 H -2.878 -4.056 -0.200 . . . 1.0 . . . . . . . . . . . . A . 13 HIS HB3 . . . . . . . . . c19602_2mgt 1 . 2 . 743 . 1 1 14 HIS HD1 H -2.108 -1.020 -1.697 . . . 1.0 . . . . . . . . . . . . A . 13 HIS HD1 . . . . . . . . . c19602_2mgt 1 . 2 . 744 . 1 1 14 HIS HD2 H -4.935 -4.004 -2.491 . . . 1.0 . . . . . . . . . . . . A . 13 HIS HD2 . . . . . . . . . c19602_2mgt 1 . 2 . 745 . 1 1 14 HIS HE1 H -2.712 -0.788 -4.153 . . . 1.0 . . . . . . . . . . . . A . 13 HIS HE1 . . . . . . . . . c19602_2mgt 1 . 2 . 746 . 1 1 14 HIS N N -5.510 -2.106 0.560 . . . 1.0 . . . . . . . . . . . . A . 13 HIS N . . . . . . . . . c19602_2mgt 1 . 2 . 747 . 1 1 14 HIS ND1 N -2.786 -1.598 -2.173 . . . 1.0 . . . . . . . . . . . . A . 13 HIS ND1 . . . . . . . . . c19602_2mgt 1 . 2 . 748 . 1 1 14 HIS NE2 N -4.024 -2.456 -3.777 . . . 1.0 . . . . . . . . . . . . A . 13 HIS NE2 . . . . . . . . . c19602_2mgt 1 . 2 . 749 . 1 1 14 HIS O O -4.014 -4.941 2.173 . . . 1.0 . . . . . . . . . . . . A . 13 HIS O . . . . . . . . . c19602_2mgt 1 . 2 . 750 . 1 1 15 HIS C C -4.993 -3.305 5.284 . . . 1.0 . . . . . . . . . . . . A . 14 HIS C . . . . . . . . . c19602_2mgt 1 . 2 . 751 . 1 1 15 HIS CA C -3.822 -3.121 4.314 . . . 1.0 . . . . . . . . . . . . A . 14 HIS CA . . . . . . . . . c19602_2mgt 1 . 2 . 752 . 1 1 15 HIS CB C -2.890 -1.991 4.760 . . . 1.0 . . . . . . . . . . . . A . 14 HIS CB . . . . . . . . . c19602_2mgt 1 . 2 . 753 . 1 1 15 HIS CD2 C -1.476 -0.851 2.960 . . . 1.0 . . . . . . . . . . . . A . 14 HIS CD2 . . . . . . . . . c19602_2mgt 1 . 2 . 754 . 1 1 15 HIS CE1 C 0.024 -2.406 2.608 . . . 1.0 . . . . . . . . . . . . A . 14 HIS CE1 . . . . . . . . . c19602_2mgt 1 . 2 . 755 . 1 1 15 HIS CG C -1.706 -1.864 3.845 . . . 1.0 . . . . . . . . . . . . A . 14 HIS CG . . . . . . . . . c19602_2mgt 1 . 2 . 756 . 1 1 15 HIS H H -4.500 -1.890 2.724 . . . 1.0 . . . . . . . . . . . . A . 14 HIS H . . . . . . . . . c19602_2mgt 1 . 2 . 757 . 1 1 15 HIS HA H -3.247 -4.049 4.321 . . . 1.0 . . . . . . . . . . . . A . 14 HIS HA . . . . . . . . . c19602_2mgt 1 . 2 . 758 . 1 1 15 HIS HB2 H -3.444 -1.050 4.776 . . . 1.0 . . . . . . . . . . . . A . 14 HIS HB2 . . . . . . . . . c19602_2mgt 1 . 2 . 759 . 1 1 15 HIS HB3 H -2.522 -2.194 5.763 . . . 1.0 . . . . . . . . . . . . A . 14 HIS HB3 . . . . . . . . . c19602_2mgt 1 . 2 . 760 . 1 1 15 HIS HD1 H -0.700 -3.728 4.067 . . . 1.0 . . . . . . . . . . . . A . 14 HIS HD1 . . . . . . . . . c19602_2mgt 1 . 2 . 761 . 1 1 15 HIS HD2 H -2.084 0.032 2.848 . . . 1.0 . . . . . . . . . . . . A . 14 HIS HD2 . . . . . . . . . c19602_2mgt 1 . 2 . 762 . 1 1 15 HIS HE1 H 0.838 -2.968 2.179 . . . 1.0 . . . . . . . . . . . . A . 14 HIS HE1 . . . . . . . . . c19602_2mgt 1 . 2 . 763 . 1 1 15 HIS N N -4.260 -2.846 2.951 . . . 1.0 . . . . . . . . . . . . A . 14 HIS N . . . . . . . . . c19602_2mgt 1 . 2 . 764 . 1 1 15 HIS ND1 N -0.750 -2.823 3.619 . . . 1.0 . . . . . . . . . . . . A . 14 HIS ND1 . . . . . . . . . c19602_2mgt 1 . 2 . 765 . 1 1 15 HIS NE2 N -0.377 -1.205 2.176 . . . 1.0 . . . . . . . . . . . . A . 14 HIS NE2 . . . . . . . . . c19602_2mgt 1 . 2 . 766 . 1 1 15 HIS O O -4.762 -3.404 6.485 . . . 1.0 . . . . . . . . . . . . A . 14 HIS O . . . . . . . . . c19602_2mgt 1 . 2 . 767 . 1 1 16 GLN C C -7.553 -4.990 6.033 . . . 1.0 . . . . . . . . . . . . A . 15 GLN C . . . . . . . . . c19602_2mgt 1 . 2 . 768 . 1 1 16 GLN CA C -7.401 -3.521 5.649 . . . 1.0 . . . . . . . . . . . . A . 15 GLN CA . . . . . . . . . c19602_2mgt 1 . 2 . 769 . 1 1 16 GLN CB C -8.624 -2.946 4.943 . . . 1.0 . . . . . . . . . . . . A . 15 GLN CB . . . . . . . . . c19602_2mgt 1 . 2 . 770 . 1 1 16 GLN CD C -9.860 -2.495 7.127 . . . 1.0 . . . . . . . . . . . . A . 15 GLN CD . . . . . . . . . c19602_2mgt 1 . 2 . 771 . 1 1 16 GLN CG C -9.911 -3.135 5.744 . . . 1.0 . . . . . . . . . . . . A . 15 GLN CG . . . . . . . . . c19602_2mgt 1 . 2 . 772 . 1 1 16 GLN H H -6.416 -3.236 3.819 . . . 1.0 . . . . . . . . . . . . A . 15 GLN H . . . . . . . . . c19602_2mgt 1 . 2 . 773 . 1 1 16 GLN HA H -7.250 -2.943 6.553 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HA . . . . . . . . . c19602_2mgt 1 . 2 . 774 . 1 1 16 GLN HB2 H -8.462 -1.884 4.767 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HB2 . . . . . . . . . c19602_2mgt 1 . 2 . 775 . 1 1 16 GLN HB3 H -8.741 -3.430 3.980 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HB3 . . . . . . . . . c19602_2mgt 1 . 2 . 776 . 1 1 16 GLN HE21 H -10.231 -4.251 8.074 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HE21 . . . . . . . . . c19602_2mgt 1 . 2 . 777 . 1 1 16 GLN HE22 H -10.033 -2.859 9.116 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HE22 . . . . . . . . . c19602_2mgt 1 . 2 . 778 . 1 1 16 GLN HG2 H -10.697 -2.656 5.180 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HG2 . . . . . . . . . c19602_2mgt 1 . 2 . 779 . 1 1 16 GLN HG3 H -10.147 -4.196 5.827 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HG3 . . . . . . . . . c19602_2mgt 1 . 2 . 780 . 1 1 16 GLN N N -6.242 -3.343 4.805 . . . 1.0 . . . . . . . . . . . . A . 15 GLN N . . . . . . . . . c19602_2mgt 1 . 2 . 781 . 1 1 16 GLN NE2 N -10.056 -3.264 8.190 . . . 1.0 . . . . . . . . . . . . A . 15 GLN NE2 . . . . . . . . . c19602_2mgt 1 . 2 . 782 . 1 1 16 GLN O O -7.225 -5.350 7.156 . . . 1.0 . . . . . . . . . . . . A . 15 GLN O . . . . . . . . . c19602_2mgt 1 . 2 . 783 . 1 1 16 GLN OE1 O -9.632 -1.300 7.242 . . . 1.0 . . . . . . . . . . . . A . 15 GLN OE1 . . . . . . . . . c19602_2mgt 1 . 2 . 784 . 1 1 17 LYS C C -7.222 -8.127 5.567 . . . 1.0 . . . . . . . . . . . . A . 16 LYS C . . . . . . . . . c19602_2mgt 1 . 2 . 785 . 1 1 17 LYS CA C -8.433 -7.201 5.434 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CA . . . . . . . . . c19602_2mgt 1 . 2 . 786 . 1 1 17 LYS CB C -9.449 -7.682 4.391 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CB . . . . . . . . . c19602_2mgt 1 . 2 . 787 . 1 1 17 LYS CD C -11.209 -9.428 3.918 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CD . . . . . . . . . c19602_2mgt 1 . 2 . 788 . 1 1 17 LYS CE C -11.636 -10.842 4.300 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CE . . . . . . . . . c19602_2mgt 1 . 2 . 789 . 1 1 17 LYS CG C -9.959 -9.088 4.720 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CG . . . . . . . . . c19602_2mgt 1 . 2 . 790 . 1 1 17 LYS H H -8.304 -5.475 4.209 . . . 1.0 . . . . . . . . . . . . A . 16 LYS H . . . . . . . . . c19602_2mgt 1 . 2 . 791 . 1 1 17 LYS HA H -8.933 -7.208 6.400 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HA . . . . . . . . . c19602_2mgt 1 . 2 . 792 . 1 1 17 LYS HB2 H -10.293 -6.990 4.395 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HB2 . . . . . . . . . c19602_2mgt 1 . 2 . 793 . 1 1 17 LYS HB3 H -8.995 -7.684 3.400 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HB3 . . . . . . . . . c19602_2mgt 1 . 2 . 794 . 1 1 17 LYS HD2 H -11.994 -8.708 4.141 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HD2 . . . . . . . . . c19602_2mgt 1 . 2 . 795 . 1 1 17 LYS HD3 H -11.017 -9.379 2.853 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HD3 . . . . . . . . . c19602_2mgt 1 . 2 . 796 . 1 1 17 LYS HE2 H -10.882 -11.553 3.966 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HE2 . . . . . . . . . c19602_2mgt 1 . 2 . 797 . 1 1 17 LYS HE3 H -11.729 -10.903 5.383 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HE3 . . . . . . . . . c19602_2mgt 1 . 2 . 798 . 1 1 17 LYS HG2 H -9.183 -9.815 4.483 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HG2 . . . . . . . . . c19602_2mgt 1 . 2 . 799 . 1 1 17 LYS HG3 H -10.200 -9.151 5.783 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HG3 . . . . . . . . . c19602_2mgt 1 . 2 . 800 . 1 1 17 LYS HZ1 H -13.632 -10.532 4.034 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HZ1 . . . . . . . . . c19602_2mgt 1 . 2 . 801 . 1 1 17 LYS HZ2 H -12.863 -11.094 2.691 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HZ2 . . . . . . . . . c19602_2mgt 1 . 2 . 802 . 1 1 17 LYS HZ3 H -13.192 -12.115 3.939 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HZ3 . . . . . . . . . c19602_2mgt 1 . 2 . 803 . 1 1 17 LYS N N -8.064 -5.828 5.124 . . . 1.0 . . . . . . . . . . . . A . 16 LYS N . . . . . . . . . c19602_2mgt 1 . 2 . 804 . 1 1 17 LYS NZ N -12.926 -11.171 3.695 . . . 1.0 . . . . . . . . . . . . A . 16 LYS NZ . . . . . . . . . c19602_2mgt 1 . 2 . 805 . 1 1 17 LYS O O -7.306 -9.110 6.292 . . . 1.0 . . . . . . . . . . . . A . 16 LYS O . . . . . . . . . c19602_2mgt 1 . 2 . 806 . 1 1 18 NH2 HN1 H -6.036 -6.971 4.391 . . . 1.0 . . . . . . . . . . . . A . 17 NH2 HN1 . . . . . . . . . c19602_2mgt 1 . 2 . 807 . 1 1 18 NH2 HN2 H -5.281 -8.414 5.028 . . . 1.0 . . . . . . . . . . . . A . 17 NH2 HN2 . . . . . . . . . c19602_2mgt 1 . 2 . 808 . 1 1 18 NH2 N N -6.088 -7.813 4.945 . . . 1.0 . . . . . . . . . . . . A . 17 NH2 N . . . . . . . . . c19602_2mgt 1 . 2 . 809 . 2 1 1 ACE C C 21.178 5.387 -2.715 . . . 1.0 . . . . . . . . . . . . B . 0 ACE C . . . . . . . . . c19602_2mgt 1 . 2 . 810 . 2 1 1 ACE CH3 C 22.440 5.696 -3.508 . . . 1.0 . . . . . . . . . . . . B . 0 ACE CH3 . . . . . . . . . c19602_2mgt 1 . 2 . 811 . 2 1 1 ACE H1 H 22.177 6.185 -4.445 . . . 1.0 . . . . . . . . . . . . B . 0 ACE H1 . . . . . . . . . c19602_2mgt 1 . 2 . 812 . 2 1 1 ACE H2 H 23.091 6.346 -2.926 . . . 1.0 . . . . . . . . . . . . B . 0 ACE H2 . . . . . . . . . c19602_2mgt 1 . 2 . 813 . 2 1 1 ACE H3 H 22.971 4.772 -3.731 . . . 1.0 . . . . . . . . . . . . B . 0 ACE H3 . . . . . . . . . c19602_2mgt 1 . 2 . 814 . 2 1 1 ACE O O 21.044 5.837 -1.581 . . . 1.0 . . . . . . . . . . . . B . 0 ACE O . . . . . . . . . c19602_2mgt 1 . 2 . 815 . 2 1 2 ASP C C 19.001 2.617 -2.518 . . . 1.0 . . . . . . . . . . . . B . 1 ASP C . . . . . . . . . c19602_2mgt 1 . 2 . 816 . 2 1 2 ASP CA C 19.021 4.128 -2.737 . . . 1.0 . . . . . . . . . . . . B . 1 ASP CA . . . . . . . . . c19602_2mgt 1 . 2 . 817 . 2 1 2 ASP CB C 17.886 4.426 -3.719 . . . 1.0 . . . . . . . . . . . . B . 1 ASP CB . . . . . . . . . c19602_2mgt 1 . 2 . 818 . 2 1 2 ASP CG C 17.509 5.891 -3.767 . . . 1.0 . . . . . . . . . . . . B . 1 ASP CG . . . . . . . . . c19602_2mgt 1 . 2 . 819 . 2 1 2 ASP H H 20.460 4.313 -4.263 . . . 1.0 . . . . . . . . . . . . B . 1 ASP H . . . . . . . . . c19602_2mgt 1 . 2 . 820 . 2 1 2 ASP HA H 18.829 4.610 -1.779 . . . 1.0 . . . . . . . . . . . . B . 1 ASP HA . . . . . . . . . c19602_2mgt 1 . 2 . 821 . 2 1 2 ASP HB2 H 18.168 4.075 -4.712 . . . 1.0 . . . . . . . . . . . . B . 1 ASP HB2 . . . . . . . . . c19602_2mgt 1 . 2 . 822 . 2 1 2 ASP HB3 H 17.005 3.880 -3.408 . . . 1.0 . . . . . . . . . . . . B . 1 ASP HB3 . . . . . . . . . c19602_2mgt 1 . 2 . 823 . 2 1 2 ASP N N 20.268 4.617 -3.320 . . . 1.0 . . . . . . . . . . . . B . 1 ASP N . . . . . . . . . c19602_2mgt 1 . 2 . 824 . 2 1 2 ASP O O 18.123 2.137 -1.806 . . . 1.0 . . . . . . . . . . . . B . 1 ASP O . . . . . . . . . c19602_2mgt 1 . 2 . 825 . 2 1 2 ASP OD1 O 17.408 6.502 -2.700 . . . 1.0 . . . . . . . . . . . . B . 1 ASP OD1 . . . . . . . . . c19602_2mgt 1 . 2 . 826 . 2 1 2 ASP OD2 O 17.294 6.391 -4.892 . . . 1.0 . . . . . . . . . . . . B . 1 ASP OD2 . . . . . . . . . c19602_2mgt 1 . 2 . 827 . 2 1 3 ALA C C 19.699 -0.271 -1.904 . . . 1.0 . . . . . . . . . . . . B . 2 ALA C . . . . . . . . . c19602_2mgt 1 . 2 . 828 . 2 1 3 ALA CA C 19.952 0.429 -3.240 . . . 1.0 . . . . . . . . . . . . B . 2 ALA CA . . . . . . . . . c19602_2mgt 1 . 2 . 829 . 2 1 3 ALA CB C 21.316 0.019 -3.792 . . . 1.0 . . . . . . . . . . . . B . 2 ALA CB . . . . . . . . . c19602_2mgt 1 . 2 . 830 . 2 1 3 ALA H H 20.579 2.381 -3.736 . . . 1.0 . . . . . . . . . . . . B . 2 ALA H . . . . . . . . . c19602_2mgt 1 . 2 . 831 . 2 1 3 ALA HA H 19.191 0.105 -3.948 . . . 1.0 . . . . . . . . . . . . B . 2 ALA HA . . . . . . . . . c19602_2mgt 1 . 2 . 832 . 2 1 3 ALA HB1 H 21.360 -1.065 -3.871 . . . 1.0 . . . . . . . . . . . . B . 2 ALA HB1 . . . . . . . . . c19602_2mgt 1 . 2 . 833 . 2 1 3 ALA HB2 H 21.468 0.456 -4.777 . . . 1.0 . . . . . . . . . . . . B . 2 ALA HB2 . . . . . . . . . c19602_2mgt 1 . 2 . 834 . 2 1 3 ALA HB3 H 22.102 0.359 -3.118 . . . 1.0 . . . . . . . . . . . . B . 2 ALA HB3 . . . . . . . . . c19602_2mgt 1 . 2 . 835 . 2 1 3 ALA N N 19.922 1.884 -3.156 . . . 1.0 . . . . . . . . . . . . B . 2 ALA N . . . . . . . . . c19602_2mgt 1 . 2 . 836 . 2 1 3 ALA O O 19.003 -1.280 -1.884 . . . 1.0 . . . . . . . . . . . . B . 2 ALA O . . . . . . . . . c19602_2mgt 1 . 2 . 837 . 2 1 4 GLU C C 18.725 -0.539 1.015 . . . 1.0 . . . . . . . . . . . . B . 3 GLU C . . . . . . . . . c19602_2mgt 1 . 2 . 838 . 2 1 4 GLU CA C 20.147 -0.249 0.547 . . . 1.0 . . . . . . . . . . . . B . 3 GLU CA . . . . . . . . . c19602_2mgt 1 . 2 . 839 . 2 1 4 GLU CB C 20.856 0.704 1.513 . . . 1.0 . . . . . . . . . . . . B . 3 GLU CB . . . . . . . . . c19602_2mgt 1 . 2 . 840 . 2 1 4 GLU CD C 21.041 3.089 2.410 . . . 1.0 . . . . . . . . . . . . B . 3 GLU CD . . . . . . . . . c19602_2mgt 1 . 2 . 841 . 2 1 4 GLU CG C 20.268 2.126 1.521 . . . 1.0 . . . . . . . . . . . . B . 3 GLU CG . . . . . . . . . c19602_2mgt 1 . 2 . 842 . 2 1 4 GLU H H 20.746 1.143 -0.921 . . . 1.0 . . . . . . . . . . . . B . 3 GLU H . . . . . . . . . c19602_2mgt 1 . 2 . 843 . 2 1 4 GLU HA H 20.682 -1.193 0.561 . . . 1.0 . . . . . . . . . . . . B . 3 GLU HA . . . . . . . . . c19602_2mgt 1 . 2 . 844 . 2 1 4 GLU HB2 H 20.795 0.288 2.518 . . . 1.0 . . . . . . . . . . . . B . 3 GLU HB2 . . . . . . . . . c19602_2mgt 1 . 2 . 845 . 2 1 4 GLU HB3 H 21.907 0.753 1.233 . . . 1.0 . . . . . . . . . . . . B . 3 GLU HB3 . . . . . . . . . c19602_2mgt 1 . 2 . 846 . 2 1 4 GLU HG2 H 20.261 2.526 0.506 . . . 1.0 . . . . . . . . . . . . B . 3 GLU HG2 . . . . . . . . . c19602_2mgt 1 . 2 . 847 . 2 1 4 GLU HG3 H 19.243 2.091 1.880 . . . 1.0 . . . . . . . . . . . . B . 3 GLU HG3 . . . . . . . . . c19602_2mgt 1 . 2 . 848 . 2 1 4 GLU N N 20.221 0.288 -0.806 . . . 1.0 . . . . . . . . . . . . B . 3 GLU N . . . . . . . . . c19602_2mgt 1 . 2 . 849 . 2 1 4 GLU O O 18.528 -1.526 1.714 . . . 1.0 . . . . . . . . . . . . B . 3 GLU O . . . . . . . . . c19602_2mgt 1 . 2 . 850 . 2 1 4 GLU OE1 O 21.781 2.619 3.301 . . . 1.0 . . . . . . . . . . . . B . 3 GLU OE1 . . . . . . . . . c19602_2mgt 1 . 2 . 851 . 2 1 4 GLU OE2 O 20.885 4.303 2.216 . . . 1.0 . . . . . . . . . . . . B . 3 GLU OE2 . . . . . . . . . c19602_2mgt 1 . 2 . 852 . 2 1 5 PHE C C 15.593 -0.365 -0.419 . . . 1.0 . . . . . . . . . . . . B . 4 PHE C . . . . . . . . . c19602_2mgt 1 . 2 . 853 . 2 1 5 PHE CA C 16.335 0.003 0.858 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CA . . . . . . . . . c19602_2mgt 1 . 2 . 854 . 2 1 5 PHE CB C 15.690 1.210 1.525 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CB . . . . . . . . . c19602_2mgt 1 . 2 . 855 . 2 1 5 PHE CD1 C 14.149 2.395 -0.085 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CD1 . . . . . . . . . c19602_2mgt 1 . 2 . 856 . 2 1 5 PHE CD2 C 16.351 3.333 0.349 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CD2 . . . . . . . . . c19602_2mgt 1 . 2 . 857 . 2 1 5 PHE CE1 C 13.849 3.478 -0.928 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CE1 . . . . . . . . . c19602_2mgt 1 . 2 . 858 . 2 1 5 PHE CE2 C 16.054 4.409 -0.501 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CE2 . . . . . . . . . c19602_2mgt 1 . 2 . 859 . 2 1 5 PHE CG C 15.386 2.345 0.581 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CG . . . . . . . . . c19602_2mgt 1 . 2 . 860 . 2 1 5 PHE CZ C 14.803 4.487 -1.138 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CZ . . . . . . . . . c19602_2mgt 1 . 2 . 861 . 2 1 5 PHE H H 17.970 1.073 0.039 . . . 1.0 . . . . . . . . . . . . B . 4 PHE H . . . . . . . . . c19602_2mgt 1 . 2 . 862 . 2 1 5 PHE HA H 16.241 -0.836 1.540 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HA . . . . . . . . . c19602_2mgt 1 . 2 . 863 . 2 1 5 PHE HB2 H 14.760 0.880 1.985 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HB2 . . . . . . . . . c19602_2mgt 1 . 2 . 864 . 2 1 5 PHE HB3 H 16.344 1.568 2.319 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HB3 . . . . . . . . . c19602_2mgt 1 . 2 . 865 . 2 1 5 PHE HD1 H 13.443 1.589 0.053 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HD1 . . . . . . . . . c19602_2mgt 1 . 2 . 866 . 2 1 5 PHE HD2 H 17.321 3.249 0.817 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HD2 . . . . . . . . . c19602_2mgt 1 . 2 . 867 . 2 1 5 PHE HE1 H 12.892 3.531 -1.423 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HE1 . . . . . . . . . c19602_2mgt 1 . 2 . 868 . 2 1 5 PHE HE2 H 16.789 5.176 -0.662 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HE2 . . . . . . . . . c19602_2mgt 1 . 2 . 869 . 2 1 5 PHE HZ H 14.582 5.312 -1.796 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HZ . . . . . . . . . c19602_2mgt 1 . 2 . 870 . 2 1 5 PHE N N 17.743 0.270 0.610 . . . 1.0 . . . . . . . . . . . . B . 4 PHE N . . . . . . . . . c19602_2mgt 1 . 2 . 871 . 2 1 5 PHE O O 14.510 -0.927 -0.320 . . . 1.0 . . . . . . . . . . . . B . 4 PHE O . . . . . . . . . c19602_2mgt 1 . 2 . 872 . 2 1 6 ARG C C 16.143 -2.045 -3.079 . . . 1.0 . . . . . . . . . . . . B . 5 ARG C . . . . . . . . . c19602_2mgt 1 . 2 . 873 . 2 1 6 ARG CA C 15.647 -0.612 -2.864 . . . 1.0 . . . . . . . . . . . . B . 5 ARG CA . . . . . . . . . c19602_2mgt 1 . 2 . 874 . 2 1 6 ARG CB C 15.956 0.363 -4.004 . . . 1.0 . . . . . . . . . . . . B . 5 ARG CB . . . . . . . . . c19602_2mgt 1 . 2 . 875 . 2 1 6 ARG CD C 13.704 1.597 -3.611 . . . 1.0 . . . . . . . . . . . . B . 5 ARG CD . . . . . . . . . c19602_2mgt 1 . 2 . 876 . 2 1 6 ARG CG C 15.214 1.702 -3.857 . . . 1.0 . . . . . . . . . . . . B . 5 ARG CG . . . . . . . . . c19602_2mgt 1 . 2 . 877 . 2 1 6 ARG CZ C 12.110 1.289 -5.516 . . . 1.0 . . . . . . . . . . . . B . 5 ARG CZ . . . . . . . . . c19602_2mgt 1 . 2 . 878 . 2 1 6 ARG H H 17.033 0.405 -1.632 . . . 1.0 . . . . . . . . . . . . B . 5 ARG H . . . . . . . . . c19602_2mgt 1 . 2 . 879 . 2 1 6 ARG HA H 14.567 -0.690 -2.778 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HA . . . . . . . . . c19602_2mgt 1 . 2 . 880 . 2 1 6 ARG HB2 H 17.027 0.553 -4.028 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HB2 . . . . . . . . . c19602_2mgt 1 . 2 . 881 . 2 1 6 ARG HB3 H 15.665 -0.092 -4.949 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HB3 . . . . . . . . . c19602_2mgt 1 . 2 . 882 . 2 1 6 ARG HD2 H 13.518 1.128 -2.644 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HD2 . . . . . . . . . c19602_2mgt 1 . 2 . 883 . 2 1 6 ARG HD3 H 13.288 2.599 -3.548 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HD3 . . . . . . . . . c19602_2mgt 1 . 2 . 884 . 2 1 6 ARG HE H 13.137 -0.182 -4.600 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HE . . . . . . . . . c19602_2mgt 1 . 2 . 885 . 2 1 6 ARG HG2 H 15.638 2.239 -3.012 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HG2 . . . . . . . . . c19602_2mgt 1 . 2 . 886 . 2 1 6 ARG HG3 H 15.384 2.292 -4.756 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HG3 . . . . . . . . . c19602_2mgt 1 . 2 . 887 . 2 1 6 ARG HH11 H 12.439 3.255 -5.131 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HH11 . . . . . . . . . c19602_2mgt 1 . 2 . 888 . 2 1 6 ARG HH12 H 11.217 2.921 -6.336 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HH12 . . . . . . . . . c19602_2mgt 1 . 2 . 889 . 2 1 6 ARG HH21 H 11.491 -0.559 -6.099 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HH21 . . . . . . . . . c19602_2mgt 1 . 2 . 890 . 2 1 6 ARG HH22 H 10.680 0.786 -6.872 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HH22 . . . . . . . . . c19602_2mgt 1 . 2 . 891 . 2 1 6 ARG N N 16.157 -0.097 -1.603 . . . 1.0 . . . . . . . . . . . . B . 5 ARG N . . . . . . . . . c19602_2mgt 1 . 2 . 892 . 2 1 6 ARG NE N 13.008 0.818 -4.642 . . . 1.0 . . . . . . . . . . . . B . 5 ARG NE . . . . . . . . . c19602_2mgt 1 . 2 . 893 . 2 1 6 ARG NH1 N 11.911 2.594 -5.681 . . . 1.0 . . . . . . . . . . . . B . 5 ARG NH1 . . . . . . . . . c19602_2mgt 1 . 2 . 894 . 2 1 6 ARG NH2 N 11.374 0.436 -6.226 . . . 1.0 . . . . . . . . . . . . B . 5 ARG NH2 . . . . . . . . . c19602_2mgt 1 . 2 . 895 . 2 1 6 ARG O O 16.706 -2.396 -4.111 . . . 1.0 . . . . . . . . . . . . B . 5 ARG O . . . . . . . . . c19602_2mgt 1 . 2 . 896 . 2 1 7 ARG C C 15.084 -5.011 -2.873 . . . 1.0 . . . . . . . . . . . . B . 6 ARG C . . . . . . . . . c19602_2mgt 1 . 2 . 897 . 2 1 7 ARG CA C 16.109 -4.296 -1.989 . . . 1.0 . . . . . . . . . . . . B . 6 ARG CA . . . . . . . . . c19602_2mgt 1 . 2 . 898 . 2 1 7 ARG CB C 15.901 -4.714 -0.529 . . . 1.0 . . . . . . . . . . . . B . 6 ARG CB . . . . . . . . . c19602_2mgt 1 . 2 . 899 . 2 1 7 ARG CD C 18.266 -4.493 0.503 . . . 1.0 . . . . . . . . . . . . B . 6 ARG CD . . . . . . . . . c19602_2mgt 1 . 2 . 900 . 2 1 7 ARG CG C 16.808 -4.041 0.511 . . . 1.0 . . . . . . . . . . . . B . 6 ARG CG . . . . . . . . . c19602_2mgt 1 . 2 . 901 . 2 1 7 ARG CZ C 19.797 -4.483 -1.487 . . . 1.0 . . . . . . . . . . . . B . 6 ARG CZ . . . . . . . . . c19602_2mgt 1 . 2 . 902 . 2 1 7 ARG H H 15.465 -2.468 -1.244 . . . 1.0 . . . . . . . . . . . . B . 6 ARG H . . . . . . . . . c19602_2mgt 1 . 2 . 903 . 2 1 7 ARG HA H 17.120 -4.531 -2.306 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HA . . . . . . . . . c19602_2mgt 1 . 2 . 904 . 2 1 7 ARG HB2 H 14.881 -4.430 -0.271 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HB2 . . . . . . . . . c19602_2mgt 1 . 2 . 905 . 2 1 7 ARG HB3 H 15.994 -5.797 -0.442 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HB3 . . . . . . . . . c19602_2mgt 1 . 2 . 906 . 2 1 7 ARG HD2 H 18.707 -4.197 1.454 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HD2 . . . . . . . . . c19602_2mgt 1 . 2 . 907 . 2 1 7 ARG HD3 H 18.297 -5.578 0.436 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HD3 . . . . . . . . . c19602_2mgt 1 . 2 . 908 . 2 1 7 ARG HE H 18.997 -2.851 -0.612 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HE . . . . . . . . . c19602_2mgt 1 . 2 . 909 . 2 1 7 ARG HG2 H 16.752 -2.957 0.414 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HG2 . . . . . . . . . c19602_2mgt 1 . 2 . 910 . 2 1 7 ARG HG3 H 16.417 -4.306 1.487 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HG3 . . . . . . . . . c19602_2mgt 1 . 2 . 911 . 2 1 7 ARG HH11 H 19.518 -6.366 -0.786 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HH11 . . . . . . . . . c19602_2mgt 1 . 2 . 912 . 2 1 7 ARG HH12 H 20.512 -6.244 -2.216 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HH12 . . . . . . . . . c19602_2mgt 1 . 2 . 913 . 2 1 7 ARG HH21 H 20.278 -2.772 -2.468 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HH21 . . . . . . . . . c19602_2mgt 1 . 2 . 914 . 2 1 7 ARG HH22 H 20.941 -4.242 -3.149 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HH22 . . . . . . . . . c19602_2mgt 1 . 2 . 915 . 2 1 7 ARG N N 15.905 -2.867 -2.057 . . . 1.0 . . . . . . . . . . . . B . 6 ARG N . . . . . . . . . c19602_2mgt 1 . 2 . 916 . 2 1 7 ARG NE N 19.044 -3.861 -0.568 . . . 1.0 . . . . . . . . . . . . B . 6 ARG NE . . . . . . . . . c19602_2mgt 1 . 2 . 917 . 2 1 7 ARG NH1 N 19.961 -5.803 -1.496 . . . 1.0 . . . . . . . . . . . . B . 6 ARG NH1 . . . . . . . . . c19602_2mgt 1 . 2 . 918 . 2 1 7 ARG NH2 N 20.411 -3.773 -2.430 . . . 1.0 . . . . . . . . . . . . B . 6 ARG NH2 . . . . . . . . . c19602_2mgt 1 . 2 . 919 . 2 1 7 ARG O O 13.970 -4.530 -3.063 . . . 1.0 . . . . . . . . . . . . B . 6 ARG O . . . . . . . . . c19602_2mgt 1 . 2 . 920 . 2 1 8 ASP C C 13.337 -7.534 -3.447 . . . 1.0 . . . . . . . . . . . . B . 7 ASP C . . . . . . . . . c19602_2mgt 1 . 2 . 921 . 2 1 8 ASP CA C 14.580 -7.037 -4.190 . . . 1.0 . . . . . . . . . . . . B . 7 ASP CA . . . . . . . . . c19602_2mgt 1 . 2 . 922 . 2 1 8 ASP CB C 15.388 -8.226 -4.731 . . . 1.0 . . . . . . . . . . . . B . 7 ASP CB . . . . . . . . . c19602_2mgt 1 . 2 . 923 . 2 1 8 ASP CG C 16.268 -8.965 -3.717 . . . 1.0 . . . . . . . . . . . . B . 7 ASP CG . . . . . . . . . c19602_2mgt 1 . 2 . 924 . 2 1 8 ASP H H 16.368 -6.543 -3.163 . . . 1.0 . . . . . . . . . . . . B . 7 ASP H . . . . . . . . . c19602_2mgt 1 . 2 . 925 . 2 1 8 ASP HA H 14.236 -6.449 -5.038 . . . 1.0 . . . . . . . . . . . . B . 7 ASP HA . . . . . . . . . c19602_2mgt 1 . 2 . 926 . 2 1 8 ASP HB2 H 14.696 -8.942 -5.171 . . . 1.0 . . . . . . . . . . . . B . 7 ASP HB2 . . . . . . . . . c19602_2mgt 1 . 2 . 927 . 2 1 8 ASP HB3 H 16.038 -7.858 -5.523 . . . 1.0 . . . . . . . . . . . . B . 7 ASP HB3 . . . . . . . . . c19602_2mgt 1 . 2 . 928 . 2 1 8 ASP N N 15.442 -6.192 -3.370 . . . 1.0 . . . . . . . . . . . . B . 7 ASP N . . . . . . . . . c19602_2mgt 1 . 2 . 929 . 2 1 8 ASP O O 12.260 -7.594 -4.027 . . . 1.0 . . . . . . . . . . . . B . 7 ASP O . . . . . . . . . c19602_2mgt 1 . 2 . 930 . 2 1 8 ASP OD1 O 16.044 -8.849 -2.495 . . . 1.0 . . . . . . . . . . . . B . 7 ASP OD1 . . . . . . . . . c19602_2mgt 1 . 2 . 931 . 2 1 8 ASP OD2 O 17.186 -9.660 -4.179 . . . 1.0 . . . . . . . . . . . . B . 7 ASP OD2 . . . . . . . . . c19602_2mgt 1 . 2 . 932 . 2 1 9 SER C C 11.470 -7.639 -0.847 . . . 1.0 . . . . . . . . . . . . B . 8 SER C . . . . . . . . . c19602_2mgt 1 . 2 . 933 . 2 1 9 SER CA C 12.471 -8.632 -1.433 . . . 1.0 . . . . . . . . . . . . B . 8 SER CA . . . . . . . . . c19602_2mgt 1 . 2 . 934 . 2 1 9 SER CB C 13.163 -9.475 -0.354 . . . 1.0 . . . . . . . . . . . . B . 8 SER CB . . . . . . . . . c19602_2mgt 1 . 2 . 935 . 2 1 9 SER H H 14.403 -7.868 -1.780 . . . 1.0 . . . . . . . . . . . . B . 8 SER H . . . . . . . . . c19602_2mgt 1 . 2 . 936 . 2 1 9 SER HA H 11.960 -9.309 -2.108 . . . 1.0 . . . . . . . . . . . . B . 8 SER HA . . . . . . . . . c19602_2mgt 1 . 2 . 937 . 2 1 9 SER HB2 H 13.672 -8.821 0.355 . . . 1.0 . . . . . . . . . . . . B . 8 SER HB2 . . . . . . . . . c19602_2mgt 1 . 2 . 938 . 2 1 9 SER HB3 H 12.418 -10.067 0.172 . . . 1.0 . . . . . . . . . . . . B . 8 SER HB3 . . . . . . . . . c19602_2mgt 1 . 2 . 939 . 2 1 9 SER HG H 14.717 -9.844 -1.474 . . . 1.0 . . . . . . . . . . . . B . 8 SER HG . . . . . . . . . c19602_2mgt 1 . 2 . 940 . 2 1 9 SER N N 13.479 -7.907 -2.178 . . . 1.0 . . . . . . . . . . . . B . 8 SER N . . . . . . . . . c19602_2mgt 1 . 2 . 941 . 2 1 9 SER O O 11.869 -6.757 -0.095 . . . 1.0 . . . . . . . . . . . . B . 8 SER O . . . . . . . . . c19602_2mgt 1 . 2 . 942 . 2 1 9 SER OG O 14.112 -10.353 -0.926 . . . 1.0 . . . . . . . . . . . . B . 8 SER OG . . . . . . . . . c19602_2mgt 1 . 2 . 943 . 2 1 10 GLY C C 7.961 -6.955 -1.655 . . . 1.0 . . . . . . . . . . . . B . 9 GLY C . . . . . . . . . c19602_2mgt 1 . 2 . 944 . 2 1 10 GLY CA C 9.130 -6.894 -0.672 . . . 1.0 . . . . . . . . . . . . B . 9 GLY CA . . . . . . . . . c19602_2mgt 1 . 2 . 945 . 2 1 10 GLY H H 9.886 -8.395 -1.909 . . . 1.0 . . . . . . . . . . . . B . 9 GLY H . . . . . . . . . c19602_2mgt 1 . 2 . 946 . 2 1 10 GLY HA2 H 8.803 -7.246 0.303 . . . 1.0 . . . . . . . . . . . . B . 9 GLY HA2 . . . . . . . . . c19602_2mgt 1 . 2 . 947 . 2 1 10 GLY HA3 H 9.516 -5.884 -0.538 . . . 1.0 . . . . . . . . . . . . B . 9 GLY HA3 . . . . . . . . . c19602_2mgt 1 . 2 . 948 . 2 1 10 GLY N N 10.179 -7.756 -1.182 . . . 1.0 . . . . . . . . . . . . B . 9 GLY N . . . . . . . . . c19602_2mgt 1 . 2 . 949 . 2 1 10 GLY O O 7.600 -8.034 -2.103 . . . 1.0 . . . . . . . . . . . . B . 9 GLY O . . . . . . . . . c19602_2mgt 1 . 2 . 950 . 2 1 11 TYR C C 6.448 -3.577 -2.038 . . . 1.0 . . . . . . . . . . . . B . 10 TYR C . . . . . . . . . c19602_2mgt 1 . 2 . 951 . 2 1 11 TYR CA C 7.579 -4.493 -1.590 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CA . . . . . . . . . c19602_2mgt 1 . 2 . 952 . 2 1 11 TYR CB C 8.882 -3.957 -2.193 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CB . . . . . . . . . c19602_2mgt 1 . 2 . 953 . 2 1 11 TYR CD1 C 9.325 -2.506 -0.144 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CD1 . . . . . . . . . c19602_2mgt 1 . 2 . 954 . 2 1 11 TYR CD2 C 11.191 -3.438 -1.393 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CD2 . . . . . . . . . c19602_2mgt 1 . 2 . 955 . 2 1 11 TYR CE1 C 10.210 -1.873 0.734 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CE1 . . . . . . . . . c19602_2mgt 1 . 2 . 956 . 2 1 11 TYR CE2 C 12.086 -2.823 -0.508 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CE2 . . . . . . . . . c19602_2mgt 1 . 2 . 957 . 2 1 11 TYR CG C 9.810 -3.282 -1.214 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CG . . . . . . . . . c19602_2mgt 1 . 2 . 958 . 2 1 11 TYR CZ C 11.598 -2.027 0.556 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CZ . . . . . . . . . c19602_2mgt 1 . 2 . 959 . 2 1 11 TYR H H 6.703 -5.941 -2.810 . . . 1.0 . . . . . . . . . . . . B . 10 TYR H . . . . . . . . . c19602_2mgt 1 . 2 . 960 . 2 1 11 TYR HA H 7.642 -4.506 -0.502 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HA . . . . . . . . . c19602_2mgt 1 . 2 . 961 . 2 1 11 TYR HB2 H 9.428 -4.772 -2.658 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HB2 . . . . . . . . . c19602_2mgt 1 . 2 . 962 . 2 1 11 TYR HB3 H 8.649 -3.256 -2.993 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HB3 . . . . . . . . . c19602_2mgt 1 . 2 . 963 . 2 1 11 TYR HD1 H 8.272 -2.390 0.025 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HD1 . . . . . . . . . c19602_2mgt 1 . 2 . 964 . 2 1 11 TYR HD2 H 11.559 -4.044 -2.208 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HD2 . . . . . . . . . c19602_2mgt 1 . 2 . 965 . 2 1 11 TYR HE1 H 9.824 -1.295 1.556 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HE1 . . . . . . . . . c19602_2mgt 1 . 2 . 966 . 2 1 11 TYR HE2 H 13.140 -2.988 -0.642 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HE2 . . . . . . . . . c19602_2mgt 1 . 2 . 967 . 2 1 11 TYR HH H 13.368 -1.570 1.211 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HH . . . . . . . . . c19602_2mgt 1 . 2 . 968 . 2 1 11 TYR N N 7.337 -5.846 -2.042 . . . 1.0 . . . . . . . . . . . . B . 10 TYR N . . . . . . . . . c19602_2mgt 1 . 2 . 969 . 2 1 11 TYR O O 5.937 -3.722 -3.145 . . . 1.0 . . . . . . . . . . . . B . 10 TYR O . . . . . . . . . c19602_2mgt 1 . 2 . 970 . 2 1 11 TYR OH O 12.446 -1.443 1.450 . . . 1.0 . . . . . . . . . . . . B . 10 TYR OH . . . . . . . . . c19602_2mgt 1 . 2 . 971 . 2 1 12 GLU C C 6.123 -0.160 -1.045 . . . 1.0 . . . . . . . . . . . . B . 11 GLU C . . . . . . . . . c19602_2mgt 1 . 2 . 972 . 2 1 12 GLU CA C 5.391 -1.400 -1.587 . . . 1.0 . . . . . . . . . . . . B . 11 GLU CA . . . . . . . . . c19602_2mgt 1 . 2 . 973 . 2 1 12 GLU CB C 3.974 -1.571 -1.051 . . . 1.0 . . . . . . . . . . . . B . 11 GLU CB . . . . . . . . . c19602_2mgt 1 . 2 . 974 . 2 1 12 GLU CD C 1.831 -0.296 -0.843 . . . 1.0 . . . . . . . . . . . . B . 11 GLU CD . . . . . . . . . c19602_2mgt 1 . 2 . 975 . 2 1 12 GLU CG C 3.014 -0.603 -1.737 . . . 1.0 . . . . . . . . . . . . B . 11 GLU CG . . . . . . . . . c19602_2mgt 1 . 2 . 976 . 2 1 12 GLU H H 6.569 -2.560 -0.295 . . . 1.0 . . . . . . . . . . . . B . 11 GLU H . . . . . . . . . c19602_2mgt 1 . 2 . 977 . 2 1 12 GLU HA H 5.349 -1.346 -2.671 . . . 1.0 . . . . . . . . . . . . B . 11 GLU HA . . . . . . . . . c19602_2mgt 1 . 2 . 978 . 2 1 12 GLU HB2 H 3.624 -2.580 -1.256 . . . 1.0 . . . . . . . . . . . . B . 11 GLU HB2 . . . . . . . . . c19602_2mgt 1 . 2 . 979 . 2 1 12 GLU HB3 H 3.977 -1.423 0.028 . . . 1.0 . . . . . . . . . . . . B . 11 GLU HB3 . . . . . . . . . c19602_2mgt 1 . 2 . 980 . 2 1 12 GLU HG2 H 3.531 0.329 -1.957 . . . 1.0 . . . . . . . . . . . . B . 11 GLU HG2 . . . . . . . . . c19602_2mgt 1 . 2 . 981 . 2 1 12 GLU HG3 H 2.664 -1.045 -2.669 . . . 1.0 . . . . . . . . . . . . B . 11 GLU HG3 . . . . . . . . . c19602_2mgt 1 . 2 . 982 . 2 1 12 GLU N N 6.156 -2.571 -1.215 . . . 1.0 . . . . . . . . . . . . B . 11 GLU N . . . . . . . . . c19602_2mgt 1 . 2 . 983 . 2 1 12 GLU O O 5.736 0.430 -0.037 . . . 1.0 . . . . . . . . . . . . B . 11 GLU O . . . . . . . . . c19602_2mgt 1 . 2 . 984 . 2 1 12 GLU OE1 O 1.388 -1.184 -0.103 . . . 1.0 . . . . . . . . . . . . B . 11 GLU OE1 . . . . . . . . . c19602_2mgt 1 . 2 . 985 . 2 1 12 GLU OE2 O 1.389 0.873 -0.881 . . . 1.0 . . . . . . . . . . . . B . 11 GLU OE2 . . . . . . . . . c19602_2mgt 1 . 2 . 986 . 2 1 13 VAL C C 7.875 2.417 -0.736 . . . 1.0 . . . . . . . . . . . . B . 12 VAL C . . . . . . . . . c19602_2mgt 1 . 2 . 987 . 2 1 13 VAL CA C 8.321 1.052 -1.275 . . . 1.0 . . . . . . . . . . . . B . 12 VAL CA . . . . . . . . . c19602_2mgt 1 . 2 . 988 . 2 1 13 VAL CB C 9.323 1.213 -2.440 . . . 1.0 . . . . . . . . . . . . B . 12 VAL CB . . . . . . . . . c19602_2mgt 1 . 2 . 989 . 2 1 13 VAL CG1 C 10.382 2.296 -2.191 . . . 1.0 . . . . . . . . . . . . B . 12 VAL CG1 . . . . . . . . . c19602_2mgt 1 . 2 . 990 . 2 1 13 VAL CG2 C 10.060 -0.116 -2.667 . . . 1.0 . . . . . . . . . . . . B . 12 VAL CG2 . . . . . . . . . c19602_2mgt 1 . 2 . 991 . 2 1 13 VAL H H 7.407 -0.315 -2.576 . . . 1.0 . . . . . . . . . . . . B . 12 VAL H . . . . . . . . . c19602_2mgt 1 . 2 . 992 . 2 1 13 VAL HA H 8.846 0.536 -0.475 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HA . . . . . . . . . c19602_2mgt 1 . 2 . 993 . 2 1 13 VAL HB H 8.779 1.475 -3.348 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HB . . . . . . . . . c19602_2mgt 1 . 2 . 994 . 2 1 13 VAL HG11 H 11.089 2.313 -3.013 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HG11 . . . . . . . . . c19602_2mgt 1 . 2 . 995 . 2 1 13 VAL HG12 H 9.916 3.279 -2.143 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HG12 . . . . . . . . . c19602_2mgt 1 . 2 . 996 . 2 1 13 VAL HG13 H 10.911 2.093 -1.259 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HG13 . . . . . . . . . c19602_2mgt 1 . 2 . 997 . 2 1 13 VAL HG21 H 10.705 -0.037 -3.535 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HG21 . . . . . . . . . c19602_2mgt 1 . 2 . 998 . 2 1 13 VAL HG22 H 10.662 -0.357 -1.792 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HG22 . . . . . . . . . c19602_2mgt 1 . 2 . 999 . 2 1 13 VAL HG23 H 9.344 -0.914 -2.849 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HG23 . . . . . . . . . c19602_2mgt 1 . 2 . 1000 . 2 1 13 VAL N N 7.230 0.181 -1.716 . . . 1.0 . . . . . . . . . . . . B . 12 VAL N . . . . . . . . . c19602_2mgt 1 . 2 . 1001 . 2 1 13 VAL O O 8.581 2.975 0.101 . . . 1.0 . . . . . . . . . . . . B . 12 VAL O . . . . . . . . . c19602_2mgt 1 . 2 . 1002 . 2 1 14 HIS C C 5.910 4.396 0.706 . . . 1.0 . . . . . . . . . . . . B . 13 HIS C . . . . . . . . . c19602_2mgt 1 . 2 . 1003 . 2 1 14 HIS CA C 6.286 4.285 -0.782 . . . 1.0 . . . . . . . . . . . . B . 13 HIS CA . . . . . . . . . c19602_2mgt 1 . 2 . 1004 . 2 1 14 HIS CB C 5.155 4.771 -1.706 . . . 1.0 . . . . . . . . . . . . B . 13 HIS CB . . . . . . . . . c19602_2mgt 1 . 2 . 1005 . 2 1 14 HIS CD2 C 6.846 5.154 -3.621 . . . 1.0 . . . . . . . . . . . . B . 13 HIS CD2 . . . . . . . . . c19602_2mgt 1 . 2 . 1006 . 2 1 14 HIS CE1 C 5.468 5.621 -5.256 . . . 1.0 . . . . . . . . . . . . B . 13 HIS CE1 . . . . . . . . . c19602_2mgt 1 . 2 . 1007 . 2 1 14 HIS CG C 5.571 5.066 -3.129 . . . 1.0 . . . . . . . . . . . . B . 13 HIS CG . . . . . . . . . c19602_2mgt 1 . 2 . 1008 . 2 1 14 HIS H H 6.174 2.449 -1.855 . . . 1.0 . . . . . . . . . . . . B . 13 HIS H . . . . . . . . . c19602_2mgt 1 . 2 . 1009 . 2 1 14 HIS HA H 7.139 4.938 -0.924 . . . 1.0 . . . . . . . . . . . . B . 13 HIS HA . . . . . . . . . c19602_2mgt 1 . 2 . 1010 . 2 1 14 HIS HB2 H 4.350 4.035 -1.713 . . . 1.0 . . . . . . . . . . . . B . 13 HIS HB2 . . . . . . . . . c19602_2mgt 1 . 2 . 1011 . 2 1 14 HIS HB3 H 4.757 5.700 -1.302 . . . 1.0 . . . . . . . . . . . . B . 13 HIS HB3 . . . . . . . . . c19602_2mgt 1 . 2 . 1012 . 2 1 14 HIS HD1 H 3.713 5.389 -4.129 . . . 1.0 . . . . . . . . . . . . B . 13 HIS HD1 . . . . . . . . . c19602_2mgt 1 . 2 . 1013 . 2 1 14 HIS HD2 H 7.759 5.007 -3.064 . . . 1.0 . . . . . . . . . . . . B . 13 HIS HD2 . . . . . . . . . c19602_2mgt 1 . 2 . 1014 . 2 1 14 HIS HE1 H 5.079 5.890 -6.227 . . . 1.0 . . . . . . . . . . . . B . 13 HIS HE1 . . . . . . . . . c19602_2mgt 1 . 2 . 1015 . 2 1 14 HIS N N 6.732 2.955 -1.181 . . . 1.0 . . . . . . . . . . . . B . 13 HIS N . . . . . . . . . c19602_2mgt 1 . 2 . 1016 . 2 1 14 HIS ND1 N 4.722 5.367 -4.170 . . . 1.0 . . . . . . . . . . . . B . 13 HIS ND1 . . . . . . . . . c19602_2mgt 1 . 2 . 1017 . 2 1 14 HIS NE2 N 6.769 5.498 -4.970 . . . 1.0 . . . . . . . . . . . . B . 13 HIS NE2 . . . . . . . . . c19602_2mgt 1 . 2 . 1018 . 2 1 14 HIS O O 5.781 5.513 1.204 . . . 1.0 . . . . . . . . . . . . B . 13 HIS O . . . . . . . . . c19602_2mgt 1 . 2 . 1019 . 2 1 15 HIS C C 6.970 3.400 3.637 . . . 1.0 . . . . . . . . . . . . B . 14 HIS C . . . . . . . . . c19602_2mgt 1 . 2 . 1020 . 2 1 15 HIS CA C 5.650 3.271 2.885 . . . 1.0 . . . . . . . . . . . . B . 14 HIS CA . . . . . . . . . c19602_2mgt 1 . 2 . 1021 . 2 1 15 HIS CB C 5.000 1.966 3.340 . . . 1.0 . . . . . . . . . . . . B . 14 HIS CB . . . . . . . . . c19602_2mgt 1 . 2 . 1022 . 2 1 15 HIS CD2 C 2.965 1.189 2.037 . . . 1.0 . . . . . . . . . . . . B . 14 HIS CD2 . . . . . . . . . c19602_2mgt 1 . 2 . 1023 . 2 1 15 HIS CE1 C 1.386 2.276 3.103 . . . 1.0 . . . . . . . . . . . . B . 14 HIS CE1 . . . . . . . . . c19602_2mgt 1 . 2 . 1024 . 2 1 15 HIS CG C 3.544 1.924 3.025 . . . 1.0 . . . . . . . . . . . . B . 14 HIS CG . . . . . . . . . c19602_2mgt 1 . 2 . 1025 . 2 1 15 HIS H H 5.906 2.379 0.968 . . . 1.0 . . . . . . . . . . . . B . 14 HIS H . . . . . . . . . c19602_2mgt 1 . 2 . 1026 . 2 1 15 HIS HA H 5.010 4.102 3.183 . . . 1.0 . . . . . . . . . . . . B . 14 HIS HA . . . . . . . . . c19602_2mgt 1 . 2 . 1027 . 2 1 15 HIS HB2 H 5.507 1.118 2.878 . . . 1.0 . . . . . . . . . . . . B . 14 HIS HB2 . . . . . . . . . c19602_2mgt 1 . 2 . 1028 . 2 1 15 HIS HB3 H 5.099 1.862 4.420 . . . 1.0 . . . . . . . . . . . . B . 14 HIS HB3 . . . . . . . . . c19602_2mgt 1 . 2 . 1029 . 2 1 15 HIS HD1 H 2.669 3.223 4.475 . . . 1.0 . . . . . . . . . . . . B . 14 HIS HD1 . . . . . . . . . c19602_2mgt 1 . 2 . 1030 . 2 1 15 HIS HD2 H 3.483 0.533 1.357 . . . 1.0 . . . . . . . . . . . . B . 14 HIS HD2 . . . . . . . . . c19602_2mgt 1 . 2 . 1031 . 2 1 15 HIS HE1 H 0.416 2.638 3.412 . . . 1.0 . . . . . . . . . . . . B . 14 HIS HE1 . . . . . . . . . c19602_2mgt 1 . 2 . 1032 . 2 1 15 HIS N N 5.796 3.272 1.431 . . . 1.0 . . . . . . . . . . . . B . 14 HIS N . . . . . . . . . c19602_2mgt 1 . 2 . 1033 . 2 1 15 HIS ND1 N 2.549 2.604 3.684 . . . 1.0 . . . . . . . . . . . . B . 14 HIS ND1 . . . . . . . . . c19602_2mgt 1 . 2 . 1034 . 2 1 15 HIS NE2 N 1.592 1.421 2.091 . . . 1.0 . . . . . . . . . . . . B . 14 HIS NE2 . . . . . . . . . c19602_2mgt 1 . 2 . 1035 . 2 1 15 HIS O O 6.935 3.728 4.820 . . . 1.0 . . . . . . . . . . . . B . 14 HIS O . . . . . . . . . c19602_2mgt 1 . 2 . 1036 . 2 1 16 GLN C C 10.016 3.963 4.358 . . . 1.0 . . . . . . . . . . . . B . 15 GLN C . . . . . . . . . c19602_2mgt 1 . 2 . 1037 . 2 1 16 GLN CA C 9.305 2.749 3.777 . . . 1.0 . . . . . . . . . . . . B . 15 GLN CA . . . . . . . . . c19602_2mgt 1 . 2 . 1038 . 2 1 16 GLN CB C 10.188 1.762 3.008 . . . 1.0 . . . . . . . . . . . . B . 15 GLN CB . . . . . . . . . c19602_2mgt 1 . 2 . 1039 . 2 1 16 GLN CD C 12.504 2.798 2.781 . . . 1.0 . . . . . . . . . . . . B . 15 GLN CD . . . . . . . . . c19602_2mgt 1 . 2 . 1040 . 2 1 16 GLN CG C 11.225 2.369 2.056 . . . 1.0 . . . . . . . . . . . . B . 15 GLN CG . . . . . . . . . c19602_2mgt 1 . 2 . 1041 . 2 1 16 GLN H H 8.103 2.845 2.040 . . . 1.0 . . . . . . . . . . . . B . 15 GLN H . . . . . . . . . c19602_2mgt 1 . 2 . 1042 . 2 1 16 GLN HA H 8.946 2.195 4.637 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HA . . . . . . . . . c19602_2mgt 1 . 2 . 1043 . 2 1 16 GLN HB2 H 10.703 1.142 3.733 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HB2 . . . . . . . . . c19602_2mgt 1 . 2 . 1044 . 2 1 16 GLN HB3 H 9.537 1.097 2.447 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HB3 . . . . . . . . . c19602_2mgt 1 . 2 . 1045 . 2 1 16 GLN HE21 H 12.649 4.536 1.746 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HE21 . . . . . . . . . c19602_2mgt 1 . 2 . 1046 . 2 1 16 GLN HE22 H 13.929 4.237 2.898 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HE22 . . . . . . . . . c19602_2mgt 1 . 2 . 1047 . 2 1 16 GLN HG2 H 11.492 1.614 1.316 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HG2 . . . . . . . . . c19602_2mgt 1 . 2 . 1048 . 2 1 16 GLN HG3 H 10.779 3.208 1.529 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HG3 . . . . . . . . . c19602_2mgt 1 . 2 . 1049 . 2 1 16 GLN N N 8.115 3.090 3.017 . . . 1.0 . . . . . . . . . . . . B . 15 GLN N . . . . . . . . . c19602_2mgt 1 . 2 . 1050 . 2 1 16 GLN NE2 N 13.058 3.961 2.467 . . . 1.0 . . . . . . . . . . . . B . 15 GLN NE2 . . . . . . . . . c19602_2mgt 1 . 2 . 1051 . 2 1 16 GLN O O 10.005 5.048 3.787 . . . 1.0 . . . . . . . . . . . . B . 15 GLN O . . . . . . . . . c19602_2mgt 1 . 2 . 1052 . 2 1 16 GLN OE1 O 13.009 2.081 3.632 . . . 1.0 . . . . . . . . . . . . B . 15 GLN OE1 . . . . . . . . . c19602_2mgt 1 . 2 . 1053 . 2 1 17 LYS C C 12.590 4.339 6.879 . . . 1.0 . . . . . . . . . . . . B . 16 LYS C . . . . . . . . . c19602_2mgt 1 . 2 . 1054 . 2 1 17 LYS CA C 11.170 4.730 6.438 . . . 1.0 . . . . . . . . . . . . B . 16 LYS CA . . . . . . . . . c19602_2mgt 1 . 2 . 1055 . 2 1 17 LYS CB C 10.231 4.871 7.653 . . . 1.0 . . . . . . . . . . . . B . 16 LYS CB . . . . . . . . . c19602_2mgt 1 . 2 . 1056 . 2 1 17 LYS CD C 7.943 5.715 8.440 . . . 1.0 . . . . . . . . . . . . B . 16 LYS CD . . . . . . . . . c19602_2mgt 1 . 2 . 1057 . 2 1 17 LYS CE C 7.247 4.378 8.707 . . . 1.0 . . . . . . . . . . . . B . 16 LYS CE . . . . . . . . . c19602_2mgt 1 . 2 . 1058 . 2 1 17 LYS CG C 8.969 5.671 7.297 . . . 1.0 . . . . . . . . . . . . B . 16 LYS CG . . . . . . . . . c19602_2mgt 1 . 2 . 1059 . 2 1 17 LYS H H 10.552 2.791 5.881 . . . 1.0 . . . . . . . . . . . . B . 16 LYS H . . . . . . . . . c19602_2mgt 1 . 2 . 1060 . 2 1 17 LYS HA H 11.238 5.694 5.934 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HA . . . . . . . . . c19602_2mgt 1 . 2 . 1061 . 2 1 17 LYS HB2 H 9.959 3.879 8.017 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HB2 . . . . . . . . . c19602_2mgt 1 . 2 . 1062 . 2 1 17 LYS HB3 H 10.749 5.398 8.457 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HB3 . . . . . . . . . c19602_2mgt 1 . 2 . 1063 . 2 1 17 LYS HD2 H 8.446 6.017 9.353 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HD2 . . . . . . . . . c19602_2mgt 1 . 2 . 1064 . 2 1 17 LYS HD3 H 7.185 6.464 8.206 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HD3 . . . . . . . . . c19602_2mgt 1 . 2 . 1065 . 2 1 17 LYS HE2 H 7.991 3.605 8.896 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HE2 . . . . . . . . . c19602_2mgt 1 . 2 . 1066 . 2 1 17 LYS HE3 H 6.619 4.482 9.589 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HE3 . . . . . . . . . c19602_2mgt 1 . 2 . 1067 . 2 1 17 LYS HG2 H 9.274 6.693 7.068 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HG2 . . . . . . . . . c19602_2mgt 1 . 2 . 1068 . 2 1 17 LYS HG3 H 8.496 5.256 6.408 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HG3 . . . . . . . . . c19602_2mgt 1 . 2 . 1069 . 2 1 17 LYS HZ1 H 5.766 4.728 7.340 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HZ1 . . . . . . . . . c19602_2mgt 1 . 2 . 1070 . 2 1 17 LYS HZ2 H 6.957 3.740 6.790 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HZ2 . . . . . . . . . c19602_2mgt 1 . 2 . 1071 . 2 1 17 LYS HZ3 H 5.841 3.164 7.851 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HZ3 . . . . . . . . . c19602_2mgt 1 . 2 . 1072 . 2 1 17 LYS N N 10.599 3.738 5.535 . . . 1.0 . . . . . . . . . . . . B . 16 LYS N . . . . . . . . . c19602_2mgt 1 . 2 . 1073 . 2 1 17 LYS NZ N 6.386 3.973 7.591 . . . 1.0 . . . . . . . . . . . . B . 16 LYS NZ . . . . . . . . . c19602_2mgt 1 . 2 . 1074 . 2 1 17 LYS O O 13.242 5.114 7.570 . . . 1.0 . . . . . . . . . . . . B . 16 LYS O . . . . . . . . . c19602_2mgt 1 . 2 . 1075 . 2 1 18 NH2 HN1 H 12.562 2.559 5.892 . . . 1.0 . . . . . . . . . . . . B . 17 NH2 HN1 . . . . . . . . . c19602_2mgt 1 . 2 . 1076 . 2 1 18 NH2 HN2 H 14.034 2.910 6.771 . . . 1.0 . . . . . . . . . . . . B . 17 NH2 HN2 . . . . . . . . . c19602_2mgt 1 . 2 . 1077 . 2 1 18 NH2 N N 13.100 3.167 6.491 . . . 1.0 . . . . . . . . . . . . B . 17 NH2 N . . . . . . . . . c19602_2mgt 1 . 2 . 1078 . 3 2 1 ZN ZN Zn 0.390 0.232 0.887 . . . 1.0 . . . . . . . . . . . . A . 101 ZN ZN . . . . . . . . . c19602_2mgt 1 . 3 . 1079 . 1 1 1 ACE C C -11.707 -3.598 -3.620 . . . 1.0 . . . . . . . . . . . . A . 0 ACE C . . . . . . . . . c19602_2mgt 1 . 3 . 1080 . 1 1 1 ACE CH3 C -10.521 -3.909 -2.722 . . . 1.0 . . . . . . . . . . . . A . 0 ACE CH3 . . . . . . . . . c19602_2mgt 1 . 3 . 1081 . 1 1 1 ACE H1 H -9.682 -3.268 -2.991 . . . 1.0 . . . . . . . . . . . . A . 0 ACE H1 . . . . . . . . . c19602_2mgt 1 . 3 . 1082 . 1 1 1 ACE H2 H -10.795 -3.730 -1.683 . . . 1.0 . . . . . . . . . . . . A . 0 ACE H2 . . . . . . . . . c19602_2mgt 1 . 3 . 1083 . 1 1 1 ACE H3 H -10.237 -4.953 -2.831 . . . 1.0 . . . . . . . . . . . . A . 0 ACE H3 . . . . . . . . . c19602_2mgt 1 . 3 . 1084 . 1 1 1 ACE O O -11.598 -2.779 -4.530 . . . 1.0 . . . . . . . . . . . . A . 0 ACE O . . . . . . . . . c19602_2mgt 1 . 3 . 1085 . 1 1 2 ASP C C -14.604 -2.541 -3.664 . . . 1.0 . . . . . . . . . . . . A . 1 ASP C . . . . . . . . . c19602_2mgt 1 . 3 . 1086 . 1 1 2 ASP CA C -14.144 -3.986 -3.934 . . . 1.0 . . . . . . . . . . . . A . 1 ASP CA . . . . . . . . . c19602_2mgt 1 . 3 . 1087 . 1 1 2 ASP CB C -15.140 -5.025 -3.397 . . . 1.0 . . . . . . . . . . . . A . 1 ASP CB . . . . . . . . . c19602_2mgt 1 . 3 . 1088 . 1 1 2 ASP CG C -16.270 -5.266 -4.386 . . . 1.0 . . . . . . . . . . . . A . 1 ASP CG . . . . . . . . . c19602_2mgt 1 . 3 . 1089 . 1 1 2 ASP H H -12.829 -4.910 -2.572 . . . 1.0 . . . . . . . . . . . . A . 1 ASP H . . . . . . . . . c19602_2mgt 1 . 3 . 1090 . 1 1 2 ASP HA H -14.047 -4.130 -5.010 . . . 1.0 . . . . . . . . . . . . A . 1 ASP HA . . . . . . . . . c19602_2mgt 1 . 3 . 1091 . 1 1 2 ASP HB2 H -14.632 -5.975 -3.229 . . . 1.0 . . . . . . . . . . . . A . 1 ASP HB2 . . . . . . . . . c19602_2mgt 1 . 3 . 1092 . 1 1 2 ASP HB3 H -15.547 -4.693 -2.439 . . . 1.0 . . . . . . . . . . . . A . 1 ASP HB3 . . . . . . . . . c19602_2mgt 1 . 3 . 1093 . 1 1 2 ASP N N -12.843 -4.239 -3.327 . . . 1.0 . . . . . . . . . . . . A . 1 ASP N . . . . . . . . . c19602_2mgt 1 . 3 . 1094 . 1 1 2 ASP O O -13.987 -1.833 -2.873 . . . 1.0 . . . . . . . . . . . . A . 1 ASP O . . . . . . . . . c19602_2mgt 1 . 3 . 1095 . 1 1 2 ASP OD1 O -17.265 -4.529 -4.326 . . . 1.0 . . . . . . . . . . . . A . 1 ASP OD1 . . . . . . . . . c19602_2mgt 1 . 3 . 1096 . 1 1 2 ASP OD2 O -16.124 -6.190 -5.216 . . . 1.0 . . . . . . . . . . . . A . 1 ASP OD2 . . . . . . . . . c19602_2mgt 1 . 3 . 1097 . 1 1 3 ALA C C -16.405 -0.133 -2.964 . . . 1.0 . . . . . . . . . . . . A . 2 ALA C . . . . . . . . . c19602_2mgt 1 . 3 . 1098 . 1 1 3 ALA CA C -16.110 -0.701 -4.355 . . . 1.0 . . . . . . . . . . . . A . 2 ALA CA . . . . . . . . . c19602_2mgt 1 . 3 . 1099 . 1 1 3 ALA CB C -17.350 -0.604 -5.242 . . . 1.0 . . . . . . . . . . . . A . 2 ALA CB . . . . . . . . . c19602_2mgt 1 . 3 . 1100 . 1 1 3 ALA H H -16.155 -2.729 -4.954 . . . 1.0 . . . . . . . . . . . . A . 2 ALA H . . . . . . . . . c19602_2mgt 1 . 3 . 1101 . 1 1 3 ALA HA H -15.314 -0.107 -4.794 . . . 1.0 . . . . . . . . . . . . A . 2 ALA HA . . . . . . . . . c19602_2mgt 1 . 3 . 1102 . 1 1 3 ALA HB1 H -17.710 0.424 -5.253 . . . 1.0 . . . . . . . . . . . . A . 2 ALA HB1 . . . . . . . . . c19602_2mgt 1 . 3 . 1103 . 1 1 3 ALA HB2 H -17.107 -0.907 -6.259 . . . 1.0 . . . . . . . . . . . . A . 2 ALA HB2 . . . . . . . . . c19602_2mgt 1 . 3 . 1104 . 1 1 3 ALA HB3 H -18.128 -1.258 -4.847 . . . 1.0 . . . . . . . . . . . . A . 2 ALA HB3 . . . . . . . . . c19602_2mgt 1 . 3 . 1105 . 1 1 3 ALA N N -15.673 -2.093 -4.333 . . . 1.0 . . . . . . . . . . . . A . 2 ALA N . . . . . . . . . c19602_2mgt 1 . 3 . 1106 . 1 1 3 ALA O O -16.040 1.006 -2.683 . . . 1.0 . . . . . . . . . . . . A . 2 ALA O . . . . . . . . . c19602_2mgt 1 . 3 . 1107 . 1 1 4 GLU C C -16.006 -0.408 0.163 . . . 1.0 . . . . . . . . . . . . A . 3 GLU C . . . . . . . . . c19602_2mgt 1 . 3 . 1108 . 1 1 4 GLU CA C -17.259 -0.660 -0.679 . . . 1.0 . . . . . . . . . . . . A . 3 GLU CA . . . . . . . . . c19602_2mgt 1 . 3 . 1109 . 1 1 4 GLU CB C -18.058 -1.827 -0.097 . . . 1.0 . . . . . . . . . . . . A . 3 GLU CB . . . . . . . . . c19602_2mgt 1 . 3 . 1110 . 1 1 4 GLU CD C -18.100 -4.308 0.298 . . . 1.0 . . . . . . . . . . . . A . 3 GLU CD . . . . . . . . . c19602_2mgt 1 . 3 . 1111 . 1 1 4 GLU CG C -17.241 -3.123 -0.097 . . . 1.0 . . . . . . . . . . . . A . 3 GLU CG . . . . . . . . . c19602_2mgt 1 . 3 . 1112 . 1 1 4 GLU H H -17.271 -1.865 -2.414 . . . 1.0 . . . . . . . . . . . . A . 3 GLU H . . . . . . . . . c19602_2mgt 1 . 3 . 1113 . 1 1 4 GLU HA H -17.864 0.238 -0.611 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HA . . . . . . . . . c19602_2mgt 1 . 3 . 1114 . 1 1 4 GLU HB2 H -18.344 -1.591 0.927 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HB2 . . . . . . . . . c19602_2mgt 1 . 3 . 1115 . 1 1 4 GLU HB3 H -18.960 -1.966 -0.690 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HB3 . . . . . . . . . c19602_2mgt 1 . 3 . 1116 . 1 1 4 GLU HG2 H -16.821 -3.301 -1.087 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HG2 . . . . . . . . . c19602_2mgt 1 . 3 . 1117 . 1 1 4 GLU HG3 H -16.426 -3.023 0.618 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HG3 . . . . . . . . . c19602_2mgt 1 . 3 . 1118 . 1 1 4 GLU N N -17.002 -0.947 -2.089 . . . 1.0 . . . . . . . . . . . . A . 3 GLU N . . . . . . . . . c19602_2mgt 1 . 3 . 1119 . 1 1 4 GLU O O -16.134 0.039 1.298 . . . 1.0 . . . . . . . . . . . . A . 3 GLU O . . . . . . . . . c19602_2mgt 1 . 3 . 1120 . 1 1 4 GLU OE1 O -18.708 -4.911 -0.614 . . . 1.0 . . . . . . . . . . . . A . 3 GLU OE1 . . . . . . . . . c19602_2mgt 1 . 3 . 1121 . 1 1 4 GLU OE2 O -18.154 -4.606 1.501 . . . 1.0 . . . . . . . . . . . . A . 3 GLU OE2 . . . . . . . . . c19602_2mgt 1 . 3 . 1122 . 1 1 5 PHE C C -12.823 0.763 -0.501 . . . 1.0 . . . . . . . . . . . . A . 4 PHE C . . . . . . . . . c19602_2mgt 1 . 3 . 1123 . 1 1 5 PHE CA C -13.528 -0.372 0.227 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CA . . . . . . . . . c19602_2mgt 1 . 3 . 1124 . 1 1 5 PHE CB C -12.657 -1.624 0.266 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CB . . . . . . . . . c19602_2mgt 1 . 3 . 1125 . 1 1 5 PHE CD1 C -13.550 -2.668 2.376 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CD1 . . . . . . . . . c19602_2mgt 1 . 3 . 1126 . 1 1 5 PHE CD2 C -13.826 -3.868 0.277 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CD2 . . . . . . . . . c19602_2mgt 1 . 3 . 1127 . 1 1 5 PHE CE1 C -14.216 -3.699 3.055 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CE1 . . . . . . . . . c19602_2mgt 1 . 3 . 1128 . 1 1 5 PHE CE2 C -14.486 -4.907 0.957 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CE2 . . . . . . . . . c19602_2mgt 1 . 3 . 1129 . 1 1 5 PHE CG C -13.335 -2.762 0.991 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CG . . . . . . . . . c19602_2mgt 1 . 3 . 1130 . 1 1 5 PHE CZ C -14.672 -4.825 2.349 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CZ . . . . . . . . . c19602_2mgt 1 . 3 . 1131 . 1 1 5 PHE H H -14.802 -1.143 -1.274 . . . 1.0 . . . . . . . . . . . . A . 4 PHE H . . . . . . . . . c19602_2mgt 1 . 3 . 1132 . 1 1 5 PHE HA H -13.683 -0.039 1.248 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HA . . . . . . . . . c19602_2mgt 1 . 3 . 1133 . 1 1 5 PHE HB2 H -12.400 -1.928 -0.749 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HB2 . . . . . . . . . c19602_2mgt 1 . 3 . 1134 . 1 1 5 PHE HB3 H -11.735 -1.383 0.793 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HB3 . . . . . . . . . c19602_2mgt 1 . 3 . 1135 . 1 1 5 PHE HD1 H -13.216 -1.791 2.910 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HD1 . . . . . . . . . c19602_2mgt 1 . 3 . 1136 . 1 1 5 PHE HD2 H -13.713 -3.904 -0.793 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HD2 . . . . . . . . . c19602_2mgt 1 . 3 . 1137 . 1 1 5 PHE HE1 H -14.366 -3.635 4.119 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HE1 . . . . . . . . . c19602_2mgt 1 . 3 . 1138 . 1 1 5 PHE HE2 H -14.855 -5.760 0.407 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HE2 . . . . . . . . . c19602_2mgt 1 . 3 . 1139 . 1 1 5 PHE HZ H -15.167 -5.619 2.883 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HZ . . . . . . . . . c19602_2mgt 1 . 3 . 1140 . 1 1 5 PHE N N -14.815 -0.691 -0.373 . . . 1.0 . . . . . . . . . . . . A . 4 PHE N . . . . . . . . . c19602_2mgt 1 . 3 . 1141 . 1 1 5 PHE O O -12.098 1.504 0.151 . . . 1.0 . . . . . . . . . . . . A . 4 PHE O . . . . . . . . . c19602_2mgt 1 . 3 . 1142 . 1 1 6 ARG C C -13.207 3.452 -2.131 . . . 1.0 . . . . . . . . . . . . A . 5 ARG C . . . . . . . . . c19602_2mgt 1 . 3 . 1143 . 1 1 6 ARG CA C -12.592 2.105 -2.574 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CA . . . . . . . . . c19602_2mgt 1 . 3 . 1144 . 1 1 6 ARG CB C -12.805 1.837 -4.073 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CB . . . . . . . . . c19602_2mgt 1 . 3 . 1145 . 1 1 6 ARG CD C -10.582 0.496 -4.292 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CD . . . . . . . . . c19602_2mgt 1 . 3 . 1146 . 1 1 6 ARG CG C -12.078 0.598 -4.627 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CG . . . . . . . . . c19602_2mgt 1 . 3 . 1147 . 1 1 6 ARG CZ C -9.421 2.108 -5.853 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CZ . . . . . . . . . c19602_2mgt 1 . 3 . 1148 . 1 1 6 ARG H H -13.706 0.326 -2.276 . . . 1.0 . . . . . . . . . . . . A . 5 ARG H . . . . . . . . . c19602_2mgt 1 . 3 . 1149 . 1 1 6 ARG HA H -11.523 2.183 -2.393 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HA . . . . . . . . . c19602_2mgt 1 . 3 . 1150 . 1 1 6 ARG HB2 H -13.874 1.723 -4.246 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HB2 . . . . . . . . . c19602_2mgt 1 . 3 . 1151 . 1 1 6 ARG HB3 H -12.463 2.701 -4.642 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HB3 . . . . . . . . . c19602_2mgt 1 . 3 . 1152 . 1 1 6 ARG HD2 H -10.468 0.319 -3.222 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HD2 . . . . . . . . . c19602_2mgt 1 . 3 . 1153 . 1 1 6 ARG HD3 H -10.150 -0.358 -4.812 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HD3 . . . . . . . . . c19602_2mgt 1 . 3 . 1154 . 1 1 6 ARG HE H -9.638 2.334 -3.870 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HE . . . . . . . . . c19602_2mgt 1 . 3 . 1155 . 1 1 6 ARG HG2 H -12.568 -0.293 -4.248 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HG2 . . . . . . . . . c19602_2mgt 1 . 3 . 1156 . 1 1 6 ARG HG3 H -12.193 0.593 -5.708 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HG3 . . . . . . . . . c19602_2mgt 1 . 3 . 1157 . 1 1 6 ARG HH11 H -10.130 0.497 -6.874 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH11 . . . . . . . . . c19602_2mgt 1 . 3 . 1158 . 1 1 6 ARG HH12 H -9.297 1.691 -7.842 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH12 . . . . . . . . . c19602_2mgt 1 . 3 . 1159 . 1 1 6 ARG HH21 H -8.603 3.838 -5.159 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH21 . . . . . . . . . c19602_2mgt 1 . 3 . 1160 . 1 1 6 ARG HH22 H -8.454 3.576 -6.881 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH22 . . . . . . . . . c19602_2mgt 1 . 3 . 1161 . 1 1 6 ARG N N -13.087 0.967 -1.801 . . . 1.0 . . . . . . . . . . . . A . 5 ARG N . . . . . . . . . c19602_2mgt 1 . 3 . 1162 . 1 1 6 ARG NE N -9.841 1.717 -4.641 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NE . . . . . . . . . c19602_2mgt 1 . 3 . 1163 . 1 1 6 ARG NH1 N -9.626 1.369 -6.942 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NH1 . . . . . . . . . c19602_2mgt 1 . 3 . 1164 . 1 1 6 ARG NH2 N -8.777 3.269 -5.975 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NH2 . . . . . . . . . c19602_2mgt 1 . 3 . 1165 . 1 1 6 ARG O O -13.134 4.436 -2.858 . . . 1.0 . . . . . . . . . . . . A . 5 ARG O . . . . . . . . . c19602_2mgt 1 . 3 . 1166 . 1 1 7 ARG C C -13.148 5.759 -0.166 . . . 1.0 . . . . . . . . . . . . A . 6 ARG C . . . . . . . . . c19602_2mgt 1 . 3 . 1167 . 1 1 7 ARG CA C -14.256 4.710 -0.254 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CA . . . . . . . . . c19602_2mgt 1 . 3 . 1168 . 1 1 7 ARG CB C -14.706 4.342 1.167 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CB . . . . . . . . . c19602_2mgt 1 . 3 . 1169 . 1 1 7 ARG CD C -17.083 3.560 0.549 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CD . . . . . . . . . c19602_2mgt 1 . 3 . 1170 . 1 1 7 ARG CG C -15.753 3.227 1.231 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CG . . . . . . . . . c19602_2mgt 1 . 3 . 1171 . 1 1 7 ARG CZ C -17.524 3.977 -1.889 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CZ . . . . . . . . . c19602_2mgt 1 . 3 . 1172 . 1 1 7 ARG H H -13.836 2.662 -0.387 . . . 1.0 . . . . . . . . . . . . A . 6 ARG H . . . . . . . . . c19602_2mgt 1 . 3 . 1173 . 1 1 7 ARG HA H -15.103 5.108 -0.803 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HA . . . . . . . . . c19602_2mgt 1 . 3 . 1174 . 1 1 7 ARG HB2 H -13.838 4.000 1.730 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HB2 . . . . . . . . . c19602_2mgt 1 . 3 . 1175 . 1 1 7 ARG HB3 H -15.101 5.232 1.659 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HB3 . . . . . . . . . c19602_2mgt 1 . 3 . 1176 . 1 1 7 ARG HD2 H -17.872 2.978 1.021 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HD2 . . . . . . . . . c19602_2mgt 1 . 3 . 1177 . 1 1 7 ARG HD3 H -17.298 4.616 0.697 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HD3 . . . . . . . . . c19602_2mgt 1 . 3 . 1178 . 1 1 7 ARG HE H -16.701 2.305 -1.115 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HE . . . . . . . . . c19602_2mgt 1 . 3 . 1179 . 1 1 7 ARG HG2 H -15.333 2.327 0.792 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HG2 . . . . . . . . . c19602_2mgt 1 . 3 . 1180 . 1 1 7 ARG HG3 H -15.950 3.019 2.278 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HG3 . . . . . . . . . c19602_2mgt 1 . 3 . 1181 . 1 1 7 ARG HH11 H -18.093 5.577 -0.771 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH11 . . . . . . . . . c19602_2mgt 1 . 3 . 1182 . 1 1 7 ARG HH12 H -18.361 5.733 -2.490 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH12 . . . . . . . . . c19602_2mgt 1 . 3 . 1183 . 1 1 7 ARG HH21 H -17.075 2.588 -3.302 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH21 . . . . . . . . . c19602_2mgt 1 . 3 . 1184 . 1 1 7 ARG HH22 H -17.799 4.061 -3.902 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH22 . . . . . . . . . c19602_2mgt 1 . 3 . 1185 . 1 1 7 ARG N N -13.792 3.512 -0.930 . . . 1.0 . . . . . . . . . . . . A . 6 ARG N . . . . . . . . . c19602_2mgt 1 . 3 . 1186 . 1 1 7 ARG NE N -17.072 3.216 -0.880 . . . 1.0 . . . . . . . . . . . . A . 6 ARG NE . . . . . . . . . c19602_2mgt 1 . 3 . 1187 . 1 1 7 ARG NH1 N -18.032 5.194 -1.703 . . . 1.0 . . . . . . . . . . . . A . 6 ARG NH1 . . . . . . . . . c19602_2mgt 1 . 3 . 1188 . 1 1 7 ARG NH2 N -17.464 3.504 -3.130 . . . 1.0 . . . . . . . . . . . . A . 6 ARG NH2 . . . . . . . . . c19602_2mgt 1 . 3 . 1189 . 1 1 7 ARG O O -11.999 5.430 0.116 . . . 1.0 . . . . . . . . . . . . A . 6 ARG O . . . . . . . . . c19602_2mgt 1 . 3 . 1190 . 1 1 8 ASP C C -12.427 8.308 1.474 . . . 1.0 . . . . . . . . . . . . A . 7 ASP C . . . . . . . . . c19602_2mgt 1 . 3 . 1191 . 1 1 8 ASP CA C -12.677 8.181 -0.035 . . . 1.0 . . . . . . . . . . . . A . 7 ASP CA . . . . . . . . . c19602_2mgt 1 . 3 . 1192 . 1 1 8 ASP CB C -13.376 9.447 -0.543 . . . 1.0 . . . . . . . . . . . . A . 7 ASP CB . . . . . . . . . c19602_2mgt 1 . 3 . 1193 . 1 1 8 ASP CG C -12.359 10.525 -0.888 . . . 1.0 . . . . . . . . . . . . A . 7 ASP CG . . . . . . . . . c19602_2mgt 1 . 3 . 1194 . 1 1 8 ASP H H -14.486 7.220 -0.556 . . . 1.0 . . . . . . . . . . . . A . 7 ASP H . . . . . . . . . c19602_2mgt 1 . 3 . 1195 . 1 1 8 ASP HA H -11.725 8.060 -0.555 . . . 1.0 . . . . . . . . . . . . A . 7 ASP HA . . . . . . . . . c19602_2mgt 1 . 3 . 1196 . 1 1 8 ASP HB2 H -13.964 9.220 -1.430 . . . 1.0 . . . . . . . . . . . . A . 7 ASP HB2 . . . . . . . . . c19602_2mgt 1 . 3 . 1197 . 1 1 8 ASP HB3 H -14.057 9.825 0.219 . . . 1.0 . . . . . . . . . . . . A . 7 ASP HB3 . . . . . . . . . c19602_2mgt 1 . 3 . 1198 . 1 1 8 ASP N N -13.519 7.030 -0.334 . . . 1.0 . . . . . . . . . . . . A . 7 ASP N . . . . . . . . . c19602_2mgt 1 . 3 . 1199 . 1 1 8 ASP O O -11.468 8.949 1.889 . . . 1.0 . . . . . . . . . . . . A . 7 ASP O . . . . . . . . . c19602_2mgt 1 . 3 . 1200 . 1 1 8 ASP OD1 O -11.836 11.164 0.038 . . . 1.0 . . . . . . . . . . . . A . 7 ASP OD1 . . . . . . . . . c19602_2mgt 1 . 3 . 1201 . 1 1 8 ASP OD2 O -12.088 10.677 -2.096 . . . 1.0 . . . . . . . . . . . . A . 7 ASP OD2 . . . . . . . . . c19602_2mgt 1 . 3 . 1202 . 1 1 9 SER C C -12.073 7.230 4.443 . . . 1.0 . . . . . . . . . . . . A . 8 SER C . . . . . . . . . c19602_2mgt 1 . 3 . 1203 . 1 1 9 SER CA C -13.319 7.782 3.738 . . . 1.0 . . . . . . . . . . . . A . 8 SER CA . . . . . . . . . c19602_2mgt 1 . 3 . 1204 . 1 1 9 SER CB C -14.564 7.042 4.239 . . . 1.0 . . . . . . . . . . . . A . 8 SER CB . . . . . . . . . c19602_2mgt 1 . 3 . 1205 . 1 1 9 SER H H -14.081 7.226 1.870 . . . 1.0 . . . . . . . . . . . . A . 8 SER H . . . . . . . . . c19602_2mgt 1 . 3 . 1206 . 1 1 9 SER HA H -13.417 8.834 4.002 . . . 1.0 . . . . . . . . . . . . A . 8 SER HA . . . . . . . . . c19602_2mgt 1 . 3 . 1207 . 1 1 9 SER HB2 H -14.475 5.980 4.011 . . . 1.0 . . . . . . . . . . . . A . 8 SER HB2 . . . . . . . . . c19602_2mgt 1 . 3 . 1208 . 1 1 9 SER HB3 H -14.646 7.168 5.318 . . . 1.0 . . . . . . . . . . . . A . 8 SER HB3 . . . . . . . . . c19602_2mgt 1 . 3 . 1209 . 1 1 9 SER HG H -16.404 7.665 4.300 . . . 1.0 . . . . . . . . . . . . A . 8 SER HG . . . . . . . . . c19602_2mgt 1 . 3 . 1210 . 1 1 9 SER N N -13.291 7.693 2.288 . . . 1.0 . . . . . . . . . . . . A . 8 SER N . . . . . . . . . c19602_2mgt 1 . 3 . 1211 . 1 1 9 SER O O -12.028 7.299 5.665 . . . 1.0 . . . . . . . . . . . . A . 8 SER O . . . . . . . . . c19602_2mgt 1 . 3 . 1212 . 1 1 9 SER OG O -15.726 7.554 3.625 . . . 1.0 . . . . . . . . . . . . A . 8 SER OG . . . . . . . . . c19602_2mgt 1 . 3 . 1213 . 1 1 10 GLY C C -8.712 7.058 3.469 . . . 1.0 . . . . . . . . . . . . A . 9 GLY C . . . . . . . . . c19602_2mgt 1 . 3 . 1214 . 1 1 10 GLY CA C -9.784 6.307 4.260 . . . 1.0 . . . . . . . . . . . . A . 9 GLY CA . . . . . . . . . c19602_2mgt 1 . 3 . 1215 . 1 1 10 GLY H H -11.117 6.726 2.714 . . . 1.0 . . . . . . . . . . . . A . 9 GLY H . . . . . . . . . c19602_2mgt 1 . 3 . 1216 . 1 1 10 GLY HA2 H -9.698 6.541 5.319 . . . 1.0 . . . . . . . . . . . . A . 9 GLY HA2 . . . . . . . . . c19602_2mgt 1 . 3 . 1217 . 1 1 10 GLY HA3 H -9.688 5.233 4.136 . . . 1.0 . . . . . . . . . . . . A . 9 GLY HA3 . . . . . . . . . c19602_2mgt 1 . 3 . 1218 . 1 1 10 GLY N N -11.072 6.701 3.723 . . . 1.0 . . . . . . . . . . . . A . 9 GLY N . . . . . . . . . c19602_2mgt 1 . 3 . 1219 . 1 1 10 GLY O O -8.745 8.282 3.442 . . . 1.0 . . . . . . . . . . . . A . 9 GLY O . . . . . . . . . c19602_2mgt 1 . 3 . 1220 . 1 1 11 TYR C C -6.318 4.601 1.953 . . . 1.0 . . . . . . . . . . . . A . 10 TYR C . . . . . . . . . c19602_2mgt 1 . 3 . 1221 . 1 1 11 TYR CA C -7.629 4.962 2.648 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CA . . . . . . . . . c19602_2mgt 1 . 3 . 1222 . 1 1 11 TYR CB C -8.791 4.417 1.803 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CB . . . . . . . . . c19602_2mgt 1 . 3 . 1223 . 1 1 11 TYR CD1 C -8.814 2.201 3.036 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CD1 . . . . . . . . . c19602_2mgt 1 . 3 . 1224 . 1 1 11 TYR CD2 C -10.921 3.262 2.462 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CD2 . . . . . . . . . c19602_2mgt 1 . 3 . 1225 . 1 1 11 TYR CE1 C -9.504 1.116 3.585 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CE1 . . . . . . . . . c19602_2mgt 1 . 3 . 1226 . 1 1 11 TYR CE2 C -11.619 2.177 3.001 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CE2 . . . . . . . . . c19602_2mgt 1 . 3 . 1227 . 1 1 11 TYR CG C -9.520 3.263 2.444 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CG . . . . . . . . . c19602_2mgt 1 . 3 . 1228 . 1 1 11 TYR CZ C -10.913 1.080 3.542 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CZ . . . . . . . . . c19602_2mgt 1 . 3 . 1229 . 1 1 11 TYR H H -7.200 6.927 2.161 . . . 1.0 . . . . . . . . . . . . A . 10 TYR H . . . . . . . . . c19602_2mgt 1 . 3 . 1230 . 1 1 11 TYR HA H -7.638 4.518 3.641 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HA . . . . . . . . . c19602_2mgt 1 . 3 . 1231 . 1 1 11 TYR HB2 H -9.510 5.209 1.595 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HB2 . . . . . . . . . c19602_2mgt 1 . 3 . 1232 . 1 1 11 TYR HB3 H -8.418 4.106 0.829 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HB3 . . . . . . . . . c19602_2mgt 1 . 3 . 1233 . 1 1 11 TYR HD1 H -7.741 2.203 3.070 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HD1 . . . . . . . . . c19602_2mgt 1 . 3 . 1234 . 1 1 11 TYR HD2 H -11.465 4.099 2.061 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HD2 . . . . . . . . . c19602_2mgt 1 . 3 . 1235 . 1 1 11 TYR HE1 H -8.950 0.325 4.053 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HE1 . . . . . . . . . c19602_2mgt 1 . 3 . 1236 . 1 1 11 TYR HE2 H -12.693 2.195 2.997 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HE2 . . . . . . . . . c19602_2mgt 1 . 3 . 1237 . 1 1 11 TYR HH H -12.537 0.113 3.995 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HH . . . . . . . . . c19602_2mgt 1 . 3 . 1238 . 1 1 11 TYR N N -7.768 6.396 2.793 . . . 1.0 . . . . . . . . . . . . A . 10 TYR N . . . . . . . . . c19602_2mgt 1 . 3 . 1239 . 1 1 11 TYR O O -5.917 5.267 1.006 . . . 1.0 . . . . . . . . . . . . A . 10 TYR O . . . . . . . . . c19602_2mgt 1 . 3 . 1240 . 1 1 11 TYR OH O -11.585 0.014 4.060 . . . 1.0 . . . . . . . . . . . . A . 10 TYR OH . . . . . . . . . c19602_2mgt 1 . 3 . 1241 . 1 1 12 GLU C C -5.354 1.255 1.538 . . . 1.0 . . . . . . . . . . . . A . 11 GLU C . . . . . . . . . c19602_2mgt 1 . 3 . 1242 . 1 1 12 GLU CA C -4.859 2.705 1.475 . . . 1.0 . . . . . . . . . . . . A . 11 GLU CA . . . . . . . . . c19602_2mgt 1 . 3 . 1243 . 1 1 12 GLU CB C -3.394 2.890 1.876 . . . 1.0 . . . . . . . . . . . . A . 11 GLU CB . . . . . . . . . c19602_2mgt 1 . 3 . 1244 . 1 1 12 GLU CD C -1.266 1.703 1.151 . . . 1.0 . . . . . . . . . . . . A . 11 GLU CD . . . . . . . . . c19602_2mgt 1 . 3 . 1245 . 1 1 12 GLU CG C -2.493 2.478 0.703 . . . 1.0 . . . . . . . . . . . . A . 11 GLU CG . . . . . . . . . c19602_2mgt 1 . 3 . 1246 . 1 1 12 GLU H H -6.044 3.014 3.179 . . . 1.0 . . . . . . . . . . . . A . 11 GLU H . . . . . . . . . c19602_2mgt 1 . 3 . 1247 . 1 1 12 GLU HA H -4.973 3.076 0.458 . . . 1.0 . . . . . . . . . . . . A . 11 GLU HA . . . . . . . . . c19602_2mgt 1 . 3 . 1248 . 1 1 12 GLU HB2 H -3.214 3.941 2.101 . . . 1.0 . . . . . . . . . . . . A . 11 GLU HB2 . . . . . . . . . c19602_2mgt 1 . 3 . 1249 . 1 1 12 GLU HB3 H -3.182 2.311 2.774 . . . 1.0 . . . . . . . . . . . . A . 11 GLU HB3 . . . . . . . . . c19602_2mgt 1 . 3 . 1250 . 1 1 12 GLU HG2 H -3.050 1.850 0.015 . . . 1.0 . . . . . . . . . . . . A . 11 GLU HG2 . . . . . . . . . c19602_2mgt 1 . 3 . 1251 . 1 1 12 GLU HG3 H -2.192 3.372 0.159 . . . 1.0 . . . . . . . . . . . . A . 11 GLU HG3 . . . . . . . . . c19602_2mgt 1 . 3 . 1252 . 1 1 12 GLU N N -5.718 3.478 2.345 . . . 1.0 . . . . . . . . . . . . A . 11 GLU N . . . . . . . . . c19602_2mgt 1 . 3 . 1253 . 1 1 12 GLU O O -4.847 0.446 2.312 . . . 1.0 . . . . . . . . . . . . A . 11 GLU O . . . . . . . . . c19602_2mgt 1 . 3 . 1254 . 1 1 12 GLU OE1 O -0.386 2.314 1.785 . . . 1.0 . . . . . . . . . . . . A . 11 GLU OE1 . . . . . . . . . c19602_2mgt 1 . 3 . 1255 . 1 1 12 GLU OE2 O -1.223 0.487 0.879 . . . 1.0 . . . . . . . . . . . . A . 11 GLU OE2 . . . . . . . . . c19602_2mgt 1 . 3 . 1256 . 1 1 13 VAL C C -6.510 -1.522 0.742 . . . 1.0 . . . . . . . . . . . . A . 12 VAL C . . . . . . . . . c19602_2mgt 1 . 3 . 1257 . 1 1 13 VAL CA C -7.267 -0.204 0.749 . . . 1.0 . . . . . . . . . . . . A . 12 VAL CA . . . . . . . . . c19602_2mgt 1 . 3 . 1258 . 1 1 13 VAL CB C -8.237 -0.129 -0.452 . . . 1.0 . . . . . . . . . . . . A . 12 VAL CB . . . . . . . . . c19602_2mgt 1 . 3 . 1259 . 1 1 13 VAL CG1 C -9.074 -1.402 -0.657 . . . 1.0 . . . . . . . . . . . . A . 12 VAL CG1 . . . . . . . . . c19602_2mgt 1 . 3 . 1260 . 1 1 13 VAL CG2 C -9.230 1.000 -0.210 . . . 1.0 . . . . . . . . . . . . A . 12 VAL CG2 . . . . . . . . . c19602_2mgt 1 . 3 . 1261 . 1 1 13 VAL H H -6.694 1.708 0.114 . . . 1.0 . . . . . . . . . . . . A . 12 VAL H . . . . . . . . . c19602_2mgt 1 . 3 . 1262 . 1 1 13 VAL HA H -7.861 -0.177 1.655 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HA . . . . . . . . . c19602_2mgt 1 . 3 . 1263 . 1 1 13 VAL HB H -7.678 0.073 -1.367 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HB . . . . . . . . . c19602_2mgt 1 . 3 . 1264 . 1 1 13 VAL HG11 H -8.439 -2.221 -0.977 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HG11 . . . . . . . . . c19602_2mgt 1 . 3 . 1265 . 1 1 13 VAL HG12 H -9.558 -1.677 0.278 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HG12 . . . . . . . . . c19602_2mgt 1 . 3 . 1266 . 1 1 13 VAL HG13 H -9.831 -1.240 -1.425 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HG13 . . . . . . . . . c19602_2mgt 1 . 3 . 1267 . 1 1 13 VAL HG21 H -9.887 1.087 -1.071 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HG21 . . . . . . . . . c19602_2mgt 1 . 3 . 1268 . 1 1 13 VAL HG22 H -9.801 0.773 0.688 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HG22 . . . . . . . . . c19602_2mgt 1 . 3 . 1269 . 1 1 13 VAL HG23 H -8.713 1.944 -0.071 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HG23 . . . . . . . . . c19602_2mgt 1 . 3 . 1270 . 1 1 13 VAL N N -6.396 0.976 0.739 . . . 1.0 . . . . . . . . . . . . A . 12 VAL N . . . . . . . . . c19602_2mgt 1 . 3 . 1271 . 1 1 13 VAL O O -7.018 -2.509 1.262 . . . 1.0 . . . . . . . . . . . . A . 12 VAL O . . . . . . . . . c19602_2mgt 1 . 3 . 1272 . 1 1 14 HIS C C -4.209 -3.304 1.580 . . . 1.0 . . . . . . . . . . . . A . 13 HIS C . . . . . . . . . c19602_2mgt 1 . 3 . 1273 . 1 1 14 HIS CA C -4.442 -2.699 0.182 . . . 1.0 . . . . . . . . . . . . A . 13 HIS CA . . . . . . . . . c19602_2mgt 1 . 3 . 1274 . 1 1 14 HIS CB C -3.130 -2.277 -0.481 . . . 1.0 . . . . . . . . . . . . A . 13 HIS CB . . . . . . . . . c19602_2mgt 1 . 3 . 1275 . 1 1 14 HIS CD2 C -1.739 -4.427 -0.644 . . . 1.0 . . . . . . . . . . . . A . 13 HIS CD2 . . . . . . . . . c19602_2mgt 1 . 3 . 1276 . 1 1 14 HIS CE1 C -0.119 -3.925 0.745 . . . 1.0 . . . . . . . . . . . . A . 13 HIS CE1 . . . . . . . . . c19602_2mgt 1 . 3 . 1277 . 1 1 14 HIS CG C -1.966 -3.169 -0.166 . . . 1.0 . . . . . . . . . . . . A . 13 HIS CG . . . . . . . . . c19602_2mgt 1 . 3 . 1278 . 1 1 14 HIS H H -4.933 -0.686 -0.208 . . . 1.0 . . . . . . . . . . . . A . 13 HIS H . . . . . . . . . c19602_2mgt 1 . 3 . 1279 . 1 1 14 HIS HA H -4.945 -3.443 -0.433 . . . 1.0 . . . . . . . . . . . . A . 13 HIS HA . . . . . . . . . c19602_2mgt 1 . 3 . 1280 . 1 1 14 HIS HB2 H -3.275 -2.233 -1.560 . . . 1.0 . . . . . . . . . . . . A . 13 HIS HB2 . . . . . . . . . c19602_2mgt 1 . 3 . 1281 . 1 1 14 HIS HB3 H -2.872 -1.278 -0.132 . . . 1.0 . . . . . . . . . . . . A . 13 HIS HB3 . . . . . . . . . c19602_2mgt 1 . 3 . 1282 . 1 1 14 HIS HD1 H -0.821 -2.002 1.203 . . . 1.0 . . . . . . . . . . . . A . 13 HIS HD1 . . . . . . . . . c19602_2mgt 1 . 3 . 1283 . 1 1 14 HIS HD2 H -2.362 -4.969 -1.339 . . . 1.0 . . . . . . . . . . . . A . 13 HIS HD2 . . . . . . . . . c19602_2mgt 1 . 3 . 1284 . 1 1 14 HIS HE1 H 0.796 -3.970 1.317 . . . 1.0 . . . . . . . . . . . . A . 13 HIS HE1 . . . . . . . . . c19602_2mgt 1 . 3 . 1285 . 1 1 14 HIS N N -5.296 -1.536 0.199 . . . 1.0 . . . . . . . . . . . . A . 13 HIS N . . . . . . . . . c19602_2mgt 1 . 3 . 1286 . 1 1 14 HIS ND1 N -0.949 -2.874 0.709 . . . 1.0 . . . . . . . . . . . . A . 13 HIS ND1 . . . . . . . . . c19602_2mgt 1 . 3 . 1287 . 1 1 14 HIS NE2 N -0.561 -4.894 -0.066 . . . 1.0 . . . . . . . . . . . . A . 13 HIS NE2 . . . . . . . . . c19602_2mgt 1 . 3 . 1288 . 1 1 14 HIS O O -4.013 -4.508 1.669 . . . 1.0 . . . . . . . . . . . . A . 13 HIS O . . . . . . . . . c19602_2mgt 1 . 3 . 1289 . 1 1 15 HIS C C -5.279 -3.489 4.758 . . . 1.0 . . . . . . . . . . . . A . 14 HIS C . . . . . . . . . c19602_2mgt 1 . 3 . 1290 . 1 1 15 HIS CA C -4.015 -3.041 4.022 . . . 1.0 . . . . . . . . . . . . A . 14 HIS CA . . . . . . . . . c19602_2mgt 1 . 3 . 1291 . 1 1 15 HIS CB C -3.304 -1.969 4.839 . . . 1.0 . . . . . . . . . . . . A . 14 HIS CB . . . . . . . . . c19602_2mgt 1 . 3 . 1292 . 1 1 15 HIS CD2 C -1.543 -0.566 3.671 . . . 1.0 . . . . . . . . . . . . A . 14 HIS CD2 . . . . . . . . . c19602_2mgt 1 . 3 . 1293 . 1 1 15 HIS CE1 C 0.170 -1.932 3.755 . . . 1.0 . . . . . . . . . . . . A . 14 HIS CE1 . . . . . . . . . c19602_2mgt 1 . 3 . 1294 . 1 1 15 HIS CG C -1.929 -1.691 4.330 . . . 1.0 . . . . . . . . . . . . A . 14 HIS CG . . . . . . . . . c19602_2mgt 1 . 3 . 1295 . 1 1 15 HIS H H -4.429 -1.539 2.560 . . . 1.0 . . . . . . . . . . . . A . 14 HIS H . . . . . . . . . c19602_2mgt 1 . 3 . 1296 . 1 1 15 HIS HA H -3.355 -3.906 3.961 . . . 1.0 . . . . . . . . . . . . A . 14 HIS HA . . . . . . . . . c19602_2mgt 1 . 3 . 1297 . 1 1 15 HIS HB2 H -3.892 -1.056 4.800 . . . 1.0 . . . . . . . . . . . . A . 14 HIS HB2 . . . . . . . . . c19602_2mgt 1 . 3 . 1298 . 1 1 15 HIS HB3 H -3.213 -2.288 5.876 . . . 1.0 . . . . . . . . . . . . A . 14 HIS HB3 . . . . . . . . . c19602_2mgt 1 . 3 . 1299 . 1 1 15 HIS HD1 H -0.827 -3.456 4.799 . . . 1.0 . . . . . . . . . . . . A . 14 HIS HD1 . . . . . . . . . c19602_2mgt 1 . 3 . 1300 . 1 1 15 HIS HD2 H -2.177 0.279 3.453 . . . 1.0 . . . . . . . . . . . . A . 14 HIS HD2 . . . . . . . . . c19602_2mgt 1 . 3 . 1301 . 1 1 15 HIS HE1 H 1.152 -2.358 3.615 . . . 1.0 . . . . . . . . . . . . A . 14 HIS HE1 . . . . . . . . . c19602_2mgt 1 . 3 . 1302 . 1 1 15 HIS N N -4.249 -2.527 2.669 . . . 1.0 . . . . . . . . . . . . A . 14 HIS N . . . . . . . . . c19602_2mgt 1 . 3 . 1303 . 1 1 15 HIS ND1 N -0.848 -2.535 4.382 . . . 1.0 . . . . . . . . . . . . A . 14 HIS ND1 . . . . . . . . . c19602_2mgt 1 . 3 . 1304 . 1 1 15 HIS NE2 N -0.209 -0.729 3.304 . . . 1.0 . . . . . . . . . . . . A . 14 HIS NE2 . . . . . . . . . c19602_2mgt 1 . 3 . 1305 . 1 1 15 HIS O O -5.176 -3.884 5.917 . . . 1.0 . . . . . . . . . . . . A . 14 HIS O . . . . . . . . . c19602_2mgt 1 . 3 . 1306 . 1 1 16 GLN C C -8.564 -4.558 3.794 . . . 1.0 . . . . . . . . . . . . A . 15 GLN C . . . . . . . . . c19602_2mgt 1 . 3 . 1307 . 1 1 16 GLN CA C -7.740 -3.705 4.744 . . . 1.0 . . . . . . . . . . . . A . 15 GLN CA . . . . . . . . . c19602_2mgt 1 . 3 . 1308 . 1 1 16 GLN CB C -8.457 -2.391 5.073 . . . 1.0 . . . . . . . . . . . . A . 15 GLN CB . . . . . . . . . c19602_2mgt 1 . 3 . 1309 . 1 1 16 GLN CD C -8.105 -2.517 7.585 . . . 1.0 . . . . . . . . . . . . A . 15 GLN CD . . . . . . . . . c19602_2mgt 1 . 3 . 1310 . 1 1 16 GLN CG C -7.885 -1.698 6.315 . . . 1.0 . . . . . . . . . . . . A . 15 GLN CG . . . . . . . . . c19602_2mgt 1 . 3 . 1311 . 1 1 16 GLN H H -6.486 -3.091 3.177 . . . 1.0 . . . . . . . . . . . . A . 15 GLN H . . . . . . . . . c19602_2mgt 1 . 3 . 1312 . 1 1 16 GLN HA H -7.595 -4.280 5.653 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HA . . . . . . . . . c19602_2mgt 1 . 3 . 1313 . 1 1 16 GLN HB2 H -8.377 -1.726 4.214 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HB2 . . . . . . . . . c19602_2mgt 1 . 3 . 1314 . 1 1 16 GLN HB3 H -9.511 -2.594 5.244 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HB3 . . . . . . . . . c19602_2mgt 1 . 3 . 1315 . 1 1 16 GLN HE21 H -6.141 -3.031 7.678 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HE21 . . . . . . . . . c19602_2mgt 1 . 3 . 1316 . 1 1 16 GLN HE22 H -7.150 -3.644 8.973 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HE22 . . . . . . . . . c19602_2mgt 1 . 3 . 1317 . 1 1 16 GLN HG2 H -6.819 -1.528 6.179 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HG2 . . . . . . . . . c19602_2mgt 1 . 3 . 1318 . 1 1 16 GLN HG3 H -8.369 -0.728 6.429 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HG3 . . . . . . . . . c19602_2mgt 1 . 3 . 1319 . 1 1 16 GLN N N -6.457 -3.414 4.129 . . . 1.0 . . . . . . . . . . . . A . 15 GLN N . . . . . . . . . c19602_2mgt 1 . 3 . 1320 . 1 1 16 GLN NE2 N -7.044 -3.104 8.128 . . . 1.0 . . . . . . . . . . . . A . 15 GLN NE2 . . . . . . . . . c19602_2mgt 1 . 3 . 1321 . 1 1 16 GLN O O -8.795 -5.724 4.100 . . . 1.0 . . . . . . . . . . . . A . 15 GLN O . . . . . . . . . c19602_2mgt 1 . 3 . 1322 . 1 1 16 GLN OE1 O -9.225 -2.646 8.064 . . . 1.0 . . . . . . . . . . . . A . 15 GLN OE1 . . . . . . . . . c19602_2mgt 1 . 3 . 1323 . 1 1 17 LYS C C -10.993 -5.303 1.923 . . . 1.0 . . . . . . . . . . . . A . 16 LYS C . . . . . . . . . c19602_2mgt 1 . 3 . 1324 . 1 1 17 LYS CA C -9.683 -4.604 1.541 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CA . . . . . . . . . c19602_2mgt 1 . 3 . 1325 . 1 1 17 LYS CB C -8.724 -5.421 0.634 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CB . . . . . . . . . c19602_2mgt 1 . 3 . 1326 . 1 1 17 LYS CD C -8.802 -7.858 1.457 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CD . . . . . . . . . c19602_2mgt 1 . 3 . 1327 . 1 1 17 LYS CE C -8.120 -8.874 2.372 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CE . . . . . . . . . c19602_2mgt 1 . 3 . 1328 . 1 1 17 LYS CG C -7.943 -6.606 1.233 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CG . . . . . . . . . c19602_2mgt 1 . 3 . 1329 . 1 1 17 LYS H H -8.737 -3.008 2.522 . . . 1.0 . . . . . . . . . . . . A . 16 LYS H . . . . . . . . . c19602_2mgt 1 . 3 . 1330 . 1 1 17 LYS HA H -10.011 -3.771 0.920 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HA . . . . . . . . . c19602_2mgt 1 . 3 . 1331 . 1 1 17 LYS HB2 H -9.283 -5.783 -0.230 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HB2 . . . . . . . . . c19602_2mgt 1 . 3 . 1332 . 1 1 17 LYS HB3 H -7.984 -4.725 0.243 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HB3 . . . . . . . . . c19602_2mgt 1 . 3 . 1333 . 1 1 17 LYS HD2 H -9.763 -7.600 1.892 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HD2 . . . . . . . . . c19602_2mgt 1 . 3 . 1334 . 1 1 17 LYS HD3 H -8.981 -8.317 0.487 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HD3 . . . . . . . . . c19602_2mgt 1 . 3 . 1335 . 1 1 17 LYS HE2 H -8.517 -9.867 2.160 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HE2 . . . . . . . . . c19602_2mgt 1 . 3 . 1336 . 1 1 17 LYS HE3 H -7.044 -8.875 2.190 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HE3 . . . . . . . . . c19602_2mgt 1 . 3 . 1337 . 1 1 17 LYS HG2 H -7.155 -6.875 0.531 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HG2 . . . . . . . . . c19602_2mgt 1 . 3 . 1338 . 1 1 17 LYS HG3 H -7.435 -6.308 2.146 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HG3 . . . . . . . . . c19602_2mgt 1 . 3 . 1339 . 1 1 17 LYS HZ1 H -8.018 -7.652 4.009 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HZ1 . . . . . . . . . c19602_2mgt 1 . 3 . 1340 . 1 1 17 LYS HZ2 H -9.384 -8.562 3.951 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HZ2 . . . . . . . . . c19602_2mgt 1 . 3 . 1341 . 1 1 17 LYS HZ3 H -7.952 -9.253 4.381 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HZ3 . . . . . . . . . c19602_2mgt 1 . 3 . 1342 . 1 1 17 LYS N N -8.980 -3.979 2.658 . . . 1.0 . . . . . . . . . . . . A . 16 LYS N . . . . . . . . . c19602_2mgt 1 . 3 . 1343 . 1 1 17 LYS NZ N -8.388 -8.565 3.782 . . . 1.0 . . . . . . . . . . . . A . 16 LYS NZ . . . . . . . . . c19602_2mgt 1 . 3 . 1344 . 1 1 17 LYS O O -11.600 -5.926 1.069 . . . 1.0 . . . . . . . . . . . . A . 16 LYS O . . . . . . . . . c19602_2mgt 1 . 3 . 1345 . 1 1 18 NH2 HN1 H -10.981 -4.681 3.863 . . . 1.0 . . . . . . . . . . . . A . 17 NH2 HN1 . . . . . . . . . c19602_2mgt 1 . 3 . 1346 . 1 1 18 NH2 HN2 H -12.340 -5.678 3.398 . . . 1.0 . . . . . . . . . . . . A . 17 NH2 HN2 . . . . . . . . . c19602_2mgt 1 . 3 . 1347 . 1 1 18 NH2 N N -11.477 -5.212 3.161 . . . 1.0 . . . . . . . . . . . . A . 17 NH2 N . . . . . . . . . c19602_2mgt 1 . 3 . 1348 . 2 1 1 ACE C C 9.166 5.121 -6.147 . . . 1.0 . . . . . . . . . . . . B . 0 ACE C . . . . . . . . . c19602_2mgt 1 . 3 . 1349 . 2 1 1 ACE CH3 C 8.058 5.375 -5.135 . . . 1.0 . . . . . . . . . . . . B . 0 ACE CH3 . . . . . . . . . c19602_2mgt 1 . 3 . 1350 . 2 1 1 ACE H1 H 8.433 5.208 -4.126 . . . 1.0 . . . . . . . . . . . . B . 0 ACE H1 . . . . . . . . . c19602_2mgt 1 . 3 . 1351 . 2 1 1 ACE H2 H 7.737 6.412 -5.221 . . . 1.0 . . . . . . . . . . . . B . 0 ACE H2 . . . . . . . . . c19602_2mgt 1 . 3 . 1352 . 2 1 1 ACE H3 H 7.213 4.716 -5.329 . . . 1.0 . . . . . . . . . . . . B . 0 ACE H3 . . . . . . . . . c19602_2mgt 1 . 3 . 1353 . 2 1 1 ACE O O 8.969 4.383 -7.105 . . . 1.0 . . . . . . . . . . . . B . 0 ACE O . . . . . . . . . c19602_2mgt 1 . 3 . 1354 . 2 1 2 ASP C C 11.953 4.589 -7.404 . . . 1.0 . . . . . . . . . . . . B . 1 ASP C . . . . . . . . . c19602_2mgt 1 . 3 . 1355 . 2 1 2 ASP CA C 11.432 5.920 -6.848 . . . 1.0 . . . . . . . . . . . . B . 1 ASP CA . . . . . . . . . c19602_2mgt 1 . 3 . 1356 . 2 1 2 ASP CB C 12.547 6.669 -6.108 . . . 1.0 . . . . . . . . . . . . B . 1 ASP CB . . . . . . . . . c19602_2mgt 1 . 3 . 1357 . 2 1 2 ASP CG C 13.521 7.363 -7.050 . . . 1.0 . . . . . . . . . . . . B . 1 ASP CG . . . . . . . . . c19602_2mgt 1 . 3 . 1358 . 2 1 2 ASP H H 10.395 6.279 -5.060 . . . 1.0 . . . . . . . . . . . . B . 1 ASP H . . . . . . . . . c19602_2mgt 1 . 3 . 1359 . 2 1 2 ASP HA H 11.092 6.543 -7.677 . . . 1.0 . . . . . . . . . . . . B . 1 ASP HA . . . . . . . . . c19602_2mgt 1 . 3 . 1360 . 2 1 2 ASP HB2 H 12.111 7.430 -5.459 . . . 1.0 . . . . . . . . . . . . B . 1 ASP HB2 . . . . . . . . . c19602_2mgt 1 . 3 . 1361 . 2 1 2 ASP HB3 H 13.089 5.970 -5.478 . . . 1.0 . . . . . . . . . . . . B . 1 ASP HB3 . . . . . . . . . c19602_2mgt 1 . 3 . 1362 . 2 1 2 ASP N N 10.317 5.761 -5.922 . . . 1.0 . . . . . . . . . . . . B . 1 ASP N . . . . . . . . . c19602_2mgt 1 . 3 . 1363 . 2 1 2 ASP O O 11.843 3.557 -6.746 . . . 1.0 . . . . . . . . . . . . B . 1 ASP O . . . . . . . . . c19602_2mgt 1 . 3 . 1364 . 2 1 2 ASP OD1 O 14.368 6.661 -7.645 . . . 1.0 . . . . . . . . . . . . B . 1 ASP OD1 . . . . . . . . . c19602_2mgt 1 . 3 . 1365 . 2 1 2 ASP OD2 O 13.425 8.594 -7.165 . . . 1.0 . . . . . . . . . . . . B . 1 ASP OD2 . . . . . . . . . c19602_2mgt 1 . 3 . 1366 . 2 1 3 ALA C C 14.171 2.749 -8.416 . . . 1.0 . . . . . . . . . . . . B . 2 ALA C . . . . . . . . . c19602_2mgt 1 . 3 . 1367 . 2 1 3 ALA CA C 13.190 3.525 -9.291 . . . 1.0 . . . . . . . . . . . . B . 2 ALA CA . . . . . . . . . c19602_2mgt 1 . 3 . 1368 . 2 1 3 ALA CB C 13.949 4.069 -10.500 . . . 1.0 . . . . . . . . . . . . B . 2 ALA CB . . . . . . . . . c19602_2mgt 1 . 3 . 1369 . 2 1 3 ALA H H 12.631 5.545 -9.047 . . . 1.0 . . . . . . . . . . . . B . 2 ALA H . . . . . . . . . c19602_2mgt 1 . 3 . 1370 . 2 1 3 ALA HA H 12.412 2.846 -9.637 . . . 1.0 . . . . . . . . . . . . B . 2 ALA HA . . . . . . . . . c19602_2mgt 1 . 3 . 1371 . 2 1 3 ALA HB1 H 13.291 4.683 -11.106 . . . 1.0 . . . . . . . . . . . . B . 2 ALA HB1 . . . . . . . . . c19602_2mgt 1 . 3 . 1372 . 2 1 3 ALA HB2 H 14.785 4.680 -10.163 . . . 1.0 . . . . . . . . . . . . B . 2 ALA HB2 . . . . . . . . . c19602_2mgt 1 . 3 . 1373 . 2 1 3 ALA HB3 H 14.330 3.239 -11.096 . . . 1.0 . . . . . . . . . . . . B . 2 ALA HB3 . . . . . . . . . c19602_2mgt 1 . 3 . 1374 . 2 1 3 ALA N N 12.563 4.645 -8.595 . . . 1.0 . . . . . . . . . . . . B . 2 ALA N . . . . . . . . . c19602_2mgt 1 . 3 . 1375 . 2 1 3 ALA O O 14.146 1.525 -8.436 . . . 1.0 . . . . . . . . . . . . B . 2 ALA O . . . . . . . . . c19602_2mgt 1 . 3 . 1376 . 2 1 4 GLU C C 15.319 1.972 -5.633 . . . 1.0 . . . . . . . . . . . . B . 3 GLU C . . . . . . . . . c19602_2mgt 1 . 3 . 1377 . 2 1 4 GLU CA C 15.965 2.839 -6.718 . . . 1.0 . . . . . . . . . . . . B . 3 GLU CA . . . . . . . . . c19602_2mgt 1 . 3 . 1378 . 2 1 4 GLU CB C 16.805 3.934 -6.056 . . . 1.0 . . . . . . . . . . . . B . 3 GLU CB . . . . . . . . . c19602_2mgt 1 . 3 . 1379 . 2 1 4 GLU CD C 16.746 5.943 -4.530 . . . 1.0 . . . . . . . . . . . . B . 3 GLU CD . . . . . . . . . c19602_2mgt 1 . 3 . 1380 . 2 1 4 GLU CG C 15.944 4.850 -5.195 . . . 1.0 . . . . . . . . . . . . B . 3 GLU CG . . . . . . . . . c19602_2mgt 1 . 3 . 1381 . 2 1 4 GLU H H 14.952 4.457 -7.654 . . . 1.0 . . . . . . . . . . . . B . 3 GLU H . . . . . . . . . c19602_2mgt 1 . 3 . 1382 . 2 1 4 GLU HA H 16.631 2.206 -7.301 . . . 1.0 . . . . . . . . . . . . B . 3 GLU HA . . . . . . . . . c19602_2mgt 1 . 3 . 1383 . 2 1 4 GLU HB2 H 17.562 3.467 -5.422 . . . 1.0 . . . . . . . . . . . . B . 3 GLU HB2 . . . . . . . . . c19602_2mgt 1 . 3 . 1384 . 2 1 4 GLU HB3 H 17.309 4.519 -6.822 . . . 1.0 . . . . . . . . . . . . B . 3 GLU HB3 . . . . . . . . . c19602_2mgt 1 . 3 . 1385 . 2 1 4 GLU HG2 H 15.207 5.344 -5.828 . . . 1.0 . . . . . . . . . . . . B . 3 GLU HG2 . . . . . . . . . c19602_2mgt 1 . 3 . 1386 . 2 1 4 GLU HG3 H 15.409 4.287 -4.447 . . . 1.0 . . . . . . . . . . . . B . 3 GLU HG3 . . . . . . . . . c19602_2mgt 1 . 3 . 1387 . 2 1 4 GLU N N 15.000 3.447 -7.631 . . . 1.0 . . . . . . . . . . . . B . 3 GLU N . . . . . . . . . c19602_2mgt 1 . 3 . 1388 . 2 1 4 GLU O O 16.026 1.190 -5.011 . . . 1.0 . . . . . . . . . . . . B . 3 GLU O . . . . . . . . . c19602_2mgt 1 . 3 . 1389 . 2 1 4 GLU OE1 O 17.569 5.496 -3.589 . . . 1.0 . . . . . . . . . . . . B . 3 GLU OE1 . . . . . . . . . c19602_2mgt 1 . 3 . 1390 . 2 1 4 GLU OE2 O 16.630 7.055 -4.823 . . . 1.0 . . . . . . . . . . . . B . 3 GLU OE2 . . . . . . . . . c19602_2mgt 1 . 3 . 1391 . 2 1 5 PHE C C 12.312 0.326 -5.155 . . . 1.0 . . . . . . . . . . . . B . 4 PHE C . . . . . . . . . c19602_2mgt 1 . 3 . 1392 . 2 1 5 PHE CA C 13.227 1.324 -4.456 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CA . . . . . . . . . c19602_2mgt 1 . 3 . 1393 . 2 1 5 PHE CB C 12.381 2.256 -3.594 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CB . . . . . . . . . c19602_2mgt 1 . 3 . 1394 . 2 1 5 PHE CD1 C 14.356 3.118 -2.270 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CD1 . . . . . . . . . c19602_2mgt 1 . 3 . 1395 . 2 1 5 PHE CD2 C 12.692 4.698 -3.077 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CD2 . . . . . . . . . c19602_2mgt 1 . 3 . 1396 . 2 1 5 PHE CE1 C 15.083 4.173 -1.700 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CE1 . . . . . . . . . c19602_2mgt 1 . 3 . 1397 . 2 1 5 PHE CE2 C 13.430 5.756 -2.524 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CE2 . . . . . . . . . c19602_2mgt 1 . 3 . 1398 . 2 1 5 PHE CG C 13.158 3.382 -2.956 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CG . . . . . . . . . c19602_2mgt 1 . 3 . 1399 . 2 1 5 PHE CZ C 14.623 5.492 -1.832 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CZ . . . . . . . . . c19602_2mgt 1 . 3 . 1400 . 2 1 5 PHE H H 13.519 2.843 -5.898 . . . 1.0 . . . . . . . . . . . . B . 4 PHE H . . . . . . . . . c19602_2mgt 1 . 3 . 1401 . 2 1 5 PHE HA H 13.897 0.760 -3.810 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HA . . . . . . . . . c19602_2mgt 1 . 3 . 1402 . 2 1 5 PHE HB2 H 11.599 2.684 -4.222 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HB2 . . . . . . . . . c19602_2mgt 1 . 3 . 1403 . 2 1 5 PHE HB3 H 11.903 1.670 -2.810 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HB3 . . . . . . . . . c19602_2mgt 1 . 3 . 1404 . 2 1 5 PHE HD1 H 14.719 2.106 -2.193 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HD1 . . . . . . . . . c19602_2mgt 1 . 3 . 1405 . 2 1 5 PHE HD2 H 11.780 4.892 -3.619 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HD2 . . . . . . . . . c19602_2mgt 1 . 3 . 1406 . 2 1 5 PHE HE1 H 16.002 3.972 -1.177 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HE1 . . . . . . . . . c19602_2mgt 1 . 3 . 1407 . 2 1 5 PHE HE2 H 13.082 6.768 -2.639 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HE2 . . . . . . . . . c19602_2mgt 1 . 3 . 1408 . 2 1 5 PHE HZ H 15.194 6.300 -1.410 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HZ . . . . . . . . . c19602_2mgt 1 . 3 . 1409 . 2 1 5 PHE N N 14.011 2.119 -5.395 . . . 1.0 . . . . . . . . . . . . B . 4 PHE N . . . . . . . . . c19602_2mgt 1 . 3 . 1410 . 2 1 5 PHE O O 11.818 -0.576 -4.484 . . . 1.0 . . . . . . . . . . . . B . 4 PHE O . . . . . . . . . c19602_2mgt 1 . 3 . 1411 . 2 1 6 ARG C C 12.409 -1.729 -7.589 . . . 1.0 . . . . . . . . . . . . B . 5 ARG C . . . . . . . . . c19602_2mgt 1 . 3 . 1412 . 2 1 6 ARG CA C 11.468 -0.541 -7.325 . . . 1.0 . . . . . . . . . . . . B . 5 ARG CA . . . . . . . . . c19602_2mgt 1 . 3 . 1413 . 2 1 6 ARG CB C 10.956 0.119 -8.615 . . . 1.0 . . . . . . . . . . . . B . 5 ARG CB . . . . . . . . . c19602_2mgt 1 . 3 . 1414 . 2 1 6 ARG CD C 8.722 0.797 -7.495 . . . 1.0 . . . . . . . . . . . . B . 5 ARG CD . . . . . . . . . c19602_2mgt 1 . 3 . 1415 . 2 1 6 ARG CG C 9.871 1.197 -8.426 . . . 1.0 . . . . . . . . . . . . B . 5 ARG CG . . . . . . . . . c19602_2mgt 1 . 3 . 1416 . 2 1 6 ARG CZ C 7.017 -0.479 -8.800 . . . 1.0 . . . . . . . . . . . . B . 5 ARG CZ . . . . . . . . . c19602_2mgt 1 . 3 . 1417 . 2 1 6 ARG H H 12.552 1.231 -6.953 . . . 1.0 . . . . . . . . . . . . B . 5 ARG H . . . . . . . . . c19602_2mgt 1 . 3 . 1418 . 2 1 6 ARG HA H 10.610 -0.932 -6.787 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HA . . . . . . . . . c19602_2mgt 1 . 3 . 1419 . 2 1 6 ARG HB2 H 11.800 0.557 -9.146 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HB2 . . . . . . . . . c19602_2mgt 1 . 3 . 1420 . 2 1 6 ARG HB3 H 10.541 -0.664 -9.244 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HB3 . . . . . . . . . c19602_2mgt 1 . 3 . 1421 . 2 1 6 ARG HD2 H 9.126 0.629 -6.505 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HD2 . . . . . . . . . c19602_2mgt 1 . 3 . 1422 . 2 1 6 ARG HD3 H 8.009 1.615 -7.412 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HD3 . . . . . . . . . c19602_2mgt 1 . 3 . 1423 . 2 1 6 ARG HE H 8.451 -1.303 -7.647 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HE . . . . . . . . . c19602_2mgt 1 . 3 . 1424 . 2 1 6 ARG HG2 H 10.333 2.094 -8.028 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HG2 . . . . . . . . . c19602_2mgt 1 . 3 . 1425 . 2 1 6 ARG HG3 H 9.453 1.453 -9.400 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HG3 . . . . . . . . . c19602_2mgt 1 . 3 . 1426 . 2 1 6 ARG HH11 H 6.760 1.531 -8.980 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HH11 . . . . . . . . . c19602_2mgt 1 . 3 . 1427 . 2 1 6 ARG HH12 H 5.669 0.544 -9.927 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HH12 . . . . . . . . . c19602_2mgt 1 . 3 . 1428 . 2 1 6 ARG HH21 H 7.015 -2.510 -8.888 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HH21 . . . . . . . . . c19602_2mgt 1 . 3 . 1429 . 2 1 6 ARG HH22 H 5.819 -1.711 -9.883 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HH22 . . . . . . . . . c19602_2mgt 1 . 3 . 1430 . 2 1 6 ARG N N 12.125 0.447 -6.479 . . . 1.0 . . . . . . . . . . . . B . 5 ARG N . . . . . . . . . c19602_2mgt 1 . 3 . 1431 . 2 1 6 ARG NE N 8.047 -0.426 -7.947 . . . 1.0 . . . . . . . . . . . . B . 5 ARG NE . . . . . . . . . c19602_2mgt 1 . 3 . 1432 . 2 1 6 ARG NH1 N 6.430 0.623 -9.268 . . . 1.0 . . . . . . . . . . . . B . 5 ARG NH1 . . . . . . . . . c19602_2mgt 1 . 3 . 1433 . 2 1 6 ARG NH2 N 6.567 -1.663 -9.207 . . . 1.0 . . . . . . . . . . . . B . 5 ARG NH2 . . . . . . . . . c19602_2mgt 1 . 3 . 1434 . 2 1 6 ARG O O 12.651 -2.112 -8.731 . . . 1.0 . . . . . . . . . . . . B . 5 ARG O . . . . . . . . . c19602_2mgt 1 . 3 . 1435 . 2 1 7 ARG C C 13.201 -4.719 -6.335 . . . 1.0 . . . . . . . . . . . . B . 6 ARG C . . . . . . . . . c19602_2mgt 1 . 3 . 1436 . 2 1 7 ARG CA C 13.921 -3.369 -6.449 . . . 1.0 . . . . . . . . . . . . B . 6 ARG CA . . . . . . . . . c19602_2mgt 1 . 3 . 1437 . 2 1 7 ARG CB C 14.862 -3.113 -5.264 . . . 1.0 . . . . . . . . . . . . B . 6 ARG CB . . . . . . . . . c19602_2mgt 1 . 3 . 1438 . 2 1 7 ARG CD C 16.475 -1.498 -6.513 . . . 1.0 . . . . . . . . . . . . B . 6 ARG CD . . . . . . . . . c19602_2mgt 1 . 3 . 1439 . 2 1 7 ARG CG C 15.563 -1.749 -5.307 . . . 1.0 . . . . . . . . . . . . B . 6 ARG CG . . . . . . . . . c19602_2mgt 1 . 3 . 1440 . 2 1 7 ARG CZ C 15.759 -1.395 -8.921 . . . 1.0 . . . . . . . . . . . . B . 6 ARG CZ . . . . . . . . . c19602_2mgt 1 . 3 . 1441 . 2 1 7 ARG H H 12.742 -1.862 -5.613 . . . 1.0 . . . . . . . . . . . . B . 6 ARG H . . . . . . . . . c19602_2mgt 1 . 3 . 1442 . 2 1 7 ARG HA H 14.507 -3.363 -7.360 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HA . . . . . . . . . c19602_2mgt 1 . 3 . 1443 . 2 1 7 ARG HB2 H 14.280 -3.156 -4.344 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HB2 . . . . . . . . . c19602_2mgt 1 . 3 . 1444 . 2 1 7 ARG HB3 H 15.619 -3.890 -5.223 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HB3 . . . . . . . . . c19602_2mgt 1 . 3 . 1445 . 2 1 7 ARG HD2 H 17.230 -0.774 -6.213 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HD2 . . . . . . . . . c19602_2mgt 1 . 3 . 1446 . 2 1 7 ARG HD3 H 16.989 -2.414 -6.783 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HD3 . . . . . . . . . c19602_2mgt 1 . 3 . 1447 . 2 1 7 ARG HE H 15.328 -0.022 -7.505 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HE . . . . . . . . . c19602_2mgt 1 . 3 . 1448 . 2 1 7 ARG HG2 H 14.811 -0.969 -5.254 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HG2 . . . . . . . . . c19602_2mgt 1 . 3 . 1449 . 2 1 7 ARG HG3 H 16.178 -1.660 -4.416 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HG3 . . . . . . . . . c19602_2mgt 1 . 3 . 1450 . 2 1 7 ARG HH11 H 16.678 -3.172 -8.535 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HH11 . . . . . . . . . c19602_2mgt 1 . 3 . 1451 . 2 1 7 ARG HH12 H 16.233 -2.900 -10.206 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HH12 . . . . . . . . . c19602_2mgt 1 . 3 . 1452 . 2 1 7 ARG HH21 H 14.796 0.232 -9.668 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HH21 . . . . . . . . . c19602_2mgt 1 . 3 . 1453 . 2 1 7 ARG HH22 H 15.159 -1.021 -10.827 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HH22 . . . . . . . . . c19602_2mgt 1 . 3 . 1454 . 2 1 7 ARG N N 12.964 -2.279 -6.504 . . . 1.0 . . . . . . . . . . . . B . 6 ARG N . . . . . . . . . c19602_2mgt 1 . 3 . 1455 . 2 1 7 ARG NE N 15.773 -0.916 -7.666 . . . 1.0 . . . . . . . . . . . . B . 6 ARG NE . . . . . . . . . c19602_2mgt 1 . 3 . 1456 . 2 1 7 ARG NH1 N 16.277 -2.581 -9.249 . . . 1.0 . . . . . . . . . . . . B . 6 ARG NH1 . . . . . . . . . c19602_2mgt 1 . 3 . 1457 . 2 1 7 ARG NH2 N 15.205 -0.665 -9.884 . . . 1.0 . . . . . . . . . . . . B . 6 ARG NH2 . . . . . . . . . c19602_2mgt 1 . 3 . 1458 . 2 1 7 ARG O O 11.984 -4.764 -6.179 . . . 1.0 . . . . . . . . . . . . B . 6 ARG O . . . . . . . . . c19602_2mgt 1 . 3 . 1459 . 2 1 8 ASP C C 12.657 -7.693 -5.304 . . . 1.0 . . . . . . . . . . . . B . 7 ASP C . . . . . . . . . c19602_2mgt 1 . 3 . 1460 . 2 1 8 ASP CA C 13.346 -7.161 -6.571 . . . 1.0 . . . . . . . . . . . . B . 7 ASP CA . . . . . . . . . c19602_2mgt 1 . 3 . 1461 . 2 1 8 ASP CB C 14.408 -8.148 -7.081 . . . 1.0 . . . . . . . . . . . . B . 7 ASP CB . . . . . . . . . c19602_2mgt 1 . 3 . 1462 . 2 1 8 ASP CG C 15.554 -8.343 -6.100 . . . 1.0 . . . . . . . . . . . . B . 7 ASP CG . . . . . . . . . c19602_2mgt 1 . 3 . 1463 . 2 1 8 ASP H H 14.938 -5.750 -6.543 . . . 1.0 . . . . . . . . . . . . B . 7 ASP H . . . . . . . . . c19602_2mgt 1 . 3 . 1464 . 2 1 8 ASP HA H 12.585 -7.093 -7.349 . . . 1.0 . . . . . . . . . . . . B . 7 ASP HA . . . . . . . . . c19602_2mgt 1 . 3 . 1465 . 2 1 8 ASP HB2 H 13.936 -9.096 -7.303 . . . 1.0 . . . . . . . . . . . . B . 7 ASP HB2 . . . . . . . . . c19602_2mgt 1 . 3 . 1466 . 2 1 8 ASP HB3 H 14.833 -7.756 -8.004 . . . 1.0 . . . . . . . . . . . . B . 7 ASP HB3 . . . . . . . . . c19602_2mgt 1 . 3 . 1467 . 2 1 8 ASP N N 13.936 -5.831 -6.427 . . . 1.0 . . . . . . . . . . . . B . 7 ASP N . . . . . . . . . c19602_2mgt 1 . 3 . 1468 . 2 1 8 ASP O O 11.668 -8.407 -5.429 . . . 1.0 . . . . . . . . . . . . B . 7 ASP O . . . . . . . . . c19602_2mgt 1 . 3 . 1469 . 2 1 8 ASP OD1 O 16.338 -7.448 -5.950 . . . 1.0 . . . . . . . . . . . . B . 7 ASP OD1 . . . . . . . . . c19602_2mgt 1 . 3 . 1470 . 2 1 8 ASP OD2 O 15.606 -9.483 -5.496 . . . 1.0 . . . . . . . . . . . . B . 7 ASP OD2 . . . . . . . . . c19602_2mgt 1 . 3 . 1471 . 2 1 9 SER C C 11.979 -6.951 -1.923 . . . 1.0 . . . . . . . . . . . . B . 8 SER C . . . . . . . . . c19602_2mgt 1 . 3 . 1472 . 2 1 9 SER CA C 12.670 -7.957 -2.848 . . . 1.0 . . . . . . . . . . . . B . 8 SER CA . . . . . . . . . c19602_2mgt 1 . 3 . 1473 . 2 1 9 SER CB C 13.852 -8.607 -2.129 . . . 1.0 . . . . . . . . . . . . B . 8 SER CB . . . . . . . . . c19602_2mgt 1 . 3 . 1474 . 2 1 9 SER H H 13.978 -6.806 -4.063 . . . 1.0 . . . . . . . . . . . . B . 8 SER H . . . . . . . . . c19602_2mgt 1 . 3 . 1475 . 2 1 9 SER HA H 11.958 -8.743 -3.073 . . . 1.0 . . . . . . . . . . . . B . 8 SER HA . . . . . . . . . c19602_2mgt 1 . 3 . 1476 . 2 1 9 SER HB2 H 14.670 -7.892 -2.056 . . . 1.0 . . . . . . . . . . . . B . 8 SER HB2 . . . . . . . . . c19602_2mgt 1 . 3 . 1477 . 2 1 9 SER HB3 H 13.546 -8.911 -1.128 . . . 1.0 . . . . . . . . . . . . B . 8 SER HB3 . . . . . . . . . c19602_2mgt 1 . 3 . 1478 . 2 1 9 SER HG H 15.124 -10.038 -2.470 . . . 1.0 . . . . . . . . . . . . B . 8 SER HG . . . . . . . . . c19602_2mgt 1 . 3 . 1479 . 2 1 9 SER N N 13.142 -7.361 -4.101 . . . 1.0 . . . . . . . . . . . . B . 8 SER N . . . . . . . . . c19602_2mgt 1 . 3 . 1480 . 2 1 9 SER O O 12.543 -5.911 -1.607 . . . 1.0 . . . . . . . . . . . . B . 8 SER O . . . . . . . . . c19602_2mgt 1 . 3 . 1481 . 2 1 9 SER OG O 14.286 -9.746 -2.839 . . . 1.0 . . . . . . . . . . . . B . 8 SER OG . . . . . . . . . c19602_2mgt 1 . 3 . 1482 . 2 1 10 GLY C C 8.516 -7.027 -0.745 . . . 1.0 . . . . . . . . . . . . B . 9 GLY C . . . . . . . . . c19602_2mgt 1 . 3 . 1483 . 2 1 10 GLY CA C 9.955 -6.556 -0.508 . . . 1.0 . . . . . . . . . . . . B . 9 GLY CA . . . . . . . . . c19602_2mgt 1 . 3 . 1484 . 2 1 10 GLY H H 10.318 -8.118 -1.823 . . . 1.0 . . . . . . . . . . . . B . 9 GLY H . . . . . . . . . c19602_2mgt 1 . 3 . 1485 . 2 1 10 GLY HA2 H 10.251 -6.794 0.513 . . . 1.0 . . . . . . . . . . . . B . 9 GLY HA2 . . . . . . . . . c19602_2mgt 1 . 3 . 1486 . 2 1 10 GLY HA3 H 10.088 -5.487 -0.645 . . . 1.0 . . . . . . . . . . . . B . 9 GLY HA3 . . . . . . . . . c19602_2mgt 1 . 3 . 1487 . 2 1 10 GLY N N 10.778 -7.301 -1.444 . . . 1.0 . . . . . . . . . . . . B . 9 GLY N . . . . . . . . . c19602_2mgt 1 . 3 . 1488 . 2 1 10 GLY O O 8.285 -8.229 -0.791 . . . 1.0 . . . . . . . . . . . . B . 9 GLY O . . . . . . . . . c19602_2mgt 1 . 3 . 1489 . 2 1 11 TYR C C 6.113 -4.188 -1.103 . . . 1.0 . . . . . . . . . . . . B . 10 TYR C . . . . . . . . . c19602_2mgt 1 . 3 . 1490 . 2 1 11 TYR CA C 7.528 -4.731 -0.937 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CA . . . . . . . . . c19602_2mgt 1 . 3 . 1491 . 2 1 11 TYR CB C 8.356 -4.202 -2.117 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CB . . . . . . . . . c19602_2mgt 1 . 3 . 1492 . 2 1 11 TYR CD1 C 9.319 -2.276 -0.769 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CD1 . . . . . . . . . c19602_2mgt 1 . 3 . 1493 . 2 1 11 TYR CD2 C 10.722 -3.434 -2.386 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CD2 . . . . . . . . . c19602_2mgt 1 . 3 . 1494 . 2 1 11 TYR CE1 C 10.378 -1.413 -0.461 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CE1 . . . . . . . . . c19602_2mgt 1 . 3 . 1495 . 2 1 11 TYR CE2 C 11.769 -2.549 -2.119 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CE2 . . . . . . . . . c19602_2mgt 1 . 3 . 1496 . 2 1 11 TYR CG C 9.488 -3.281 -1.738 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CG . . . . . . . . . c19602_2mgt 1 . 3 . 1497 . 2 1 11 TYR CZ C 11.598 -1.526 -1.167 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CZ . . . . . . . . . c19602_2mgt 1 . 3 . 1498 . 2 1 11 TYR H H 6.657 -6.573 -1.276 . . . 1.0 . . . . . . . . . . . . B . 10 TYR H . . . . . . . . . c19602_2mgt 1 . 3 . 1499 . 2 1 11 TYR HA H 7.946 -4.394 0.012 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HA . . . . . . . . . c19602_2mgt 1 . 3 . 1500 . 2 1 11 TYR HB2 H 8.761 -5.038 -2.679 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HB2 . . . . . . . . . c19602_2mgt 1 . 3 . 1501 . 2 1 11 TYR HB3 H 7.706 -3.672 -2.810 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HB3 . . . . . . . . . c19602_2mgt 1 . 3 . 1502 . 2 1 11 TYR HD1 H 8.377 -2.154 -0.263 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HD1 . . . . . . . . . c19602_2mgt 1 . 3 . 1503 . 2 1 11 TYR HD2 H 10.861 -4.224 -3.106 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HD2 . . . . . . . . . c19602_2mgt 1 . 3 . 1504 . 2 1 11 TYR HE1 H 10.237 -0.665 0.301 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HE1 . . . . . . . . . c19602_2mgt 1 . 3 . 1505 . 2 1 11 TYR HE2 H 12.703 -2.654 -2.641 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HE2 . . . . . . . . . c19602_2mgt 1 . 3 . 1506 . 2 1 11 TYR HH H 12.430 -0.039 -0.239 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HH . . . . . . . . . c19602_2mgt 1 . 3 . 1507 . 2 1 11 TYR N N 7.511 -6.174 -0.939 . . . 1.0 . . . . . . . . . . . . B . 10 TYR N . . . . . . . . . c19602_2mgt 1 . 3 . 1508 . 2 1 11 TYR O O 5.333 -4.673 -1.923 . . . 1.0 . . . . . . . . . . . . B . 10 TYR O . . . . . . . . . c19602_2mgt 1 . 3 . 1509 . 2 1 11 TYR OH O 12.621 -0.662 -0.945 . . . 1.0 . . . . . . . . . . . . B . 10 TYR OH . . . . . . . . . c19602_2mgt 1 . 3 . 1510 . 2 1 12 GLU C C 5.943 -0.733 -0.839 . . . 1.0 . . . . . . . . . . . . B . 11 GLU C . . . . . . . . . c19602_2mgt 1 . 3 . 1511 . 2 1 12 GLU CA C 5.082 -1.989 -0.991 . . . 1.0 . . . . . . . . . . . . B . 11 GLU CA . . . . . . . . . c19602_2mgt 1 . 3 . 1512 . 2 1 12 GLU CB C 3.758 -1.894 -0.244 . . . 1.0 . . . . . . . . . . . . B . 11 GLU CB . . . . . . . . . c19602_2mgt 1 . 3 . 1513 . 2 1 12 GLU CD C 1.783 -0.373 0.103 . . . 1.0 . . . . . . . . . . . . B . 11 GLU CD . . . . . . . . . c19602_2mgt 1 . 3 . 1514 . 2 1 12 GLU CG C 2.807 -0.883 -0.903 . . . 1.0 . . . . . . . . . . . . B . 11 GLU CG . . . . . . . . . c19602_2mgt 1 . 3 . 1515 . 2 1 12 GLU H H 6.527 -2.779 0.274 . . . 1.0 . . . . . . . . . . . . B . 11 GLU H . . . . . . . . . c19602_2mgt 1 . 3 . 1516 . 2 1 12 GLU HA H 4.887 -2.190 -2.043 . . . 1.0 . . . . . . . . . . . . B . 11 GLU HA . . . . . . . . . c19602_2mgt 1 . 3 . 1517 . 2 1 12 GLU HB2 H 3.283 -2.874 -0.225 . . . 1.0 . . . . . . . . . . . . B . 11 GLU HB2 . . . . . . . . . c19602_2mgt 1 . 3 . 1518 . 2 1 12 GLU HB3 H 3.975 -1.600 0.778 . . . 1.0 . . . . . . . . . . . . B . 11 GLU HB3 . . . . . . . . . c19602_2mgt 1 . 3 . 1519 . 2 1 12 GLU HG2 H 3.379 -0.039 -1.285 . . . 1.0 . . . . . . . . . . . . B . 11 GLU HG2 . . . . . . . . . c19602_2mgt 1 . 3 . 1520 . 2 1 12 GLU HG3 H 2.291 -1.356 -1.738 . . . 1.0 . . . . . . . . . . . . B . 11 GLU HG3 . . . . . . . . . c19602_2mgt 1 . 3 . 1521 . 2 1 12 GLU N N 5.872 -3.061 -0.440 . . . 1.0 . . . . . . . . . . . . B . 11 GLU N . . . . . . . . . c19602_2mgt 1 . 3 . 1522 . 2 1 12 GLU O O 6.158 -0.238 0.268 . . . 1.0 . . . . . . . . . . . . B . 11 GLU O . . . . . . . . . c19602_2mgt 1 . 3 . 1523 . 2 1 12 GLU OE1 O 1.353 -1.138 0.958 . . . 1.0 . . . . . . . . . . . . B . 11 GLU OE1 . . . . . . . . . c19602_2mgt 1 . 3 . 1524 . 2 1 12 GLU OE2 O 1.476 0.851 0.036 . . . 1.0 . . . . . . . . . . . . B . 11 GLU OE2 . . . . . . . . . c19602_2mgt 1 . 3 . 1525 . 2 1 13 VAL C C 7.049 2.128 -1.547 . . . 1.0 . . . . . . . . . . . . B . 12 VAL C . . . . . . . . . c19602_2mgt 1 . 3 . 1526 . 2 1 13 VAL CA C 7.505 0.768 -2.068 . . . 1.0 . . . . . . . . . . . . B . 12 VAL CA . . . . . . . . . c19602_2mgt 1 . 3 . 1527 . 2 1 13 VAL CB C 7.999 0.822 -3.526 . . . 1.0 . . . . . . . . . . . . B . 12 VAL CB . . . . . . . . . c19602_2mgt 1 . 3 . 1528 . 2 1 13 VAL CG1 C 8.843 2.060 -3.844 . . . 1.0 . . . . . . . . . . . . B . 12 VAL CG1 . . . . . . . . . c19602_2mgt 1 . 3 . 1529 . 2 1 13 VAL CG2 C 8.835 -0.433 -3.764 . . . 1.0 . . . . . . . . . . . . B . 12 VAL CG2 . . . . . . . . . c19602_2mgt 1 . 3 . 1530 . 2 1 13 VAL H H 6.239 -0.728 -2.832 . . . 1.0 . . . . . . . . . . . . B . 12 VAL H . . . . . . . . . c19602_2mgt 1 . 3 . 1531 . 2 1 13 VAL HA H 8.344 0.459 -1.454 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HA . . . . . . . . . c19602_2mgt 1 . 3 . 1532 . 2 1 13 VAL HB H 7.147 0.815 -4.202 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HB . . . . . . . . . c19602_2mgt 1 . 3 . 1533 . 2 1 13 VAL HG11 H 9.617 2.179 -3.089 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HG11 . . . . . . . . . c19602_2mgt 1 . 3 . 1534 . 2 1 13 VAL HG12 H 9.302 1.975 -4.827 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HG12 . . . . . . . . . c19602_2mgt 1 . 3 . 1535 . 2 1 13 VAL HG13 H 8.201 2.936 -3.843 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HG13 . . . . . . . . . c19602_2mgt 1 . 3 . 1536 . 2 1 13 VAL HG21 H 9.682 -0.434 -3.082 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HG21 . . . . . . . . . c19602_2mgt 1 . 3 . 1537 . 2 1 13 VAL HG22 H 8.236 -1.326 -3.597 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HG22 . . . . . . . . . c19602_2mgt 1 . 3 . 1538 . 2 1 13 VAL HG23 H 9.192 -0.452 -4.785 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HG23 . . . . . . . . . c19602_2mgt 1 . 3 . 1539 . 2 1 13 VAL N N 6.470 -0.257 -1.970 . . . 1.0 . . . . . . . . . . . . B . 12 VAL N . . . . . . . . . c19602_2mgt 1 . 3 . 1540 . 2 1 13 VAL O O 7.891 2.957 -1.199 . . . 1.0 . . . . . . . . . . . . B . 12 VAL O . . . . . . . . . c19602_2mgt 1 . 3 . 1541 . 2 1 14 HIS C C 5.638 3.754 0.591 . . . 1.0 . . . . . . . . . . . . B . 13 HIS C . . . . . . . . . c19602_2mgt 1 . 3 . 1542 . 2 1 14 HIS CA C 5.212 3.577 -0.868 . . . 1.0 . . . . . . . . . . . . B . 13 HIS CA . . . . . . . . . c19602_2mgt 1 . 3 . 1543 . 2 1 14 HIS CB C 3.681 3.597 -0.950 . . . 1.0 . . . . . . . . . . . . B . 13 HIS CB . . . . . . . . . c19602_2mgt 1 . 3 . 1544 . 2 1 14 HIS CD2 C 3.593 3.302 -3.504 . . . 1.0 . . . . . . . . . . . . B . 13 HIS CD2 . . . . . . . . . c19602_2mgt 1 . 3 . 1545 . 2 1 14 HIS CE1 C 1.881 1.944 -3.652 . . . 1.0 . . . . . . . . . . . . B . 13 HIS CE1 . . . . . . . . . c19602_2mgt 1 . 3 . 1546 . 2 1 14 HIS CG C 3.109 3.090 -2.244 . . . 1.0 . . . . . . . . . . . . B . 13 HIS CG . . . . . . . . . c19602_2mgt 1 . 3 . 1547 . 2 1 14 HIS H H 5.079 1.639 -1.727 . . . 1.0 . . . . . . . . . . . . B . 13 HIS H . . . . . . . . . c19602_2mgt 1 . 3 . 1548 . 2 1 14 HIS HA H 5.628 4.387 -1.465 . . . 1.0 . . . . . . . . . . . . B . 13 HIS HA . . . . . . . . . c19602_2mgt 1 . 3 . 1549 . 2 1 14 HIS HB2 H 3.280 2.985 -0.140 . . . 1.0 . . . . . . . . . . . . B . 13 HIS HB2 . . . . . . . . . c19602_2mgt 1 . 3 . 1550 . 2 1 14 HIS HB3 H 3.338 4.617 -0.794 . . . 1.0 . . . . . . . . . . . . B . 13 HIS HB3 . . . . . . . . . c19602_2mgt 1 . 3 . 1551 . 2 1 14 HIS HD1 H 1.470 1.899 -1.597 . . . 1.0 . . . . . . . . . . . . B . 13 HIS HD1 . . . . . . . . . c19602_2mgt 1 . 3 . 1552 . 2 1 14 HIS HD2 H 4.449 3.907 -3.766 . . . 1.0 . . . . . . . . . . . . B . 13 HIS HD2 . . . . . . . . . c19602_2mgt 1 . 3 . 1553 . 2 1 14 HIS HE1 H 1.113 1.298 -4.041 . . . 1.0 . . . . . . . . . . . . B . 13 HIS HE1 . . . . . . . . . c19602_2mgt 1 . 3 . 1554 . 2 1 14 HIS N N 5.735 2.348 -1.430 . . . 1.0 . . . . . . . . . . . . B . 13 HIS N . . . . . . . . . c19602_2mgt 1 . 3 . 1555 . 2 1 14 HIS ND1 N 2.033 2.248 -2.360 . . . 1.0 . . . . . . . . . . . . B . 13 HIS ND1 . . . . . . . . . c19602_2mgt 1 . 3 . 1556 . 2 1 14 HIS NE2 N 2.817 2.550 -4.389 . . . 1.0 . . . . . . . . . . . . B . 13 HIS NE2 . . . . . . . . . c19602_2mgt 1 . 3 . 1557 . 2 1 14 HIS O O 5.678 4.879 1.066 . . . 1.0 . . . . . . . . . . . . B . 13 HIS O . . . . . . . . . c19602_2mgt 1 . 3 . 1558 . 2 1 15 HIS C C 7.888 2.806 2.868 . . . 1.0 . . . . . . . . . . . . B . 14 HIS C . . . . . . . . . c19602_2mgt 1 . 3 . 1559 . 2 1 15 HIS CA C 6.378 2.698 2.691 . . . 1.0 . . . . . . . . . . . . B . 14 HIS CA . . . . . . . . . c19602_2mgt 1 . 3 . 1560 . 2 1 15 HIS CB C 5.782 1.479 3.395 . . . 1.0 . . . . . . . . . . . . B . 14 HIS CB . . . . . . . . . c19602_2mgt 1 . 3 . 1561 . 2 1 15 HIS CD2 C 3.386 0.930 2.725 . . . 1.0 . . . . . . . . . . . . B . 14 HIS CD2 . . . . . . . . . c19602_2mgt 1 . 3 . 1562 . 2 1 15 HIS CE1 C 2.328 2.586 3.689 . . . 1.0 . . . . . . . . . . . . B . 14 HIS CE1 . . . . . . . . . c19602_2mgt 1 . 3 . 1563 . 2 1 15 HIS CG C 4.291 1.631 3.461 . . . 1.0 . . . . . . . . . . . . B . 14 HIS CG . . . . . . . . . c19602_2mgt 1 . 3 . 1564 . 2 1 15 HIS H H 5.922 1.759 0.849 . . . 1.0 . . . . . . . . . . . . B . 14 HIS H . . . . . . . . . c19602_2mgt 1 . 3 . 1565 . 2 1 15 HIS HA H 5.956 3.587 3.161 . . . 1.0 . . . . . . . . . . . . B . 14 HIS HA . . . . . . . . . c19602_2mgt 1 . 3 . 1566 . 2 1 15 HIS HB2 H 6.043 0.565 2.858 . . . 1.0 . . . . . . . . . . . . B . 14 HIS HB2 . . . . . . . . . c19602_2mgt 1 . 3 . 1567 . 2 1 15 HIS HB3 H 6.171 1.398 4.403 . . . 1.0 . . . . . . . . . . . . B . 14 HIS HB3 . . . . . . . . . c19602_2mgt 1 . 3 . 1568 . 2 1 15 HIS HD1 H 4.017 3.386 4.636 . . . 1.0 . . . . . . . . . . . . B . 14 HIS HD1 . . . . . . . . . c19602_2mgt 1 . 3 . 1569 . 2 1 15 HIS HD2 H 3.622 0.099 2.083 . . . 1.0 . . . . . . . . . . . . B . 14 HIS HD2 . . . . . . . . . c19602_2mgt 1 . 3 . 1570 . 2 1 15 HIS HE1 H 1.561 3.291 3.964 . . . 1.0 . . . . . . . . . . . . B . 14 HIS HE1 . . . . . . . . . c19602_2mgt 1 . 3 . 1571 . 2 1 15 HIS N N 5.965 2.665 1.297 . . . 1.0 . . . . . . . . . . . . B . 14 HIS N . . . . . . . . . c19602_2mgt 1 . 3 . 1572 . 2 1 15 HIS ND1 N 3.609 2.659 4.068 . . . 1.0 . . . . . . . . . . . . B . 14 HIS ND1 . . . . . . . . . c19602_2mgt 1 . 3 . 1573 . 2 1 15 HIS NE2 N 2.141 1.542 2.876 . . . 1.0 . . . . . . . . . . . . B . 14 HIS NE2 . . . . . . . . . c19602_2mgt 1 . 3 . 1574 . 2 1 15 HIS O O 8.309 3.166 3.963 . . . 1.0 . . . . . . . . . . . . B . 14 HIS O . . . . . . . . . c19602_2mgt 1 . 3 . 1575 . 2 1 16 GLN C C 10.503 4.204 2.275 . . . 1.0 . . . . . . . . . . . . B . 15 GLN C . . . . . . . . . c19602_2mgt 1 . 3 . 1576 . 2 1 16 GLN CA C 10.136 2.781 1.853 . . . 1.0 . . . . . . . . . . . . B . 15 GLN CA . . . . . . . . . c19602_2mgt 1 . 3 . 1577 . 2 1 16 GLN CB C 10.695 2.497 0.459 . . . 1.0 . . . . . . . . . . . . B . 15 GLN CB . . . . . . . . . c19602_2mgt 1 . 3 . 1578 . 2 1 16 GLN CD C 12.947 1.462 1.204 . . . 1.0 . . . . . . . . . . . . B . 15 GLN CD . . . . . . . . . c19602_2mgt 1 . 3 . 1579 . 2 1 16 GLN CG C 12.227 2.530 0.382 . . . 1.0 . . . . . . . . . . . . B . 15 GLN CG . . . . . . . . . c19602_2mgt 1 . 3 . 1580 . 2 1 16 GLN H H 8.308 2.314 0.929 . . . 1.0 . . . . . . . . . . . . B . 15 GLN H . . . . . . . . . c19602_2mgt 1 . 3 . 1581 . 2 1 16 GLN HA H 10.556 2.073 2.554 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HA . . . . . . . . . c19602_2mgt 1 . 3 . 1582 . 2 1 16 GLN HB2 H 10.333 1.534 0.115 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HB2 . . . . . . . . . c19602_2mgt 1 . 3 . 1583 . 2 1 16 GLN HB3 H 10.312 3.251 -0.219 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HB3 . . . . . . . . . c19602_2mgt 1 . 3 . 1584 . 2 1 16 GLN HE21 H 14.725 2.432 1.049 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HE21 . . . . . . . . . c19602_2mgt 1 . 3 . 1585 . 2 1 16 GLN HE22 H 14.764 0.928 1.943 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HE22 . . . . . . . . . c19602_2mgt 1 . 3 . 1586 . 2 1 16 GLN HG2 H 12.485 2.359 -0.652 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HG2 . . . . . . . . . c19602_2mgt 1 . 3 . 1587 . 2 1 16 GLN HG3 H 12.586 3.519 0.661 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HG3 . . . . . . . . . c19602_2mgt 1 . 3 . 1588 . 2 1 16 GLN N N 8.696 2.581 1.820 . . . 1.0 . . . . . . . . . . . . B . 15 GLN N . . . . . . . . . c19602_2mgt 1 . 3 . 1589 . 2 1 16 GLN NE2 N 14.251 1.617 1.412 . . . 1.0 . . . . . . . . . . . . B . 15 GLN NE2 . . . . . . . . . c19602_2mgt 1 . 3 . 1590 . 2 1 16 GLN O O 11.505 4.388 2.956 . . . 1.0 . . . . . . . . . . . . B . 15 GLN O . . . . . . . . . c19602_2mgt 1 . 3 . 1591 . 2 1 16 GLN OE1 O 12.352 0.480 1.627 . . . 1.0 . . . . . . . . . . . . B . 15 GLN OE1 . . . . . . . . . c19602_2mgt 1 . 3 . 1592 . 2 1 17 LYS C C 8.485 7.149 2.718 . . . 1.0 . . . . . . . . . . . . B . 16 LYS C . . . . . . . . . c19602_2mgt 1 . 3 . 1593 . 2 1 17 LYS CA C 9.824 6.600 2.190 . . . 1.0 . . . . . . . . . . . . B . 16 LYS CA . . . . . . . . . c19602_2mgt 1 . 3 . 1594 . 2 1 17 LYS CB C 10.291 7.350 0.927 . . . 1.0 . . . . . . . . . . . . B . 16 LYS CB . . . . . . . . . c19602_2mgt 1 . 3 . 1595 . 2 1 17 LYS CD C 12.863 6.958 1.153 . . . 1.0 . . . . . . . . . . . . B . 16 LYS CD . . . . . . . . . c19602_2mgt 1 . 3 . 1596 . 2 1 17 LYS CE C 13.258 8.419 1.364 . . . 1.0 . . . . . . . . . . . . B . 16 LYS CE . . . . . . . . . c19602_2mgt 1 . 3 . 1597 . 2 1 17 LYS CG C 11.597 6.830 0.292 . . . 1.0 . . . . . . . . . . . . B . 16 LYS CG . . . . . . . . . c19602_2mgt 1 . 3 . 1598 . 2 1 17 LYS H H 8.891 4.920 1.306 . . . 1.0 . . . . . . . . . . . . B . 16 LYS H . . . . . . . . . c19602_2mgt 1 . 3 . 1599 . 2 1 17 LYS HA H 10.571 6.736 2.970 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HA . . . . . . . . . c19602_2mgt 1 . 3 . 1600 . 2 1 17 LYS HB2 H 9.504 7.282 0.176 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HB2 . . . . . . . . . c19602_2mgt 1 . 3 . 1601 . 2 1 17 LYS HB3 H 10.418 8.401 1.171 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HB3 . . . . . . . . . c19602_2mgt 1 . 3 . 1602 . 2 1 17 LYS HD2 H 12.722 6.478 2.119 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HD2 . . . . . . . . . c19602_2mgt 1 . 3 . 1603 . 2 1 17 LYS HD3 H 13.676 6.448 0.637 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HD3 . . . . . . . . . c19602_2mgt 1 . 3 . 1604 . 2 1 17 LYS HE2 H 13.284 8.925 0.398 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HE2 . . . . . . . . . c19602_2mgt 1 . 3 . 1605 . 2 1 17 LYS HE3 H 12.518 8.903 1.998 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HE3 . . . . . . . . . c19602_2mgt 1 . 3 . 1606 . 2 1 17 LYS HG2 H 11.473 5.783 0.014 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HG2 . . . . . . . . . c19602_2mgt 1 . 3 . 1607 . 2 1 17 LYS HG3 H 11.763 7.382 -0.631 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HG3 . . . . . . . . . c19602_2mgt 1 . 3 . 1608 . 2 1 17 LYS HZ1 H 14.579 8.061 2.890 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HZ1 . . . . . . . . . c19602_2mgt 1 . 3 . 1609 . 2 1 17 LYS HZ2 H 15.279 8.095 1.400 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HZ2 . . . . . . . . . c19602_2mgt 1 . 3 . 1610 . 2 1 17 LYS HZ3 H 14.823 9.500 2.123 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HZ3 . . . . . . . . . c19602_2mgt 1 . 3 . 1611 . 2 1 17 LYS N N 9.682 5.183 1.877 . . . 1.0 . . . . . . . . . . . . B . 16 LYS N . . . . . . . . . c19602_2mgt 1 . 3 . 1612 . 2 1 17 LYS NZ N 14.583 8.527 1.993 . . . 1.0 . . . . . . . . . . . . B . 16 LYS NZ . . . . . . . . . c19602_2mgt 1 . 3 . 1613 . 2 1 17 LYS O O 7.447 6.496 2.645 . . . 1.0 . . . . . . . . . . . . B . 16 LYS O . . . . . . . . . c19602_2mgt 1 . 3 . 1614 . 2 1 18 NH2 HN1 H 9.351 8.880 3.338 . . . 1.0 . . . . . . . . . . . . B . 17 NH2 HN1 . . . . . . . . . c19602_2mgt 1 . 3 . 1615 . 2 1 18 NH2 HN2 H 7.631 8.755 3.623 . . . 1.0 . . . . . . . . . . . . B . 17 NH2 HN2 . . . . . . . . . c19602_2mgt 1 . 3 . 1616 . 2 1 18 NH2 N N 8.488 8.364 3.263 . . . 1.0 . . . . . . . . . . . . B . 17 NH2 N . . . . . . . . . c19602_2mgt 1 . 3 . 1617 . 3 2 1 ZN ZN Zn 0.619 0.551 1.907 . . . 1.0 . . . . . . . . . . . . A . 101 ZN ZN . . . . . . . . . c19602_2mgt 1 . 4 . 1618 . 1 1 1 ACE C C -14.199 -1.660 -5.912 . . . 1.0 . . . . . . . . . . . . A . 0 ACE C . . . . . . . . . c19602_2mgt 1 . 4 . 1619 . 1 1 1 ACE CH3 C -12.961 -2.313 -6.504 . . . 1.0 . . . . . . . . . . . . A . 0 ACE CH3 . . . . . . . . . c19602_2mgt 1 . 4 . 1620 . 1 1 1 ACE H1 H -13.094 -3.393 -6.527 . . . 1.0 . . . . . . . . . . . . A . 0 ACE H1 . . . . . . . . . c19602_2mgt 1 . 4 . 1621 . 1 1 1 ACE H2 H -12.802 -1.951 -7.522 . . . 1.0 . . . . . . . . . . . . A . 0 ACE H2 . . . . . . . . . c19602_2mgt 1 . 4 . 1622 . 1 1 1 ACE H3 H -12.092 -2.065 -5.896 . . . 1.0 . . . . . . . . . . . . A . 0 ACE H3 . . . . . . . . . c19602_2mgt 1 . 4 . 1623 . 1 1 1 ACE O O -14.808 -0.822 -6.565 . . . 1.0 . . . . . . . . . . . . A . 0 ACE O . . . . . . . . . c19602_2mgt 1 . 4 . 1624 . 1 1 2 ASP C C -15.544 0.064 -3.778 . . . 1.0 . . . . . . . . . . . . A . 1 ASP C . . . . . . . . . c19602_2mgt 1 . 4 . 1625 . 1 1 2 ASP CA C -15.715 -1.439 -3.979 . . . 1.0 . . . . . . . . . . . . A . 1 ASP CA . . . . . . . . . c19602_2mgt 1 . 4 . 1626 . 1 1 2 ASP CB C -15.900 -2.099 -2.619 . . . 1.0 . . . . . . . . . . . . A . 1 ASP CB . . . . . . . . . c19602_2mgt 1 . 4 . 1627 . 1 1 2 ASP CG C -16.383 -3.521 -2.778 . . . 1.0 . . . . . . . . . . . . A . 1 ASP CG . . . . . . . . . c19602_2mgt 1 . 4 . 1628 . 1 1 2 ASP H H -14.044 -2.733 -4.198 . . . 1.0 . . . . . . . . . . . . A . 1 ASP H . . . . . . . . . c19602_2mgt 1 . 4 . 1629 . 1 1 2 ASP HA H -16.615 -1.623 -4.567 . . . 1.0 . . . . . . . . . . . . A . 1 ASP HA . . . . . . . . . c19602_2mgt 1 . 4 . 1630 . 1 1 2 ASP HB2 H -14.963 -2.071 -2.067 . . . 1.0 . . . . . . . . . . . . A . 1 ASP HB2 . . . . . . . . . c19602_2mgt 1 . 4 . 1631 . 1 1 2 ASP HB3 H -16.651 -1.547 -2.057 . . . 1.0 . . . . . . . . . . . . A . 1 ASP HB3 . . . . . . . . . c19602_2mgt 1 . 4 . 1632 . 1 1 2 ASP N N -14.574 -2.022 -4.681 . . . 1.0 . . . . . . . . . . . . A . 1 ASP N . . . . . . . . . c19602_2mgt 1 . 4 . 1633 . 1 1 2 ASP O O -14.647 0.521 -3.071 . . . 1.0 . . . . . . . . . . . . A . 1 ASP O . . . . . . . . . c19602_2mgt 1 . 4 . 1634 . 1 1 2 ASP OD1 O -17.592 -3.699 -2.949 . . . 1.0 . . . . . . . . . . . . A . 1 ASP OD1 . . . . . . . . . c19602_2mgt 1 . 4 . 1635 . 1 1 2 ASP OD2 O -15.529 -4.430 -2.707 . . . 1.0 . . . . . . . . . . . . A . 1 ASP OD2 . . . . . . . . . c19602_2mgt 1 . 4 . 1636 . 1 1 3 ALA C C -16.686 2.774 -2.941 . . . 1.0 . . . . . . . . . . . . A . 2 ALA C . . . . . . . . . c19602_2mgt 1 . 4 . 1637 . 1 1 3 ALA CA C -16.466 2.264 -4.354 . . . 1.0 . . . . . . . . . . . . A . 2 ALA CA . . . . . . . . . c19602_2mgt 1 . 4 . 1638 . 1 1 3 ALA CB C -17.544 2.772 -5.308 . . . 1.0 . . . . . . . . . . . . A . 2 ALA CB . . . . . . . . . c19602_2mgt 1 . 4 . 1639 . 1 1 3 ALA H H -17.181 0.368 -4.926 . . . 1.0 . . . . . . . . . . . . A . 2 ALA H . . . . . . . . . c19602_2mgt 1 . 4 . 1640 . 1 1 3 ALA HA H -15.498 2.619 -4.693 . . . 1.0 . . . . . . . . . . . . A . 2 ALA HA . . . . . . . . . c19602_2mgt 1 . 4 . 1641 . 1 1 3 ALA HB1 H -17.309 2.455 -6.321 . . . 1.0 . . . . . . . . . . . . A . 2 ALA HB1 . . . . . . . . . c19602_2mgt 1 . 4 . 1642 . 1 1 3 ALA HB2 H -18.515 2.370 -5.019 . . . 1.0 . . . . . . . . . . . . A . 2 ALA HB2 . . . . . . . . . c19602_2mgt 1 . 4 . 1643 . 1 1 3 ALA HB3 H -17.579 3.860 -5.272 . . . 1.0 . . . . . . . . . . . . A . 2 ALA HB3 . . . . . . . . . c19602_2mgt 1 . 4 . 1644 . 1 1 3 ALA N N -16.457 0.820 -4.385 . . . 1.0 . . . . . . . . . . . . A . 2 ALA N . . . . . . . . . c19602_2mgt 1 . 4 . 1645 . 1 1 3 ALA O O -15.959 3.661 -2.520 . . . 1.0 . . . . . . . . . . . . A . 2 ALA O . . . . . . . . . c19602_2mgt 1 . 4 . 1646 . 1 1 4 GLU C C -16.765 2.585 0.116 . . . 1.0 . . . . . . . . . . . . A . 3 GLU C . . . . . . . . . c19602_2mgt 1 . 4 . 1647 . 1 1 4 GLU CA C -17.966 2.602 -0.839 . . . 1.0 . . . . . . . . . . . . A . 3 GLU CA . . . . . . . . . c19602_2mgt 1 . 4 . 1648 . 1 1 4 GLU CB C -19.124 1.739 -0.326 . . . 1.0 . . . . . . . . . . . . A . 3 GLU CB . . . . . . . . . c19602_2mgt 1 . 4 . 1649 . 1 1 4 GLU CD C -19.868 -0.583 0.252 . . . 1.0 . . . . . . . . . . . . A . 3 GLU CD . . . . . . . . . c19602_2mgt 1 . 4 . 1650 . 1 1 4 GLU CG C -18.694 0.288 -0.133 . . . 1.0 . . . . . . . . . . . . A . 3 GLU CG . . . . . . . . . c19602_2mgt 1 . 4 . 1651 . 1 1 4 GLU H H -18.136 1.408 -2.577 . . . 1.0 . . . . . . . . . . . . A . 3 GLU H . . . . . . . . . c19602_2mgt 1 . 4 . 1652 . 1 1 4 GLU HA H -18.326 3.626 -0.887 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HA . . . . . . . . . c19602_2mgt 1 . 4 . 1653 . 1 1 4 GLU HB2 H -19.480 2.136 0.624 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HB2 . . . . . . . . . c19602_2mgt 1 . 4 . 1654 . 1 1 4 GLU HB3 H -19.940 1.775 -1.044 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HB3 . . . . . . . . . c19602_2mgt 1 . 4 . 1655 . 1 1 4 GLU HG2 H -18.255 -0.088 -1.059 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HG2 . . . . . . . . . c19602_2mgt 1 . 4 . 1656 . 1 1 4 GLU HG3 H -17.960 0.243 0.662 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HG3 . . . . . . . . . c19602_2mgt 1 . 4 . 1657 . 1 1 4 GLU N N -17.621 2.185 -2.190 . . . 1.0 . . . . . . . . . . . . A . 3 GLU N . . . . . . . . . c19602_2mgt 1 . 4 . 1658 . 1 1 4 GLU O O -16.787 3.327 1.087 . . . 1.0 . . . . . . . . . . . . A . 3 GLU O . . . . . . . . . c19602_2mgt 1 . 4 . 1659 . 1 1 4 GLU OE1 O -20.265 -0.545 1.436 . . . 1.0 . . . . . . . . . . . . A . 3 GLU OE1 . . . . . . . . . c19602_2mgt 1 . 4 . 1660 . 1 1 4 GLU OE2 O -20.375 -1.282 -0.625 . . . 1.0 . . . . . . . . . . . . A . 3 GLU OE2 . . . . . . . . . c19602_2mgt 1 . 4 . 1661 . 1 1 5 PHE C C -13.354 2.621 0.038 . . . 1.0 . . . . . . . . . . . . A . 4 PHE C . . . . . . . . . c19602_2mgt 1 . 4 . 1662 . 1 1 5 PHE CA C -14.478 1.767 0.613 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CA . . . . . . . . . c19602_2mgt 1 . 4 . 1663 . 1 1 5 PHE CB C -13.981 0.327 0.732 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CB . . . . . . . . . c19602_2mgt 1 . 4 . 1664 . 1 1 5 PHE CD1 C -14.620 -0.357 3.063 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CD1 . . . . . . . . . c19602_2mgt 1 . 4 . 1665 . 1 1 5 PHE CD2 C -15.907 -1.225 1.193 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CD2 . . . . . . . . . c19602_2mgt 1 . 4 . 1666 . 1 1 5 PHE CE1 C -15.481 -1.010 3.960 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CE1 . . . . . . . . . c19602_2mgt 1 . 4 . 1667 . 1 1 5 PHE CE2 C -16.771 -1.878 2.086 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CE2 . . . . . . . . . c19602_2mgt 1 . 4 . 1668 . 1 1 5 PHE CG C -14.834 -0.469 1.681 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CG . . . . . . . . . c19602_2mgt 1 . 4 . 1669 . 1 1 5 PHE CZ C -16.549 -1.782 3.472 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CZ . . . . . . . . . c19602_2mgt 1 . 4 . 1670 . 1 1 5 PHE H H -15.784 1.176 -0.957 . . . 1.0 . . . . . . . . . . . . A . 4 PHE H . . . . . . . . . c19602_2mgt 1 . 4 . 1671 . 1 1 5 PHE HA H -14.678 2.145 1.616 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HA . . . . . . . . . c19602_2mgt 1 . 4 . 1672 . 1 1 5 PHE HB2 H -13.967 -0.143 -0.253 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HB2 . . . . . . . . . c19602_2mgt 1 . 4 . 1673 . 1 1 5 PHE HB3 H -12.960 0.327 1.117 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HB3 . . . . . . . . . c19602_2mgt 1 . 4 . 1674 . 1 1 5 PHE HD1 H -13.816 0.269 3.423 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HD1 . . . . . . . . . c19602_2mgt 1 . 4 . 1675 . 1 1 5 PHE HD2 H -16.095 -1.245 0.132 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HD2 . . . . . . . . . c19602_2mgt 1 . 4 . 1676 . 1 1 5 PHE HE1 H -15.331 -0.906 5.023 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HE1 . . . . . . . . . c19602_2mgt 1 . 4 . 1677 . 1 1 5 PHE HE2 H -17.611 -2.439 1.704 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HE2 . . . . . . . . . c19602_2mgt 1 . 4 . 1678 . 1 1 5 PHE HZ H -17.206 -2.288 4.162 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HZ . . . . . . . . . c19602_2mgt 1 . 4 . 1679 . 1 1 5 PHE N N -15.718 1.795 -0.163 . . . 1.0 . . . . . . . . . . . . A . 4 PHE N . . . . . . . . . c19602_2mgt 1 . 4 . 1680 . 1 1 5 PHE O O -12.422 2.916 0.779 . . . 1.0 . . . . . . . . . . . . A . 4 PHE O . . . . . . . . . c19602_2mgt 1 . 4 . 1681 . 1 1 6 ARG C C -12.236 5.236 -1.458 . . . 1.0 . . . . . . . . . . . . A . 5 ARG C . . . . . . . . . c19602_2mgt 1 . 4 . 1682 . 1 1 6 ARG CA C -12.336 3.762 -1.900 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CA . . . . . . . . . c19602_2mgt 1 . 4 . 1683 . 1 1 6 ARG CB C -12.501 3.608 -3.423 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CB . . . . . . . . . c19602_2mgt 1 . 4 . 1684 . 1 1 6 ARG CD C -10.521 1.932 -3.581 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CD . . . . . . . . . c19602_2mgt 1 . 4 . 1685 . 1 1 6 ARG CG C -11.184 3.217 -4.115 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CG . . . . . . . . . c19602_2mgt 1 . 4 . 1686 . 1 1 6 ARG CZ C -11.301 -0.413 -3.093 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CZ . . . . . . . . . c19602_2mgt 1 . 4 . 1687 . 1 1 6 ARG H H -14.191 2.758 -1.814 . . . 1.0 . . . . . . . . . . . . A . 5 ARG H . . . . . . . . . c19602_2mgt 1 . 4 . 1688 . 1 1 6 ARG HA H -11.412 3.278 -1.595 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HA . . . . . . . . . c19602_2mgt 1 . 4 . 1689 . 1 1 6 ARG HB2 H -13.249 2.847 -3.652 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HB2 . . . . . . . . . c19602_2mgt 1 . 4 . 1690 . 1 1 6 ARG HB3 H -12.866 4.541 -3.848 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HB3 . . . . . . . . . c19602_2mgt 1 . 4 . 1691 . 1 1 6 ARG HD2 H -9.837 1.555 -4.338 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HD2 . . . . . . . . . c19602_2mgt 1 . 4 . 1692 . 1 1 6 ARG HD3 H -9.943 2.170 -2.687 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HD3 . . . . . . . . . c19602_2mgt 1 . 4 . 1693 . 1 1 6 ARG HE H -12.433 1.251 -3.022 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HE . . . . . . . . . c19602_2mgt 1 . 4 . 1694 . 1 1 6 ARG HG2 H -11.382 3.091 -5.179 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HG2 . . . . . . . . . c19602_2mgt 1 . 4 . 1695 . 1 1 6 ARG HG3 H -10.486 4.041 -3.993 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HG3 . . . . . . . . . c19602_2mgt 1 . 4 . 1696 . 1 1 6 ARG HH11 H -9.325 -0.424 -3.578 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH11 . . . . . . . . . c19602_2mgt 1 . 4 . 1697 . 1 1 6 ARG HH12 H -10.011 -1.987 -3.200 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH12 . . . . . . . . . c19602_2mgt 1 . 4 . 1698 . 1 1 6 ARG HH21 H -13.237 -0.779 -2.601 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH21 . . . . . . . . . c19602_2mgt 1 . 4 . 1699 . 1 1 6 ARG HH22 H -12.201 -2.184 -2.652 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH22 . . . . . . . . . c19602_2mgt 1 . 4 . 1700 . 1 1 6 ARG N N -13.407 3.024 -1.238 . . . 1.0 . . . . . . . . . . . . A . 5 ARG N . . . . . . . . . c19602_2mgt 1 . 4 . 1701 . 1 1 6 ARG NE N -11.509 0.903 -3.232 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NE . . . . . . . . . c19602_2mgt 1 . 4 . 1702 . 1 1 6 ARG NH1 N -10.115 -0.989 -3.301 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NH1 . . . . . . . . . c19602_2mgt 1 . 4 . 1703 . 1 1 6 ARG NH2 N -12.321 -1.183 -2.725 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NH2 . . . . . . . . . c19602_2mgt 1 . 4 . 1704 . 1 1 6 ARG O O -11.661 6.056 -2.165 . . . 1.0 . . . . . . . . . . . . A . 5 ARG O . . . . . . . . . c19602_2mgt 1 . 4 . 1705 . 1 1 7 ARG C C -11.891 7.730 0.535 . . . 1.0 . . . . . . . . . . . . A . 6 ARG C . . . . . . . . . c19602_2mgt 1 . 4 . 1706 . 1 1 7 ARG CA C -13.126 6.912 0.166 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CA . . . . . . . . . c19602_2mgt 1 . 4 . 1707 . 1 1 7 ARG CB C -14.044 6.780 1.388 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CB . . . . . . . . . c19602_2mgt 1 . 4 . 1708 . 1 1 7 ARG CD C -16.242 6.813 0.027 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CD . . . . . . . . . c19602_2mgt 1 . 4 . 1709 . 1 1 7 ARG CG C -15.389 6.110 1.095 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CG . . . . . . . . . c19602_2mgt 1 . 4 . 1710 . 1 1 7 ARG CZ C -15.628 6.891 -2.430 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CZ . . . . . . . . . c19602_2mgt 1 . 4 . 1711 . 1 1 7 ARG H H -13.206 4.824 0.251 . . . 1.0 . . . . . . . . . . . . A . 6 ARG H . . . . . . . . . c19602_2mgt 1 . 4 . 1712 . 1 1 7 ARG HA H -13.656 7.438 -0.618 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HA . . . . . . . . . c19602_2mgt 1 . 4 . 1713 . 1 1 7 ARG HB2 H -13.534 6.175 2.143 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HB2 . . . . . . . . . c19602_2mgt 1 . 4 . 1714 . 1 1 7 ARG HB3 H -14.233 7.766 1.805 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HB3 . . . . . . . . . c19602_2mgt 1 . 4 . 1715 . 1 1 7 ARG HD2 H -17.291 6.653 0.271 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HD2 . . . . . . . . . c19602_2mgt 1 . 4 . 1716 . 1 1 7 ARG HD3 H -16.054 7.885 0.049 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HD3 . . . . . . . . . c19602_2mgt 1 . 4 . 1717 . 1 1 7 ARG HE H -16.187 5.254 -1.395 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HE . . . . . . . . . c19602_2mgt 1 . 4 . 1718 . 1 1 7 ARG HG2 H -15.191 5.085 0.790 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HG2 . . . . . . . . . c19602_2mgt 1 . 4 . 1719 . 1 1 7 ARG HG3 H -15.956 6.083 2.026 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HG3 . . . . . . . . . c19602_2mgt 1 . 4 . 1720 . 1 1 7 ARG HH11 H -15.481 8.751 -1.618 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH11 . . . . . . . . . c19602_2mgt 1 . 4 . 1721 . 1 1 7 ARG HH12 H -15.101 8.641 -3.320 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH12 . . . . . . . . . c19602_2mgt 1 . 4 . 1722 . 1 1 7 ARG HH21 H -15.692 5.228 -3.601 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH21 . . . . . . . . . c19602_2mgt 1 . 4 . 1723 . 1 1 7 ARG HH22 H -15.238 6.702 -4.421 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH22 . . . . . . . . . c19602_2mgt 1 . 4 . 1724 . 1 1 7 ARG N N -12.826 5.572 -0.308 . . . 1.0 . . . . . . . . . . . . A . 6 ARG N . . . . . . . . . c19602_2mgt 1 . 4 . 1725 . 1 1 7 ARG NE N -16.009 6.247 -1.313 . . . 1.0 . . . . . . . . . . . . A . 6 ARG NE . . . . . . . . . c19602_2mgt 1 . 4 . 1726 . 1 1 7 ARG NH1 N -15.376 8.198 -2.456 . . . 1.0 . . . . . . . . . . . . A . 6 ARG NH1 . . . . . . . . . c19602_2mgt 1 . 4 . 1727 . 1 1 7 ARG NH2 N -15.496 6.218 -3.574 . . . 1.0 . . . . . . . . . . . . A . 6 ARG NH2 . . . . . . . . . c19602_2mgt 1 . 4 . 1728 . 1 1 7 ARG O O -10.833 7.178 0.816 . . . 1.0 . . . . . . . . . . . . A . 6 ARG O . . . . . . . . . c19602_2mgt 1 . 4 . 1729 . 1 1 8 ASP C C -10.890 9.685 2.730 . . . 1.0 . . . . . . . . . . . . A . 7 ASP C . . . . . . . . . c19602_2mgt 1 . 4 . 1730 . 1 1 8 ASP CA C -11.144 9.996 1.255 . . . 1.0 . . . . . . . . . . . . A . 7 ASP CA . . . . . . . . . c19602_2mgt 1 . 4 . 1731 . 1 1 8 ASP CB C -11.725 11.407 1.147 . . . 1.0 . . . . . . . . . . . . A . 7 ASP CB . . . . . . . . . c19602_2mgt 1 . 4 . 1732 . 1 1 8 ASP CG C -11.669 11.872 -0.291 . . . 1.0 . . . . . . . . . . . . A . 7 ASP CG . . . . . . . . . c19602_2mgt 1 . 4 . 1733 . 1 1 8 ASP H H -12.978 9.425 0.366 . . . 1.0 . . . . . . . . . . . . A . 7 ASP H . . . . . . . . . c19602_2mgt 1 . 4 . 1734 . 1 1 8 ASP HA H -10.191 9.963 0.728 . . . 1.0 . . . . . . . . . . . . A . 7 ASP HA . . . . . . . . . c19602_2mgt 1 . 4 . 1735 . 1 1 8 ASP HB2 H -12.762 11.414 1.492 . . . 1.0 . . . . . . . . . . . . A . 7 ASP HB2 . . . . . . . . . c19602_2mgt 1 . 4 . 1736 . 1 1 8 ASP HB3 H -11.157 12.096 1.772 . . . 1.0 . . . . . . . . . . . . A . 7 ASP HB3 . . . . . . . . . c19602_2mgt 1 . 4 . 1737 . 1 1 8 ASP N N -12.077 9.052 0.631 . . . 1.0 . . . . . . . . . . . . A . 7 ASP N . . . . . . . . . c19602_2mgt 1 . 4 . 1738 . 1 1 8 ASP O O -9.933 10.198 3.301 . . . 1.0 . . . . . . . . . . . . A . 7 ASP O . . . . . . . . . c19602_2mgt 1 . 4 . 1739 . 1 1 8 ASP OD1 O -12.556 11.491 -1.054 . . . 1.0 . . . . . . . . . . . . A . 7 ASP OD1 . . . . . . . . . c19602_2mgt 1 . 4 . 1740 . 1 1 8 ASP OD2 O -10.706 12.596 -0.630 . . . 1.0 . . . . . . . . . . . . A . 7 ASP OD2 . . . . . . . . . c19602_2mgt 1 . 4 . 1741 . 1 1 9 SER C C -10.431 7.576 5.057 . . . 1.0 . . . . . . . . . . . . A . 8 SER C . . . . . . . . . c19602_2mgt 1 . 4 . 1742 . 1 1 9 SER CA C -11.690 8.370 4.701 . . . 1.0 . . . . . . . . . . . . A . 8 SER CA . . . . . . . . . c19602_2mgt 1 . 4 . 1743 . 1 1 9 SER CB C -12.923 7.503 4.942 . . . 1.0 . . . . . . . . . . . . A . 8 SER CB . . . . . . . . . c19602_2mgt 1 . 4 . 1744 . 1 1 9 SER H H -12.523 8.515 2.791 . . . 1.0 . . . . . . . . . . . . A . 8 SER H . . . . . . . . . c19602_2mgt 1 . 4 . 1745 . 1 1 9 SER HA H -11.751 9.232 5.358 . . . 1.0 . . . . . . . . . . . . A . 8 SER HA . . . . . . . . . c19602_2mgt 1 . 4 . 1746 . 1 1 9 SER HB2 H -12.835 6.575 4.377 . . . 1.0 . . . . . . . . . . . . A . 8 SER HB2 . . . . . . . . . c19602_2mgt 1 . 4 . 1747 . 1 1 9 SER HB3 H -13.005 7.272 6.003 . . . 1.0 . . . . . . . . . . . . A . 8 SER HB3 . . . . . . . . . c19602_2mgt 1 . 4 . 1748 . 1 1 9 SER HG H -14.843 7.639 4.698 . . . 1.0 . . . . . . . . . . . . A . 8 SER HG . . . . . . . . . c19602_2mgt 1 . 4 . 1749 . 1 1 9 SER N N -11.735 8.841 3.328 . . . 1.0 . . . . . . . . . . . . A . 8 SER N . . . . . . . . . c19602_2mgt 1 . 4 . 1750 . 1 1 9 SER O O -10.303 7.187 6.212 . . . 1.0 . . . . . . . . . . . . A . 8 SER O . . . . . . . . . c19602_2mgt 1 . 4 . 1751 . 1 1 9 SER OG O -14.076 8.197 4.534 . . . 1.0 . . . . . . . . . . . . A . 8 SER OG . . . . . . . . . c19602_2mgt 1 . 4 . 1752 . 1 1 10 GLY C C -7.283 7.374 3.259 . . . 1.0 . . . . . . . . . . . . A . 9 GLY C . . . . . . . . . c19602_2mgt 1 . 4 . 1753 . 1 1 10 GLY CA C -8.198 6.784 4.339 . . . 1.0 . . . . . . . . . . . . A . 9 GLY CA . . . . . . . . . c19602_2mgt 1 . 4 . 1754 . 1 1 10 GLY H H -9.681 7.660 3.165 . . . 1.0 . . . . . . . . . . . . A . 9 GLY H . . . . . . . . . c19602_2mgt 1 . 4 . 1755 . 1 1 10 GLY HA2 H -7.836 7.052 5.331 . . . 1.0 . . . . . . . . . . . . A . 9 GLY HA2 . . . . . . . . . c19602_2mgt 1 . 4 . 1756 . 1 1 10 GLY HA3 H -8.262 5.699 4.293 . . . 1.0 . . . . . . . . . . . . A . 9 GLY HA3 . . . . . . . . . c19602_2mgt 1 . 4 . 1757 . 1 1 10 GLY N N -9.519 7.330 4.108 . . . 1.0 . . . . . . . . . . . . A . 9 GLY N . . . . . . . . . c19602_2mgt 1 . 4 . 1758 . 1 1 10 GLY O O -7.141 8.588 3.197 . . . 1.0 . . . . . . . . . . . . A . 9 GLY O . . . . . . . . . c19602_2mgt 1 . 4 . 1759 . 1 1 11 TYR C C -5.760 4.536 1.363 . . . 1.0 . . . . . . . . . . . . A . 10 TYR C . . . . . . . . . c19602_2mgt 1 . 4 . 1760 . 1 1 11 TYR CA C -6.829 5.156 2.247 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CA . . . . . . . . . c19602_2mgt 1 . 4 . 1761 . 1 1 11 TYR CB C -8.202 4.834 1.637 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CB . . . . . . . . . c19602_2mgt 1 . 4 . 1762 . 1 1 11 TYR CD1 C -8.567 2.833 3.159 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CD1 . . . . . . . . . c19602_2mgt 1 . 4 . 1763 . 1 1 11 TYR CD2 C -10.431 4.313 2.657 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CD2 . . . . . . . . . c19602_2mgt 1 . 4 . 1764 . 1 1 11 TYR CE1 C -9.409 2.031 3.937 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CE1 . . . . . . . . . c19602_2mgt 1 . 4 . 1765 . 1 1 11 TYR CE2 C -11.274 3.530 3.448 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CE2 . . . . . . . . . c19602_2mgt 1 . 4 . 1766 . 1 1 11 TYR CG C -9.081 3.968 2.504 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CG . . . . . . . . . c19602_2mgt 1 . 4 . 1767 . 1 1 11 TYR CZ C -10.770 2.375 4.079 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CZ . . . . . . . . . c19602_2mgt 1 . 4 . 1768 . 1 1 11 TYR H H -6.211 7.021 1.597 . . . 1.0 . . . . . . . . . . . . A . 10 TYR H . . . . . . . . . c19602_2mgt 1 . 4 . 1769 . 1 1 11 TYR HA H -6.744 4.720 3.241 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HA . . . . . . . . . c19602_2mgt 1 . 4 . 1770 . 1 1 11 TYR HB2 H -8.730 5.760 1.421 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HB2 . . . . . . . . . c19602_2mgt 1 . 4 . 1771 . 1 1 11 TYR HB3 H -8.070 4.340 0.677 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HB3 . . . . . . . . . c19602_2mgt 1 . 4 . 1772 . 1 1 11 TYR HD1 H -7.530 2.561 3.064 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HD1 . . . . . . . . . c19602_2mgt 1 . 4 . 1773 . 1 1 11 TYR HD2 H -10.829 5.182 2.166 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HD2 . . . . . . . . . c19602_2mgt 1 . 4 . 1774 . 1 1 11 TYR HE1 H -9.005 1.156 4.415 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HE1 . . . . . . . . . c19602_2mgt 1 . 4 . 1775 . 1 1 11 TYR HE2 H -12.305 3.814 3.559 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HE2 . . . . . . . . . c19602_2mgt 1 . 4 . 1776 . 1 1 11 TYR HH H -11.175 0.839 5.210 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HH . . . . . . . . . c19602_2mgt 1 . 4 . 1777 . 1 1 11 TYR N N -6.670 6.584 2.372 . . . 1.0 . . . . . . . . . . . . A . 10 TYR N . . . . . . . . . c19602_2mgt 1 . 4 . 1778 . 1 1 11 TYR O O -5.386 5.060 0.316 . . . 1.0 . . . . . . . . . . . . A . 10 TYR O . . . . . . . . . c19602_2mgt 1 . 4 . 1779 . 1 1 11 TYR OH O -11.603 1.610 4.828 . . . 1.0 . . . . . . . . . . . . A . 10 TYR OH . . . . . . . . . c19602_2mgt 1 . 4 . 1780 . 1 1 12 GLU C C -5.686 1.046 1.301 . . . 1.0 . . . . . . . . . . . . A . 11 GLU C . . . . . . . . . c19602_2mgt 1 . 4 . 1781 . 1 1 12 GLU CA C -4.931 2.300 0.855 . . . 1.0 . . . . . . . . . . . . A . 11 GLU CA . . . . . . . . . c19602_2mgt 1 . 4 . 1782 . 1 1 12 GLU CB C -3.420 2.200 1.012 . . . 1.0 . . . . . . . . . . . . A . 11 GLU CB . . . . . . . . . c19602_2mgt 1 . 4 . 1783 . 1 1 12 GLU CD C -1.468 0.769 0.396 . . . 1.0 . . . . . . . . . . . . A . 11 GLU CD . . . . . . . . . c19602_2mgt 1 . 4 . 1784 . 1 1 12 GLU CG C -2.808 1.310 -0.070 . . . 1.0 . . . . . . . . . . . . A . 11 GLU CG . . . . . . . . . c19602_2mgt 1 . 4 . 1785 . 1 1 12 GLU H H -5.697 2.997 2.655 . . . 1.0 . . . . . . . . . . . . A . 11 GLU H . . . . . . . . . c19602_2mgt 1 . 4 . 1786 . 1 1 12 GLU HA H -5.180 2.567 -0.172 . . . 1.0 . . . . . . . . . . . . A . 11 GLU HA . . . . . . . . . c19602_2mgt 1 . 4 . 1787 . 1 1 12 GLU HB2 H -2.979 3.195 0.936 . . . 1.0 . . . . . . . . . . . . A . 11 GLU HB2 . . . . . . . . . c19602_2mgt 1 . 4 . 1788 . 1 1 12 GLU HB3 H -3.198 1.807 2.005 . . . 1.0 . . . . . . . . . . . . A . 11 GLU HB3 . . . . . . . . . c19602_2mgt 1 . 4 . 1789 . 1 1 12 GLU HG2 H -3.473 0.474 -0.286 . . . 1.0 . . . . . . . . . . . . A . 11 GLU HG2 . . . . . . . . . c19602_2mgt 1 . 4 . 1790 . 1 1 12 GLU HG3 H -2.677 1.894 -0.979 . . . 1.0 . . . . . . . . . . . . A . 11 GLU HG3 . . . . . . . . . c19602_2mgt 1 . 4 . 1791 . 1 1 12 GLU N N -5.403 3.319 1.746 . . . 1.0 . . . . . . . . . . . . A . 11 GLU N . . . . . . . . . c19602_2mgt 1 . 4 . 1792 . 1 1 12 GLU O O -5.251 0.346 2.218 . . . 1.0 . . . . . . . . . . . . A . 11 GLU O . . . . . . . . . c19602_2mgt 1 . 4 . 1793 . 1 1 12 GLU OE1 O -0.741 1.493 1.091 . . . 1.0 . . . . . . . . . . . . A . 11 GLU OE1 . . . . . . . . . c19602_2mgt 1 . 4 . 1794 . 1 1 12 GLU OE2 O -1.203 -0.418 0.112 . . . 1.0 . . . . . . . . . . . . A . 11 GLU OE2 . . . . . . . . . c19602_2mgt 1 . 4 . 1795 . 1 1 13 VAL C C -7.335 -1.530 1.271 . . . 1.0 . . . . . . . . . . . . A . 12 VAL C . . . . . . . . . c19602_2mgt 1 . 4 . 1796 . 1 1 13 VAL CA C -7.891 -0.121 1.121 . . . 1.0 . . . . . . . . . . . . A . 12 VAL CA . . . . . . . . . c19602_2mgt 1 . 4 . 1797 . 1 1 13 VAL CB C -9.095 -0.093 0.147 . . . 1.0 . . . . . . . . . . . . A . 12 VAL CB . . . . . . . . . c19602_2mgt 1 . 4 . 1798 . 1 1 13 VAL CG1 C -10.077 -1.264 0.351 . . . 1.0 . . . . . . . . . . . . A . 12 VAL CG1 . . . . . . . . . c19602_2mgt 1 . 4 . 1799 . 1 1 13 VAL CG2 C -9.898 1.197 0.343 . . . 1.0 . . . . . . . . . . . . A . 12 VAL CG2 . . . . . . . . . c19602_2mgt 1 . 4 . 1800 . 1 1 13 VAL H H -7.139 1.473 -0.029 . . . 1.0 . . . . . . . . . . . . A . 12 VAL H . . . . . . . . . c19602_2mgt 1 . 4 . 1801 . 1 1 13 VAL HA H -8.253 0.195 2.094 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HA . . . . . . . . . c19602_2mgt 1 . 4 . 1802 . 1 1 13 VAL HB H -8.725 -0.131 -0.879 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HB . . . . . . . . . c19602_2mgt 1 . 4 . 1803 . 1 1 13 VAL HG11 H -10.366 -1.330 1.401 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HG11 . . . . . . . . . c19602_2mgt 1 . 4 . 1804 . 1 1 13 VAL HG12 H -10.973 -1.116 -0.250 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HG12 . . . . . . . . . c19602_2mgt 1 . 4 . 1805 . 1 1 13 VAL HG13 H -9.615 -2.201 0.040 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HG13 . . . . . . . . . c19602_2mgt 1 . 4 . 1806 . 1 1 13 VAL HG21 H -9.260 2.067 0.223 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HG21 . . . . . . . . . c19602_2mgt 1 . 4 . 1807 . 1 1 13 VAL HG22 H -10.692 1.240 -0.401 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HG22 . . . . . . . . . c19602_2mgt 1 . 4 . 1808 . 1 1 13 VAL HG23 H -10.335 1.206 1.340 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HG23 . . . . . . . . . c19602_2mgt 1 . 4 . 1809 . 1 1 13 VAL N N -6.865 0.833 0.699 . . . 1.0 . . . . . . . . . . . . A . 12 VAL N . . . . . . . . . c19602_2mgt 1 . 4 . 1810 . 1 1 13 VAL O O -7.873 -2.292 2.066 . . . 1.0 . . . . . . . . . . . . A . 12 VAL O . . . . . . . . . c19602_2mgt 1 . 4 . 1811 . 1 1 14 HIS C C -5.117 -3.625 1.903 . . . 1.0 . . . . . . . . . . . . A . 13 HIS C . . . . . . . . . c19602_2mgt 1 . 4 . 1812 . 1 1 14 HIS CA C -5.713 -3.213 0.555 . . . 1.0 . . . . . . . . . . . . A . 13 HIS CA . . . . . . . . . c19602_2mgt 1 . 4 . 1813 . 1 1 14 HIS CB C -4.658 -3.368 -0.546 . . . 1.0 . . . . . . . . . . . . A . 13 HIS CB . . . . . . . . . c19602_2mgt 1 . 4 . 1814 . 1 1 14 HIS CD2 C -6.295 -2.689 -2.407 . . . 1.0 . . . . . . . . . . . . A . 13 HIS CD2 . . . . . . . . . c19602_2mgt 1 . 4 . 1815 . 1 1 14 HIS CE1 C -4.932 -1.583 -3.705 . . . 1.0 . . . . . . . . . . . . A . 13 HIS CE1 . . . . . . . . . c19602_2mgt 1 . 4 . 1816 . 1 1 14 HIS CG C -5.044 -2.751 -1.860 . . . 1.0 . . . . . . . . . . . . A . 13 HIS CG . . . . . . . . . c19602_2mgt 1 . 4 . 1817 . 1 1 14 HIS H H -5.856 -1.200 -0.084 . . . 1.0 . . . . . . . . . . . . A . 13 HIS H . . . . . . . . . c19602_2mgt 1 . 4 . 1818 . 1 1 14 HIS HA H -6.556 -3.861 0.337 . . . 1.0 . . . . . . . . . . . . A . 13 HIS HA . . . . . . . . . c19602_2mgt 1 . 4 . 1819 . 1 1 14 HIS HB2 H -3.726 -2.910 -0.210 . . . 1.0 . . . . . . . . . . . . A . 13 HIS HB2 . . . . . . . . . c19602_2mgt 1 . 4 . 1820 . 1 1 14 HIS HB3 H -4.470 -4.428 -0.709 . . . 1.0 . . . . . . . . . . . . A . 13 HIS HB3 . . . . . . . . . c19602_2mgt 1 . 4 . 1821 . 1 1 14 HIS HD1 H -3.211 -1.920 -2.551 . . . 1.0 . . . . . . . . . . . . A . 13 HIS HD1 . . . . . . . . . c19602_2mgt 1 . 4 . 1822 . 1 1 14 HIS HD2 H -7.196 -3.094 -1.979 . . . 1.0 . . . . . . . . . . . . A . 13 HIS HD2 . . . . . . . . . c19602_2mgt 1 . 4 . 1823 . 1 1 14 HIS HE1 H -4.533 -1.005 -4.523 . . . 1.0 . . . . . . . . . . . . A . 13 HIS HE1 . . . . . . . . . c19602_2mgt 1 . 4 . 1824 . 1 1 14 HIS N N -6.260 -1.871 0.553 . . . 1.0 . . . . . . . . . . . . A . 13 HIS N . . . . . . . . . c19602_2mgt 1 . 4 . 1825 . 1 1 14 HIS ND1 N -4.202 -2.058 -2.689 . . . 1.0 . . . . . . . . . . . . A . 13 HIS ND1 . . . . . . . . . c19602_2mgt 1 . 4 . 1826 . 1 1 14 HIS NE2 N -6.219 -1.942 -3.579 . . . 1.0 . . . . . . . . . . . . A . 13 HIS NE2 . . . . . . . . . c19602_2mgt 1 . 4 . 1827 . 1 1 14 HIS O O -4.875 -4.806 2.097 . . . 1.0 . . . . . . . . . . . . A . 13 HIS O . . . . . . . . . c19602_2mgt 1 . 4 . 1828 . 1 1 15 HIS C C -5.576 -3.231 5.164 . . . 1.0 . . . . . . . . . . . . A . 14 HIS C . . . . . . . . . c19602_2mgt 1 . 4 . 1829 . 1 1 15 HIS CA C -4.434 -3.028 4.182 . . . 1.0 . . . . . . . . . . . . A . 14 HIS CA . . . . . . . . . c19602_2mgt 1 . 4 . 1830 . 1 1 15 HIS CB C -3.492 -1.941 4.687 . . . 1.0 . . . . . . . . . . . . A . 14 HIS CB . . . . . . . . . c19602_2mgt 1 . 4 . 1831 . 1 1 15 HIS CD2 C -1.626 -0.989 3.243 . . . 1.0 . . . . . . . . . . . . A . 14 HIS CD2 . . . . . . . . . c19602_2mgt 1 . 4 . 1832 . 1 1 15 HIS CE1 C -0.350 -2.764 3.052 . . . 1.0 . . . . . . . . . . . . A . 14 HIS CE1 . . . . . . . . . c19602_2mgt 1 . 4 . 1833 . 1 1 15 HIS CG C -2.189 -1.994 3.962 . . . 1.0 . . . . . . . . . . . . A . 14 HIS CG . . . . . . . . . c19602_2mgt 1 . 4 . 1834 . 1 1 15 HIS H H -5.100 -1.727 2.633 . . . 1.0 . . . . . . . . . . . . A . 14 HIS H . . . . . . . . . c19602_2mgt 1 . 4 . 1835 . 1 1 15 HIS HA H -3.883 -3.968 4.157 . . . 1.0 . . . . . . . . . . . . A . 14 HIS HA . . . . . . . . . c19602_2mgt 1 . 4 . 1836 . 1 1 15 HIS HB2 H -3.954 -0.960 4.569 . . . 1.0 . . . . . . . . . . . . A . 14 HIS HB2 . . . . . . . . . c19602_2mgt 1 . 4 . 1837 . 1 1 15 HIS HB3 H -3.278 -2.100 5.742 . . . 1.0 . . . . . . . . . . . . A . 14 HIS HB3 . . . . . . . . . c19602_2mgt 1 . 4 . 1838 . 1 1 15 HIS HD1 H -1.560 -4.012 4.210 . . . 1.0 . . . . . . . . . . . . A . 14 HIS HD1 . . . . . . . . . c19602_2mgt 1 . 4 . 1839 . 1 1 15 HIS HD2 H -2.043 -0.004 3.107 . . . 1.0 . . . . . . . . . . . . A . 14 HIS HD2 . . . . . . . . . c19602_2mgt 1 . 4 . 1840 . 1 1 15 HIS HE1 H 0.434 -3.434 2.738 . . . 1.0 . . . . . . . . . . . . A . 14 HIS HE1 . . . . . . . . . c19602_2mgt 1 . 4 . 1841 . 1 1 15 HIS N N -4.887 -2.695 2.835 . . . 1.0 . . . . . . . . . . . . A . 14 HIS N . . . . . . . . . c19602_2mgt 1 . 4 . 1842 . 1 1 15 HIS ND1 N -1.380 -3.095 3.832 . . . 1.0 . . . . . . . . . . . . A . 14 HIS ND1 . . . . . . . . . c19602_2mgt 1 . 4 . 1843 . 1 1 15 HIS NE2 N -0.449 -1.485 2.686 . . . 1.0 . . . . . . . . . . . . A . 14 HIS NE2 . . . . . . . . . c19602_2mgt 1 . 4 . 1844 . 1 1 15 HIS O O -5.297 -3.574 6.303 . . . 1.0 . . . . . . . . . . . . A . 14 HIS O . . . . . . . . . c19602_2mgt 1 . 4 . 1845 . 1 1 16 GLN C C -8.988 -4.147 5.064 . . . 1.0 . . . . . . . . . . . . A . 15 GLN C . . . . . . . . . c19602_2mgt 1 . 4 . 1846 . 1 1 16 GLN CA C -7.998 -3.123 5.608 . . . 1.0 . . . . . . . . . . . . A . 15 GLN CA . . . . . . . . . c19602_2mgt 1 . 4 . 1847 . 1 1 16 GLN CB C -8.615 -1.730 5.736 . . . 1.0 . . . . . . . . . . . . A . 15 GLN CB . . . . . . . . . c19602_2mgt 1 . 4 . 1848 . 1 1 16 GLN CD C -8.315 0.526 6.899 . . . 1.0 . . . . . . . . . . . . A . 15 GLN CD . . . . . . . . . c19602_2mgt 1 . 4 . 1849 . 1 1 16 GLN CG C -7.736 -0.859 6.652 . . . 1.0 . . . . . . . . . . . . A . 15 GLN CG . . . . . . . . . c19602_2mgt 1 . 4 . 1850 . 1 1 16 GLN H H -6.999 -2.774 3.798 . . . 1.0 . . . . . . . . . . . . A . 15 GLN H . . . . . . . . . c19602_2mgt 1 . 4 . 1851 . 1 1 16 GLN HA H -7.708 -3.456 6.596 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HA . . . . . . . . . c19602_2mgt 1 . 4 . 1852 . 1 1 16 GLN HB2 H -8.714 -1.265 4.754 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HB2 . . . . . . . . . c19602_2mgt 1 . 4 . 1853 . 1 1 16 GLN HB3 H -9.604 -1.840 6.170 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HB3 . . . . . . . . . c19602_2mgt 1 . 4 . 1854 . 1 1 16 GLN HE21 H -10.215 -0.178 7.053 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HE21 . . . . . . . . . c19602_2mgt 1 . 4 . 1855 . 1 1 16 GLN HE22 H -10.020 1.550 7.248 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HE22 . . . . . . . . . c19602_2mgt 1 . 4 . 1856 . 1 1 16 GLN HG2 H -7.624 -1.351 7.615 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HG2 . . . . . . . . . c19602_2mgt 1 . 4 . 1857 . 1 1 16 GLN HG3 H -6.747 -0.743 6.208 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HG3 . . . . . . . . . c19602_2mgt 1 . 4 . 1858 . 1 1 16 GLN N N -6.830 -3.029 4.756 . . . 1.0 . . . . . . . . . . . . A . 15 GLN N . . . . . . . . . c19602_2mgt 1 . 4 . 1859 . 1 1 16 GLN NE2 N -9.619 0.634 7.115 . . . 1.0 . . . . . . . . . . . . A . 15 GLN NE2 . . . . . . . . . c19602_2mgt 1 . 4 . 1860 . 1 1 16 GLN O O -9.630 -4.830 5.849 . . . 1.0 . . . . . . . . . . . . A . 15 GLN O . . . . . . . . . c19602_2mgt 1 . 4 . 1861 . 1 1 16 GLN OE1 O -7.592 1.512 6.893 . . . 1.0 . . . . . . . . . . . . A . 15 GLN OE1 . . . . . . . . . c19602_2mgt 1 . 4 . 1862 . 1 1 17 LYS C C -8.880 -6.015 2.013 . . . 1.0 . . . . . . . . . . . . A . 16 LYS C . . . . . . . . . c19602_2mgt 1 . 4 . 1863 . 1 1 17 LYS CA C -9.796 -5.348 3.044 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CA . . . . . . . . . c19602_2mgt 1 . 4 . 1864 . 1 1 17 LYS CB C -11.040 -4.750 2.373 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CB . . . . . . . . . c19602_2mgt 1 . 4 . 1865 . 1 1 17 LYS CD C -13.342 -3.753 2.771 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CD . . . . . . . . . c19602_2mgt 1 . 4 . 1866 . 1 1 17 LYS CE C -14.127 -5.018 2.434 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CE . . . . . . . . . c19602_2mgt 1 . 4 . 1867 . 1 1 17 LYS CG C -11.995 -4.110 3.395 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CG . . . . . . . . . c19602_2mgt 1 . 4 . 1868 . 1 1 17 LYS H H -8.497 -3.696 3.167 . . . 1.0 . . . . . . . . . . . . A . 16 LYS H . . . . . . . . . c19602_2mgt 1 . 4 . 1869 . 1 1 17 LYS HA H -10.120 -6.110 3.753 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HA . . . . . . . . . c19602_2mgt 1 . 4 . 1870 . 1 1 17 LYS HB2 H -10.739 -3.998 1.640 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HB2 . . . . . . . . . c19602_2mgt 1 . 4 . 1871 . 1 1 17 LYS HB3 H -11.553 -5.552 1.846 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HB3 . . . . . . . . . c19602_2mgt 1 . 4 . 1872 . 1 1 17 LYS HD2 H -13.914 -3.170 3.488 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HD2 . . . . . . . . . c19602_2mgt 1 . 4 . 1873 . 1 1 17 LYS HD3 H -13.186 -3.150 1.875 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HD3 . . . . . . . . . c19602_2mgt 1 . 4 . 1874 . 1 1 17 LYS HE2 H -13.569 -5.625 1.720 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HE2 . . . . . . . . . c19602_2mgt 1 . 4 . 1875 . 1 1 17 LYS HE3 H -14.286 -5.596 3.344 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HE3 . . . . . . . . . c19602_2mgt 1 . 4 . 1876 . 1 1 17 LYS HG2 H -12.165 -4.797 4.224 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HG2 . . . . . . . . . c19602_2mgt 1 . 4 . 1877 . 1 1 17 LYS HG3 H -11.549 -3.195 3.785 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HG3 . . . . . . . . . c19602_2mgt 1 . 4 . 1878 . 1 1 17 LYS HZ1 H -15.937 -5.526 1.638 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HZ1 . . . . . . . . . c19602_2mgt 1 . 4 . 1879 . 1 1 17 LYS HZ2 H -15.966 -4.126 2.497 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HZ2 . . . . . . . . . c19602_2mgt 1 . 4 . 1880 . 1 1 17 LYS HZ3 H -15.291 -4.161 0.992 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HZ3 . . . . . . . . . c19602_2mgt 1 . 4 . 1881 . 1 1 17 LYS N N -9.059 -4.304 3.741 . . . 1.0 . . . . . . . . . . . . A . 16 LYS N . . . . . . . . . c19602_2mgt 1 . 4 . 1882 . 1 1 17 LYS NZ N -15.425 -4.680 1.848 . . . 1.0 . . . . . . . . . . . . A . 16 LYS NZ . . . . . . . . . c19602_2mgt 1 . 4 . 1883 . 1 1 17 LYS O O -7.812 -5.507 1.685 . . . 1.0 . . . . . . . . . . . . A . 16 LYS O . . . . . . . . . c19602_2mgt 1 . 4 . 1884 . 1 1 18 NH2 HN1 H -8.713 -7.641 0.808 . . . 1.0 . . . . . . . . . . . . A . 17 NH2 HN1 . . . . . . . . . c19602_2mgt 1 . 4 . 1885 . 1 1 18 NH2 HN2 H -10.182 -7.552 1.755 . . . 1.0 . . . . . . . . . . . . A . 17 NH2 HN2 . . . . . . . . . c19602_2mgt 1 . 4 . 1886 . 1 1 18 NH2 N N -9.290 -7.164 1.484 . . . 1.0 . . . . . . . . . . . . A . 17 NH2 N . . . . . . . . . c19602_2mgt 1 . 4 . 1887 . 2 1 1 ACE C C 9.999 6.028 -6.156 . . . 1.0 . . . . . . . . . . . . B . 0 ACE C . . . . . . . . . c19602_2mgt 1 . 4 . 1888 . 2 1 1 ACE CH3 C 9.125 5.869 -4.929 . . . 1.0 . . . . . . . . . . . . B . 0 ACE CH3 . . . . . . . . . c19602_2mgt 1 . 4 . 1889 . 2 1 1 ACE H1 H 8.737 6.844 -4.639 . . . 1.0 . . . . . . . . . . . . B . 0 ACE H1 . . . . . . . . . c19602_2mgt 1 . 4 . 1890 . 2 1 1 ACE H2 H 8.296 5.203 -5.163 . . . 1.0 . . . . . . . . . . . . B . 0 ACE H2 . . . . . . . . . c19602_2mgt 1 . 4 . 1891 . 2 1 1 ACE H3 H 9.706 5.445 -4.113 . . . 1.0 . . . . . . . . . . . . B . 0 ACE H3 . . . . . . . . . c19602_2mgt 1 . 4 . 1892 . 2 1 1 ACE O O 9.480 5.968 -7.259 . . . 1.0 . . . . . . . . . . . . B . 0 ACE O . . . . . . . . . c19602_2mgt 1 . 4 . 1893 . 2 1 2 ASP C C 12.713 4.966 -7.547 . . . 1.0 . . . . . . . . . . . . B . 1 ASP C . . . . . . . . . c19602_2mgt 1 . 4 . 1894 . 2 1 2 ASP CA C 12.317 6.344 -7.002 . . . 1.0 . . . . . . . . . . . . B . 1 ASP CA . . . . . . . . . c19602_2mgt 1 . 4 . 1895 . 2 1 2 ASP CB C 13.522 7.073 -6.400 . . . 1.0 . . . . . . . . . . . . B . 1 ASP CB . . . . . . . . . c19602_2mgt 1 . 4 . 1896 . 2 1 2 ASP CG C 14.465 7.552 -7.479 . . . 1.0 . . . . . . . . . . . . B . 1 ASP CG . . . . . . . . . c19602_2mgt 1 . 4 . 1897 . 2 1 2 ASP H H 11.644 6.259 -5.011 . . . 1.0 . . . . . . . . . . . . B . 1 ASP H . . . . . . . . . c19602_2mgt 1 . 4 . 1898 . 2 1 2 ASP HA H 11.919 6.945 -7.821 . . . 1.0 . . . . . . . . . . . . B . 1 ASP HA . . . . . . . . . c19602_2mgt 1 . 4 . 1899 . 2 1 2 ASP HB2 H 13.190 7.940 -5.834 . . . 1.0 . . . . . . . . . . . . B . 1 ASP HB2 . . . . . . . . . c19602_2mgt 1 . 4 . 1900 . 2 1 2 ASP HB3 H 14.059 6.411 -5.724 . . . 1.0 . . . . . . . . . . . . B . 1 ASP HB3 . . . . . . . . . c19602_2mgt 1 . 4 . 1901 . 2 1 2 ASP N N 11.305 6.226 -5.960 . . . 1.0 . . . . . . . . . . . . B . 1 ASP N . . . . . . . . . c19602_2mgt 1 . 4 . 1902 . 2 1 2 ASP O O 12.446 3.955 -6.900 . . . 1.0 . . . . . . . . . . . . B . 1 ASP O . . . . . . . . . c19602_2mgt 1 . 4 . 1903 . 2 1 2 ASP OD1 O 14.076 8.514 -8.176 . . . 1.0 . . . . . . . . . . . . B . 1 ASP OD1 . . . . . . . . . c19602_2mgt 1 . 4 . 1904 . 2 1 2 ASP OD2 O 15.541 6.965 -7.622 . . . 1.0 . . . . . . . . . . . . B . 1 ASP OD2 . . . . . . . . . c19602_2mgt 1 . 4 . 1905 . 2 1 3 ALA C C 14.477 2.710 -8.597 . . . 1.0 . . . . . . . . . . . . B . 2 ALA C . . . . . . . . . c19602_2mgt 1 . 4 . 1906 . 2 1 3 ALA CA C 13.641 3.675 -9.432 . . . 1.0 . . . . . . . . . . . . B . 2 ALA CA . . . . . . . . . c19602_2mgt 1 . 4 . 1907 . 2 1 3 ALA CB C 14.327 3.971 -10.767 . . . 1.0 . . . . . . . . . . . . B . 2 ALA CB . . . . . . . . . c19602_2mgt 1 . 4 . 1908 . 2 1 3 ALA H H 13.580 5.783 -9.201 . . . 1.0 . . . . . . . . . . . . B . 2 ALA H . . . . . . . . . c19602_2mgt 1 . 4 . 1909 . 2 1 3 ALA HA H 12.696 3.183 -9.641 . . . 1.0 . . . . . . . . . . . . B . 2 ALA HA . . . . . . . . . c19602_2mgt 1 . 4 . 1910 . 2 1 3 ALA HB1 H 15.303 4.419 -10.599 . . . 1.0 . . . . . . . . . . . . B . 2 ALA HB1 . . . . . . . . . c19602_2mgt 1 . 4 . 1911 . 2 1 3 ALA HB2 H 14.466 3.038 -11.314 . . . 1.0 . . . . . . . . . . . . B . 2 ALA HB2 . . . . . . . . . c19602_2mgt 1 . 4 . 1912 . 2 1 3 ALA HB3 H 13.715 4.647 -11.362 . . . 1.0 . . . . . . . . . . . . B . 2 ALA HB3 . . . . . . . . . c19602_2mgt 1 . 4 . 1913 . 2 1 3 ALA N N 13.352 4.921 -8.728 . . . 1.0 . . . . . . . . . . . . B . 2 ALA N . . . . . . . . . c19602_2mgt 1 . 4 . 1914 . 2 1 3 ALA O O 14.117 1.540 -8.510 . . . 1.0 . . . . . . . . . . . . B . 2 ALA O . . . . . . . . . c19602_2mgt 1 . 4 . 1915 . 2 1 4 GLU C C 15.716 1.791 -5.864 . . . 1.0 . . . . . . . . . . . . B . 3 GLU C . . . . . . . . . c19602_2mgt 1 . 4 . 1916 . 2 1 4 GLU CA C 16.408 2.364 -7.105 . . . 1.0 . . . . . . . . . . . . B . 3 GLU CA . . . . . . . . . c19602_2mgt 1 . 4 . 1917 . 2 1 4 GLU CB C 17.658 3.151 -6.709 . . . 1.0 . . . . . . . . . . . . B . 3 GLU CB . . . . . . . . . c19602_2mgt 1 . 4 . 1918 . 2 1 4 GLU CD C 18.527 5.044 -5.323 . . . 1.0 . . . . . . . . . . . . B . 3 GLU CD . . . . . . . . . c19602_2mgt 1 . 4 . 1919 . 2 1 4 GLU CG C 17.290 4.386 -5.892 . . . 1.0 . . . . . . . . . . . . B . 3 GLU CG . . . . . . . . . c19602_2mgt 1 . 4 . 1920 . 2 1 4 GLU H H 15.767 4.169 -8.029 . . . 1.0 . . . . . . . . . . . . B . 3 GLU H . . . . . . . . . c19602_2mgt 1 . 4 . 1921 . 2 1 4 GLU HA H 16.730 1.515 -7.699 . . . 1.0 . . . . . . . . . . . . B . 3 GLU HA . . . . . . . . . c19602_2mgt 1 . 4 . 1922 . 2 1 4 GLU HB2 H 18.309 2.509 -6.116 . . . 1.0 . . . . . . . . . . . . B . 3 GLU HB2 . . . . . . . . . c19602_2mgt 1 . 4 . 1923 . 2 1 4 GLU HB3 H 18.196 3.455 -7.606 . . . 1.0 . . . . . . . . . . . . B . 3 GLU HB3 . . . . . . . . . c19602_2mgt 1 . 4 . 1924 . 2 1 4 GLU HG2 H 16.758 5.087 -6.528 . . . 1.0 . . . . . . . . . . . . B . 3 GLU HG2 . . . . . . . . . c19602_2mgt 1 . 4 . 1925 . 2 1 4 GLU HG3 H 16.642 4.108 -5.066 . . . 1.0 . . . . . . . . . . . . B . 3 GLU HG3 . . . . . . . . . c19602_2mgt 1 . 4 . 1926 . 2 1 4 GLU N N 15.538 3.191 -7.940 . . . 1.0 . . . . . . . . . . . . B . 3 GLU N . . . . . . . . . c19602_2mgt 1 . 4 . 1927 . 2 1 4 GLU O O 16.315 0.947 -5.210 . . . 1.0 . . . . . . . . . . . . B . 3 GLU O . . . . . . . . . c19602_2mgt 1 . 4 . 1928 . 2 1 4 GLU OE1 O 19.189 5.771 -6.097 . . . 1.0 . . . . . . . . . . . . B . 3 GLU OE1 . . . . . . . . . c19602_2mgt 1 . 4 . 1929 . 2 1 4 GLU OE2 O 18.809 4.829 -4.135 . . . 1.0 . . . . . . . . . . . . B . 3 GLU OE2 . . . . . . . . . c19602_2mgt 1 . 4 . 1930 . 2 1 5 PHE C C 12.529 0.758 -5.065 . . . 1.0 . . . . . . . . . . . . B . 4 PHE C . . . . . . . . . c19602_2mgt 1 . 4 . 1931 . 2 1 5 PHE CA C 13.635 1.645 -4.515 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CA . . . . . . . . . c19602_2mgt 1 . 4 . 1932 . 2 1 5 PHE CB C 13.028 2.751 -3.655 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CB . . . . . . . . . c19602_2mgt 1 . 4 . 1933 . 2 1 5 PHE CD1 C 14.482 2.709 -1.612 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CD1 . . . . . . . . . c19602_2mgt 1 . 4 . 1934 . 2 1 5 PHE CD2 C 14.783 4.505 -3.223 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CD2 . . . . . . . . . c19602_2mgt 1 . 4 . 1935 . 2 1 5 PHE CE1 C 15.550 3.208 -0.854 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CE1 . . . . . . . . . c19602_2mgt 1 . 4 . 1936 . 2 1 5 PHE CE2 C 15.857 5.003 -2.471 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CE2 . . . . . . . . . c19602_2mgt 1 . 4 . 1937 . 2 1 5 PHE CG C 14.090 3.368 -2.787 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CG . . . . . . . . . c19602_2mgt 1 . 4 . 1938 . 2 1 5 PHE CZ C 16.237 4.358 -1.280 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CZ . . . . . . . . . c19602_2mgt 1 . 4 . 1939 . 2 1 5 PHE H H 14.105 2.986 -6.089 . . . 1.0 . . . . . . . . . . . . B . 4 PHE H . . . . . . . . . c19602_2mgt 1 . 4 . 1940 . 2 1 5 PHE HA H 14.243 1.011 -3.872 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HA . . . . . . . . . c19602_2mgt 1 . 4 . 1941 . 2 1 5 PHE HB2 H 12.557 3.508 -4.282 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HB2 . . . . . . . . . c19602_2mgt 1 . 4 . 1942 . 2 1 5 PHE HB3 H 12.258 2.324 -3.010 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HB3 . . . . . . . . . c19602_2mgt 1 . 4 . 1943 . 2 1 5 PHE HD1 H 13.986 1.796 -1.325 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HD1 . . . . . . . . . c19602_2mgt 1 . 4 . 1944 . 2 1 5 PHE HD2 H 14.520 4.960 -4.163 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HD2 . . . . . . . . . c19602_2mgt 1 . 4 . 1945 . 2 1 5 PHE HE1 H 15.857 2.691 0.040 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HE1 . . . . . . . . . c19602_2mgt 1 . 4 . 1946 . 2 1 5 PHE HE2 H 16.406 5.862 -2.826 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HE2 . . . . . . . . . c19602_2mgt 1 . 4 . 1947 . 2 1 5 PHE HZ H 17.081 4.724 -0.717 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HZ . . . . . . . . . c19602_2mgt 1 . 4 . 1948 . 2 1 5 PHE N N 14.488 2.225 -5.549 . . . 1.0 . . . . . . . . . . . . B . 4 PHE N . . . . . . . . . c19602_2mgt 1 . 4 . 1949 . 2 1 5 PHE O O 12.134 -0.150 -4.340 . . . 1.0 . . . . . . . . . . . . B . 4 PHE O . . . . . . . . . c19602_2mgt 1 . 4 . 1950 . 2 1 6 ARG C C 11.812 -1.214 -7.453 . . . 1.0 . . . . . . . . . . . . B . 5 ARG C . . . . . . . . . c19602_2mgt 1 . 4 . 1951 . 2 1 6 ARG CA C 11.145 0.112 -7.045 . . . 1.0 . . . . . . . . . . . . B . 5 ARG CA . . . . . . . . . c19602_2mgt 1 . 4 . 1952 . 2 1 6 ARG CB C 10.559 0.872 -8.255 . . . 1.0 . . . . . . . . . . . . B . 5 ARG CB . . . . . . . . . c19602_2mgt 1 . 4 . 1953 . 2 1 6 ARG CD C 8.569 1.826 -6.881 . . . 1.0 . . . . . . . . . . . . B . 5 ARG CD . . . . . . . . . c19602_2mgt 1 . 4 . 1954 . 2 1 6 ARG CG C 9.662 2.080 -7.926 . . . 1.0 . . . . . . . . . . . . B . 5 ARG CG . . . . . . . . . c19602_2mgt 1 . 4 . 1955 . 2 1 6 ARG CZ C 6.414 0.538 -6.998 . . . 1.0 . . . . . . . . . . . . B . 5 ARG CZ . . . . . . . . . c19602_2mgt 1 . 4 . 1956 . 2 1 6 ARG H H 12.463 1.752 -6.830 . . . 1.0 . . . . . . . . . . . . B . 5 ARG H . . . . . . . . . c19602_2mgt 1 . 4 . 1957 . 2 1 6 ARG HA H 10.327 -0.154 -6.380 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HA . . . . . . . . . c19602_2mgt 1 . 4 . 1958 . 2 1 6 ARG HB2 H 11.383 1.212 -8.881 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HB2 . . . . . . . . . c19602_2mgt 1 . 4 . 1959 . 2 1 6 ARG HB3 H 9.958 0.182 -8.847 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HB3 . . . . . . . . . c19602_2mgt 1 . 4 . 1960 . 2 1 6 ARG HD2 H 9.037 1.659 -5.918 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HD2 . . . . . . . . . c19602_2mgt 1 . 4 . 1961 . 2 1 6 ARG HD3 H 7.957 2.721 -6.800 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HD3 . . . . . . . . . c19602_2mgt 1 . 4 . 1962 . 2 1 6 ARG HE H 8.216 -0.143 -7.585 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HE . . . . . . . . . c19602_2mgt 1 . 4 . 1963 . 2 1 6 ARG HG2 H 10.282 2.895 -7.562 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HG2 . . . . . . . . . c19602_2mgt 1 . 4 . 1964 . 2 1 6 ARG HG3 H 9.188 2.418 -8.848 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HG3 . . . . . . . . . c19602_2mgt 1 . 4 . 1965 . 2 1 6 ARG HH11 H 6.104 2.452 -6.381 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HH11 . . . . . . . . . c19602_2mgt 1 . 4 . 1966 . 2 1 6 ARG HH12 H 4.681 1.434 -6.432 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HH12 . . . . . . . . . c19602_2mgt 1 . 4 . 1967 . 2 1 6 ARG HH21 H 6.336 -1.395 -7.634 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HH21 . . . . . . . . . c19602_2mgt 1 . 4 . 1968 . 2 1 6 ARG HH22 H 4.810 -0.703 -7.127 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HH22 . . . . . . . . . c19602_2mgt 1 . 4 . 1969 . 2 1 6 ARG N N 12.081 0.970 -6.315 . . . 1.0 . . . . . . . . . . . . B . 5 ARG N . . . . . . . . . c19602_2mgt 1 . 4 . 1970 . 2 1 6 ARG NE N 7.735 0.657 -7.201 . . . 1.0 . . . . . . . . . . . . B . 5 ARG NE . . . . . . . . . c19602_2mgt 1 . 4 . 1971 . 2 1 6 ARG NH1 N 5.677 1.554 -6.553 . . . 1.0 . . . . . . . . . . . . B . 5 ARG NH1 . . . . . . . . . c19602_2mgt 1 . 4 . 1972 . 2 1 6 ARG NH2 N 5.808 -0.619 -7.263 . . . 1.0 . . . . . . . . . . . . B . 5 ARG NH2 . . . . . . . . . c19602_2mgt 1 . 4 . 1973 . 2 1 6 ARG O O 11.697 -1.644 -8.592 . . . 1.0 . . . . . . . . . . . . B . 5 ARG O . . . . . . . . . c19602_2mgt 1 . 4 . 1974 . 2 1 7 ARG C C 12.316 -4.256 -6.160 . . . 1.0 . . . . . . . . . . . . B . 6 ARG C . . . . . . . . . c19602_2mgt 1 . 4 . 1975 . 2 1 7 ARG CA C 13.224 -3.110 -6.604 . . . 1.0 . . . . . . . . . . . . B . 6 ARG CA . . . . . . . . . c19602_2mgt 1 . 4 . 1976 . 2 1 7 ARG CB C 14.436 -3.065 -5.663 . . . 1.0 . . . . . . . . . . . . B . 6 ARG CB . . . . . . . . . c19602_2mgt 1 . 4 . 1977 . 2 1 7 ARG CD C 16.072 -2.037 -7.368 . . . 1.0 . . . . . . . . . . . . B . 6 ARG CD . . . . . . . . . c19602_2mgt 1 . 4 . 1978 . 2 1 7 ARG CG C 15.438 -1.950 -5.975 . . . 1.0 . . . . . . . . . . . . B . 6 ARG CG . . . . . . . . . c19602_2mgt 1 . 4 . 1979 . 2 1 7 ARG CZ C 14.958 -1.524 -9.566 . . . 1.0 . . . . . . . . . . . . B . 6 ARG CZ . . . . . . . . . c19602_2mgt 1 . 4 . 1980 . 2 1 7 ARG H H 12.605 -1.389 -5.622 . . . 1.0 . . . . . . . . . . . . B . 6 ARG H . . . . . . . . . c19602_2mgt 1 . 4 . 1981 . 2 1 7 ARG HA H 13.563 -3.269 -7.623 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HA . . . . . . . . . c19602_2mgt 1 . 4 . 1982 . 2 1 7 ARG HB2 H 14.079 -2.917 -4.643 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HB2 . . . . . . . . . c19602_2mgt 1 . 4 . 1983 . 2 1 7 ARG HB3 H 14.955 -4.020 -5.702 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HB3 . . . . . . . . . c19602_2mgt 1 . 4 . 1984 . 2 1 7 ARG HD2 H 17.099 -1.682 -7.294 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HD2 . . . . . . . . . c19602_2mgt 1 . 4 . 1985 . 2 1 7 ARG HD3 H 16.097 -3.074 -7.698 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HD3 . . . . . . . . . c19602_2mgt 1 . 4 . 1986 . 2 1 7 ARG HE H 15.235 -0.216 -8.059 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HE . . . . . . . . . c19602_2mgt 1 . 4 . 1987 . 2 1 7 ARG HG2 H 14.937 -0.993 -5.860 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HG2 . . . . . . . . . c19602_2mgt 1 . 4 . 1988 . 2 1 7 ARG HG3 H 16.237 -2.004 -5.236 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HG3 . . . . . . . . . c19602_2mgt 1 . 4 . 1989 . 2 1 7 ARG HH11 H 15.539 -3.481 -9.508 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HH11 . . . . . . . . . c19602_2mgt 1 . 4 . 1990 . 2 1 7 ARG HH12 H 14.781 -2.958 -10.993 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HH12 . . . . . . . . . c19602_2mgt 1 . 4 . 1991 . 2 1 7 ARG HH21 H 14.295 0.346 -10.007 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HH21 . . . . . . . . . c19602_2mgt 1 . 4 . 1992 . 2 1 7 ARG HH22 H 14.143 -0.825 -11.292 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HH22 . . . . . . . . . c19602_2mgt 1 . 4 . 1993 . 2 1 7 ARG N N 12.528 -1.842 -6.516 . . . 1.0 . . . . . . . . . . . . B . 6 ARG N . . . . . . . . . c19602_2mgt 1 . 4 . 1994 . 2 1 7 ARG NE N 15.371 -1.180 -8.337 . . . 1.0 . . . . . . . . . . . . B . 6 ARG NE . . . . . . . . . c19602_2mgt 1 . 4 . 1995 . 2 1 7 ARG NH1 N 15.092 -2.759 -10.052 . . . 1.0 . . . . . . . . . . . . B . 6 ARG NH1 . . . . . . . . . c19602_2mgt 1 . 4 . 1996 . 2 1 7 ARG NH2 N 14.397 -0.600 -10.341 . . . 1.0 . . . . . . . . . . . . B . 6 ARG NH2 . . . . . . . . . c19602_2mgt 1 . 4 . 1997 . 2 1 7 ARG O O 11.341 -4.050 -5.442 . . . 1.0 . . . . . . . . . . . . B . 6 ARG O . . . . . . . . . c19602_2mgt 1 . 4 . 1998 . 2 1 8 ASP C C 12.220 -7.032 -4.639 . . . 1.0 . . . . . . . . . . . . B . 7 ASP C . . . . . . . . . c19602_2mgt 1 . 4 . 1999 . 2 1 8 ASP CA C 12.013 -6.699 -6.125 . . . 1.0 . . . . . . . . . . . . B . 7 ASP CA . . . . . . . . . c19602_2mgt 1 . 4 . 2000 . 2 1 8 ASP CB C 12.536 -7.833 -7.009 . . . 1.0 . . . . . . . . . . . . B . 7 ASP CB . . . . . . . . . c19602_2mgt 1 . 4 . 2001 . 2 1 8 ASP CG C 11.767 -9.118 -6.754 . . . 1.0 . . . . . . . . . . . . B . 7 ASP CG . . . . . . . . . c19602_2mgt 1 . 4 . 2002 . 2 1 8 ASP H H 13.524 -5.584 -7.092 . . . 1.0 . . . . . . . . . . . . B . 7 ASP H . . . . . . . . . c19602_2mgt 1 . 4 . 2003 . 2 1 8 ASP HA H 10.944 -6.574 -6.308 . . . 1.0 . . . . . . . . . . . . B . 7 ASP HA . . . . . . . . . c19602_2mgt 1 . 4 . 2004 . 2 1 8 ASP HB2 H 12.419 -7.556 -8.057 . . . 1.0 . . . . . . . . . . . . B . 7 ASP HB2 . . . . . . . . . c19602_2mgt 1 . 4 . 2005 . 2 1 8 ASP HB3 H 13.597 -7.995 -6.809 . . . 1.0 . . . . . . . . . . . . B . 7 ASP HB3 . . . . . . . . . c19602_2mgt 1 . 4 . 2006 . 2 1 8 ASP N N 12.694 -5.481 -6.527 . . . 1.0 . . . . . . . . . . . . B . 7 ASP N . . . . . . . . . c19602_2mgt 1 . 4 . 2007 . 2 1 8 ASP O O 11.359 -7.673 -4.045 . . . 1.0 . . . . . . . . . . . . B . 7 ASP O . . . . . . . . . c19602_2mgt 1 . 4 . 2008 . 2 1 8 ASP OD1 O 10.621 -9.196 -7.232 . . . 1.0 . . . . . . . . . . . . B . 7 ASP OD1 . . . . . . . . . c19602_2mgt 1 . 4 . 2009 . 2 1 8 ASP OD2 O 12.292 -10.009 -6.079 . . . 1.0 . . . . . . . . . . . . B . 7 ASP OD2 . . . . . . . . . c19602_2mgt 1 . 4 . 2010 . 2 1 9 SER C C 12.772 -6.035 -1.713 . . . 1.0 . . . . . . . . . . . . B . 8 SER C . . . . . . . . . c19602_2mgt 1 . 4 . 2011 . 2 1 9 SER CA C 13.649 -6.878 -2.637 . . . 1.0 . . . . . . . . . . . . B . 8 SER CA . . . . . . . . . c19602_2mgt 1 . 4 . 2012 . 2 1 9 SER CB C 15.137 -6.643 -2.354 . . . 1.0 . . . . . . . . . . . . B . 8 SER CB . . . . . . . . . c19602_2mgt 1 . 4 . 2013 . 2 1 9 SER H H 14.044 -6.144 -4.577 . . . 1.0 . . . . . . . . . . . . B . 8 SER H . . . . . . . . . c19602_2mgt 1 . 4 . 2014 . 2 1 9 SER HA H 13.446 -7.925 -2.446 . . . 1.0 . . . . . . . . . . . . B . 8 SER HA . . . . . . . . . c19602_2mgt 1 . 4 . 2015 . 2 1 9 SER HB2 H 15.432 -5.657 -2.716 . . . 1.0 . . . . . . . . . . . . B . 8 SER HB2 . . . . . . . . . c19602_2mgt 1 . 4 . 2016 . 2 1 9 SER HB3 H 15.311 -6.697 -1.281 . . . 1.0 . . . . . . . . . . . . B . 8 SER HB3 . . . . . . . . . c19602_2mgt 1 . 4 . 2017 . 2 1 9 SER HG H 16.295 -8.199 -2.292 . . . 1.0 . . . . . . . . . . . . B . 8 SER HG . . . . . . . . . c19602_2mgt 1 . 4 . 2018 . 2 1 9 SER N N 13.338 -6.610 -4.033 . . . 1.0 . . . . . . . . . . . . B . 8 SER N . . . . . . . . . c19602_2mgt 1 . 4 . 2019 . 2 1 9 SER O O 13.109 -4.898 -1.411 . . . 1.0 . . . . . . . . . . . . B . 8 SER O . . . . . . . . . c19602_2mgt 1 . 4 . 2020 . 2 1 9 SER OG O 15.927 -7.630 -2.974 . . . 1.0 . . . . . . . . . . . . B . 8 SER OG . . . . . . . . . c19602_2mgt 1 . 4 . 2021 . 2 1 10 GLY C C 9.352 -6.625 -0.778 . . . 1.0 . . . . . . . . . . . . B . 9 GLY C . . . . . . . . . c19602_2mgt 1 . 4 . 2022 . 2 1 10 GLY CA C 10.688 -6.023 -0.351 . . . 1.0 . . . . . . . . . . . . B . 9 GLY CA . . . . . . . . . c19602_2mgt 1 . 4 . 2023 . 2 1 10 GLY H H 11.363 -7.490 -1.656 . . . 1.0 . . . . . . . . . . . . B . 9 GLY H . . . . . . . . . c19602_2mgt 1 . 4 . 2024 . 2 1 10 GLY HA2 H 10.906 -6.319 0.673 . . . 1.0 . . . . . . . . . . . . B . 9 GLY HA2 . . . . . . . . . c19602_2mgt 1 . 4 . 2025 . 2 1 10 GLY HA3 H 10.716 -4.938 -0.401 . . . 1.0 . . . . . . . . . . . . B . 9 GLY HA3 . . . . . . . . . c19602_2mgt 1 . 4 . 2026 . 2 1 10 GLY N N 11.656 -6.610 -1.254 . . . 1.0 . . . . . . . . . . . . B . 9 GLY N . . . . . . . . . c19602_2mgt 1 . 4 . 2027 . 2 1 10 GLY O O 9.233 -7.844 -0.815 . . . 1.0 . . . . . . . . . . . . B . 9 GLY O . . . . . . . . . c19602_2mgt 1 . 4 . 2028 . 2 1 11 TYR C C 6.809 -3.960 -1.315 . . . 1.0 . . . . . . . . . . . . B . 10 TYR C . . . . . . . . . c19602_2mgt 1 . 4 . 2029 . 2 1 11 TYR CA C 8.243 -4.405 -1.053 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CA . . . . . . . . . c19602_2mgt 1 . 4 . 2030 . 2 1 11 TYR CB C 9.164 -3.700 -2.067 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CB . . . . . . . . . c19602_2mgt 1 . 4 . 2031 . 2 1 11 TYR CD1 C 9.644 -1.808 -0.423 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CD1 . . . . . . . . . c19602_2mgt 1 . 4 . 2032 . 2 1 11 TYR CD2 C 11.364 -2.484 -2.003 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CD2 . . . . . . . . . c19602_2mgt 1 . 4 . 2033 . 2 1 11 TYR CE1 C 10.517 -0.869 0.141 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CE1 . . . . . . . . . c19602_2mgt 1 . 4 . 2034 . 2 1 11 TYR CE2 C 12.247 -1.548 -1.444 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CE2 . . . . . . . . . c19602_2mgt 1 . 4 . 2035 . 2 1 11 TYR CG C 10.069 -2.634 -1.482 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CG . . . . . . . . . c19602_2mgt 1 . 4 . 2036 . 2 1 11 TYR CZ C 11.828 -0.740 -0.361 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CZ . . . . . . . . . c19602_2mgt 1 . 4 . 2037 . 2 1 11 TYR H H 7.580 -6.286 -1.638 . . . 1.0 . . . . . . . . . . . . B . 10 TYR H . . . . . . . . . c19602_2mgt 1 . 4 . 2038 . 2 1 11 TYR HA H 8.525 -4.134 -0.035 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HA . . . . . . . . . c19602_2mgt 1 . 4 . 2039 . 2 1 11 TYR HB2 H 9.788 -4.437 -2.571 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HB2 . . . . . . . . . c19602_2mgt 1 . 4 . 2040 . 2 1 11 TYR HB3 H 8.556 -3.245 -2.844 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HB3 . . . . . . . . . c19602_2mgt 1 . 4 . 2041 . 2 1 11 TYR HD1 H 8.656 -1.897 -0.010 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HD1 . . . . . . . . . c19602_2mgt 1 . 4 . 2042 . 2 1 11 TYR HD2 H 11.690 -3.106 -2.823 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HD2 . . . . . . . . . c19602_2mgt 1 . 4 . 2043 . 2 1 11 TYR HE1 H 10.190 -0.270 0.974 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HE1 . . . . . . . . . c19602_2mgt 1 . 4 . 2044 . 2 1 11 TYR HE2 H 13.244 -1.465 -1.838 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HE2 . . . . . . . . . c19602_2mgt 1 . 4 . 2045 . 2 1 11 TYR HH H 13.562 0.111 -0.155 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HH . . . . . . . . . c19602_2mgt 1 . 4 . 2046 . 2 1 11 TYR N N 8.341 -5.844 -1.159 . . . 1.0 . . . . . . . . . . . . B . 10 TYR N . . . . . . . . . c19602_2mgt 1 . 4 . 2047 . 2 1 11 TYR O O 6.131 -4.469 -2.202 . . . 1.0 . . . . . . . . . . . . B . 10 TYR O . . . . . . . . . c19602_2mgt 1 . 4 . 2048 . 2 1 11 TYR OH O 12.681 0.141 0.227 . . . 1.0 . . . . . . . . . . . . B . 10 TYR OH . . . . . . . . . c19602_2mgt 1 . 4 . 2049 . 2 1 12 GLU C C 6.098 -0.580 -0.845 . . . 1.0 . . . . . . . . . . . . B . 11 GLU C . . . . . . . . . c19602_2mgt 1 . 4 . 2050 . 2 1 12 GLU CA C 5.463 -1.944 -1.118 . . . 1.0 . . . . . . . . . . . . B . 11 GLU CA . . . . . . . . . c19602_2mgt 1 . 4 . 2051 . 2 1 12 GLU CB C 4.123 -2.130 -0.411 . . . 1.0 . . . . . . . . . . . . B . 11 GLU CB . . . . . . . . . c19602_2mgt 1 . 4 . 2052 . 2 1 12 GLU CD C 1.913 -0.953 -0.201 . . . 1.0 . . . . . . . . . . . . B . 11 GLU CD . . . . . . . . . c19602_2mgt 1 . 4 . 2053 . 2 1 12 GLU CG C 3.033 -1.347 -1.145 . . . 1.0 . . . . . . . . . . . . B . 11 GLU CG . . . . . . . . . c19602_2mgt 1 . 4 . 2054 . 2 1 12 GLU H H 6.951 -2.619 0.184 . . . 1.0 . . . . . . . . . . . . B . 11 GLU H . . . . . . . . . c19602_2mgt 1 . 4 . 2055 . 2 1 12 GLU HA H 5.332 -2.095 -2.189 . . . 1.0 . . . . . . . . . . . . B . 11 GLU HA . . . . . . . . . c19602_2mgt 1 . 4 . 2056 . 2 1 12 GLU HB2 H 3.854 -3.186 -0.395 . . . 1.0 . . . . . . . . . . . . B . 11 GLU HB2 . . . . . . . . . c19602_2mgt 1 . 4 . 2057 . 2 1 12 GLU HB3 H 4.214 -1.787 0.619 . . . 1.0 . . . . . . . . . . . . B . 11 GLU HB3 . . . . . . . . . c19602_2mgt 1 . 4 . 2058 . 2 1 12 GLU HG2 H 3.458 -0.438 -1.572 . . . 1.0 . . . . . . . . . . . . B . 11 GLU HG2 . . . . . . . . . c19602_2mgt 1 . 4 . 2059 . 2 1 12 GLU HG3 H 2.633 -1.952 -1.957 . . . 1.0 . . . . . . . . . . . . B . 11 GLU HG3 . . . . . . . . . c19602_2mgt 1 . 4 . 2060 . 2 1 12 GLU N N 6.408 -2.906 -0.616 . . . 1.0 . . . . . . . . . . . . B . 11 GLU N . . . . . . . . . c19602_2mgt 1 . 4 . 2061 . 2 1 12 GLU O O 5.956 -0.038 0.248 . . . 1.0 . . . . . . . . . . . . B . 11 GLU O . . . . . . . . . c19602_2mgt 1 . 4 . 2062 . 2 1 12 GLU OE1 O 1.405 -1.837 0.523 . . . 1.0 . . . . . . . . . . . . B . 11 GLU OE1 . . . . . . . . . c19602_2mgt 1 . 4 . 2063 . 2 1 12 GLU OE2 O 1.591 0.241 -0.167 . . . 1.0 . . . . . . . . . . . . B . 11 GLU OE2 . . . . . . . . . c19602_2mgt 1 . 4 . 2064 . 2 1 13 VAL C C 6.932 2.368 -1.263 . . . 1.0 . . . . . . . . . . . . B . 12 VAL C . . . . . . . . . c19602_2mgt 1 . 4 . 2065 . 2 1 13 VAL CA C 7.686 1.132 -1.742 . . . 1.0 . . . . . . . . . . . . B . 12 VAL CA . . . . . . . . . c19602_2mgt 1 . 4 . 2066 . 2 1 13 VAL CB C 8.357 1.390 -3.104 . . . 1.0 . . . . . . . . . . . . B . 12 VAL CB . . . . . . . . . c19602_2mgt 1 . 4 . 2067 . 2 1 13 VAL CG1 C 9.112 2.729 -3.187 . . . 1.0 . . . . . . . . . . . . B . 12 VAL CG1 . . . . . . . . . c19602_2mgt 1 . 4 . 2068 . 2 1 13 VAL CG2 C 9.378 0.284 -3.349 . . . 1.0 . . . . . . . . . . . . B . 12 VAL CG2 . . . . . . . . . c19602_2mgt 1 . 4 . 2069 . 2 1 13 VAL H H 6.877 -0.561 -2.706 . . . 1.0 . . . . . . . . . . . . B . 12 VAL H . . . . . . . . . c19602_2mgt 1 . 4 . 2070 . 2 1 13 VAL HA H 8.465 0.915 -1.021 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HA . . . . . . . . . c19602_2mgt 1 . 4 . 2071 . 2 1 13 VAL HB H 7.604 1.364 -3.892 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HB . . . . . . . . . c19602_2mgt 1 . 4 . 2072 . 2 1 13 VAL HG11 H 9.692 2.786 -4.107 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HG11 . . . . . . . . . c19602_2mgt 1 . 4 . 2073 . 2 1 13 VAL HG12 H 8.402 3.555 -3.184 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HG12 . . . . . . . . . c19602_2mgt 1 . 4 . 2074 . 2 1 13 VAL HG13 H 9.789 2.829 -2.338 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HG13 . . . . . . . . . c19602_2mgt 1 . 4 . 2075 . 2 1 13 VAL HG21 H 10.195 0.379 -2.633 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HG21 . . . . . . . . . c19602_2mgt 1 . 4 . 2076 . 2 1 13 VAL HG22 H 8.928 -0.699 -3.251 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HG22 . . . . . . . . . c19602_2mgt 1 . 4 . 2077 . 2 1 13 VAL HG23 H 9.750 0.383 -4.359 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HG23 . . . . . . . . . c19602_2mgt 1 . 4 . 2078 . 2 1 13 VAL N N 6.833 -0.057 -1.833 . . . 1.0 . . . . . . . . . . . . B . 12 VAL N . . . . . . . . . c19602_2mgt 1 . 4 . 2079 . 2 1 13 VAL O O 7.545 3.294 -0.754 . . . 1.0 . . . . . . . . . . . . B . 12 VAL O . . . . . . . . . c19602_2mgt 1 . 4 . 2080 . 2 1 14 HIS C C 4.898 3.684 0.624 . . . 1.0 . . . . . . . . . . . . B . 13 HIS C . . . . . . . . . c19602_2mgt 1 . 4 . 2081 . 2 1 14 HIS CA C 4.737 3.402 -0.876 . . . 1.0 . . . . . . . . . . . . B . 13 HIS CA . . . . . . . . . c19602_2mgt 1 . 4 . 2082 . 2 1 14 HIS CB C 3.318 2.962 -1.231 . . . 1.0 . . . . . . . . . . . . B . 13 HIS CB . . . . . . . . . c19602_2mgt 1 . 4 . 2083 . 2 1 14 HIS CD2 C 2.017 5.151 -0.891 . . . 1.0 . . . . . . . . . . . . B . 13 HIS CD2 . . . . . . . . . c19602_2mgt 1 . 4 . 2084 . 2 1 14 HIS CE1 C 0.305 4.382 0.244 . . . 1.0 . . . . . . . . . . . . B . 13 HIS CE1 . . . . . . . . . c19602_2mgt 1 . 4 . 2085 . 2 1 14 HIS CG C 2.203 3.811 -0.699 . . . 1.0 . . . . . . . . . . . . B . 13 HIS CG . . . . . . . . . c19602_2mgt 1 . 4 . 2086 . 2 1 14 HIS H H 5.168 1.585 -1.841 . . . 1.0 . . . . . . . . . . . . B . 13 HIS H . . . . . . . . . c19602_2mgt 1 . 4 . 2087 . 2 1 14 HIS HA H 5.000 4.303 -1.416 . . . 1.0 . . . . . . . . . . . . B . 13 HIS HA . . . . . . . . . c19602_2mgt 1 . 4 . 2088 . 2 1 14 HIS HB2 H 3.218 2.922 -2.315 . . . 1.0 . . . . . . . . . . . . B . 13 HIS HB2 . . . . . . . . . c19602_2mgt 1 . 4 . 2089 . 2 1 14 HIS HB3 H 3.185 1.954 -0.849 . . . 1.0 . . . . . . . . . . . . B . 13 HIS HB3 . . . . . . . . . c19602_2mgt 1 . 4 . 2090 . 2 1 14 HIS HD1 H 0.969 2.395 0.304 . . . 1.0 . . . . . . . . . . . . B . 13 HIS HD1 . . . . . . . . . c19602_2mgt 1 . 4 . 2091 . 2 1 14 HIS HD2 H 2.678 5.815 -1.429 . . . 1.0 . . . . . . . . . . . . B . 13 HIS HD2 . . . . . . . . . c19602_2mgt 1 . 4 . 2092 . 2 1 14 HIS HE1 H -0.632 4.314 0.778 . . . 1.0 . . . . . . . . . . . . B . 13 HIS HE1 . . . . . . . . . c19602_2mgt 1 . 4 . 2093 . 2 1 14 HIS N N 5.607 2.366 -1.372 . . . 1.0 . . . . . . . . . . . . B . 13 HIS N . . . . . . . . . c19602_2mgt 1 . 4 . 2094 . 2 1 14 HIS ND1 N 1.130 3.351 0.018 . . . 1.0 . . . . . . . . . . . . B . 13 HIS ND1 . . . . . . . . . c19602_2mgt 1 . 4 . 2095 . 2 1 14 HIS NE2 N 0.801 5.503 -0.295 . . . 1.0 . . . . . . . . . . . . B . 13 HIS NE2 . . . . . . . . . c19602_2mgt 1 . 4 . 2096 . 2 1 14 HIS O O 4.549 4.779 1.046 . . . 1.0 . . . . . . . . . . . . B . 13 HIS O . . . . . . . . . c19602_2mgt 1 . 4 . 2097 . 2 1 15 HIS C C 7.198 3.113 3.178 . . . 1.0 . . . . . . . . . . . . B . 14 HIS C . . . . . . . . . c19602_2mgt 1 . 4 . 2098 . 2 1 15 HIS CA C 5.707 2.987 2.848 . . . 1.0 . . . . . . . . . . . . B . 14 HIS CA . . . . . . . . . c19602_2mgt 1 . 4 . 2099 . 2 1 15 HIS CB C 5.061 1.863 3.668 . . . 1.0 . . . . . . . . . . . . B . 14 HIS CB . . . . . . . . . c19602_2mgt 1 . 4 . 2100 . 2 1 15 HIS CD2 C 3.000 0.740 2.672 . . . 1.0 . . . . . . . . . . . . B . 14 HIS CD2 . . . . . . . . . c19602_2mgt 1 . 4 . 2101 . 2 1 15 HIS CE1 C 1.462 2.190 3.242 . . . 1.0 . . . . . . . . . . . . B . 14 HIS CE1 . . . . . . . . . c19602_2mgt 1 . 4 . 2102 . 2 1 15 HIS CG C 3.595 1.726 3.402 . . . 1.0 . . . . . . . . . . . . B . 14 HIS CG . . . . . . . . . c19602_2mgt 1 . 4 . 2103 . 2 1 15 HIS H H 5.725 1.871 1.032 . . . 1.0 . . . . . . . . . . . . B . 14 HIS H . . . . . . . . . c19602_2mgt 1 . 4 . 2104 . 2 1 15 HIS HA H 5.241 3.921 3.160 . . . 1.0 . . . . . . . . . . . . B . 14 HIS HA . . . . . . . . . c19602_2mgt 1 . 4 . 2105 . 2 1 15 HIS HB2 H 5.549 0.920 3.441 . . . 1.0 . . . . . . . . . . . . B . 14 HIS HB2 . . . . . . . . . c19602_2mgt 1 . 4 . 2106 . 2 1 15 HIS HB3 H 5.189 2.058 4.731 . . . 1.0 . . . . . . . . . . . . B . 14 HIS HB3 . . . . . . . . . c19602_2mgt 1 . 4 . 2107 . 2 1 15 HIS HD1 H 2.755 3.476 4.279 . . . 1.0 . . . . . . . . . . . . B . 14 HIS HD1 . . . . . . . . . c19602_2mgt 1 . 4 . 2108 . 2 1 15 HIS HD2 H 3.506 -0.094 2.213 . . . 1.0 . . . . . . . . . . . . B . 14 HIS HD2 . . . . . . . . . c19602_2mgt 1 . 4 . 2109 . 2 1 15 HIS HE1 H 0.519 2.708 3.320 . . . 1.0 . . . . . . . . . . . . B . 14 HIS HE1 . . . . . . . . . c19602_2mgt 1 . 4 . 2110 . 2 1 15 HIS N N 5.450 2.762 1.425 . . . 1.0 . . . . . . . . . . . . B . 14 HIS N . . . . . . . . . c19602_2mgt 1 . 4 . 2111 . 2 1 15 HIS ND1 N 2.620 2.623 3.757 . . . 1.0 . . . . . . . . . . . . B . 14 HIS ND1 . . . . . . . . . c19602_2mgt 1 . 4 . 2112 . 2 1 15 HIS NE2 N 1.643 1.042 2.577 . . . 1.0 . . . . . . . . . . . . B . 14 HIS NE2 . . . . . . . . . c19602_2mgt 1 . 4 . 2113 . 2 1 15 HIS O O 7.518 3.177 4.358 . . . 1.0 . . . . . . . . . . . . B . 14 HIS O . . . . . . . . . c19602_2mgt 1 . 4 . 2114 . 2 1 16 GLN C C 10.106 4.123 3.325 . . . 1.0 . . . . . . . . . . . . B . 15 GLN C . . . . . . . . . c19602_2mgt 1 . 4 . 2115 . 2 1 16 GLN CA C 9.547 3.026 2.420 . . . 1.0 . . . . . . . . . . . . B . 15 GLN CA . . . . . . . . . c19602_2mgt 1 . 4 . 2116 . 2 1 16 GLN CB C 10.319 2.921 1.093 . . . 1.0 . . . . . . . . . . . . B . 15 GLN CB . . . . . . . . . c19602_2mgt 1 . 4 . 2117 . 2 1 16 GLN CD C 9.798 5.179 -0.120 . . . 1.0 . . . . . . . . . . . . B . 15 GLN CD . . . . . . . . . c19602_2mgt 1 . 4 . 2118 . 2 1 16 GLN CG C 10.843 4.197 0.407 . . . 1.0 . . . . . . . . . . . . B . 15 GLN CG . . . . . . . . . c19602_2mgt 1 . 4 . 2119 . 2 1 16 GLN H H 7.802 3.149 1.231 . . . 1.0 . . . . . . . . . . . . B . 15 GLN H . . . . . . . . . c19602_2mgt 1 . 4 . 2120 . 2 1 16 GLN HA H 9.687 2.076 2.935 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HA . . . . . . . . . c19602_2mgt 1 . 4 . 2121 . 2 1 16 GLN HB2 H 11.210 2.343 1.325 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HB2 . . . . . . . . . c19602_2mgt 1 . 4 . 2122 . 2 1 16 GLN HB3 H 9.734 2.344 0.384 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HB3 . . . . . . . . . c19602_2mgt 1 . 4 . 2123 . 2 1 16 GLN HE21 H 10.937 5.658 -1.733 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HE21 . . . . . . . . . c19602_2mgt 1 . 4 . 2124 . 2 1 16 GLN HE22 H 9.403 6.494 -1.603 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HE22 . . . . . . . . . c19602_2mgt 1 . 4 . 2125 . 2 1 16 GLN HG2 H 11.489 4.732 1.099 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HG2 . . . . . . . . . c19602_2mgt 1 . 4 . 2126 . 2 1 16 GLN HG3 H 11.457 3.876 -0.435 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HG3 . . . . . . . . . c19602_2mgt 1 . 4 . 2127 . 2 1 16 GLN N N 8.109 3.138 2.191 . . . 1.0 . . . . . . . . . . . . B . 15 GLN N . . . . . . . . . c19602_2mgt 1 . 4 . 2128 . 2 1 16 GLN NE2 N 10.067 5.821 -1.249 . . . 1.0 . . . . . . . . . . . . B . 15 GLN NE2 . . . . . . . . . c19602_2mgt 1 . 4 . 2129 . 2 1 16 GLN O O 10.945 3.820 4.161 . . . 1.0 . . . . . . . . . . . . B . 15 GLN O . . . . . . . . . c19602_2mgt 1 . 4 . 2130 . 2 1 16 GLN OE1 O 8.763 5.400 0.485 . . . 1.0 . . . . . . . . . . . . B . 15 GLN OE1 . . . . . . . . . c19602_2mgt 1 . 4 . 2131 . 2 1 17 LYS C C 9.469 6.410 5.444 . . . 1.0 . . . . . . . . . . . . B . 16 LYS C . . . . . . . . . c19602_2mgt 1 . 4 . 2132 . 2 1 17 LYS CA C 9.930 6.536 3.985 . . . 1.0 . . . . . . . . . . . . B . 16 LYS CA . . . . . . . . . c19602_2mgt 1 . 4 . 2133 . 2 1 17 LYS CB C 9.250 7.764 3.352 . . . 1.0 . . . . . . . . . . . . B . 16 LYS CB . . . . . . . . . c19602_2mgt 1 . 4 . 2134 . 2 1 17 LYS CD C 9.113 9.362 1.414 . . . 1.0 . . . . . . . . . . . . B . 16 LYS CD . . . . . . . . . c19602_2mgt 1 . 4 . 2135 . 2 1 17 LYS CE C 9.662 9.751 0.043 . . . 1.0 . . . . . . . . . . . . B . 16 LYS CE . . . . . . . . . c19602_2mgt 1 . 4 . 2136 . 2 1 17 LYS CG C 9.962 8.276 2.092 . . . 1.0 . . . . . . . . . . . . B . 16 LYS CG . . . . . . . . . c19602_2mgt 1 . 4 . 2137 . 2 1 17 LYS H H 8.973 5.487 2.411 . . . 1.0 . . . . . . . . . . . . B . 16 LYS H . . . . . . . . . c19602_2mgt 1 . 4 . 2138 . 2 1 17 LYS HA H 11.011 6.690 3.983 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HA . . . . . . . . . c19602_2mgt 1 . 4 . 2139 . 2 1 17 LYS HB2 H 8.216 7.512 3.114 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HB2 . . . . . . . . . c19602_2mgt 1 . 4 . 2140 . 2 1 17 LYS HB3 H 9.234 8.575 4.080 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HB3 . . . . . . . . . c19602_2mgt 1 . 4 . 2141 . 2 1 17 LYS HD2 H 8.102 8.983 1.270 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HD2 . . . . . . . . . c19602_2mgt 1 . 4 . 2142 . 2 1 17 LYS HD3 H 9.062 10.245 2.050 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HD3 . . . . . . . . . c19602_2mgt 1 . 4 . 2143 . 2 1 17 LYS HE2 H 9.825 8.854 -0.553 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HE2 . . . . . . . . . c19602_2mgt 1 . 4 . 2144 . 2 1 17 LYS HE3 H 8.933 10.383 -0.461 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HE3 . . . . . . . . . c19602_2mgt 1 . 4 . 2145 . 2 1 17 LYS HG2 H 10.935 8.683 2.367 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HG2 . . . . . . . . . c19602_2mgt 1 . 4 . 2146 . 2 1 17 LYS HG3 H 10.114 7.456 1.395 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HG3 . . . . . . . . . c19602_2mgt 1 . 4 . 2147 . 2 1 17 LYS HZ1 H 11.195 10.825 -0.771 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HZ1 . . . . . . . . . c19602_2mgt 1 . 4 . 2148 . 2 1 17 LYS HZ2 H 10.790 11.299 0.748 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HZ2 . . . . . . . . . c19602_2mgt 1 . 4 . 2149 . 2 1 17 LYS HZ3 H 11.642 9.908 0.522 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HZ3 . . . . . . . . . c19602_2mgt 1 . 4 . 2150 . 2 1 17 LYS N N 9.608 5.357 3.183 . . . 1.0 . . . . . . . . . . . . B . 16 LYS N . . . . . . . . . c19602_2mgt 1 . 4 . 2151 . 2 1 17 LYS NZ N 10.916 10.500 0.143 . . . 1.0 . . . . . . . . . . . . B . 16 LYS NZ . . . . . . . . . c19602_2mgt 1 . 4 . 2152 . 2 1 17 LYS O O 10.016 7.090 6.302 . . . 1.0 . . . . . . . . . . . . B . 16 LYS O . . . . . . . . . c19602_2mgt 1 . 4 . 2153 . 2 1 18 NH2 HN1 H 8.068 4.994 5.032 . . . 1.0 . . . . . . . . . . . . B . 17 NH2 HN1 . . . . . . . . . c19602_2mgt 1 . 4 . 2154 . 2 1 18 NH2 HN2 H 8.179 5.478 6.711 . . . 1.0 . . . . . . . . . . . . B . 17 NH2 HN2 . . . . . . . . . c19602_2mgt 1 . 4 . 2155 . 2 1 18 NH2 N N 8.485 5.565 5.753 . . . 1.0 . . . . . . . . . . . . B . 17 NH2 N . . . . . . . . . c19602_2mgt 1 . 4 . 2156 . 3 2 1 ZN ZN Zn 0.430 -0.170 1.405 . . . 1.0 . . . . . . . . . . . . A . 101 ZN ZN . . . . . . . . . c19602_2mgt 1 . 5 . 2157 . 1 1 1 ACE C C -13.041 -4.159 -1.071 . . . 1.0 . . . . . . . . . . . . A . 0 ACE C . . . . . . . . . c19602_2mgt 1 . 5 . 2158 . 1 1 1 ACE CH3 C -11.581 -4.491 -0.826 . . . 1.0 . . . . . . . . . . . . A . 0 ACE CH3 . . . . . . . . . c19602_2mgt 1 . 5 . 2159 . 1 1 1 ACE H1 H -11.160 -3.768 -0.132 . . . 1.0 . . . . . . . . . . . . A . 0 ACE H1 . . . . . . . . . c19602_2mgt 1 . 5 . 2160 . 1 1 1 ACE H2 H -11.500 -5.488 -0.399 . . . 1.0 . . . . . . . . . . . . A . 0 ACE H2 . . . . . . . . . c19602_2mgt 1 . 5 . 2161 . 1 1 1 ACE H3 H -11.027 -4.452 -1.764 . . . 1.0 . . . . . . . . . . . . A . 0 ACE H3 . . . . . . . . . c19602_2mgt 1 . 5 . 2162 . 1 1 1 ACE O O -13.421 -3.901 -2.208 . . . 1.0 . . . . . . . . . . . . A . 0 ACE O . . . . . . . . . c19602_2mgt 1 . 5 . 2163 . 1 1 2 ASP C C -15.555 -2.399 -0.189 . . . 1.0 . . . . . . . . . . . . A . 1 ASP C . . . . . . . . . c19602_2mgt 1 . 5 . 2164 . 1 1 2 ASP CA C -15.293 -3.902 -0.100 . . . 1.0 . . . . . . . . . . . . A . 1 ASP CA . . . . . . . . . c19602_2mgt 1 . 5 . 2165 . 1 1 2 ASP CB C -16.029 -4.506 1.100 . . . 1.0 . . . . . . . . . . . . A . 1 ASP CB . . . . . . . . . c19602_2mgt 1 . 5 . 2166 . 1 1 2 ASP CG C -15.755 -5.994 1.236 . . . 1.0 . . . . . . . . . . . . A . 1 ASP CG . . . . . . . . . c19602_2mgt 1 . 5 . 2167 . 1 1 2 ASP H H -13.488 -4.400 0.894 . . . 1.0 . . . . . . . . . . . . A . 1 ASP H . . . . . . . . . c19602_2mgt 1 . 5 . 2168 . 1 1 2 ASP HA H -15.676 -4.380 -1.001 . . . 1.0 . . . . . . . . . . . . A . 1 ASP HA . . . . . . . . . c19602_2mgt 1 . 5 . 2169 . 1 1 2 ASP HB2 H -15.735 -3.999 2.014 . . . 1.0 . . . . . . . . . . . . A . 1 ASP HB2 . . . . . . . . . c19602_2mgt 1 . 5 . 2170 . 1 1 2 ASP HB3 H -17.102 -4.359 0.968 . . . 1.0 . . . . . . . . . . . . A . 1 ASP HB3 . . . . . . . . . c19602_2mgt 1 . 5 . 2171 . 1 1 2 ASP N N -13.861 -4.176 -0.016 . . . 1.0 . . . . . . . . . . . . A . 1 ASP N . . . . . . . . . c19602_2mgt 1 . 5 . 2172 . 1 1 2 ASP O O -14.777 -1.601 0.332 . . . 1.0 . . . . . . . . . . . . A . 1 ASP O . . . . . . . . . c19602_2mgt 1 . 5 . 2173 . 1 1 2 ASP OD1 O -16.468 -6.771 0.597 . . . 1.0 . . . . . . . . . . . . A . 1 ASP OD1 . . . . . . . . . c19602_2mgt 1 . 5 . 2174 . 1 1 2 ASP OD2 O -14.810 -6.351 1.981 . . . 1.0 . . . . . . . . . . . . A . 1 ASP OD2 . . . . . . . . . c19602_2mgt 1 . 5 . 2175 . 1 1 3 ALA C C -17.163 0.182 0.137 . . . 1.0 . . . . . . . . . . . . A . 2 ALA C . . . . . . . . . c19602_2mgt 1 . 5 . 2176 . 1 1 3 ALA CA C -17.077 -0.665 -1.122 . . . 1.0 . . . . . . . . . . . . A . 2 ALA CA . . . . . . . . . c19602_2mgt 1 . 5 . 2177 . 1 1 3 ALA CB C -18.428 -0.671 -1.842 . . . 1.0 . . . . . . . . . . . . A . 2 ALA CB . . . . . . . . . c19602_2mgt 1 . 5 . 2178 . 1 1 3 ALA H H -17.264 -2.766 -1.208 . . . 1.0 . . . . . . . . . . . . A . 2 ALA H . . . . . . . . . c19602_2mgt 1 . 5 . 2179 . 1 1 3 ALA HA H -16.339 -0.213 -1.779 . . . 1.0 . . . . . . . . . . . . A . 2 ALA HA . . . . . . . . . c19602_2mgt 1 . 5 . 2180 . 1 1 3 ALA HB1 H -18.348 -1.228 -2.774 . . . 1.0 . . . . . . . . . . . . A . 2 ALA HB1 . . . . . . . . . c19602_2mgt 1 . 5 . 2181 . 1 1 3 ALA HB2 H -19.186 -1.131 -1.210 . . . 1.0 . . . . . . . . . . . . A . 2 ALA HB2 . . . . . . . . . c19602_2mgt 1 . 5 . 2182 . 1 1 3 ALA HB3 H -18.725 0.355 -2.058 . . . 1.0 . . . . . . . . . . . . A . 2 ALA HB3 . . . . . . . . . c19602_2mgt 1 . 5 . 2183 . 1 1 3 ALA N N -16.673 -2.037 -0.835 . . . 1.0 . . . . . . . . . . . . A . 2 ALA N . . . . . . . . . c19602_2mgt 1 . 5 . 2184 . 1 1 3 ALA O O -16.709 1.317 0.123 . . . 1.0 . . . . . . . . . . . . A . 2 ALA O . . . . . . . . . c19602_2mgt 1 . 5 . 2185 . 1 1 4 GLU C C -16.462 0.783 3.070 . . . 1.0 . . . . . . . . . . . . A . 3 GLU C . . . . . . . . . c19602_2mgt 1 . 5 . 2186 . 1 1 4 GLU CA C -17.792 0.266 2.525 . . . 1.0 . . . . . . . . . . . . A . 3 GLU CA . . . . . . . . . c19602_2mgt 1 . 5 . 2187 . 1 1 4 GLU CB C -18.435 -0.696 3.525 . . . 1.0 . . . . . . . . . . . . A . 3 GLU CB . . . . . . . . . c19602_2mgt 1 . 5 . 2188 . 1 1 4 GLU CD C -18.245 -2.982 4.612 . . . 1.0 . . . . . . . . . . . . A . 3 GLU CD . . . . . . . . . c19602_2mgt 1 . 5 . 2189 . 1 1 4 GLU CG C -17.579 -1.948 3.729 . . . 1.0 . . . . . . . . . . . . A . 3 GLU CG . . . . . . . . . c19602_2mgt 1 . 5 . 2190 . 1 1 4 GLU H H -18.010 -1.335 1.164 . . . 1.0 . . . . . . . . . . . . A . 3 GLU H . . . . . . . . . c19602_2mgt 1 . 5 . 2191 . 1 1 4 GLU HA H -18.449 1.125 2.420 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HA . . . . . . . . . c19602_2mgt 1 . 5 . 2192 . 1 1 4 GLU HB2 H -18.553 -0.180 4.478 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HB2 . . . . . . . . . c19602_2mgt 1 . 5 . 2193 . 1 1 4 GLU HB3 H -19.421 -0.987 3.168 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HB3 . . . . . . . . . c19602_2mgt 1 . 5 . 2194 . 1 1 4 GLU HG2 H -17.369 -2.409 2.762 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HG2 . . . . . . . . . c19602_2mgt 1 . 5 . 2195 . 1 1 4 GLU HG3 H -16.646 -1.652 4.196 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HG3 . . . . . . . . . c19602_2mgt 1 . 5 . 2196 . 1 1 4 GLU N N -17.680 -0.383 1.229 . . . 1.0 . . . . . . . . . . . . A . 3 GLU N . . . . . . . . . c19602_2mgt 1 . 5 . 2197 . 1 1 4 GLU O O -16.516 1.670 3.907 . . . 1.0 . . . . . . . . . . . . A . 3 GLU O . . . . . . . . . c19602_2mgt 1 . 5 . 2198 . 1 1 4 GLU OE1 O -18.812 -2.578 5.651 . . . 1.0 . . . . . . . . . . . . A . 3 GLU OE1 . . . . . . . . . c19602_2mgt 1 . 5 . 2199 . 1 1 4 GLU OE2 O -18.188 -4.167 4.272 . . . 1.0 . . . . . . . . . . . . A . 3 GLU OE2 . . . . . . . . . c19602_2mgt 1 . 5 . 2200 . 1 1 5 PHE C C -13.308 1.603 1.941 . . . 1.0 . . . . . . . . . . . . A . 4 PHE C . . . . . . . . . c19602_2mgt 1 . 5 . 2201 . 1 1 5 PHE CA C -13.970 0.718 2.987 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CA . . . . . . . . . c19602_2mgt 1 . 5 . 2202 . 1 1 5 PHE CB C -13.068 -0.488 3.252 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CB . . . . . . . . . c19602_2mgt 1 . 5 . 2203 . 1 1 5 PHE CD1 C -13.822 -0.954 5.602 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CD1 . . . . . . . . . c19602_2mgt 1 . 5 . 2204 . 1 1 5 PHE CD2 C -14.139 -2.665 3.903 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CD2 . . . . . . . . . c19602_2mgt 1 . 5 . 2205 . 1 1 5 PHE CE1 C -14.486 -1.759 6.539 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CE1 . . . . . . . . . c19602_2mgt 1 . 5 . 2206 . 1 1 5 PHE CE2 C -14.818 -3.467 4.835 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CE2 . . . . . . . . . c19602_2mgt 1 . 5 . 2207 . 1 1 5 PHE CG C -13.654 -1.408 4.286 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CG . . . . . . . . . c19602_2mgt 1 . 5 . 2208 . 1 1 5 PHE CZ C -15.000 -3.009 6.151 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CZ . . . . . . . . . c19602_2mgt 1 . 5 . 2209 . 1 1 5 PHE H H -15.367 -0.484 1.935 . . . 1.0 . . . . . . . . . . . . A . 4 PHE H . . . . . . . . . c19602_2mgt 1 . 5 . 2210 . 1 1 5 PHE HA H -14.041 1.303 3.902 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HA . . . . . . . . . c19602_2mgt 1 . 5 . 2211 . 1 1 5 PHE HB2 H -12.913 -1.033 2.320 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HB2 . . . . . . . . . c19602_2mgt 1 . 5 . 2212 . 1 1 5 PHE HB3 H -12.096 -0.144 3.608 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HB3 . . . . . . . . . c19602_2mgt 1 . 5 . 2213 . 1 1 5 PHE HD1 H -13.466 0.028 5.875 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HD1 . . . . . . . . . c19602_2mgt 1 . 5 . 2214 . 1 1 5 PHE HD2 H -14.029 -2.979 2.879 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HD2 . . . . . . . . . c19602_2mgt 1 . 5 . 2215 . 1 1 5 PHE HE1 H -14.607 -1.408 7.550 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HE1 . . . . . . . . . c19602_2mgt 1 . 5 . 2216 . 1 1 5 PHE HE2 H -15.238 -4.409 4.528 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HE2 . . . . . . . . . c19602_2mgt 1 . 5 . 2217 . 1 1 5 PHE HZ H -15.539 -3.619 6.860 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HZ . . . . . . . . . c19602_2mgt 1 . 5 . 2218 . 1 1 5 PHE N N -15.311 0.268 2.607 . . . 1.0 . . . . . . . . . . . . A . 4 PHE N . . . . . . . . . c19602_2mgt 1 . 5 . 2219 . 1 1 5 PHE O O -12.319 2.247 2.275 . . . 1.0 . . . . . . . . . . . . A . 4 PHE O . . . . . . . . . c19602_2mgt 1 . 5 . 2220 . 1 1 6 ARG C C -13.815 4.027 -0.059 . . . 1.0 . . . . . . . . . . . . A . 5 ARG C . . . . . . . . . c19602_2mgt 1 . 5 . 2221 . 1 1 6 ARG CA C -13.382 2.571 -0.343 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CA . . . . . . . . . c19602_2mgt 1 . 5 . 2222 . 1 1 6 ARG CB C -13.876 2.058 -1.709 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CB . . . . . . . . . c19602_2mgt 1 . 5 . 2223 . 1 1 6 ARG CD C -12.027 0.221 -1.844 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CD . . . . . . . . . c19602_2mgt 1 . 5 . 2224 . 1 1 6 ARG CG C -13.497 0.607 -2.061 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CG . . . . . . . . . c19602_2mgt 1 . 5 . 2225 . 1 1 6 ARG CZ C -10.883 1.198 -3.837 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CZ . . . . . . . . . c19602_2mgt 1 . 5 . 2226 . 1 1 6 ARG H H -14.652 1.107 0.505 . . . 1.0 . . . . . . . . . . . . A . 5 ARG H . . . . . . . . . c19602_2mgt 1 . 5 . 2227 . 1 1 6 ARG HA H -12.292 2.552 -0.350 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HA . . . . . . . . . c19602_2mgt 1 . 5 . 2228 . 1 1 6 ARG HB2 H -14.963 2.136 -1.735 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HB2 . . . . . . . . . c19602_2mgt 1 . 5 . 2229 . 1 1 6 ARG HB3 H -13.476 2.708 -2.487 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HB3 . . . . . . . . . c19602_2mgt 1 . 5 . 2230 . 1 1 6 ARG HD2 H -11.820 0.221 -0.779 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HD2 . . . . . . . . . c19602_2mgt 1 . 5 . 2231 . 1 1 6 ARG HD3 H -11.861 -0.793 -2.207 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HD3 . . . . . . . . . c19602_2mgt 1 . 5 . 2232 . 1 1 6 ARG HE H -10.612 1.804 -1.931 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HE . . . . . . . . . c19602_2mgt 1 . 5 . 2233 . 1 1 6 ARG HG2 H -14.107 -0.067 -1.471 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HG2 . . . . . . . . . c19602_2mgt 1 . 5 . 2234 . 1 1 6 ARG HG3 H -13.751 0.436 -3.104 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HG3 . . . . . . . . . c19602_2mgt 1 . 5 . 2235 . 1 1 6 ARG HH11 H -12.108 -0.345 -4.346 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH11 . . . . . . . . . c19602_2mgt 1 . 5 . 2236 . 1 1 6 ARG HH12 H -11.302 0.448 -5.680 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH12 . . . . . . . . . c19602_2mgt 1 . 5 . 2237 . 1 1 6 ARG HH21 H -9.609 2.776 -3.711 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH21 . . . . . . . . . c19602_2mgt 1 . 5 . 2238 . 1 1 6 ARG HH22 H -9.913 2.180 -5.325 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH22 . . . . . . . . . c19602_2mgt 1 . 5 . 2239 . 1 1 6 ARG N N -13.843 1.675 0.714 . . . 1.0 . . . . . . . . . . . . A . 5 ARG N . . . . . . . . . c19602_2mgt 1 . 5 . 2240 . 1 1 6 ARG NE N -11.100 1.142 -2.516 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NE . . . . . . . . . c19602_2mgt 1 . 5 . 2241 . 1 1 6 ARG NH1 N -11.479 0.366 -4.689 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NH1 . . . . . . . . . c19602_2mgt 1 . 5 . 2242 . 1 1 6 ARG NH2 N -10.057 2.116 -4.329 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NH2 . . . . . . . . . c19602_2mgt 1 . 5 . 2243 . 1 1 6 ARG O O -14.295 4.726 -0.946 . . . 1.0 . . . . . . . . . . . . A . 5 ARG O . . . . . . . . . c19602_2mgt 1 . 5 . 2244 . 1 1 7 ARG C C -13.057 6.829 1.603 . . . 1.0 . . . . . . . . . . . . A . 6 ARG C . . . . . . . . . c19602_2mgt 1 . 5 . 2245 . 1 1 7 ARG CA C -14.128 5.748 1.721 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CA . . . . . . . . . c19602_2mgt 1 . 5 . 2246 . 1 1 7 ARG CB C -14.506 5.582 3.198 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CB . . . . . . . . . c19602_2mgt 1 . 5 . 2247 . 1 1 7 ARG CD C -16.917 4.670 2.805 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CD . . . . . . . . . c19602_2mgt 1 . 5 . 2248 . 1 1 7 ARG CG C -15.547 4.493 3.473 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CG . . . . . . . . . c19602_2mgt 1 . 5 . 2249 . 1 1 7 ARG CZ C -17.263 4.610 0.306 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CZ . . . . . . . . . c19602_2mgt 1 . 5 . 2250 . 1 1 7 ARG H H -13.294 3.836 1.878 . . . 1.0 . . . . . . . . . . . . A . 6 ARG H . . . . . . . . . c19602_2mgt 1 . 5 . 2251 . 1 1 7 ARG HA H -15.008 6.049 1.169 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HA . . . . . . . . . c19602_2mgt 1 . 5 . 2252 . 1 1 7 ARG HB2 H -13.605 5.322 3.756 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HB2 . . . . . . . . . c19602_2mgt 1 . 5 . 2253 . 1 1 7 ARG HB3 H -14.879 6.529 3.584 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HB3 . . . . . . . . . c19602_2mgt 1 . 5 . 2254 . 1 1 7 ARG HD2 H -17.662 4.187 3.437 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HD2 . . . . . . . . . c19602_2mgt 1 . 5 . 2255 . 1 1 7 ARG HD3 H -17.176 5.721 2.751 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HD3 . . . . . . . . . c19602_2mgt 1 . 5 . 2256 . 1 1 7 ARG HE H -16.884 3.021 1.487 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HE . . . . . . . . . c19602_2mgt 1 . 5 . 2257 . 1 1 7 ARG HG2 H -15.118 3.540 3.177 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HG2 . . . . . . . . . c19602_2mgt 1 . 5 . 2258 . 1 1 7 ARG HG3 H -15.710 4.462 4.548 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HG3 . . . . . . . . . c19602_2mgt 1 . 5 . 2259 . 1 1 7 ARG HH11 H -17.205 6.539 0.944 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH11 . . . . . . . . . c19602_2mgt 1 . 5 . 2260 . 1 1 7 ARG HH12 H -17.585 6.316 -0.749 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH12 . . . . . . . . . c19602_2mgt 1 . 5 . 2261 . 1 1 7 ARG HH21 H -17.428 2.849 -0.689 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH21 . . . . . . . . . c19602_2mgt 1 . 5 . 2262 . 1 1 7 ARG HH22 H -17.677 4.280 -1.657 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH22 . . . . . . . . . c19602_2mgt 1 . 5 . 2263 . 1 1 7 ARG N N -13.675 4.472 1.196 . . . 1.0 . . . . . . . . . . . . A . 6 ARG N . . . . . . . . . c19602_2mgt 1 . 5 . 2264 . 1 1 7 ARG NE N -16.991 4.025 1.484 . . . 1.0 . . . . . . . . . . . . A . 6 ARG NE . . . . . . . . . c19602_2mgt 1 . 5 . 2265 . 1 1 7 ARG NH1 N -17.374 5.929 0.161 . . . 1.0 . . . . . . . . . . . . A . 6 ARG NH1 . . . . . . . . . c19602_2mgt 1 . 5 . 2266 . 1 1 7 ARG NH2 N -17.434 3.855 -0.775 . . . 1.0 . . . . . . . . . . . . A . 6 ARG NH2 . . . . . . . . . c19602_2mgt 1 . 5 . 2267 . 1 1 7 ARG O O -11.863 6.548 1.693 . . . 1.0 . . . . . . . . . . . . A . 6 ARG O . . . . . . . . . c19602_2mgt 1 . 5 . 2268 . 1 1 8 ASP C C -11.804 9.399 2.812 . . . 1.0 . . . . . . . . . . . . A . 7 ASP C . . . . . . . . . c19602_2mgt 1 . 5 . 2269 . 1 1 8 ASP CA C -12.597 9.248 1.507 . . . 1.0 . . . . . . . . . . . . A . 7 ASP CA . . . . . . . . . c19602_2mgt 1 . 5 . 2270 . 1 1 8 ASP CB C -13.376 10.510 1.148 . . . 1.0 . . . . . . . . . . . . A . 7 ASP CB . . . . . . . . . c19602_2mgt 1 . 5 . 2271 . 1 1 8 ASP CG C -14.309 11.000 2.248 . . . 1.0 . . . . . . . . . . . . A . 7 ASP CG . . . . . . . . . c19602_2mgt 1 . 5 . 2272 . 1 1 8 ASP H H -14.484 8.264 1.463 . . . 1.0 . . . . . . . . . . . . A . 7 ASP H . . . . . . . . . c19602_2mgt 1 . 5 . 2273 . 1 1 8 ASP HA H -11.878 9.094 0.714 . . . 1.0 . . . . . . . . . . . . A . 7 ASP HA . . . . . . . . . c19602_2mgt 1 . 5 . 2274 . 1 1 8 ASP HB2 H -12.652 11.286 0.921 . . . 1.0 . . . . . . . . . . . . A . 7 ASP HB2 . . . . . . . . . c19602_2mgt 1 . 5 . 2275 . 1 1 8 ASP HB3 H -13.965 10.313 0.255 . . . 1.0 . . . . . . . . . . . . A . 7 ASP HB3 . . . . . . . . . c19602_2mgt 1 . 5 . 2276 . 1 1 8 ASP N N -13.490 8.090 1.507 . . . 1.0 . . . . . . . . . . . . A . 7 ASP N . . . . . . . . . c19602_2mgt 1 . 5 . 2277 . 1 1 8 ASP O O -10.812 10.114 2.861 . . . 1.0 . . . . . . . . . . . . A . 7 ASP O . . . . . . . . . c19602_2mgt 1 . 5 . 2278 . 1 1 8 ASP OD1 O -15.308 10.305 2.505 . . . 1.0 . . . . . . . . . . . . A . 7 ASP OD1 . . . . . . . . . c19602_2mgt 1 . 5 . 2279 . 1 1 8 ASP OD2 O -14.036 12.072 2.815 . . . 1.0 . . . . . . . . . . . . A . 7 ASP OD2 . . . . . . . . . c19602_2mgt 1 . 5 . 2280 . 1 1 9 SER C C -10.090 8.071 5.075 . . . 1.0 . . . . . . . . . . . . A . 8 SER C . . . . . . . . . c19602_2mgt 1 . 5 . 2281 . 1 1 9 SER CA C -11.555 8.518 5.133 . . . 1.0 . . . . . . . . . . . . A . 8 SER CA . . . . . . . . . c19602_2mgt 1 . 5 . 2282 . 1 1 9 SER CB C -12.302 7.451 5.933 . . . 1.0 . . . . . . . . . . . . A . 8 SER CB . . . . . . . . . c19602_2mgt 1 . 5 . 2283 . 1 1 9 SER H H -13.070 8.155 3.719 . . . 1.0 . . . . . . . . . . . . A . 8 SER H . . . . . . . . . c19602_2mgt 1 . 5 . 2284 . 1 1 9 SER HA H -11.616 9.469 5.658 . . . 1.0 . . . . . . . . . . . . A . 8 SER HA . . . . . . . . . c19602_2mgt 1 . 5 . 2285 . 1 1 9 SER HB2 H -12.135 6.481 5.463 . . . 1.0 . . . . . . . . . . . . A . 8 SER HB2 . . . . . . . . . c19602_2mgt 1 . 5 . 2286 . 1 1 9 SER HB3 H -11.919 7.424 6.953 . . . 1.0 . . . . . . . . . . . . A . 8 SER HB3 . . . . . . . . . c19602_2mgt 1 . 5 . 2287 . 1 1 9 SER HG H -14.120 6.927 6.318 . . . 1.0 . . . . . . . . . . . . A . 8 SER HG . . . . . . . . . c19602_2mgt 1 . 5 . 2288 . 1 1 9 SER N N -12.211 8.664 3.845 . . . 1.0 . . . . . . . . . . . . A . 8 SER N . . . . . . . . . c19602_2mgt 1 . 5 . 2289 . 1 1 9 SER O O -9.436 8.147 6.107 . . . 1.0 . . . . . . . . . . . . A . 8 SER O . . . . . . . . . c19602_2mgt 1 . 5 . 2290 . 1 1 9 SER OG O -13.684 7.708 5.962 . . . 1.0 . . . . . . . . . . . . A . 8 SER OG . . . . . . . . . c19602_2mgt 1 . 5 . 2291 . 1 1 10 GLY C C -7.761 7.370 2.362 . . . 1.0 . . . . . . . . . . . . A . 9 GLY C . . . . . . . . . c19602_2mgt 1 . 5 . 2292 . 1 1 10 GLY CA C -8.206 7.121 3.805 . . . 1.0 . . . . . . . . . . . . A . 9 GLY CA . . . . . . . . . c19602_2mgt 1 . 5 . 2293 . 1 1 10 GLY H H -10.122 7.537 3.092 . . . 1.0 . . . . . . . . . . . . A . 9 GLY H . . . . . . . . . c19602_2mgt 1 . 5 . 2294 . 1 1 10 GLY HA2 H -7.548 7.645 4.496 . . . 1.0 . . . . . . . . . . . . A . 9 GLY HA2 . . . . . . . . . c19602_2mgt 1 . 5 . 2295 . 1 1 10 GLY HA3 H -8.180 6.064 4.065 . . . 1.0 . . . . . . . . . . . . A . 9 GLY HA3 . . . . . . . . . c19602_2mgt 1 . 5 . 2296 . 1 1 10 GLY N N -9.573 7.575 3.940 . . . 1.0 . . . . . . . . . . . . A . 9 GLY N . . . . . . . . . c19602_2mgt 1 . 5 . 2297 . 1 1 10 GLY O O -7.949 8.465 1.849 . . . 1.0 . . . . . . . . . . . . A . 9 GLY O . . . . . . . . . c19602_2mgt 1 . 5 . 2298 . 1 1 11 TYR C C -6.206 4.226 1.079 . . . 1.0 . . . . . . . . . . . . A . 10 TYR C . . . . . . . . . c19602_2mgt 1 . 5 . 2299 . 1 1 11 TYR CA C -7.140 4.999 2.001 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CA . . . . . . . . . c19602_2mgt 1 . 5 . 2300 . 1 1 11 TYR CB C -8.550 4.410 1.871 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CB . . . . . . . . . c19602_2mgt 1 . 5 . 2301 . 1 1 11 TYR CD1 C -8.215 2.704 3.705 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CD1 . . . . . . . . . c19602_2mgt 1 . 5 . 2302 . 1 1 11 TYR CD2 C -10.290 3.967 3.631 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CD2 . . . . . . . . . c19602_2mgt 1 . 5 . 2303 . 1 1 11 TYR CE1 C -8.688 1.968 4.789 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CE1 . . . . . . . . . c19602_2mgt 1 . 5 . 2304 . 1 1 11 TYR CE2 C -10.773 3.233 4.724 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CE2 . . . . . . . . . c19602_2mgt 1 . 5 . 2305 . 1 1 11 TYR CG C -9.022 3.684 3.104 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CG . . . . . . . . . c19602_2mgt 1 . 5 . 2306 . 1 1 11 TYR CZ C -9.975 2.213 5.295 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CZ . . . . . . . . . c19602_2mgt 1 . 5 . 2307 . 1 1 11 TYR H H -7.053 6.580 0.674 . . . 1.0 . . . . . . . . . . . . A . 10 TYR H . . . . . . . . . c19602_2mgt 1 . 5 . 2308 . 1 1 11 TYR HA H -6.781 4.909 3.024 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HA . . . . . . . . . c19602_2mgt 1 . 5 . 2309 . 1 1 11 TYR HB2 H -9.270 5.191 1.633 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HB2 . . . . . . . . . c19602_2mgt 1 . 5 . 2310 . 1 1 11 TYR HB3 H -8.575 3.727 1.023 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HB3 . . . . . . . . . c19602_2mgt 1 . 5 . 2311 . 1 1 11 TYR HD1 H -7.242 2.472 3.326 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HD1 . . . . . . . . . c19602_2mgt 1 . 5 . 2312 . 1 1 11 TYR HD2 H -10.908 4.727 3.179 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HD2 . . . . . . . . . c19602_2mgt 1 . 5 . 2313 . 1 1 11 TYR HE1 H -8.064 1.211 5.225 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HE1 . . . . . . . . . c19602_2mgt 1 . 5 . 2314 . 1 1 11 TYR HE2 H -11.754 3.454 5.112 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HE2 . . . . . . . . . c19602_2mgt 1 . 5 . 2315 . 1 1 11 TYR HH H -11.306 1.707 6.609 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HH . . . . . . . . . c19602_2mgt 1 . 5 . 2316 . 1 1 11 TYR N N -7.192 6.397 1.649 . . . 1.0 . . . . . . . . . . . . A . 10 TYR N . . . . . . . . . c19602_2mgt 1 . 5 . 2317 . 1 1 11 TYR O O -6.072 4.557 -0.094 . . . 1.0 . . . . . . . . . . . . A . 10 TYR O . . . . . . . . . c19602_2mgt 1 . 5 . 2318 . 1 1 11 TYR OH O -10.417 1.461 6.335 . . . 1.0 . . . . . . . . . . . . A . 10 TYR OH . . . . . . . . . c19602_2mgt 1 . 5 . 2319 . 1 1 12 GLU C C -5.589 0.721 1.472 . . . 1.0 . . . . . . . . . . . . A . 11 GLU C . . . . . . . . . c19602_2mgt 1 . 5 . 2320 . 1 1 12 GLU CA C -5.067 2.045 0.867 . . . 1.0 . . . . . . . . . . . . A . 11 GLU CA . . . . . . . . . c19602_2mgt 1 . 5 . 2321 . 1 1 12 GLU CB C -3.552 2.210 0.931 . . . 1.0 . . . . . . . . . . . . A . 11 GLU CB . . . . . . . . . c19602_2mgt 1 . 5 . 2322 . 1 1 12 GLU CD C -1.434 0.999 0.283 . . . 1.0 . . . . . . . . . . . . A . 11 GLU CD . . . . . . . . . c19602_2mgt 1 . 5 . 2323 . 1 1 12 GLU CG C -2.868 1.318 -0.105 . . . 1.0 . . . . . . . . . . . . A . 11 GLU CG . . . . . . . . . c19602_2mgt 1 . 5 . 2324 . 1 1 12 GLU H H -5.751 2.989 2.606 . . . 1.0 . . . . . . . . . . . . A . 11 GLU H . . . . . . . . . c19602_2mgt 1 . 5 . 2325 . 1 1 12 GLU HA H -5.381 2.124 -0.172 . . . 1.0 . . . . . . . . . . . . A . 11 GLU HA . . . . . . . . . c19602_2mgt 1 . 5 . 2326 . 1 1 12 GLU HB2 H -3.284 3.246 0.718 . . . 1.0 . . . . . . . . . . . . A . 11 GLU HB2 . . . . . . . . . c19602_2mgt 1 . 5 . 2327 . 1 1 12 GLU HB3 H -3.218 1.974 1.941 . . . 1.0 . . . . . . . . . . . . A . 11 GLU HB3 . . . . . . . . . c19602_2mgt 1 . 5 . 2328 . 1 1 12 GLU HG2 H -3.412 0.376 -0.190 . . . 1.0 . . . . . . . . . . . . A . 11 GLU HG2 . . . . . . . . . c19602_2mgt 1 . 5 . 2329 . 1 1 12 GLU HG3 H -2.884 1.813 -1.077 . . . 1.0 . . . . . . . . . . . . A . 11 GLU HG3 . . . . . . . . . c19602_2mgt 1 . 5 . 2330 . 1 1 12 GLU N N -5.658 3.134 1.611 . . . 1.0 . . . . . . . . . . . . A . 11 GLU N . . . . . . . . . c19602_2mgt 1 . 5 . 2331 . 1 1 12 GLU O O -4.872 0.002 2.166 . . . 1.0 . . . . . . . . . . . . A . 11 GLU O . . . . . . . . . c19602_2mgt 1 . 5 . 2332 . 1 1 12 GLU OE1 O -0.850 1.726 1.114 . . . 1.0 . . . . . . . . . . . . A . 11 GLU OE1 . . . . . . . . . c19602_2mgt 1 . 5 . 2333 . 1 1 12 GLU OE2 O -0.933 -0.024 -0.199 . . . 1.0 . . . . . . . . . . . . A . 11 GLU OE2 . . . . . . . . . c19602_2mgt 1 . 5 . 2334 . 1 1 13 VAL C C -7.213 -1.951 1.947 . . . 1.0 . . . . . . . . . . . . A . 12 VAL C . . . . . . . . . c19602_2mgt 1 . 5 . 2335 . 1 1 13 VAL CA C -7.763 -0.531 1.869 . . . 1.0 . . . . . . . . . . . . A . 12 VAL CA . . . . . . . . . c19602_2mgt 1 . 5 . 2336 . 1 1 13 VAL CB C -9.118 -0.520 1.122 . . . 1.0 . . . . . . . . . . . . A . 12 VAL CB . . . . . . . . . c19602_2mgt 1 . 5 . 2337 . 1 1 13 VAL CG1 C -10.055 -1.688 1.467 . . . 1.0 . . . . . . . . . . . . A . 12 VAL CG1 . . . . . . . . . c19602_2mgt 1 . 5 . 2338 . 1 1 13 VAL CG2 C -9.860 0.766 1.466 . . . 1.0 . . . . . . . . . . . . A . 12 VAL CG2 . . . . . . . . . c19602_2mgt 1 . 5 . 2339 . 1 1 13 VAL H H -7.343 1.056 0.574 . . . 1.0 . . . . . . . . . . . . A . 12 VAL H . . . . . . . . . c19602_2mgt 1 . 5 . 2340 . 1 1 13 VAL HA H -7.951 -0.196 2.885 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HA . . . . . . . . . c19602_2mgt 1 . 5 . 2341 . 1 1 13 VAL HB H -8.938 -0.537 0.048 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HB . . . . . . . . . c19602_2mgt 1 . 5 . 2342 . 1 1 13 VAL HG11 H -9.623 -2.618 1.105 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HG11 . . . . . . . . . c19602_2mgt 1 . 5 . 2343 . 1 1 13 VAL HG12 H -10.200 -1.747 2.547 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HG12 . . . . . . . . . c19602_2mgt 1 . 5 . 2344 . 1 1 13 VAL HG13 H -11.017 -1.553 0.976 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HG13 . . . . . . . . . c19602_2mgt 1 . 5 . 2345 . 1 1 13 VAL HG21 H -10.063 0.796 2.535 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HG21 . . . . . . . . . c19602_2mgt 1 . 5 . 2346 . 1 1 13 VAL HG22 H -9.265 1.623 1.173 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HG22 . . . . . . . . . c19602_2mgt 1 . 5 . 2347 . 1 1 13 VAL HG23 H -10.791 0.796 0.914 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HG23 . . . . . . . . . c19602_2mgt 1 . 5 . 2348 . 1 1 13 VAL N N -6.878 0.447 1.229 . . . 1.0 . . . . . . . . . . . . A . 12 VAL N . . . . . . . . . c19602_2mgt 1 . 5 . 2349 . 1 1 13 VAL O O -7.634 -2.693 2.828 . . . 1.0 . . . . . . . . . . . . A . 12 VAL O . . . . . . . . . c19602_2mgt 1 . 5 . 2350 . 1 1 14 HIS C C -4.817 -3.988 2.183 . . . 1.0 . . . . . . . . . . . . A . 13 HIS C . . . . . . . . . c19602_2mgt 1 . 5 . 2351 . 1 1 14 HIS CA C -5.778 -3.700 1.024 . . . 1.0 . . . . . . . . . . . . A . 13 HIS CA . . . . . . . . . c19602_2mgt 1 . 5 . 2352 . 1 1 14 HIS CB C -5.196 -3.963 -0.374 . . . 1.0 . . . . . . . . . . . . A . 13 HIS CB . . . . . . . . . c19602_2mgt 1 . 5 . 2353 . 1 1 14 HIS CD2 C -5.353 -6.304 -1.419 . . . 1.0 . . . . . . . . . . . . A . 13 HIS CD2 . . . . . . . . . c19602_2mgt 1 . 5 . 2354 . 1 1 14 HIS CE1 C -3.401 -7.120 -0.845 . . . 1.0 . . . . . . . . . . . . A . 13 HIS CE1 . . . . . . . . . c19602_2mgt 1 . 5 . 2355 . 1 1 14 HIS CG C -4.717 -5.365 -0.654 . . . 1.0 . . . . . . . . . . . . A . 13 HIS CG . . . . . . . . . c19602_2mgt 1 . 5 . 2356 . 1 1 14 HIS H H -5.974 -1.694 0.360 . . . 1.0 . . . . . . . . . . . . A . 13 HIS H . . . . . . . . . c19602_2mgt 1 . 5 . 2357 . 1 1 14 HIS HA H -6.629 -4.356 1.174 . . . 1.0 . . . . . . . . . . . . A . 13 HIS HA . . . . . . . . . c19602_2mgt 1 . 5 . 2358 . 1 1 14 HIS HB2 H -5.960 -3.729 -1.115 . . . 1.0 . . . . . . . . . . . . A . 13 HIS HB2 . . . . . . . . . c19602_2mgt 1 . 5 . 2359 . 1 1 14 HIS HB3 H -4.371 -3.283 -0.537 . . . 1.0 . . . . . . . . . . . . A . 13 HIS HB3 . . . . . . . . . c19602_2mgt 1 . 5 . 2360 . 1 1 14 HIS HD1 H -2.799 -5.447 0.263 . . . 1.0 . . . . . . . . . . . . A . 13 HIS HD1 . . . . . . . . . c19602_2mgt 1 . 5 . 2361 . 1 1 14 HIS HD2 H -6.312 -6.189 -1.899 . . . 1.0 . . . . . . . . . . . . A . 13 HIS HD2 . . . . . . . . . c19602_2mgt 1 . 5 . 2362 . 1 1 14 HIS HE1 H -2.545 -7.772 -0.755 . . . 1.0 . . . . . . . . . . . . A . 13 HIS HE1 . . . . . . . . . c19602_2mgt 1 . 5 . 2363 . 1 1 14 HIS N N -6.297 -2.345 1.061 . . . 1.0 . . . . . . . . . . . . A . 13 HIS N . . . . . . . . . c19602_2mgt 1 . 5 . 2364 . 1 1 14 HIS ND1 N -3.496 -5.896 -0.311 . . . 1.0 . . . . . . . . . . . . A . 13 HIS ND1 . . . . . . . . . c19602_2mgt 1 . 5 . 2365 . 1 1 14 HIS NE2 N -4.514 -7.416 -1.526 . . . 1.0 . . . . . . . . . . . . A . 13 HIS NE2 . . . . . . . . . c19602_2mgt 1 . 5 . 2366 . 1 1 14 HIS O O -4.450 -5.139 2.357 . . . 1.0 . . . . . . . . . . . . A . 13 HIS O . . . . . . . . . c19602_2mgt 1 . 5 . 2367 . 1 1 15 HIS C C -4.872 -3.462 5.469 . . . 1.0 . . . . . . . . . . . . A . 14 HIS C . . . . . . . . . c19602_2mgt 1 . 5 . 2368 . 1 1 15 HIS CA C -3.850 -3.281 4.332 . . . 1.0 . . . . . . . . . . . . A . 14 HIS CA . . . . . . . . . c19602_2mgt 1 . 5 . 2369 . 1 1 15 HIS CB C -2.886 -2.153 4.693 . . . 1.0 . . . . . . . . . . . . A . 14 HIS CB . . . . . . . . . c19602_2mgt 1 . 5 . 2370 . 1 1 15 HIS CD2 C -1.345 -0.896 3.094 . . . 1.0 . . . . . . . . . . . . A . 14 HIS CD2 . . . . . . . . . c19602_2mgt 1 . 5 . 2371 . 1 1 15 HIS CE1 C 0.224 -2.388 2.809 . . . 1.0 . . . . . . . . . . . . A . 14 HIS CE1 . . . . . . . . . c19602_2mgt 1 . 5 . 2372 . 1 1 15 HIS CG C -1.705 -2.020 3.780 . . . 1.0 . . . . . . . . . . . . A . 14 HIS CG . . . . . . . . . c19602_2mgt 1 . 5 . 2373 . 1 1 15 HIS H H -4.757 -2.061 2.833 . . . 1.0 . . . . . . . . . . . . A . 14 HIS H . . . . . . . . . c19602_2mgt 1 . 5 . 2374 . 1 1 15 HIS HA H -3.278 -4.202 4.265 . . . 1.0 . . . . . . . . . . . . A . 14 HIS HA . . . . . . . . . c19602_2mgt 1 . 5 . 2375 . 1 1 15 HIS HB2 H -3.432 -1.215 4.726 . . . 1.0 . . . . . . . . . . . . A . 14 HIS HB2 . . . . . . . . . c19602_2mgt 1 . 5 . 2376 . 1 1 15 HIS HB3 H -2.489 -2.343 5.686 . . . 1.0 . . . . . . . . . . . . A . 14 HIS HB3 . . . . . . . . . c19602_2mgt 1 . 5 . 2377 . 1 1 15 HIS HD1 H -0.673 -3.875 3.994 . . . 1.0 . . . . . . . . . . . . A . 14 HIS HD1 . . . . . . . . . c19602_2mgt 1 . 5 . 2378 . 1 1 15 HIS HD2 H -1.900 0.029 3.069 . . . 1.0 . . . . . . . . . . . . A . 14 HIS HD2 . . . . . . . . . c19602_2mgt 1 . 5 . 2379 . 1 1 15 HIS HE1 H 1.126 -2.869 2.478 . . . 1.0 . . . . . . . . . . . . A . 14 HIS HE1 . . . . . . . . . c19602_2mgt 1 . 5 . 2380 . 1 1 15 HIS N N -4.465 -3.010 3.031 . . . 1.0 . . . . . . . . . . . . A . 14 HIS N . . . . . . . . . c19602_2mgt 1 . 5 . 2381 . 1 1 15 HIS ND1 N -0.707 -2.948 3.595 . . . 1.0 . . . . . . . . . . . . A . 14 HIS ND1 . . . . . . . . . c19602_2mgt 1 . 5 . 2382 . 1 1 15 HIS NE2 N -0.114 -1.136 2.485 . . . 1.0 . . . . . . . . . . . . A . 14 HIS NE2 . . . . . . . . . c19602_2mgt 1 . 5 . 2383 . 1 1 15 HIS O O -4.469 -3.689 6.605 . . . 1.0 . . . . . . . . . . . . A . 14 HIS O . . . . . . . . . c19602_2mgt 1 . 5 . 2384 . 1 1 16 GLN C C -8.377 -4.184 5.877 . . . 1.0 . . . . . . . . . . . . A . 15 GLN C . . . . . . . . . c19602_2mgt 1 . 5 . 2385 . 1 1 16 GLN CA C -7.233 -3.226 6.191 . . . 1.0 . . . . . . . . . . . . A . 15 GLN CA . . . . . . . . . c19602_2mgt 1 . 5 . 2386 . 1 1 16 GLN CB C -7.740 -1.773 6.234 . . . 1.0 . . . . . . . . . . . . A . 15 GLN CB . . . . . . . . . c19602_2mgt 1 . 5 . 2387 . 1 1 16 GLN CD C -6.445 -1.150 8.346 . . . 1.0 . . . . . . . . . . . . A . 15 GLN CD . . . . . . . . . c19602_2mgt 1 . 5 . 2388 . 1 1 16 GLN CG C -6.734 -0.805 6.888 . . . 1.0 . . . . . . . . . . . . A . 15 GLN CG . . . . . . . . . c19602_2mgt 1 . 5 . 2389 . 1 1 16 GLN H H -6.462 -3.213 4.245 . . . 1.0 . . . . . . . . . . . . A . 15 GLN H . . . . . . . . . c19602_2mgt 1 . 5 . 2390 . 1 1 16 GLN HA H -6.845 -3.511 7.163 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HA . . . . . . . . . c19602_2mgt 1 . 5 . 2391 . 1 1 16 GLN HB2 H -7.965 -1.438 5.223 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HB2 . . . . . . . . . c19602_2mgt 1 . 5 . 2392 . 1 1 16 GLN HB3 H -8.669 -1.735 6.796 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HB3 . . . . . . . . . c19602_2mgt 1 . 5 . 2393 . 1 1 16 GLN HE21 H -4.684 -0.145 8.355 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HE21 . . . . . . . . . c19602_2mgt 1 . 5 . 2394 . 1 1 16 GLN HE22 H -5.116 -0.932 9.857 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HE22 . . . . . . . . . c19602_2mgt 1 . 5 . 2395 . 1 1 16 GLN HG2 H -5.806 -0.801 6.317 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HG2 . . . . . . . . . c19602_2mgt 1 . 5 . 2396 . 1 1 16 GLN HG3 H -7.147 0.201 6.875 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HG3 . . . . . . . . . c19602_2mgt 1 . 5 . 2397 . 1 1 16 GLN N N -6.173 -3.333 5.199 . . . 1.0 . . . . . . . . . . . . A . 15 GLN N . . . . . . . . . c19602_2mgt 1 . 5 . 2398 . 1 1 16 GLN NE2 N -5.324 -0.704 8.897 . . . 1.0 . . . . . . . . . . . . A . 15 GLN NE2 . . . . . . . . . c19602_2mgt 1 . 5 . 2399 . 1 1 16 GLN O O -8.491 -4.688 4.768 . . . 1.0 . . . . . . . . . . . . A . 15 GLN O . . . . . . . . . c19602_2mgt 1 . 5 . 2400 . 1 1 16 GLN OE1 O -7.232 -1.821 8.991 . . . 1.0 . . . . . . . . . . . . A . 15 GLN OE1 . . . . . . . . . c19602_2mgt 1 . 5 . 2401 . 1 1 17 LYS C C -11.527 -4.839 6.060 . . . 1.0 . . . . . . . . . . . . A . 16 LYS C . . . . . . . . . c19602_2mgt 1 . 5 . 2402 . 1 1 17 LYS CA C -10.320 -5.397 6.810 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CA . . . . . . . . . c19602_2mgt 1 . 5 . 2403 . 1 1 17 LYS CB C -10.715 -5.795 8.238 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CB . . . . . . . . . c19602_2mgt 1 . 5 . 2404 . 1 1 17 LYS CD C -9.902 -6.900 10.353 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CD . . . . . . . . . c19602_2mgt 1 . 5 . 2405 . 1 1 17 LYS CE C -8.696 -7.622 10.940 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CE . . . . . . . . . c19602_2mgt 1 . 5 . 2406 . 1 1 17 LYS CG C -9.575 -6.569 8.902 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CG . . . . . . . . . c19602_2mgt 1 . 5 . 2407 . 1 1 17 LYS H H -9.109 -3.931 7.743 . . . 1.0 . . . . . . . . . . . . A . 16 LYS H . . . . . . . . . c19602_2mgt 1 . 5 . 2408 . 1 1 17 LYS HA H -9.982 -6.290 6.282 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HA . . . . . . . . . c19602_2mgt 1 . 5 . 2409 . 1 1 17 LYS HB2 H -10.950 -4.906 8.822 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HB2 . . . . . . . . . c19602_2mgt 1 . 5 . 2410 . 1 1 17 LYS HB3 H -11.600 -6.427 8.213 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HB3 . . . . . . . . . c19602_2mgt 1 . 5 . 2411 . 1 1 17 LYS HD2 H -10.077 -5.978 10.908 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HD2 . . . . . . . . . c19602_2mgt 1 . 5 . 2412 . 1 1 17 LYS HD3 H -10.786 -7.538 10.402 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HD3 . . . . . . . . . c19602_2mgt 1 . 5 . 2413 . 1 1 17 LYS HE2 H -8.532 -8.551 10.393 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HE2 . . . . . . . . . c19602_2mgt 1 . 5 . 2414 . 1 1 17 LYS HE3 H -7.815 -6.989 10.841 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HE3 . . . . . . . . . c19602_2mgt 1 . 5 . 2415 . 1 1 17 LYS HG2 H -9.412 -7.494 8.350 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HG2 . . . . . . . . . c19602_2mgt 1 . 5 . 2416 . 1 1 17 LYS HG3 H -8.660 -5.976 8.885 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HG3 . . . . . . . . . c19602_2mgt 1 . 5 . 2417 . 1 1 17 LYS HZ1 H -9.715 -8.516 12.462 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HZ1 . . . . . . . . . c19602_2mgt 1 . 5 . 2418 . 1 1 17 LYS HZ2 H -8.097 -8.402 12.728 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HZ2 . . . . . . . . . c19602_2mgt 1 . 5 . 2419 . 1 1 17 LYS HZ3 H -9.056 -7.072 12.876 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HZ3 . . . . . . . . . c19602_2mgt 1 . 5 . 2420 . 1 1 17 LYS N N -9.228 -4.431 6.875 . . . 1.0 . . . . . . . . . . . . A . 16 LYS N . . . . . . . . . c19602_2mgt 1 . 5 . 2421 . 1 1 17 LYS NZ N -8.905 -7.924 12.358 . . . 1.0 . . . . . . . . . . . . A . 16 LYS NZ . . . . . . . . . c19602_2mgt 1 . 5 . 2422 . 1 1 17 LYS O O -12.193 -5.590 5.363 . . . 1.0 . . . . . . . . . . . . A . 16 LYS O . . . . . . . . . c19602_2mgt 1 . 5 . 2423 . 1 1 18 NH2 HN1 H -12.617 -3.161 5.695 . . . 1.0 . . . . . . . . . . . . A . 17 NH2 HN1 . . . . . . . . . c19602_2mgt 1 . 5 . 2424 . 1 1 18 NH2 HN2 H -11.241 -2.953 6.758 . . . 1.0 . . . . . . . . . . . . A . 17 NH2 HN2 . . . . . . . . . c19602_2mgt 1 . 5 . 2425 . 1 1 18 NH2 N N -11.805 -3.541 6.162 . . . 1.0 . . . . . . . . . . . . A . 17 NH2 N . . . . . . . . . c19602_2mgt 1 . 5 . 2426 . 2 1 1 ACE C C 12.736 4.844 4.258 . . . 1.0 . . . . . . . . . . . . B . 0 ACE C . . . . . . . . . c19602_2mgt 1 . 5 . 2427 . 2 1 1 ACE CH3 C 11.674 5.197 3.227 . . . 1.0 . . . . . . . . . . . . B . 0 ACE CH3 . . . . . . . . . c19602_2mgt 1 . 5 . 2428 . 2 1 1 ACE H1 H 11.441 4.314 2.634 . . . 1.0 . . . . . . . . . . . . B . 0 ACE H1 . . . . . . . . . c19602_2mgt 1 . 5 . 2429 . 2 1 1 ACE H2 H 10.775 5.551 3.724 . . . 1.0 . . . . . . . . . . . . B . 0 ACE H2 . . . . . . . . . c19602_2mgt 1 . 5 . 2430 . 2 1 1 ACE H3 H 12.038 5.993 2.577 . . . 1.0 . . . . . . . . . . . . B . 0 ACE H3 . . . . . . . . . c19602_2mgt 1 . 5 . 2431 . 2 1 1 ACE O O 13.921 4.957 3.965 . . . 1.0 . . . . . . . . . . . . B . 0 ACE O . . . . . . . . . c19602_2mgt 1 . 5 . 2432 . 2 1 2 ASP C C 13.854 2.757 6.432 . . . 1.0 . . . . . . . . . . . . B . 1 ASP C . . . . . . . . . c19602_2mgt 1 . 5 . 2433 . 2 1 2 ASP CA C 13.214 4.142 6.572 . . . 1.0 . . . . . . . . . . . . B . 1 ASP CA . . . . . . . . . c19602_2mgt 1 . 5 . 2434 . 2 1 2 ASP CB C 12.444 4.261 7.886 . . . 1.0 . . . . . . . . . . . . B . 1 ASP CB . . . . . . . . . c19602_2mgt 1 . 5 . 2435 . 2 1 2 ASP CG C 13.429 4.403 9.029 . . . 1.0 . . . . . . . . . . . . B . 1 ASP CG . . . . . . . . . c19602_2mgt 1 . 5 . 2436 . 2 1 2 ASP H H 11.328 4.336 5.630 . . . 1.0 . . . . . . . . . . . . B . 1 ASP H . . . . . . . . . c19602_2mgt 1 . 5 . 2437 . 2 1 2 ASP HA H 14.007 4.892 6.575 . . . 1.0 . . . . . . . . . . . . B . 1 ASP HA . . . . . . . . . c19602_2mgt 1 . 5 . 2438 . 2 1 2 ASP HB2 H 11.809 5.147 7.864 . . . 1.0 . . . . . . . . . . . . B . 1 ASP HB2 . . . . . . . . . c19602_2mgt 1 . 5 . 2439 . 2 1 2 ASP HB3 H 11.822 3.379 8.038 . . . 1.0 . . . . . . . . . . . . B . 1 ASP HB3 . . . . . . . . . c19602_2mgt 1 . 5 . 2440 . 2 1 2 ASP N N 12.318 4.434 5.460 . . . 1.0 . . . . . . . . . . . . B . 1 ASP N . . . . . . . . . c19602_2mgt 1 . 5 . 2441 . 2 1 2 ASP O O 13.256 1.873 5.825 . . . 1.0 . . . . . . . . . . . . B . 1 ASP O . . . . . . . . . c19602_2mgt 1 . 5 . 2442 . 2 1 2 ASP OD1 O 13.865 5.544 9.263 . . . 1.0 . . . . . . . . . . . . B . 1 ASP OD1 . . . . . . . . . c19602_2mgt 1 . 5 . 2443 . 2 1 2 ASP OD2 O 13.779 3.376 9.633 . . . 1.0 . . . . . . . . . . . . B . 1 ASP OD2 . . . . . . . . . c19602_2mgt 1 . 5 . 2444 . 2 1 3 ALA C C 15.339 0.086 6.800 . . . 1.0 . . . . . . . . . . . . B . 2 ALA C . . . . . . . . . c19602_2mgt 1 . 5 . 2445 . 2 1 3 ALA CA C 15.976 1.477 6.766 . . . 1.0 . . . . . . . . . . . . B . 2 ALA CA . . . . . . . . . c19602_2mgt 1 . 5 . 2446 . 2 1 3 ALA CB C 17.122 1.556 7.775 . . . 1.0 . . . . . . . . . . . . B . 2 ALA CB . . . . . . . . . c19602_2mgt 1 . 5 . 2447 . 2 1 3 ALA H H 15.421 3.351 7.556 . . . 1.0 . . . . . . . . . . . . B . 2 ALA H . . . . . . . . . c19602_2mgt 1 . 5 . 2448 . 2 1 3 ALA HA H 16.411 1.613 5.778 . . . 1.0 . . . . . . . . . . . . B . 2 ALA HA . . . . . . . . . c19602_2mgt 1 . 5 . 2449 . 2 1 3 ALA HB1 H 17.790 0.705 7.638 . . . 1.0 . . . . . . . . . . . . B . 2 ALA HB1 . . . . . . . . . c19602_2mgt 1 . 5 . 2450 . 2 1 3 ALA HB2 H 17.679 2.477 7.619 . . . 1.0 . . . . . . . . . . . . B . 2 ALA HB2 . . . . . . . . . c19602_2mgt 1 . 5 . 2451 . 2 1 3 ALA HB3 H 16.730 1.544 8.791 . . . 1.0 . . . . . . . . . . . . B . 2 ALA HB3 . . . . . . . . . c19602_2mgt 1 . 5 . 2452 . 2 1 3 ALA N N 15.053 2.585 7.010 . . . 1.0 . . . . . . . . . . . . B . 2 ALA N . . . . . . . . . c19602_2mgt 1 . 5 . 2453 . 2 1 3 ALA O O 15.660 -0.726 5.944 . . . 1.0 . . . . . . . . . . . . B . 2 ALA O . . . . . . . . . c19602_2mgt 1 . 5 . 2454 . 2 1 4 GLU C C 12.973 -1.996 6.760 . . . 1.0 . . . . . . . . . . . . B . 3 GLU C . . . . . . . . . c19602_2mgt 1 . 5 . 2455 . 2 1 4 GLU CA C 13.821 -1.503 7.939 . . . 1.0 . . . . . . . . . . . . B . 3 GLU CA . . . . . . . . . c19602_2mgt 1 . 5 . 2456 . 2 1 4 GLU CB C 12.965 -1.471 9.205 . . . 1.0 . . . . . . . . . . . . B . 3 GLU CB . . . . . . . . . c19602_2mgt 1 . 5 . 2457 . 2 1 4 GLU CD C 11.029 -0.410 10.372 . . . 1.0 . . . . . . . . . . . . B . 3 GLU CD . . . . . . . . . c19602_2mgt 1 . 5 . 2458 . 2 1 4 GLU CG C 11.859 -0.412 9.111 . . . 1.0 . . . . . . . . . . . . B . 3 GLU CG . . . . . . . . . c19602_2mgt 1 . 5 . 2459 . 2 1 4 GLU H H 14.191 0.538 8.401 . . . 1.0 . . . . . . . . . . . . B . 3 GLU H . . . . . . . . . c19602_2mgt 1 . 5 . 2460 . 2 1 4 GLU HA H 14.619 -2.225 8.089 . . . 1.0 . . . . . . . . . . . . B . 3 GLU HA . . . . . . . . . c19602_2mgt 1 . 5 . 2461 . 2 1 4 GLU HB2 H 12.513 -2.452 9.348 . . . 1.0 . . . . . . . . . . . . B . 3 GLU HB2 . . . . . . . . . c19602_2mgt 1 . 5 . 2462 . 2 1 4 GLU HB3 H 13.597 -1.258 10.066 . . . 1.0 . . . . . . . . . . . . B . 3 GLU HB3 . . . . . . . . . c19602_2mgt 1 . 5 . 2463 . 2 1 4 GLU HG2 H 12.304 0.571 8.956 . . . 1.0 . . . . . . . . . . . . B . 3 GLU HG2 . . . . . . . . . c19602_2mgt 1 . 5 . 2464 . 2 1 4 GLU HG3 H 11.192 -0.635 8.279 . . . 1.0 . . . . . . . . . . . . B . 3 GLU HG3 . . . . . . . . . c19602_2mgt 1 . 5 . 2465 . 2 1 4 GLU N N 14.433 -0.188 7.743 . . . 1.0 . . . . . . . . . . . . B . 3 GLU N . . . . . . . . . c19602_2mgt 1 . 5 . 2466 . 2 1 4 GLU O O 12.837 -3.202 6.577 . . . 1.0 . . . . . . . . . . . . B . 3 GLU O . . . . . . . . . c19602_2mgt 1 . 5 . 2467 . 2 1 4 GLU OE1 O 10.265 -1.355 10.569 . . . 1.0 . . . . . . . . . . . . B . 3 GLU OE1 . . . . . . . . . c19602_2mgt 1 . 5 . 2468 . 2 1 4 GLU OE2 O 11.168 0.550 11.157 . . . 1.0 . . . . . . . . . . . . B . 3 GLU OE2 . . . . . . . . . c19602_2mgt 1 . 5 . 2469 . 2 1 5 PHE C C 12.291 -0.894 3.507 . . . 1.0 . . . . . . . . . . . . B . 4 PHE C . . . . . . . . . c19602_2mgt 1 . 5 . 2470 . 2 1 5 PHE CA C 11.643 -1.442 4.772 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CA . . . . . . . . . c19602_2mgt 1 . 5 . 2471 . 2 1 5 PHE CB C 10.200 -0.986 4.932 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CB . . . . . . . . . c19602_2mgt 1 . 5 . 2472 . 2 1 5 PHE CD1 C 9.671 0.999 3.477 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CD1 . . . . . . . . . c19602_2mgt 1 . 5 . 2473 . 2 1 5 PHE CD2 C 9.970 1.346 5.871 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CD2 . . . . . . . . . c19602_2mgt 1 . 5 . 2474 . 2 1 5 PHE CE1 C 9.355 2.356 3.317 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CE1 . . . . . . . . . c19602_2mgt 1 . 5 . 2475 . 2 1 5 PHE CE2 C 9.642 2.702 5.711 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CE2 . . . . . . . . . c19602_2mgt 1 . 5 . 2476 . 2 1 5 PHE CG C 9.953 0.490 4.757 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CG . . . . . . . . . c19602_2mgt 1 . 5 . 2477 . 2 1 5 PHE CZ C 9.313 3.199 4.439 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CZ . . . . . . . . . c19602_2mgt 1 . 5 . 2478 . 2 1 5 PHE H H 12.514 -0.110 6.173 . . . 1.0 . . . . . . . . . . . . B . 4 PHE H . . . . . . . . . c19602_2mgt 1 . 5 . 2479 . 2 1 5 PHE HA H 11.620 -2.523 4.664 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HA . . . . . . . . . c19602_2mgt 1 . 5 . 2480 . 2 1 5 PHE HB2 H 9.603 -1.517 4.195 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HB2 . . . . . . . . . c19602_2mgt 1 . 5 . 2481 . 2 1 5 PHE HB3 H 9.855 -1.289 5.920 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HB3 . . . . . . . . . c19602_2mgt 1 . 5 . 2482 . 2 1 5 PHE HD1 H 9.696 0.338 2.623 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HD1 . . . . . . . . . c19602_2mgt 1 . 5 . 2483 . 2 1 5 PHE HD2 H 10.227 0.954 6.844 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HD2 . . . . . . . . . c19602_2mgt 1 . 5 . 2484 . 2 1 5 PHE HE1 H 9.131 2.748 2.337 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HE1 . . . . . . . . . c19602_2mgt 1 . 5 . 2485 . 2 1 5 PHE HE2 H 9.645 3.365 6.561 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HE2 . . . . . . . . . c19602_2mgt 1 . 5 . 2486 . 2 1 5 PHE HZ H 9.045 4.235 4.322 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HZ . . . . . . . . . c19602_2mgt 1 . 5 . 2487 . 2 1 5 PHE N N 12.402 -1.090 5.963 . . . 1.0 . . . . . . . . . . . . B . 4 PHE N . . . . . . . . . c19602_2mgt 1 . 5 . 2488 . 2 1 5 PHE O O 11.938 -1.337 2.423 . . . 1.0 . . . . . . . . . . . . B . 4 PHE O . . . . . . . . . c19602_2mgt 1 . 5 . 2489 . 2 1 6 ARG C C 15.211 -0.685 2.401 . . . 1.0 . . . . . . . . . . . . B . 5 ARG C . . . . . . . . . c19602_2mgt 1 . 5 . 2490 . 2 1 6 ARG CA C 14.169 0.421 2.591 . . . 1.0 . . . . . . . . . . . . B . 5 ARG CA . . . . . . . . . c19602_2mgt 1 . 5 . 2491 . 2 1 6 ARG CB C 14.728 1.786 2.992 . . . 1.0 . . . . . . . . . . . . B . 5 ARG CB . . . . . . . . . c19602_2mgt 1 . 5 . 2492 . 2 1 6 ARG CD C 14.830 2.641 0.597 . . . 1.0 . . . . . . . . . . . . B . 5 ARG CD . . . . . . . . . c19602_2mgt 1 . 5 . 2493 . 2 1 6 ARG CG C 15.574 2.461 1.919 . . . 1.0 . . . . . . . . . . . . B . 5 ARG CG . . . . . . . . . c19602_2mgt 1 . 5 . 2494 . 2 1 6 ARG CZ C 14.698 1.549 -1.624 . . . 1.0 . . . . . . . . . . . . B . 5 ARG CZ . . . . . . . . . c19602_2mgt 1 . 5 . 2495 . 2 1 6 ARG H H 13.509 0.332 4.568 . . . 1.0 . . . . . . . . . . . . B . 5 ARG H . . . . . . . . . c19602_2mgt 1 . 5 . 2496 . 2 1 6 ARG HA H 13.594 0.542 1.678 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HA . . . . . . . . . c19602_2mgt 1 . 5 . 2497 . 2 1 6 ARG HB2 H 13.883 2.437 3.215 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HB2 . . . . . . . . . c19602_2mgt 1 . 5 . 2498 . 2 1 6 ARG HB3 H 15.327 1.686 3.894 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HB3 . . . . . . . . . c19602_2mgt 1 . 5 . 2499 . 2 1 6 ARG HD2 H 13.761 2.687 0.790 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HD2 . . . . . . . . . c19602_2mgt 1 . 5 . 2500 . 2 1 6 ARG HD3 H 15.146 3.574 0.140 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HD3 . . . . . . . . . c19602_2mgt 1 . 5 . 2501 . 2 1 6 ARG HE H 15.662 0.794 -0.016 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HE . . . . . . . . . c19602_2mgt 1 . 5 . 2502 . 2 1 6 ARG HG2 H 15.837 3.450 2.283 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HG2 . . . . . . . . . c19602_2mgt 1 . 5 . 2503 . 2 1 6 ARG HG3 H 16.483 1.885 1.776 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HG3 . . . . . . . . . c19602_2mgt 1 . 5 . 2504 . 2 1 6 ARG HH11 H 13.674 3.304 -1.539 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HH11 . . . . . . . . . c19602_2mgt 1 . 5 . 2505 . 2 1 6 ARG HH12 H 13.624 2.480 -3.075 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HH12 . . . . . . . . . c19602_2mgt 1 . 5 . 2506 . 2 1 6 ARG HH21 H 15.624 -0.211 -2.048 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HH21 . . . . . . . . . c19602_2mgt 1 . 5 . 2507 . 2 1 6 ARG HH22 H 14.745 0.516 -3.375 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HH22 . . . . . . . . . c19602_2mgt 1 . 5 . 2508 . 2 1 6 ARG N N 13.281 -0.005 3.644 . . . 1.0 . . . . . . . . . . . . B . 5 ARG N . . . . . . . . . c19602_2mgt 1 . 5 . 2509 . 2 1 6 ARG NE N 15.105 1.566 -0.351 . . . 1.0 . . . . . . . . . . . . B . 5 ARG NE . . . . . . . . . c19602_2mgt 1 . 5 . 2510 . 2 1 6 ARG NH1 N 13.936 2.522 -2.119 . . . 1.0 . . . . . . . . . . . . B . 5 ARG NH1 . . . . . . . . . c19602_2mgt 1 . 5 . 2511 . 2 1 6 ARG NH2 N 15.052 0.537 -2.413 . . . 1.0 . . . . . . . . . . . . B . 5 ARG NH2 . . . . . . . . . c19602_2mgt 1 . 5 . 2512 . 2 1 6 ARG O O 16.298 -0.646 2.962 . . . 1.0 . . . . . . . . . . . . B . 5 ARG O . . . . . . . . . c19602_2mgt 1 . 5 . 2513 . 2 1 7 ARG C C 15.883 -3.202 0.042 . . . 1.0 . . . . . . . . . . . . B . 6 ARG C . . . . . . . . . c19602_2mgt 1 . 5 . 2514 . 2 1 7 ARG CA C 15.472 -3.000 1.501 . . . 1.0 . . . . . . . . . . . . B . 6 ARG CA . . . . . . . . . c19602_2mgt 1 . 5 . 2515 . 2 1 7 ARG CB C 14.463 -4.079 1.915 . . . 1.0 . . . . . . . . . . . . B . 6 ARG CB . . . . . . . . . c19602_2mgt 1 . 5 . 2516 . 2 1 7 ARG CD C 15.080 -4.450 4.423 . . . 1.0 . . . . . . . . . . . . B . 6 ARG CD . . . . . . . . . c19602_2mgt 1 . 5 . 2517 . 2 1 7 ARG CG C 14.024 -4.058 3.386 . . . 1.0 . . . . . . . . . . . . B . 6 ARG CG . . . . . . . . . c19602_2mgt 1 . 5 . 2518 . 2 1 7 ARG CZ C 17.307 -3.284 4.602 . . . 1.0 . . . . . . . . . . . . B . 6 ARG CZ . . . . . . . . . c19602_2mgt 1 . 5 . 2519 . 2 1 7 ARG H H 13.888 -1.670 1.263 . . . 1.0 . . . . . . . . . . . . B . 6 ARG H . . . . . . . . . c19602_2mgt 1 . 5 . 2520 . 2 1 7 ARG HA H 16.349 -3.052 2.130 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HA . . . . . . . . . c19602_2mgt 1 . 5 . 2521 . 2 1 7 ARG HB2 H 13.570 -3.920 1.315 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HB2 . . . . . . . . . c19602_2mgt 1 . 5 . 2522 . 2 1 7 ARG HB3 H 14.850 -5.066 1.677 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HB3 . . . . . . . . . c19602_2mgt 1 . 5 . 2523 . 2 1 7 ARG HD2 H 14.562 -4.735 5.337 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HD2 . . . . . . . . . c19602_2mgt 1 . 5 . 2524 . 2 1 7 ARG HD3 H 15.636 -5.316 4.085 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HD3 . . . . . . . . . c19602_2mgt 1 . 5 . 2525 . 2 1 7 ARG HE H 15.534 -2.548 5.215 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HE . . . . . . . . . c19602_2mgt 1 . 5 . 2526 . 2 1 7 ARG HG2 H 13.651 -3.068 3.620 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HG2 . . . . . . . . . c19602_2mgt 1 . 5 . 2527 . 2 1 7 ARG HG3 H 13.193 -4.753 3.489 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HG3 . . . . . . . . . c19602_2mgt 1 . 5 . 2528 . 2 1 7 ARG HH11 H 17.534 -5.065 3.644 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HH11 . . . . . . . . . c19602_2mgt 1 . 5 . 2529 . 2 1 7 ARG HH12 H 19.007 -4.157 3.902 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HH12 . . . . . . . . . c19602_2mgt 1 . 5 . 2530 . 2 1 7 ARG HH21 H 17.453 -1.470 5.498 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HH21 . . . . . . . . . c19602_2mgt 1 . 5 . 2531 . 2 1 7 ARG HH22 H 18.965 -2.158 4.957 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HH22 . . . . . . . . . c19602_2mgt 1 . 5 . 2532 . 2 1 7 ARG N N 14.811 -1.717 1.660 . . . 1.0 . . . . . . . . . . . . B . 6 ARG N . . . . . . . . . c19602_2mgt 1 . 5 . 2533 . 2 1 7 ARG NE N 15.976 -3.338 4.760 . . . 1.0 . . . . . . . . . . . . B . 6 ARG NE . . . . . . . . . c19602_2mgt 1 . 5 . 2534 . 2 1 7 ARG NH1 N 18.008 -4.254 4.012 . . . 1.0 . . . . . . . . . . . . B . 6 ARG NH1 . . . . . . . . . c19602_2mgt 1 . 5 . 2535 . 2 1 7 ARG NH2 N 17.961 -2.215 5.047 . . . 1.0 . . . . . . . . . . . . B . 6 ARG NH2 . . . . . . . . . c19602_2mgt 1 . 5 . 2536 . 2 1 7 ARG O O 15.557 -2.384 -0.814 . . . 1.0 . . . . . . . . . . . . B . 6 ARG O . . . . . . . . . c19602_2mgt 1 . 5 . 2537 . 2 1 8 ASP C C 15.480 -5.084 -2.350 . . . 1.0 . . . . . . . . . . . . B . 7 ASP C . . . . . . . . . c19602_2mgt 1 . 5 . 2538 . 2 1 8 ASP CA C 16.795 -4.774 -1.619 . . . 1.0 . . . . . . . . . . . . B . 7 ASP CA . . . . . . . . . c19602_2mgt 1 . 5 . 2539 . 2 1 8 ASP CB C 17.729 -5.992 -1.631 . . . 1.0 . . . . . . . . . . . . B . 7 ASP CB . . . . . . . . . c19602_2mgt 1 . 5 . 2540 . 2 1 8 ASP CG C 17.048 -7.279 -1.195 . . . 1.0 . . . . . . . . . . . . B . 7 ASP CG . . . . . . . . . c19602_2mgt 1 . 5 . 2541 . 2 1 8 ASP H H 16.787 -4.965 0.497 . . . 1.0 . . . . . . . . . . . . B . 7 ASP H . . . . . . . . . c19602_2mgt 1 . 5 . 2542 . 2 1 8 ASP HA H 17.317 -3.980 -2.146 . . . 1.0 . . . . . . . . . . . . B . 7 ASP HA . . . . . . . . . c19602_2mgt 1 . 5 . 2543 . 2 1 8 ASP HB2 H 18.099 -6.122 -2.646 . . . 1.0 . . . . . . . . . . . . B . 7 ASP HB2 . . . . . . . . . c19602_2mgt 1 . 5 . 2544 . 2 1 8 ASP HB3 H 18.578 -5.811 -0.978 . . . 1.0 . . . . . . . . . . . . B . 7 ASP HB3 . . . . . . . . . c19602_2mgt 1 . 5 . 2545 . 2 1 8 ASP N N 16.551 -4.327 -0.249 . . . 1.0 . . . . . . . . . . . . B . 7 ASP N . . . . . . . . . c19602_2mgt 1 . 5 . 2546 . 2 1 8 ASP O O 15.365 -4.773 -3.526 . . . 1.0 . . . . . . . . . . . . B . 7 ASP O . . . . . . . . . c19602_2mgt 1 . 5 . 2547 . 2 1 8 ASP OD1 O 16.371 -7.270 -0.162 . . . 1.0 . . . . . . . . . . . . B . 7 ASP OD1 . . . . . . . . . c19602_2mgt 1 . 5 . 2548 . 2 1 8 ASP OD2 O 17.207 -8.285 -1.923 . . . 1.0 . . . . . . . . . . . . B . 7 ASP OD2 . . . . . . . . . c19602_2mgt 1 . 5 . 2549 . 2 1 9 SER C C 12.145 -6.125 -1.101 . . . 1.0 . . . . . . . . . . . . B . 8 SER C . . . . . . . . . c19602_2mgt 1 . 5 . 2550 . 2 1 9 SER CA C 13.245 -6.206 -2.165 . . . 1.0 . . . . . . . . . . . . B . 8 SER CA . . . . . . . . . c19602_2mgt 1 . 5 . 2551 . 2 1 9 SER CB C 13.462 -7.667 -2.571 . . . 1.0 . . . . . . . . . . . . B . 8 SER CB . . . . . . . . . c19602_2mgt 1 . 5 . 2552 . 2 1 9 SER H H 14.721 -5.938 -0.705 . . . 1.0 . . . . . . . . . . . . B . 8 SER H . . . . . . . . . c19602_2mgt 1 . 5 . 2553 . 2 1 9 SER HA H 12.938 -5.625 -3.028 . . . 1.0 . . . . . . . . . . . . B . 8 SER HA . . . . . . . . . c19602_2mgt 1 . 5 . 2554 . 2 1 9 SER HB2 H 14.007 -8.189 -1.786 . . . 1.0 . . . . . . . . . . . . B . 8 SER HB2 . . . . . . . . . c19602_2mgt 1 . 5 . 2555 . 2 1 9 SER HB3 H 12.500 -8.158 -2.719 . . . 1.0 . . . . . . . . . . . . B . 8 SER HB3 . . . . . . . . . c19602_2mgt 1 . 5 . 2556 . 2 1 9 SER HG H 13.608 -7.423 -4.481 . . . 1.0 . . . . . . . . . . . . B . 8 SER HG . . . . . . . . . c19602_2mgt 1 . 5 . 2557 . 2 1 9 SER N N 14.502 -5.673 -1.651 . . . 1.0 . . . . . . . . . . . . B . 8 SER N . . . . . . . . . c19602_2mgt 1 . 5 . 2558 . 2 1 9 SER O O 12.421 -5.793 0.050 . . . 1.0 . . . . . . . . . . . . B . 8 SER O . . . . . . . . . c19602_2mgt 1 . 5 . 2559 . 2 1 9 SER OG O 14.190 -7.727 -3.774 . . . 1.0 . . . . . . . . . . . . B . 8 SER OG . . . . . . . . . c19602_2mgt 1 . 5 . 2560 . 2 1 10 GLY C C 8.466 -6.740 -1.250 . . . 1.0 . . . . . . . . . . . . B . 9 GLY C . . . . . . . . . c19602_2mgt 1 . 5 . 2561 . 2 1 10 GLY CA C 9.775 -6.353 -0.550 . . . 1.0 . . . . . . . . . . . . B . 9 GLY CA . . . . . . . . . c19602_2mgt 1 . 5 . 2562 . 2 1 10 GLY H H 10.673 -6.672 -2.427 . . . 1.0 . . . . . . . . . . . . B . 9 GLY H . . . . . . . . . c19602_2mgt 1 . 5 . 2563 . 2 1 10 GLY HA2 H 9.955 -7.006 0.302 . . . 1.0 . . . . . . . . . . . . B . 9 GLY HA2 . . . . . . . . . c19602_2mgt 1 . 5 . 2564 . 2 1 10 GLY HA3 H 9.745 -5.338 -0.157 . . . 1.0 . . . . . . . . . . . . B . 9 GLY HA3 . . . . . . . . . c19602_2mgt 1 . 5 . 2565 . 2 1 10 GLY N N 10.893 -6.436 -1.468 . . . 1.0 . . . . . . . . . . . . B . 9 GLY N . . . . . . . . . c19602_2mgt 1 . 5 . 2566 . 2 1 10 GLY O O 8.203 -7.924 -1.430 . . . 1.0 . . . . . . . . . . . . B . 9 GLY O . . . . . . . . . c19602_2mgt 1 . 5 . 2567 . 2 1 11 TYR C C 6.504 -3.602 -1.728 . . . 1.0 . . . . . . . . . . . . B . 10 TYR C . . . . . . . . . c19602_2mgt 1 . 5 . 2568 . 2 1 11 TYR CA C 7.790 -4.364 -1.476 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CA . . . . . . . . . c19602_2mgt 1 . 5 . 2569 . 2 1 11 TYR CB C 8.853 -3.831 -2.442 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CB . . . . . . . . . c19602_2mgt 1 . 5 . 2570 . 2 1 11 TYR CD1 C 9.705 -2.147 -0.761 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CD1 . . . . . . . . . c19602_2mgt 1 . 5 . 2571 . 2 1 11 TYR CD2 C 11.264 -3.192 -2.313 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CD2 . . . . . . . . . c19602_2mgt 1 . 5 . 2572 . 2 1 11 TYR CE1 C 10.730 -1.348 -0.261 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CE1 . . . . . . . . . c19602_2mgt 1 . 5 . 2573 . 2 1 11 TYR CE2 C 12.308 -2.422 -1.787 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CE2 . . . . . . . . . c19602_2mgt 1 . 5 . 2574 . 2 1 11 TYR CG C 9.964 -3.046 -1.808 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CG . . . . . . . . . c19602_2mgt 1 . 5 . 2575 . 2 1 11 TYR CZ C 12.029 -1.465 -0.792 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CZ . . . . . . . . . c19602_2mgt 1 . 5 . 2576 . 2 1 11 TYR H H 6.869 -6.045 -2.270 . . . 1.0 . . . . . . . . . . . . B . 10 TYR H . . . . . . . . . c19602_2mgt 1 . 5 . 2577 . 2 1 11 TYR HA H 8.091 -4.178 -0.448 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HA . . . . . . . . . c19602_2mgt 1 . 5 . 2578 . 2 1 11 TYR HB2 H 9.303 -4.655 -2.979 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HB2 . . . . . . . . . c19602_2mgt 1 . 5 . 2579 . 2 1 11 TYR HB3 H 8.383 -3.195 -3.188 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HB3 . . . . . . . . . c19602_2mgt 1 . 5 . 2580 . 2 1 11 TYR HD1 H 8.721 -2.039 -0.347 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HD1 . . . . . . . . . c19602_2mgt 1 . 5 . 2581 . 2 1 11 TYR HD2 H 11.452 -3.886 -3.117 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HD2 . . . . . . . . . c19602_2mgt 1 . 5 . 2582 . 2 1 11 TYR HE1 H 10.510 -0.645 0.522 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HE1 . . . . . . . . . c19602_2mgt 1 . 5 . 2583 . 2 1 11 TYR HE2 H 13.308 -2.541 -2.163 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HE2 . . . . . . . . . c19602_2mgt 1 . 5 . 2584 . 2 1 11 TYR HH H 12.672 0.030 0.250 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HH . . . . . . . . . c19602_2mgt 1 . 5 . 2585 . 2 1 11 TYR N N 7.621 -5.787 -1.659 . . . 1.0 . . . . . . . . . . . . B . 10 TYR N . . . . . . . . . c19602_2mgt 1 . 5 . 2586 . 2 1 11 TYR O O 5.760 -3.884 -2.664 . . . 1.0 . . . . . . . . . . . . B . 10 TYR O . . . . . . . . . c19602_2mgt 1 . 5 . 2587 . 2 1 11 TYR OH O 13.000 -0.624 -0.372 . . . 1.0 . . . . . . . . . . . . B . 10 TYR OH . . . . . . . . . c19602_2mgt 1 . 5 . 2588 . 2 1 12 GLU C C 6.497 -0.154 -1.064 . . . 1.0 . . . . . . . . . . . . B . 11 GLU C . . . . . . . . . c19602_2mgt 1 . 5 . 2589 . 2 1 12 GLU CA C 5.624 -1.367 -1.394 . . . 1.0 . . . . . . . . . . . . B . 11 GLU CA . . . . . . . . . c19602_2mgt 1 . 5 . 2590 . 2 1 12 GLU CB C 4.279 -1.372 -0.685 . . . 1.0 . . . . . . . . . . . . B . 11 GLU CB . . . . . . . . . c19602_2mgt 1 . 5 . 2591 . 2 1 12 GLU CD C 2.117 -0.136 -0.474 . . . 1.0 . . . . . . . . . . . . B . 11 GLU CD . . . . . . . . . c19602_2mgt 1 . 5 . 2592 . 2 1 12 GLU CG C 3.327 -0.385 -1.351 . . . 1.0 . . . . . . . . . . . . B . 11 GLU CG . . . . . . . . . c19602_2mgt 1 . 5 . 2593 . 2 1 12 GLU H H 6.960 -2.398 -0.170 . . . 1.0 . . . . . . . . . . . . B . 11 GLU H . . . . . . . . . c19602_2mgt 1 . 5 . 2594 . 2 1 12 GLU HA H 5.453 -1.425 -2.467 . . . 1.0 . . . . . . . . . . . . B . 11 GLU HA . . . . . . . . . c19602_2mgt 1 . 5 . 2595 . 2 1 12 GLU HB2 H 3.849 -2.369 -0.742 . . . 1.0 . . . . . . . . . . . . B . 11 GLU HB2 . . . . . . . . . c19602_2mgt 1 . 5 . 2596 . 2 1 12 GLU HB3 H 4.417 -1.132 0.368 . . . 1.0 . . . . . . . . . . . . B . 11 GLU HB3 . . . . . . . . . c19602_2mgt 1 . 5 . 2597 . 2 1 12 GLU HG2 H 3.839 0.567 -1.509 . . . 1.0 . . . . . . . . . . . . B . 11 GLU HG2 . . . . . . . . . c19602_2mgt 1 . 5 . 2598 . 2 1 12 GLU HG3 H 3.008 -0.774 -2.317 . . . 1.0 . . . . . . . . . . . . B . 11 GLU HG3 . . . . . . . . . c19602_2mgt 1 . 5 . 2599 . 2 1 12 GLU N N 6.354 -2.527 -0.966 . . . 1.0 . . . . . . . . . . . . B . 11 GLU N . . . . . . . . . c19602_2mgt 1 . 5 . 2600 . 2 1 12 GLU O O 6.271 0.503 -0.054 . . . 1.0 . . . . . . . . . . . . B . 11 GLU O . . . . . . . . . c19602_2mgt 1 . 5 . 2601 . 2 1 12 GLU OE1 O 1.715 -1.067 0.268 . . . 1.0 . . . . . . . . . . . . B . 11 GLU OE1 . . . . . . . . . c19602_2mgt 1 . 5 . 2602 . 2 1 12 GLU OE2 O 1.617 0.994 -0.510 . . . 1.0 . . . . . . . . . . . . B . 11 GLU OE2 . . . . . . . . . c19602_2mgt 1 . 5 . 2603 . 2 1 13 VAL C C 8.074 2.416 -1.167 . . . 1.0 . . . . . . . . . . . . B . 12 VAL C . . . . . . . . . c19602_2mgt 1 . 5 . 2604 . 2 1 13 VAL CA C 8.578 1.102 -1.753 . . . 1.0 . . . . . . . . . . . . B . 12 VAL CA . . . . . . . . . c19602_2mgt 1 . 5 . 2605 . 2 1 13 VAL CB C 9.255 1.353 -3.121 . . . 1.0 . . . . . . . . . . . . B . 12 VAL CB . . . . . . . . . c19602_2mgt 1 . 5 . 2606 . 2 1 13 VAL CG1 C 10.253 2.524 -3.093 . . . 1.0 . . . . . . . . . . . . B . 12 VAL CG1 . . . . . . . . . c19602_2mgt 1 . 5 . 2607 . 2 1 13 VAL CG2 C 10.026 0.116 -3.591 . . . 1.0 . . . . . . . . . . . . B . 12 VAL CG2 . . . . . . . . . c19602_2mgt 1 . 5 . 2608 . 2 1 13 VAL H H 7.596 -0.494 -2.713 . . . 1.0 . . . . . . . . . . . . B . 12 VAL H . . . . . . . . . c19602_2mgt 1 . 5 . 2609 . 2 1 13 VAL HA H 9.333 0.714 -1.075 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HA . . . . . . . . . c19602_2mgt 1 . 5 . 2610 . 2 1 13 VAL HB H 8.484 1.580 -3.859 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HB . . . . . . . . . c19602_2mgt 1 . 5 . 2611 . 2 1 13 VAL HG11 H 9.725 3.468 -2.964 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HG11 . . . . . . . . . c19602_2mgt 1 . 5 . 2612 . 2 1 13 VAL HG12 H 10.964 2.392 -2.278 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HG12 . . . . . . . . . c19602_2mgt 1 . 5 . 2613 . 2 1 13 VAL HG13 H 10.798 2.566 -4.035 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HG13 . . . . . . . . . c19602_2mgt 1 . 5 . 2614 . 2 1 13 VAL HG21 H 9.383 -0.762 -3.590 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HG21 . . . . . . . . . c19602_2mgt 1 . 5 . 2615 . 2 1 13 VAL HG22 H 10.384 0.285 -4.605 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HG22 . . . . . . . . . c19602_2mgt 1 . 5 . 2616 . 2 1 13 VAL HG23 H 10.879 -0.057 -2.937 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HG23 . . . . . . . . . c19602_2mgt 1 . 5 . 2617 . 2 1 13 VAL N N 7.518 0.098 -1.901 . . . 1.0 . . . . . . . . . . . . B . 12 VAL N . . . . . . . . . c19602_2mgt 1 . 5 . 2618 . 2 1 13 VAL O O 8.759 2.990 -0.325 . . . 1.0 . . . . . . . . . . . . B . 12 VAL O . . . . . . . . . c19602_2mgt 1 . 5 . 2619 . 2 1 14 HIS C C 6.178 4.285 0.341 . . . 1.0 . . . . . . . . . . . . B . 13 HIS C . . . . . . . . . c19602_2mgt 1 . 5 . 2620 . 2 1 14 HIS CA C 6.317 4.131 -1.170 . . . 1.0 . . . . . . . . . . . . B . 13 HIS CA . . . . . . . . . c19602_2mgt 1 . 5 . 2621 . 2 1 14 HIS CB C 4.963 4.386 -1.843 . . . 1.0 . . . . . . . . . . . . B . 13 HIS CB . . . . . . . . . c19602_2mgt 1 . 5 . 2622 . 2 1 14 HIS CD2 C 6.094 4.693 -4.156 . . . 1.0 . . . . . . . . . . . . B . 13 HIS CD2 . . . . . . . . . c19602_2mgt 1 . 5 . 2623 . 2 1 14 HIS CE1 C 4.317 5.108 -5.369 . . . 1.0 . . . . . . . . . . . . B . 13 HIS CE1 . . . . . . . . . c19602_2mgt 1 . 5 . 2624 . 2 1 14 HIS CG C 5.006 4.669 -3.325 . . . 1.0 . . . . . . . . . . . . B . 13 HIS CG . . . . . . . . . c19602_2mgt 1 . 5 . 2625 . 2 1 14 HIS H H 6.370 2.327 -2.266 . . . 1.0 . . . . . . . . . . . . B . 13 HIS H . . . . . . . . . c19602_2mgt 1 . 5 . 2626 . 2 1 14 HIS HA H 7.017 4.881 -1.501 . . . 1.0 . . . . . . . . . . . . B . 13 HIS HA . . . . . . . . . c19602_2mgt 1 . 5 . 2627 . 2 1 14 HIS HB2 H 4.306 3.535 -1.661 . . . 1.0 . . . . . . . . . . . . B . 13 HIS HB2 . . . . . . . . . c19602_2mgt 1 . 5 . 2628 . 2 1 14 HIS HB3 H 4.510 5.256 -1.370 . . . 1.0 . . . . . . . . . . . . B . 13 HIS HB3 . . . . . . . . . c19602_2mgt 1 . 5 . 2629 . 2 1 14 HIS HD1 H 2.953 4.981 -3.784 . . . 1.0 . . . . . . . . . . . . B . 13 HIS HD1 . . . . . . . . . c19602_2mgt 1 . 5 . 2630 . 2 1 14 HIS HD2 H 7.120 4.514 -3.870 . . . 1.0 . . . . . . . . . . . . B . 13 HIS HD2 . . . . . . . . . c19602_2mgt 1 . 5 . 2631 . 2 1 14 HIS HE1 H 3.664 5.304 -6.207 . . . 1.0 . . . . . . . . . . . . B . 13 HIS HE1 . . . . . . . . . c19602_2mgt 1 . 5 . 2632 . 2 1 14 HIS N N 6.882 2.864 -1.581 . . . 1.0 . . . . . . . . . . . . B . 13 HIS N . . . . . . . . . c19602_2mgt 1 . 5 . 2633 . 2 1 14 HIS ND1 N 3.910 4.953 -4.103 . . . 1.0 . . . . . . . . . . . . B . 13 HIS ND1 . . . . . . . . . c19602_2mgt 1 . 5 . 2634 . 2 1 14 HIS NE2 N 5.646 4.961 -5.450 . . . 1.0 . . . . . . . . . . . . B . 13 HIS NE2 . . . . . . . . . c19602_2mgt 1 . 5 . 2635 . 2 1 14 HIS O O 6.250 5.421 0.794 . . . 1.0 . . . . . . . . . . . . B . 13 HIS O . . . . . . . . . c19602_2mgt 1 . 5 . 2636 . 2 1 15 HIS C C 6.044 2.048 3.387 . . . 1.0 . . . . . . . . . . . . B . 14 HIS C . . . . . . . . . c19602_2mgt 1 . 5 . 2637 . 2 1 15 HIS CA C 5.874 3.341 2.576 . . . 1.0 . . . . . . . . . . . . B . 14 HIS CA . . . . . . . . . c19602_2mgt 1 . 5 . 2638 . 2 1 15 HIS CB C 4.526 4.018 2.913 . . . 1.0 . . . . . . . . . . . . B . 14 HIS CB . . . . . . . . . c19602_2mgt 1 . 5 . 2639 . 2 1 15 HIS CD2 C 2.745 2.489 1.872 . . . 1.0 . . . . . . . . . . . . B . 14 HIS CD2 . . . . . . . . . c19602_2mgt 1 . 5 . 2640 . 2 1 15 HIS CE1 C 1.742 1.787 3.686 . . . 1.0 . . . . . . . . . . . . B . 14 HIS CE1 . . . . . . . . . c19602_2mgt 1 . 5 . 2641 . 2 1 15 HIS CG C 3.349 3.083 2.942 . . . 1.0 . . . . . . . . . . . . B . 14 HIS CG . . . . . . . . . c19602_2mgt 1 . 5 . 2642 . 2 1 15 HIS H H 5.991 2.285 0.713 . . . 1.0 . . . . . . . . . . . . B . 14 HIS H . . . . . . . . . c19602_2mgt 1 . 5 . 2643 . 2 1 15 HIS HA H 6.667 4.014 2.904 . . . 1.0 . . . . . . . . . . . . B . 14 HIS HA . . . . . . . . . c19602_2mgt 1 . 5 . 2644 . 2 1 15 HIS HB2 H 4.609 4.479 3.895 . . . 1.0 . . . . . . . . . . . . B . 14 HIS HB2 . . . . . . . . . c19602_2mgt 1 . 5 . 2645 . 2 1 15 HIS HB3 H 4.302 4.820 2.212 . . . 1.0 . . . . . . . . . . . . B . 14 HIS HB3 . . . . . . . . . c19602_2mgt 1 . 5 . 2646 . 2 1 15 HIS HD1 H 2.945 2.871 5.021 . . . 1.0 . . . . . . . . . . . . B . 14 HIS HD1 . . . . . . . . . c19602_2mgt 1 . 5 . 2647 . 2 1 15 HIS HD2 H 3.022 2.624 0.837 . . . 1.0 . . . . . . . . . . . . B . 14 HIS HD2 . . . . . . . . . c19602_2mgt 1 . 5 . 2648 . 2 1 15 HIS HE1 H 1.092 1.251 4.359 . . . 1.0 . . . . . . . . . . . . B . 14 HIS HE1 . . . . . . . . . c19602_2mgt 1 . 5 . 2649 . 2 1 15 HIS N N 6.017 3.208 1.127 . . . 1.0 . . . . . . . . . . . . B . 14 HIS N . . . . . . . . . c19602_2mgt 1 . 5 . 2650 . 2 1 15 HIS ND1 N 2.703 2.640 4.068 . . . 1.0 . . . . . . . . . . . . B . 14 HIS ND1 . . . . . . . . . c19602_2mgt 1 . 5 . 2651 . 2 1 15 HIS NE2 N 1.725 1.665 2.353 . . . 1.0 . . . . . . . . . . . . B . 14 HIS NE2 . . . . . . . . . c19602_2mgt 1 . 5 . 2652 . 2 1 15 HIS O O 5.943 2.126 4.604 . . . 1.0 . . . . . . . . . . . . B . 14 HIS O . . . . . . . . . c19602_2mgt 1 . 5 . 2653 . 2 1 16 GLN C C 6.870 -1.541 2.895 . . . 1.0 . . . . . . . . . . . . B . 15 GLN C . . . . . . . . . c19602_2mgt 1 . 5 . 2654 . 2 1 16 GLN CA C 6.062 -0.388 3.507 . . . 1.0 . . . . . . . . . . . . B . 15 GLN CA . . . . . . . . . c19602_2mgt 1 . 5 . 2655 . 2 1 16 GLN CB C 4.546 -0.627 3.574 . . . 1.0 . . . . . . . . . . . . B . 15 GLN CB . . . . . . . . . c19602_2mgt 1 . 5 . 2656 . 2 1 16 GLN CD C 4.398 -1.921 5.760 . . . 1.0 . . . . . . . . . . . . B . 15 GLN CD . . . . . . . . . c19602_2mgt 1 . 5 . 2657 . 2 1 16 GLN CG C 4.060 -1.889 4.270 . . . 1.0 . . . . . . . . . . . . B . 15 GLN CG . . . . . . . . . c19602_2mgt 1 . 5 . 2658 . 2 1 16 GLN H H 6.303 0.793 1.796 . . . 1.0 . . . . . . . . . . . . B . 15 GLN H . . . . . . . . . c19602_2mgt 1 . 5 . 2659 . 2 1 16 GLN HA H 6.419 -0.261 4.522 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HA . . . . . . . . . c19602_2mgt 1 . 5 . 2660 . 2 1 16 GLN HB2 H 4.089 0.211 4.093 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HB2 . . . . . . . . . c19602_2mgt 1 . 5 . 2661 . 2 1 16 GLN HB3 H 4.170 -0.643 2.558 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HB3 . . . . . . . . . c19602_2mgt 1 . 5 . 2662 . 2 1 16 GLN HE21 H 2.534 -1.293 6.277 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HE21 . . . . . . . . . c19602_2mgt 1 . 5 . 2663 . 2 1 16 GLN HE22 H 3.637 -1.582 7.603 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HE22 . . . . . . . . . c19602_2mgt 1 . 5 . 2664 . 2 1 16 GLN HG2 H 2.980 -1.935 4.145 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HG2 . . . . . . . . . c19602_2mgt 1 . 5 . 2665 . 2 1 16 GLN HG3 H 4.485 -2.751 3.768 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HG3 . . . . . . . . . c19602_2mgt 1 . 5 . 2666 . 2 1 16 GLN N N 6.251 0.866 2.795 . . . 1.0 . . . . . . . . . . . . B . 15 GLN N . . . . . . . . . c19602_2mgt 1 . 5 . 2667 . 2 1 16 GLN NE2 N 3.448 -1.554 6.612 . . . 1.0 . . . . . . . . . . . . B . 15 GLN NE2 . . . . . . . . . c19602_2mgt 1 . 5 . 2668 . 2 1 16 GLN O O 7.338 -1.477 1.762 . . . 1.0 . . . . . . . . . . . . B . 15 GLN O . . . . . . . . . c19602_2mgt 1 . 5 . 2669 . 2 1 16 GLN OE1 O 5.503 -2.276 6.152 . . . 1.0 . . . . . . . . . . . . B . 15 GLN OE1 . . . . . . . . . c19602_2mgt 1 . 5 . 2670 . 2 1 17 LYS C C 7.212 -4.620 2.244 . . . 1.0 . . . . . . . . . . . . B . 16 LYS C . . . . . . . . . c19602_2mgt 1 . 5 . 2671 . 2 1 17 LYS CA C 7.802 -3.801 3.391 . . . 1.0 . . . . . . . . . . . . B . 16 LYS CA . . . . . . . . . c19602_2mgt 1 . 5 . 2672 . 2 1 17 LYS CB C 7.896 -4.676 4.652 . . . 1.0 . . . . . . . . . . . . B . 16 LYS CB . . . . . . . . . c19602_2mgt 1 . 5 . 2673 . 2 1 17 LYS CD C 8.966 -4.924 6.940 . . . 1.0 . . . . . . . . . . . . B . 16 LYS CD . . . . . . . . . c19602_2mgt 1 . 5 . 2674 . 2 1 17 LYS CE C 9.807 -4.231 8.015 . . . 1.0 . . . . . . . . . . . . B . 16 LYS CE . . . . . . . . . c19602_2mgt 1 . 5 . 2675 . 2 1 17 LYS CG C 8.770 -4.017 5.722 . . . 1.0 . . . . . . . . . . . . B . 16 LYS CG . . . . . . . . . c19602_2mgt 1 . 5 . 2676 . 2 1 17 LYS H H 6.586 -2.566 4.597 . . . 1.0 . . . . . . . . . . . . B . 16 LYS H . . . . . . . . . c19602_2mgt 1 . 5 . 2677 . 2 1 17 LYS HA H 8.805 -3.500 3.099 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HA . . . . . . . . . c19602_2mgt 1 . 5 . 2678 . 2 1 17 LYS HB2 H 6.897 -4.858 5.052 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HB2 . . . . . . . . . c19602_2mgt 1 . 5 . 2679 . 2 1 17 LYS HB3 H 8.339 -5.636 4.387 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HB3 . . . . . . . . . c19602_2mgt 1 . 5 . 2680 . 2 1 17 LYS HD2 H 7.997 -5.204 7.356 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HD2 . . . . . . . . . c19602_2mgt 1 . 5 . 2681 . 2 1 17 LYS HD3 H 9.486 -5.829 6.627 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HD3 . . . . . . . . . c19602_2mgt 1 . 5 . 2682 . 2 1 17 LYS HE2 H 10.054 -4.953 8.791 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HE2 . . . . . . . . . c19602_2mgt 1 . 5 . 2683 . 2 1 17 LYS HE3 H 10.729 -3.857 7.571 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HE3 . . . . . . . . . c19602_2mgt 1 . 5 . 2684 . 2 1 17 LYS HG2 H 9.749 -3.801 5.296 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HG2 . . . . . . . . . c19602_2mgt 1 . 5 . 2685 . 2 1 17 LYS HG3 H 8.298 -3.089 6.035 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HG3 . . . . . . . . . c19602_2mgt 1 . 5 . 2686 . 2 1 17 LYS HZ1 H 9.636 -2.704 9.373 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HZ1 . . . . . . . . . c19602_2mgt 1 . 5 . 2687 . 2 1 17 LYS HZ2 H 8.873 -2.409 7.946 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HZ2 . . . . . . . . . c19602_2mgt 1 . 5 . 2688 . 2 1 17 LYS HZ3 H 8.213 -3.448 9.030 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HZ3 . . . . . . . . . c19602_2mgt 1 . 5 . 2689 . 2 1 17 LYS N N 7.035 -2.599 3.695 . . . 1.0 . . . . . . . . . . . . B . 16 LYS N . . . . . . . . . c19602_2mgt 1 . 5 . 2690 . 2 1 17 LYS NZ N 9.082 -3.116 8.637 . . . 1.0 . . . . . . . . . . . . B . 16 LYS NZ . . . . . . . . . c19602_2mgt 1 . 5 . 2691 . 2 1 17 LYS O O 7.923 -5.430 1.666 . . . 1.0 . . . . . . . . . . . . B . 16 LYS O . . . . . . . . . c19602_2mgt 1 . 5 . 2692 . 2 1 18 NH2 HN1 H 5.376 -3.751 2.363 . . . 1.0 . . . . . . . . . . . . B . 17 NH2 HN1 . . . . . . . . . c19602_2mgt 1 . 5 . 2693 . 2 1 18 NH2 HN2 H 5.552 -4.980 1.130 . . . 1.0 . . . . . . . . . . . . B . 17 NH2 HN2 . . . . . . . . . c19602_2mgt 1 . 5 . 2694 . 2 1 18 NH2 N N 5.945 -4.433 1.883 . . . 1.0 . . . . . . . . . . . . B . 17 NH2 N . . . . . . . . . c19602_2mgt 1 . 5 . 2695 . 3 2 1 ZN ZN Zn 0.609 0.333 1.216 . . . 1.0 . . . . . . . . . . . . A . 101 ZN ZN . . . . . . . . . c19602_2mgt 1 . 6 . 2696 . 1 1 1 ACE C C -11.347 -4.049 -2.378 . . . 1.0 . . . . . . . . . . . . A . 0 ACE C . . . . . . . . . c19602_2mgt 1 . 6 . 2697 . 1 1 1 ACE CH3 C -9.948 -4.526 -2.044 . . . 1.0 . . . . . . . . . . . . A . 0 ACE CH3 . . . . . . . . . c19602_2mgt 1 . 6 . 2698 . 1 1 1 ACE H1 H -9.218 -3.860 -2.502 . . . 1.0 . . . . . . . . . . . . A . 0 ACE H1 . . . . . . . . . c19602_2mgt 1 . 6 . 2699 . 1 1 1 ACE H2 H -9.811 -4.548 -0.964 . . . 1.0 . . . . . . . . . . . . A . 0 ACE H2 . . . . . . . . . c19602_2mgt 1 . 6 . 2700 . 1 1 1 ACE H3 H -9.810 -5.526 -2.447 . . . 1.0 . . . . . . . . . . . . A . 0 ACE H3 . . . . . . . . . c19602_2mgt 1 . 6 . 2701 . 1 1 1 ACE O O -11.500 -3.095 -3.131 . . . 1.0 . . . . . . . . . . . . A . 0 ACE O . . . . . . . . . c19602_2mgt 1 . 6 . 2702 . 1 1 2 ASP C C -14.414 -3.301 -2.080 . . . 1.0 . . . . . . . . . . . . A . 1 ASP C . . . . . . . . . c19602_2mgt 1 . 6 . 2703 . 1 1 2 ASP CA C -13.748 -4.665 -2.267 . . . 1.0 . . . . . . . . . . . . A . 1 ASP CA . . . . . . . . . c19602_2mgt 1 . 6 . 2704 . 1 1 2 ASP CB C -14.526 -5.774 -1.559 . . . 1.0 . . . . . . . . . . . . A . 1 ASP CB . . . . . . . . . c19602_2mgt 1 . 6 . 2705 . 1 1 2 ASP CG C -14.123 -7.126 -2.125 . . . 1.0 . . . . . . . . . . . . A . 1 ASP CG . . . . . . . . . c19602_2mgt 1 . 6 . 2706 . 1 1 2 ASP H H -12.128 -5.477 -1.185 . . . 1.0 . . . . . . . . . . . . A . 1 ASP H . . . . . . . . . c19602_2mgt 1 . 6 . 2707 . 1 1 2 ASP HA H -13.772 -4.874 -3.337 . . . 1.0 . . . . . . . . . . . . A . 1 ASP HA . . . . . . . . . c19602_2mgt 1 . 6 . 2708 . 1 1 2 ASP HB2 H -14.325 -5.746 -0.484 . . . 1.0 . . . . . . . . . . . . A . 1 ASP HB2 . . . . . . . . . c19602_2mgt 1 . 6 . 2709 . 1 1 2 ASP HB3 H -15.591 -5.645 -1.709 . . . 1.0 . . . . . . . . . . . . A . 1 ASP HB3 . . . . . . . . . c19602_2mgt 1 . 6 . 2710 . 1 1 2 ASP N N -12.354 -4.739 -1.837 . . . 1.0 . . . . . . . . . . . . A . 1 ASP N . . . . . . . . . c19602_2mgt 1 . 6 . 2711 . 1 1 2 ASP O O -13.876 -2.426 -1.411 . . . 1.0 . . . . . . . . . . . . A . 1 ASP O . . . . . . . . . c19602_2mgt 1 . 6 . 2712 . 1 1 2 ASP OD1 O -14.454 -7.342 -3.337 . . . 1.0 . . . . . . . . . . . . A . 1 ASP OD1 . . . . . . . . . c19602_2mgt 1 . 6 . 2713 . 1 1 2 ASP OD2 O -13.498 -7.898 -1.425 . . . 1.0 . . . . . . . . . . . . A . 1 ASP OD2 . . . . . . . . . c19602_2mgt 1 . 6 . 2714 . 1 1 3 ALA C C -16.620 -1.238 -1.462 . . . 1.0 . . . . . . . . . . . . A . 2 ALA C . . . . . . . . . c19602_2mgt 1 . 6 . 2715 . 1 1 3 ALA CA C -16.381 -1.927 -2.805 . . . 1.0 . . . . . . . . . . . . A . 2 ALA CA . . . . . . . . . c19602_2mgt 1 . 6 . 2716 . 1 1 3 ALA CB C -17.727 -2.284 -3.439 . . . 1.0 . . . . . . . . . . . . A . 2 ALA CB . . . . . . . . . c19602_2mgt 1 . 6 . 2717 . 1 1 3 ALA H H -15.969 -3.953 -3.187 . . . 1.0 . . . . . . . . . . . . A . 2 ALA H . . . . . . . . . c19602_2mgt 1 . 6 . 2718 . 1 1 3 ALA HA H -15.857 -1.237 -3.462 . . . 1.0 . . . . . . . . . . . . A . 2 ALA HA . . . . . . . . . c19602_2mgt 1 . 6 . 2719 . 1 1 3 ALA HB1 H -18.384 -1.417 -3.424 . . . 1.0 . . . . . . . . . . . . A . 2 ALA HB1 . . . . . . . . . c19602_2mgt 1 . 6 . 2720 . 1 1 3 ALA HB2 H -17.576 -2.605 -4.467 . . . 1.0 . . . . . . . . . . . . A . 2 ALA HB2 . . . . . . . . . c19602_2mgt 1 . 6 . 2721 . 1 1 3 ALA HB3 H -18.206 -3.087 -2.882 . . . 1.0 . . . . . . . . . . . . A . 2 ALA HB3 . . . . . . . . . c19602_2mgt 1 . 6 . 2722 . 1 1 3 ALA N N -15.596 -3.152 -2.698 . . . 1.0 . . . . . . . . . . . . A . 2 ALA N . . . . . . . . . c19602_2mgt 1 . 6 . 2723 . 1 1 3 ALA O O -16.487 -0.021 -1.367 . . . 1.0 . . . . . . . . . . . . A . 2 ALA O . . . . . . . . . c19602_2mgt 1 . 6 . 2724 . 1 1 4 GLU C C -15.905 -0.912 1.561 . . . 1.0 . . . . . . . . . . . . A . 3 GLU C . . . . . . . . . c19602_2mgt 1 . 6 . 2725 . 1 1 4 GLU CA C -17.129 -1.586 0.947 . . . 1.0 . . . . . . . . . . . . A . 3 GLU CA . . . . . . . . . c19602_2mgt 1 . 6 . 2726 . 1 1 4 GLU CB C -17.497 -2.812 1.781 . . . 1.0 . . . . . . . . . . . . A . 3 GLU CB . . . . . . . . . c19602_2mgt 1 . 6 . 2727 . 1 1 4 GLU CD C -16.838 -5.191 2.165 . . . 1.0 . . . . . . . . . . . . A . 3 GLU CD . . . . . . . . . c19602_2mgt 1 . 6 . 2728 . 1 1 4 GLU CG C -16.328 -3.801 1.865 . . . 1.0 . . . . . . . . . . . . A . 3 GLU CG . . . . . . . . . c19602_2mgt 1 . 6 . 2729 . 1 1 4 GLU H H -16.999 -3.017 -0.598 . . . 1.0 . . . . . . . . . . . . A . 3 GLU H . . . . . . . . . c19602_2mgt 1 . 6 . 2730 . 1 1 4 GLU HA H -17.959 -0.883 0.972 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HA . . . . . . . . . c19602_2mgt 1 . 6 . 2731 . 1 1 4 GLU HB2 H -17.774 -2.501 2.789 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HB2 . . . . . . . . . c19602_2mgt 1 . 6 . 2732 . 1 1 4 GLU HB3 H -18.357 -3.298 1.323 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HB3 . . . . . . . . . c19602_2mgt 1 . 6 . 2733 . 1 1 4 GLU HG2 H -15.785 -3.841 0.917 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HG2 . . . . . . . . . c19602_2mgt 1 . 6 . 2734 . 1 1 4 GLU HG3 H -15.640 -3.486 2.645 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HG3 . . . . . . . . . c19602_2mgt 1 . 6 . 2735 . 1 1 4 GLU N N -16.930 -2.023 -0.429 . . . 1.0 . . . . . . . . . . . . A . 3 GLU N . . . . . . . . . c19602_2mgt 1 . 6 . 2736 . 1 1 4 GLU O O -16.060 -0.216 2.552 . . . 1.0 . . . . . . . . . . . . A . 3 GLU O . . . . . . . . . c19602_2mgt 1 . 6 . 2737 . 1 1 4 GLU OE1 O -17.317 -5.385 3.312 . . . 1.0 . . . . . . . . . . . . A . 3 GLU OE1 . . . . . . . . . c19602_2mgt 1 . 6 . 2738 . 1 1 4 GLU OE2 O -16.796 -6.027 1.265 . . . 1.0 . . . . . . . . . . . . A . 3 GLU OE2 . . . . . . . . . c19602_2mgt 1 . 6 . 2739 . 1 1 5 PHE C C -13.011 0.564 0.380 . . . 1.0 . . . . . . . . . . . . A . 4 PHE C . . . . . . . . . c19602_2mgt 1 . 6 . 2740 . 1 1 5 PHE CA C -13.469 -0.470 1.402 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CA . . . . . . . . . c19602_2mgt 1 . 6 . 2741 . 1 1 5 PHE CB C -12.383 -1.526 1.585 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CB . . . . . . . . . c19602_2mgt 1 . 6 . 2742 . 1 1 5 PHE CD1 C -13.237 -2.399 3.806 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CD1 . . . . . . . . . c19602_2mgt 1 . 6 . 2743 . 1 1 5 PHE CD2 C -12.716 -3.983 2.030 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CD2 . . . . . . . . . c19602_2mgt 1 . 6 . 2744 . 1 1 5 PHE CE1 C -13.528 -3.463 4.672 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CE1 . . . . . . . . . c19602_2mgt 1 . 6 . 2745 . 1 1 5 PHE CE2 C -13.048 -5.043 2.885 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CE2 . . . . . . . . . c19602_2mgt 1 . 6 . 2746 . 1 1 5 PHE CG C -12.784 -2.661 2.498 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CG . . . . . . . . . c19602_2mgt 1 . 6 . 2747 . 1 1 5 PHE CZ C -13.419 -4.785 4.213 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CZ . . . . . . . . . c19602_2mgt 1 . 6 . 2748 . 1 1 5 PHE H H -14.647 -1.792 0.252 . . . 1.0 . . . . . . . . . . . . A . 4 PHE H . . . . . . . . . c19602_2mgt 1 . 6 . 2749 . 1 1 5 PHE HA H -13.618 0.048 2.349 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HA . . . . . . . . . c19602_2mgt 1 . 6 . 2750 . 1 1 5 PHE HB2 H -12.113 -1.927 0.608 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HB2 . . . . . . . . . c19602_2mgt 1 . 6 . 2751 . 1 1 5 PHE HB3 H -11.496 -1.049 2.002 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HB3 . . . . . . . . . c19602_2mgt 1 . 6 . 2752 . 1 1 5 PHE HD1 H -13.356 -1.383 4.151 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HD1 . . . . . . . . . c19602_2mgt 1 . 6 . 2753 . 1 1 5 PHE HD2 H -12.420 -4.183 1.013 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HD2 . . . . . . . . . c19602_2mgt 1 . 6 . 2754 . 1 1 5 PHE HE1 H -13.841 -3.264 5.685 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HE1 . . . . . . . . . c19602_2mgt 1 . 6 . 2755 . 1 1 5 PHE HE2 H -13.022 -6.055 2.518 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HE2 . . . . . . . . . c19602_2mgt 1 . 6 . 2756 . 1 1 5 PHE HZ H -13.636 -5.603 4.874 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HZ . . . . . . . . . c19602_2mgt 1 . 6 . 2757 . 1 1 5 PHE N N -14.708 -1.122 1.005 . . . 1.0 . . . . . . . . . . . . A . 4 PHE N . . . . . . . . . c19602_2mgt 1 . 6 . 2758 . 1 1 5 PHE O O -12.231 1.434 0.741 . . . 1.0 . . . . . . . . . . . . A . 4 PHE O . . . . . . . . . c19602_2mgt 1 . 6 . 2759 . 1 1 6 ARG C C -14.092 2.859 -1.538 . . . 1.0 . . . . . . . . . . . . A . 5 ARG C . . . . . . . . . c19602_2mgt 1 . 6 . 2760 . 1 1 6 ARG CA C -13.312 1.571 -1.860 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CA . . . . . . . . . c19602_2mgt 1 . 6 . 2761 . 1 1 6 ARG CB C -13.631 1.015 -3.253 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CB . . . . . . . . . c19602_2mgt 1 . 6 . 2762 . 1 1 6 ARG CD C -11.170 0.301 -3.666 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CD . . . . . . . . . c19602_2mgt 1 . 6 . 2763 . 1 1 6 ARG CG C -12.653 -0.088 -3.694 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CG . . . . . . . . . c19602_2mgt 1 . 6 . 2764 . 1 1 6 ARG CZ C -10.084 1.893 -5.288 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CZ . . . . . . . . . c19602_2mgt 1 . 6 . 2765 . 1 1 6 ARG H H -14.150 -0.223 -1.103 . . . 1.0 . . . . . . . . . . . . A . 5 ARG H . . . . . . . . . c19602_2mgt 1 . 6 . 2766 . 1 1 6 ARG HA H -12.259 1.842 -1.838 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HA . . . . . . . . . c19602_2mgt 1 . 6 . 2767 . 1 1 6 ARG HB2 H -14.643 0.617 -3.251 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HB2 . . . . . . . . . c19602_2mgt 1 . 6 . 2768 . 1 1 6 ARG HB3 H -13.589 1.818 -3.987 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HB3 . . . . . . . . . c19602_2mgt 1 . 6 . 2769 . 1 1 6 ARG HD2 H -10.822 0.347 -2.634 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HD2 . . . . . . . . . c19602_2mgt 1 . 6 . 2770 . 1 1 6 ARG HD3 H -10.612 -0.480 -4.175 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HD3 . . . . . . . . . c19602_2mgt 1 . 6 . 2771 . 1 1 6 ARG HE H -11.535 2.355 -3.983 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HE . . . . . . . . . c19602_2mgt 1 . 6 . 2772 . 1 1 6 ARG HG2 H -12.786 -0.949 -3.052 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HG2 . . . . . . . . . c19602_2mgt 1 . 6 . 2773 . 1 1 6 ARG HG3 H -12.912 -0.395 -4.702 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HG3 . . . . . . . . . c19602_2mgt 1 . 6 . 2774 . 1 1 6 ARG HH11 H -9.163 0.081 -5.357 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH11 . . . . . . . . . c19602_2mgt 1 . 6 . 2775 . 1 1 6 ARG HH12 H -8.568 1.265 -6.496 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH12 . . . . . . . . . c19602_2mgt 1 . 6 . 2776 . 1 1 6 ARG HH21 H -10.753 3.808 -5.437 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH21 . . . . . . . . . c19602_2mgt 1 . 6 . 2777 . 1 1 6 ARG HH22 H -9.459 3.379 -6.530 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH22 . . . . . . . . . c19602_2mgt 1 . 6 . 2778 . 1 1 6 ARG N N -13.522 0.529 -0.857 . . . 1.0 . . . . . . . . . . . . A . 5 ARG N . . . . . . . . . c19602_2mgt 1 . 6 . 2779 . 1 1 6 ARG NE N -10.944 1.603 -4.305 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NE . . . . . . . . . c19602_2mgt 1 . 6 . 2780 . 1 1 6 ARG NH1 N -9.213 1.003 -5.764 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NH1 . . . . . . . . . c19602_2mgt 1 . 6 . 2781 . 1 1 6 ARG NH2 N -10.105 3.123 -5.798 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NH2 . . . . . . . . . c19602_2mgt 1 . 6 . 2782 . 1 1 6 ARG O O -14.293 3.699 -2.411 . . . 1.0 . . . . . . . . . . . . A . 5 ARG O . . . . . . . . . c19602_2mgt 1 . 6 . 2783 . 1 1 7 ARG C C -13.906 5.365 0.161 . . . 1.0 . . . . . . . . . . . . A . 6 ARG C . . . . . . . . . c19602_2mgt 1 . 6 . 2784 . 1 1 7 ARG CA C -14.976 4.282 0.291 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CA . . . . . . . . . c19602_2mgt 1 . 6 . 2785 . 1 1 7 ARG CB C -15.308 4.088 1.778 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CB . . . . . . . . . c19602_2mgt 1 . 6 . 2786 . 1 1 7 ARG CD C -17.594 2.943 1.422 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CD . . . . . . . . . c19602_2mgt 1 . 6 . 2787 . 1 1 7 ARG CG C -16.211 2.886 2.072 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CG . . . . . . . . . c19602_2mgt 1 . 6 . 2788 . 1 1 7 ARG CZ C -18.271 2.860 -0.987 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CZ . . . . . . . . . c19602_2mgt 1 . 6 . 2789 . 1 1 7 ARG H H -14.351 2.284 0.378 . . . 1.0 . . . . . . . . . . . . A . 6 ARG H . . . . . . . . . c19602_2mgt 1 . 6 . 2790 . 1 1 7 ARG HA H -15.879 4.569 -0.236 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HA . . . . . . . . . c19602_2mgt 1 . 6 . 2791 . 1 1 7 ARG HB2 H -14.375 3.939 2.325 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HB2 . . . . . . . . . c19602_2mgt 1 . 6 . 2792 . 1 1 7 ARG HB3 H -15.783 4.992 2.161 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HB3 . . . . . . . . . c19602_2mgt 1 . 6 . 2793 . 1 1 7 ARG HD2 H -18.283 2.338 2.007 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HD2 . . . . . . . . . c19602_2mgt 1 . 6 . 2794 . 1 1 7 ARG HD3 H -17.936 3.977 1.421 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HD3 . . . . . . . . . c19602_2mgt 1 . 6 . 2795 . 1 1 7 ARG HE H -17.032 1.556 -0.076 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HE . . . . . . . . . c19602_2mgt 1 . 6 . 2796 . 1 1 7 ARG HG2 H -15.693 1.995 1.738 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HG2 . . . . . . . . . c19602_2mgt 1 . 6 . 2797 . 1 1 7 ARG HG3 H -16.339 2.813 3.150 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HG3 . . . . . . . . . c19602_2mgt 1 . 6 . 2798 . 1 1 7 ARG HH11 H -19.178 4.421 -0.045 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH11 . . . . . . . . . c19602_2mgt 1 . 6 . 2799 . 1 1 7 ARG HH12 H -19.565 4.234 -1.743 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH12 . . . . . . . . . c19602_2mgt 1 . 6 . 2800 . 1 1 7 ARG HH21 H -17.575 1.412 -2.235 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH21 . . . . . . . . . c19602_2mgt 1 . 6 . 2801 . 1 1 7 ARG HH22 H -18.672 2.564 -2.956 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH22 . . . . . . . . . c19602_2mgt 1 . 6 . 2802 . 1 1 7 ARG N N -14.497 3.036 -0.277 . . . 1.0 . . . . . . . . . . . . A . 6 ARG N . . . . . . . . . c19602_2mgt 1 . 6 . 2803 . 1 1 7 ARG NE N -17.588 2.389 0.064 . . . 1.0 . . . . . . . . . . . . A . 6 ARG NE . . . . . . . . . c19602_2mgt 1 . 6 . 2804 . 1 1 7 ARG NH1 N -19.063 3.930 -0.920 . . . 1.0 . . . . . . . . . . . . A . 6 ARG NH1 . . . . . . . . . c19602_2mgt 1 . 6 . 2805 . 1 1 7 ARG NH2 N -18.160 2.232 -2.152 . . . 1.0 . . . . . . . . . . . . A . 6 ARG NH2 . . . . . . . . . c19602_2mgt 1 . 6 . 2806 . 1 1 7 ARG O O -12.713 5.079 0.225 . . . 1.0 . . . . . . . . . . . . A . 6 ARG O . . . . . . . . . c19602_2mgt 1 . 6 . 2807 . 1 1 8 ASP C C -12.838 7.820 1.640 . . . 1.0 . . . . . . . . . . . . A . 7 ASP C . . . . . . . . . c19602_2mgt 1 . 6 . 2808 . 1 1 8 ASP CA C -13.438 7.760 0.227 . . . 1.0 . . . . . . . . . . . . A . 7 ASP CA . . . . . . . . . c19602_2mgt 1 . 6 . 2809 . 1 1 8 ASP CB C -14.226 9.037 -0.062 . . . 1.0 . . . . . . . . . . . . A . 7 ASP CB . . . . . . . . . c19602_2mgt 1 . 6 . 2810 . 1 1 8 ASP CG C -13.309 10.243 0.055 . . . 1.0 . . . . . . . . . . . . A . 7 ASP CG . . . . . . . . . c19602_2mgt 1 . 6 . 2811 . 1 1 8 ASP H H -15.321 6.812 0.023 . . . 1.0 . . . . . . . . . . . . A . 7 ASP H . . . . . . . . . c19602_2mgt 1 . 6 . 2812 . 1 1 8 ASP HA H -12.625 7.675 -0.494 . . . 1.0 . . . . . . . . . . . . A . 7 ASP HA . . . . . . . . . c19602_2mgt 1 . 6 . 2813 . 1 1 8 ASP HB2 H -14.633 8.991 -1.072 . . . 1.0 . . . . . . . . . . . . A . 7 ASP HB2 . . . . . . . . . c19602_2mgt 1 . 6 . 2814 . 1 1 8 ASP HB3 H -15.052 9.130 0.644 . . . 1.0 . . . . . . . . . . . . A . 7 ASP HB3 . . . . . . . . . c19602_2mgt 1 . 6 . 2815 . 1 1 8 ASP N N -14.330 6.624 0.066 . . . 1.0 . . . . . . . . . . . . A . 7 ASP N . . . . . . . . . c19602_2mgt 1 . 6 . 2816 . 1 1 8 ASP O O -11.756 8.372 1.815 . . . 1.0 . . . . . . . . . . . . A . 7 ASP O . . . . . . . . . c19602_2mgt 1 . 6 . 2817 . 1 1 8 ASP OD1 O -12.543 10.474 -0.887 . . . 1.0 . . . . . . . . . . . . A . 7 ASP OD1 . . . . . . . . . c19602_2mgt 1 . 6 . 2818 . 1 1 8 ASP OD2 O -13.340 10.894 1.124 . . . 1.0 . . . . . . . . . . . . A . 7 ASP OD2 . . . . . . . . . c19602_2mgt 1 . 6 . 2819 . 1 1 9 SER C C -11.968 6.378 4.325 . . . 1.0 . . . . . . . . . . . . A . 8 SER C . . . . . . . . . c19602_2mgt 1 . 6 . 2820 . 1 1 9 SER CA C -13.140 7.320 4.035 . . . 1.0 . . . . . . . . . . . . A . 8 SER CA . . . . . . . . . c19602_2mgt 1 . 6 . 2821 . 1 1 9 SER CB C -14.359 7.015 4.909 . . . 1.0 . . . . . . . . . . . . A . 8 SER CB . . . . . . . . . c19602_2mgt 1 . 6 . 2822 . 1 1 9 SER H H -14.427 6.849 2.440 . . . 1.0 . . . . . . . . . . . . A . 8 SER H . . . . . . . . . c19602_2mgt 1 . 6 . 2823 . 1 1 9 SER HA H -12.827 8.336 4.246 . . . 1.0 . . . . . . . . . . . . A . 8 SER HA . . . . . . . . . c19602_2mgt 1 . 6 . 2824 . 1 1 9 SER HB2 H -14.777 6.051 4.634 . . . 1.0 . . . . . . . . . . . . A . 8 SER HB2 . . . . . . . . . c19602_2mgt 1 . 6 . 2825 . 1 1 9 SER HB3 H -14.066 7.006 5.959 . . . 1.0 . . . . . . . . . . . . A . 8 SER HB3 . . . . . . . . . c19602_2mgt 1 . 6 . 2826 . 1 1 9 SER HG H -16.081 7.812 5.318 . . . 1.0 . . . . . . . . . . . . A . 8 SER HG . . . . . . . . . c19602_2mgt 1 . 6 . 2827 . 1 1 9 SER N N -13.530 7.259 2.640 . . . 1.0 . . . . . . . . . . . . A . 8 SER N . . . . . . . . . c19602_2mgt 1 . 6 . 2828 . 1 1 9 SER O O -12.172 5.217 4.664 . . . 1.0 . . . . . . . . . . . . A . 8 SER O . . . . . . . . . c19602_2mgt 1 . 6 . 2829 . 1 1 9 SER OG O -15.353 7.989 4.713 . . . 1.0 . . . . . . . . . . . . A . 8 SER OG . . . . . . . . . c19602_2mgt 1 . 6 . 2830 . 1 1 10 GLY C C -8.404 6.947 3.741 . . . 1.0 . . . . . . . . . . . . A . 9 GLY C . . . . . . . . . c19602_2mgt 1 . 6 . 2831 . 1 1 10 GLY CA C -9.495 6.205 4.510 . . . 1.0 . . . . . . . . . . . . A . 9 GLY CA . . . . . . . . . c19602_2mgt 1 . 6 . 2832 . 1 1 10 GLY H H -10.617 7.812 3.814 . . . 1.0 . . . . . . . . . . . . A . 9 GLY H . . . . . . . . . c19602_2mgt 1 . 6 . 2833 . 1 1 10 GLY HA2 H -9.297 6.268 5.578 . . . 1.0 . . . . . . . . . . . . A . 9 GLY HA2 . . . . . . . . . c19602_2mgt 1 . 6 . 2834 . 1 1 10 GLY HA3 H -9.564 5.155 4.246 . . . 1.0 . . . . . . . . . . . . A . 9 GLY HA3 . . . . . . . . . c19602_2mgt 1 . 6 . 2835 . 1 1 10 GLY N N -10.737 6.887 4.205 . . . 1.0 . . . . . . . . . . . . A . 9 GLY N . . . . . . . . . c19602_2mgt 1 . 6 . 2836 . 1 1 10 GLY O O -8.343 8.167 3.824 . . . 1.0 . . . . . . . . . . . . A . 9 GLY O . . . . . . . . . c19602_2mgt 1 . 6 . 2837 . 1 1 11 TYR C C -6.020 4.552 2.151 . . . 1.0 . . . . . . . . . . . . A . 10 TYR C . . . . . . . . . c19602_2mgt 1 . 6 . 2838 . 1 1 11 TYR CA C -7.364 4.872 2.801 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CA . . . . . . . . . c19602_2mgt 1 . 6 . 2839 . 1 1 11 TYR CB C -8.485 4.304 1.915 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CB . . . . . . . . . c19602_2mgt 1 . 6 . 2840 . 1 1 11 TYR CD1 C -8.662 2.140 3.212 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CD1 . . . . . . . . . c19602_2mgt 1 . 6 . 2841 . 1 1 11 TYR CD2 C -10.695 3.359 2.658 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CD2 . . . . . . . . . c19602_2mgt 1 . 6 . 2842 . 1 1 11 TYR CE1 C -9.413 1.171 3.880 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CE1 . . . . . . . . . c19602_2mgt 1 . 6 . 2843 . 1 1 11 TYR CE2 C -11.456 2.393 3.328 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CE2 . . . . . . . . . c19602_2mgt 1 . 6 . 2844 . 1 1 11 TYR CG C -9.298 3.233 2.596 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CG . . . . . . . . . c19602_2mgt 1 . 6 . 2845 . 1 1 11 TYR CZ C -10.817 1.288 3.924 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CZ . . . . . . . . . c19602_2mgt 1 . 6 . 2846 . 1 1 11 TYR H H -6.985 6.856 2.347 . . . 1.0 . . . . . . . . . . . . A . 10 TYR H . . . . . . . . . c19602_2mgt 1 . 6 . 2847 . 1 1 11 TYR HA H -7.392 4.410 3.786 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HA . . . . . . . . . c19602_2mgt 1 . 6 . 2848 . 1 1 11 TYR HB2 H -9.155 5.101 1.593 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HB2 . . . . . . . . . c19602_2mgt 1 . 6 . 2849 . 1 1 11 TYR HB3 H -8.057 3.891 1.002 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HB3 . . . . . . . . . c19602_2mgt 1 . 6 . 2850 . 1 1 11 TYR HD1 H -7.591 2.045 3.195 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HD1 . . . . . . . . . c19602_2mgt 1 . 6 . 2851 . 1 1 11 TYR HD2 H -11.182 4.212 2.210 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HD2 . . . . . . . . . c19602_2mgt 1 . 6 . 2852 . 1 1 11 TYR HE1 H -8.914 0.354 4.369 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HE1 . . . . . . . . . c19602_2mgt 1 . 6 . 2853 . 1 1 11 TYR HE2 H -12.528 2.497 3.383 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HE2 . . . . . . . . . c19602_2mgt 1 . 6 . 2854 . 1 1 11 TYR HH H -11.019 -0.327 4.988 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HH . . . . . . . . . c19602_2mgt 1 . 6 . 2855 . 1 1 11 TYR N N -7.535 6.297 2.967 . . . 1.0 . . . . . . . . . . . . A . 10 TYR N . . . . . . . . . c19602_2mgt 1 . 6 . 2856 . 1 1 11 TYR O O -5.494 5.314 1.341 . . . 1.0 . . . . . . . . . . . . A . 10 TYR O . . . . . . . . . c19602_2mgt 1 . 6 . 2857 . 1 1 11 TYR OH O -11.555 0.348 4.560 . . . 1.0 . . . . . . . . . . . . A . 10 TYR OH . . . . . . . . . c19602_2mgt 1 . 6 . 2858 . 1 1 12 GLU C C -5.415 1.083 1.622 . . . 1.0 . . . . . . . . . . . . A . 11 GLU C . . . . . . . . . c19602_2mgt 1 . 6 . 2859 . 1 1 12 GLU CA C -4.882 2.513 1.441 . . . 1.0 . . . . . . . . . . . . A . 11 GLU CA . . . . . . . . . c19602_2mgt 1 . 6 . 2860 . 1 1 12 GLU CB C -3.374 2.616 1.647 . . . 1.0 . . . . . . . . . . . . A . 11 GLU CB . . . . . . . . . c19602_2mgt 1 . 6 . 2861 . 1 1 12 GLU CD C -1.237 1.547 0.839 . . . 1.0 . . . . . . . . . . . . A . 11 GLU CD . . . . . . . . . c19602_2mgt 1 . 6 . 2862 . 1 1 12 GLU CG C -2.631 2.005 0.455 . . . 1.0 . . . . . . . . . . . . A . 11 GLU CG . . . . . . . . . c19602_2mgt 1 . 6 . 2863 . 1 1 12 GLU H H -5.969 2.826 3.188 . . . 1.0 . . . . . . . . . . . . A . 11 GLU H . . . . . . . . . c19602_2mgt 1 . 6 . 2864 . 1 1 12 GLU HA H -5.130 2.883 0.446 . . . 1.0 . . . . . . . . . . . . A . 11 GLU HA . . . . . . . . . c19602_2mgt 1 . 6 . 2865 . 1 1 12 GLU HB2 H -3.095 3.662 1.734 . . . 1.0 . . . . . . . . . . . . A . 11 GLU HB2 . . . . . . . . . c19602_2mgt 1 . 6 . 2866 . 1 1 12 GLU HB3 H -3.108 2.117 2.577 . . . 1.0 . . . . . . . . . . . . A . 11 GLU HB3 . . . . . . . . . c19602_2mgt 1 . 6 . 2867 . 1 1 12 GLU HG2 H -3.181 1.142 0.093 . . . 1.0 . . . . . . . . . . . . A . 11 GLU HG2 . . . . . . . . . c19602_2mgt 1 . 6 . 2868 . 1 1 12 GLU HG3 H -2.563 2.740 -0.345 . . . 1.0 . . . . . . . . . . . . A . 11 GLU HG3 . . . . . . . . . c19602_2mgt 1 . 6 . 2869 . 1 1 12 GLU N N -5.558 3.332 2.422 . . . 1.0 . . . . . . . . . . . . A . 11 GLU N . . . . . . . . . c19602_2mgt 1 . 6 . 2870 . 1 1 12 GLU O O -4.942 0.339 2.480 . . . 1.0 . . . . . . . . . . . . A . 11 GLU O . . . . . . . . . c19602_2mgt 1 . 6 . 2871 . 1 1 12 GLU OE1 O -0.462 2.379 1.344 . . . 1.0 . . . . . . . . . . . . A . 11 GLU OE1 . . . . . . . . . c19602_2mgt 1 . 6 . 2872 . 1 1 12 GLU OE2 O -0.972 0.342 0.655 . . . 1.0 . . . . . . . . . . . . A . 11 GLU OE2 . . . . . . . . . c19602_2mgt 1 . 6 . 2873 . 1 1 13 VAL C C -6.364 -1.786 0.780 . . . 1.0 . . . . . . . . . . . . A . 12 VAL C . . . . . . . . . c19602_2mgt 1 . 6 . 2874 . 1 1 13 VAL CA C -7.214 -0.514 0.903 . . . 1.0 . . . . . . . . . . . . A . 12 VAL CA . . . . . . . . . c19602_2mgt 1 . 6 . 2875 . 1 1 13 VAL CB C -8.326 -0.461 -0.167 . . . 1.0 . . . . . . . . . . . . A . 12 VAL CB . . . . . . . . . c19602_2mgt 1 . 6 . 2876 . 1 1 13 VAL CG1 C -9.126 -1.760 -0.315 . . . 1.0 . . . . . . . . . . . . A . 12 VAL CG1 . . . . . . . . . c19602_2mgt 1 . 6 . 2877 . 1 1 13 VAL CG2 C -9.331 0.630 0.203 . . . 1.0 . . . . . . . . . . . . A . 12 VAL CG2 . . . . . . . . . c19602_2mgt 1 . 6 . 2878 . 1 1 13 VAL H H -6.732 1.385 0.127 . . . 1.0 . . . . . . . . . . . . A . 12 VAL H . . . . . . . . . c19602_2mgt 1 . 6 . 2879 . 1 1 13 VAL HA H -7.696 -0.525 1.875 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HA . . . . . . . . . c19602_2mgt 1 . 6 . 2880 . 1 1 13 VAL HB H -7.880 -0.218 -1.132 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HB . . . . . . . . . c19602_2mgt 1 . 6 . 2881 . 1 1 13 VAL HG11 H -9.964 -1.612 -0.998 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HG11 . . . . . . . . . c19602_2mgt 1 . 6 . 2882 . 1 1 13 VAL HG12 H -8.485 -2.529 -0.732 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HG12 . . . . . . . . . c19602_2mgt 1 . 6 . 2883 . 1 1 13 VAL HG13 H -9.503 -2.085 0.655 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HG13 . . . . . . . . . c19602_2mgt 1 . 6 . 2884 . 1 1 13 VAL HG21 H -8.828 1.592 0.266 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HG21 . . . . . . . . . c19602_2mgt 1 . 6 . 2885 . 1 1 13 VAL HG22 H -10.096 0.686 -0.566 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HG22 . . . . . . . . . c19602_2mgt 1 . 6 . 2886 . 1 1 13 VAL HG23 H -9.785 0.393 1.161 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HG23 . . . . . . . . . c19602_2mgt 1 . 6 . 2887 . 1 1 13 VAL N N -6.427 0.721 0.824 . . . 1.0 . . . . . . . . . . . . A . 12 VAL N . . . . . . . . . c19602_2mgt 1 . 6 . 2888 . 1 1 13 VAL O O -6.810 -2.865 1.161 . . . 1.0 . . . . . . . . . . . . A . 12 VAL O . . . . . . . . . c19602_2mgt 1 . 6 . 2889 . 1 1 14 HIS C C -3.821 -3.298 1.613 . . . 1.0 . . . . . . . . . . . . A . 13 HIS C . . . . . . . . . c19602_2mgt 1 . 6 . 2890 . 1 1 14 HIS CA C -4.173 -2.746 0.223 . . . 1.0 . . . . . . . . . . . . A . 13 HIS CA . . . . . . . . . c19602_2mgt 1 . 6 . 2891 . 1 1 14 HIS CB C -2.945 -2.251 -0.556 . . . 1.0 . . . . . . . . . . . . A . 13 HIS CB . . . . . . . . . c19602_2mgt 1 . 6 . 2892 . 1 1 14 HIS CD2 C -1.468 -4.353 -0.719 . . . 1.0 . . . . . . . . . . . . A . 13 HIS CD2 . . . . . . . . . c19602_2mgt 1 . 6 . 2893 . 1 1 14 HIS CE1 C 0.280 -3.661 0.407 . . . 1.0 . . . . . . . . . . . . A . 13 HIS CE1 . . . . . . . . . c19602_2mgt 1 . 6 . 2894 . 1 1 14 HIS CG C -1.698 -3.062 -0.331 . . . 1.0 . . . . . . . . . . . . A . 13 HIS CG . . . . . . . . . c19602_2mgt 1 . 6 . 2895 . 1 1 14 HIS H H -4.815 -0.753 -0.017 . . . 1.0 . . . . . . . . . . . . A . 13 HIS H . . . . . . . . . c19602_2mgt 1 . 6 . 2896 . 1 1 14 HIS HA H -4.656 -3.539 -0.340 . . . 1.0 . . . . . . . . . . . . A . 13 HIS HA . . . . . . . . . c19602_2mgt 1 . 6 . 2897 . 1 1 14 HIS HB2 H -3.177 -2.244 -1.620 . . . 1.0 . . . . . . . . . . . . A . 13 HIS HB2 . . . . . . . . . c19602_2mgt 1 . 6 . 2898 . 1 1 14 HIS HB3 H -2.733 -1.226 -0.266 . . . 1.0 . . . . . . . . . . . . A . 13 HIS HB3 . . . . . . . . . c19602_2mgt 1 . 6 . 2899 . 1 1 14 HIS HD1 H -0.466 -1.734 0.789 . . . 1.0 . . . . . . . . . . . . A . 13 HIS HD1 . . . . . . . . . c19602_2mgt 1 . 6 . 2900 . 1 1 14 HIS HD2 H -2.147 -4.978 -1.279 . . . 1.0 . . . . . . . . . . . . A . 13 HIS HD2 . . . . . . . . . c19602_2mgt 1 . 6 . 2901 . 1 1 14 HIS HE1 H 1.246 -3.619 0.889 . . . 1.0 . . . . . . . . . . . . A . 13 HIS HE1 . . . . . . . . . c19602_2mgt 1 . 6 . 2902 . 1 1 14 HIS N N -5.126 -1.661 0.297 . . . 1.0 . . . . . . . . . . . . A . 13 HIS N . . . . . . . . . c19602_2mgt 1 . 6 . 2903 . 1 1 14 HIS ND1 N -0.597 -2.648 0.377 . . . 1.0 . . . . . . . . . . . . A . 13 HIS ND1 . . . . . . . . . c19602_2mgt 1 . 6 . 2904 . 1 1 14 HIS NE2 N -0.210 -4.732 -0.241 . . . 1.0 . . . . . . . . . . . . A . 13 HIS NE2 . . . . . . . . . c19602_2mgt 1 . 6 . 2905 . 1 1 14 HIS O O -3.514 -4.479 1.709 . . . 1.0 . . . . . . . . . . . . A . 13 HIS O . . . . . . . . . c19602_2mgt 1 . 6 . 2906 . 1 1 15 HIS C C -5.069 -3.525 4.660 . . . 1.0 . . . . . . . . . . . . A . 14 HIS C . . . . . . . . . c19602_2mgt 1 . 6 . 2907 . 1 1 15 HIS CA C -3.748 -3.031 4.056 . . . 1.0 . . . . . . . . . . . . A . 14 HIS CA . . . . . . . . . c19602_2mgt 1 . 6 . 2908 . 1 1 15 HIS CB C -3.079 -1.971 4.935 . . . 1.0 . . . . . . . . . . . . A . 14 HIS CB . . . . . . . . . c19602_2mgt 1 . 6 . 2909 . 1 1 15 HIS CD2 C -1.434 -0.525 3.625 . . . 1.0 . . . . . . . . . . . . A . 14 HIS CD2 . . . . . . . . . c19602_2mgt 1 . 6 . 2910 . 1 1 15 HIS CE1 C 0.381 -1.728 3.793 . . . 1.0 . . . . . . . . . . . . A . 14 HIS CE1 . . . . . . . . . c19602_2mgt 1 . 6 . 2911 . 1 1 15 HIS CG C -1.719 -1.599 4.414 . . . 1.0 . . . . . . . . . . . . A . 14 HIS CG . . . . . . . . . c19602_2mgt 1 . 6 . 2912 . 1 1 15 HIS H H -4.187 -1.546 2.583 . . . 1.0 . . . . . . . . . . . . A . 14 HIS H . . . . . . . . . c19602_2mgt 1 . 6 . 2913 . 1 1 15 HIS HA H -3.077 -3.888 4.030 . . . 1.0 . . . . . . . . . . . . A . 14 HIS HA . . . . . . . . . c19602_2mgt 1 . 6 . 2914 . 1 1 15 HIS HB2 H -3.709 -1.082 4.981 . . . 1.0 . . . . . . . . . . . . A . 14 HIS HB2 . . . . . . . . . c19602_2mgt 1 . 6 . 2915 . 1 1 15 HIS HB3 H -2.961 -2.357 5.946 . . . 1.0 . . . . . . . . . . . . A . 14 HIS HB3 . . . . . . . . . c19602_2mgt 1 . 6 . 2916 . 1 1 15 HIS HD1 H -0.458 -3.213 5.016 . . . 1.0 . . . . . . . . . . . . A . 14 HIS HD1 . . . . . . . . . c19602_2mgt 1 . 6 . 2917 . 1 1 15 HIS HD2 H -2.144 0.224 3.318 . . . 1.0 . . . . . . . . . . . . A . 14 HIS HD2 . . . . . . . . . c19602_2mgt 1 . 6 . 2918 . 1 1 15 HIS HE1 H 1.383 -2.105 3.651 . . . 1.0 . . . . . . . . . . . . A . 14 HIS HE1 . . . . . . . . . c19602_2mgt 1 . 6 . 2919 . 1 1 15 HIS N N -3.914 -2.513 2.695 . . . 1.0 . . . . . . . . . . . . A . 14 HIS N . . . . . . . . . c19602_2mgt 1 . 6 . 2920 . 1 1 15 HIS ND1 N -0.565 -2.339 4.518 . . . 1.0 . . . . . . . . . . . . A . 14 HIS ND1 . . . . . . . . . c19602_2mgt 1 . 6 . 2921 . 1 1 15 HIS NE2 N -0.095 -0.605 3.239 . . . 1.0 . . . . . . . . . . . . A . 14 HIS NE2 . . . . . . . . . c19602_2mgt 1 . 6 . 2922 . 1 1 15 HIS O O -5.041 -4.196 5.688 . . . 1.0 . . . . . . . . . . . . A . 14 HIS O . . . . . . . . . c19602_2mgt 1 . 6 . 2923 . 1 1 16 GLN C C -7.881 -5.051 4.021 . . . 1.0 . . . . . . . . . . . . A . 15 GLN C . . . . . . . . . c19602_2mgt 1 . 6 . 2924 . 1 1 16 GLN CA C -7.529 -3.647 4.501 . . . 1.0 . . . . . . . . . . . . A . 15 GLN CA . . . . . . . . . c19602_2mgt 1 . 6 . 2925 . 1 1 16 GLN CB C -8.569 -2.663 3.972 . . . 1.0 . . . . . . . . . . . . A . 15 GLN CB . . . . . . . . . c19602_2mgt 1 . 6 . 2926 . 1 1 16 GLN CD C -10.014 -2.436 6.109 . . . 1.0 . . . . . . . . . . . . A . 15 GLN CD . . . . . . . . . c19602_2mgt 1 . 6 . 2927 . 1 1 16 GLN CG C -9.952 -2.785 4.619 . . . 1.0 . . . . . . . . . . . . A . 15 GLN CG . . . . . . . . . c19602_2mgt 1 . 6 . 2928 . 1 1 16 GLN H H -6.209 -2.671 3.199 . . . 1.0 . . . . . . . . . . . . A . 15 GLN H . . . . . . . . . c19602_2mgt 1 . 6 . 2929 . 1 1 16 GLN HA H -7.529 -3.616 5.581 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HA . . . . . . . . . c19602_2mgt 1 . 6 . 2930 . 1 1 16 GLN HB2 H -8.200 -1.651 4.088 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HB2 . . . . . . . . . c19602_2mgt 1 . 6 . 2931 . 1 1 16 GLN HB3 H -8.689 -2.838 2.908 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HB3 . . . . . . . . . c19602_2mgt 1 . 6 . 2932 . 1 1 16 GLN HE21 H -9.322 -4.259 6.696 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HE21 . . . . . . . . . c19602_2mgt 1 . 6 . 2933 . 1 1 16 GLN HE22 H -9.668 -3.123 7.982 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HE22 . . . . . . . . . c19602_2mgt 1 . 6 . 2934 . 1 1 16 GLN HG2 H -10.594 -2.098 4.082 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HG2 . . . . . . . . . c19602_2mgt 1 . 6 . 2935 . 1 1 16 GLN HG3 H -10.335 -3.792 4.465 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HG3 . . . . . . . . . c19602_2mgt 1 . 6 . 2936 . 1 1 16 GLN N N -6.219 -3.227 4.038 . . . 1.0 . . . . . . . . . . . . A . 15 GLN N . . . . . . . . . c19602_2mgt 1 . 6 . 2937 . 1 1 16 GLN NE2 N -9.620 -3.342 6.997 . . . 1.0 . . . . . . . . . . . . A . 15 GLN NE2 . . . . . . . . . c19602_2mgt 1 . 6 . 2938 . 1 1 16 GLN O O -8.626 -5.750 4.699 . . . 1.0 . . . . . . . . . . . . A . 15 GLN O . . . . . . . . . c19602_2mgt 1 . 6 . 2939 . 1 1 16 GLN OE1 O -10.447 -1.352 6.475 . . . 1.0 . . . . . . . . . . . . A . 15 GLN OE1 . . . . . . . . . c19602_2mgt 1 . 6 . 2940 . 1 1 17 LYS C C -6.586 -6.923 1.084 . . . 1.0 . . . . . . . . . . . . A . 16 LYS C . . . . . . . . . c19602_2mgt 1 . 6 . 2941 . 1 1 17 LYS CA C -7.629 -6.708 2.190 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CA . . . . . . . . . c19602_2mgt 1 . 6 . 2942 . 1 1 17 LYS CB C -9.076 -6.720 1.650 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CB . . . . . . . . . c19602_2mgt 1 . 6 . 2943 . 1 1 17 LYS CD C -11.039 -8.177 0.989 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CD . . . . . . . . . c19602_2mgt 1 . 6 . 2944 . 1 1 17 LYS CE C -11.489 -9.636 0.987 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CE . . . . . . . . . c19602_2mgt 1 . 6 . 2945 . 1 1 17 LYS CG C -9.590 -8.152 1.469 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CG . . . . . . . . . c19602_2mgt 1 . 6 . 2946 . 1 1 17 LYS H H -6.785 -4.777 2.352 . . . 1.0 . . . . . . . . . . . . A . 16 LYS H . . . . . . . . . c19602_2mgt 1 . 6 . 2947 . 1 1 17 LYS HA H -7.522 -7.500 2.932 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HA . . . . . . . . . c19602_2mgt 1 . 6 . 2948 . 1 1 17 LYS HB2 H -9.740 -6.219 2.355 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HB2 . . . . . . . . . c19602_2mgt 1 . 6 . 2949 . 1 1 17 LYS HB3 H -9.123 -6.181 0.705 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HB3 . . . . . . . . . c19602_2mgt 1 . 6 . 2950 . 1 1 17 LYS HD2 H -11.663 -7.599 1.667 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HD2 . . . . . . . . . c19602_2mgt 1 . 6 . 2951 . 1 1 17 LYS HD3 H -11.110 -7.753 -0.013 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HD3 . . . . . . . . . c19602_2mgt 1 . 6 . 2952 . 1 1 17 LYS HE2 H -10.850 -10.203 0.312 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HE2 . . . . . . . . . c19602_2mgt 1 . 6 . 2953 . 1 1 17 LYS HE3 H -11.389 -10.037 1.996 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HE3 . . . . . . . . . c19602_2mgt 1 . 6 . 2954 . 1 1 17 LYS HG2 H -8.978 -8.685 0.744 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HG2 . . . . . . . . . c19602_2mgt 1 . 6 . 2955 . 1 1 17 LYS HG3 H -9.529 -8.669 2.428 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HG3 . . . . . . . . . c19602_2mgt 1 . 6 . 2956 . 1 1 17 LYS HZ1 H -12.998 -9.414 -0.366 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HZ1 . . . . . . . . . c19602_2mgt 1 . 6 . 2957 . 1 1 17 LYS HZ2 H -13.151 -10.756 0.578 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HZ2 . . . . . . . . . c19602_2mgt 1 . 6 . 2958 . 1 1 17 LYS HZ3 H -13.483 -9.264 1.196 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HZ3 . . . . . . . . . c19602_2mgt 1 . 6 . 2959 . 1 1 17 LYS N N -7.361 -5.440 2.852 . . . 1.0 . . . . . . . . . . . . A . 16 LYS N . . . . . . . . . c19602_2mgt 1 . 6 . 2960 . 1 1 17 LYS NZ N -12.884 -9.782 0.569 . . . 1.0 . . . . . . . . . . . . A . 16 LYS NZ . . . . . . . . . c19602_2mgt 1 . 6 . 2961 . 1 1 17 LYS O O -5.989 -5.974 0.581 . . . 1.0 . . . . . . . . . . . . A . 16 LYS O . . . . . . . . . c19602_2mgt 1 . 6 . 2962 . 1 1 18 NH2 HN1 H -5.674 -8.353 -0.034 . . . 1.0 . . . . . . . . . . . . A . 17 NH2 HN1 . . . . . . . . . c19602_2mgt 1 . 6 . 2963 . 1 1 18 NH2 HN2 H -6.862 -8.934 1.109 . . . 1.0 . . . . . . . . . . . . A . 17 NH2 HN2 . . . . . . . . . c19602_2mgt 1 . 6 . 2964 . 1 1 18 NH2 N N -6.352 -8.171 0.690 . . . 1.0 . . . . . . . . . . . . A . 17 NH2 N . . . . . . . . . c19602_2mgt 1 . 6 . 2965 . 2 1 1 ACE C C 15.198 3.310 -11.814 . . . 1.0 . . . . . . . . . . . . B . 0 ACE C . . . . . . . . . c19602_2mgt 1 . 6 . 2966 . 2 1 1 ACE CH3 C 15.756 4.091 -12.993 . . . 1.0 . . . . . . . . . . . . B . 0 ACE CH3 . . . . . . . . . c19602_2mgt 1 . 6 . 2967 . 2 1 1 ACE H1 H 16.775 4.410 -12.774 . . . 1.0 . . . . . . . . . . . . B . 0 ACE H1 . . . . . . . . . c19602_2mgt 1 . 6 . 2968 . 2 1 1 ACE H2 H 15.751 3.472 -13.888 . . . 1.0 . . . . . . . . . . . . B . 0 ACE H2 . . . . . . . . . c19602_2mgt 1 . 6 . 2969 . 2 1 1 ACE H3 H 15.135 4.969 -13.171 . . . 1.0 . . . . . . . . . . . . B . 0 ACE H3 . . . . . . . . . c19602_2mgt 1 . 6 . 2970 . 2 1 1 ACE O O 15.930 2.985 -10.883 . . . 1.0 . . . . . . . . . . . . B . 0 ACE O . . . . . . . . . c19602_2mgt 1 . 6 . 2971 . 2 1 2 ASP C C 13.435 1.066 -10.365 . . . 1.0 . . . . . . . . . . . . B . 1 ASP C . . . . . . . . . c19602_2mgt 1 . 6 . 2972 . 2 1 2 ASP CA C 13.182 2.528 -10.667 . . . 1.0 . . . . . . . . . . . . B . 1 ASP CA . . . . . . . . . c19602_2mgt 1 . 6 . 2973 . 2 1 2 ASP CB C 11.685 2.682 -10.865 . . . 1.0 . . . . . . . . . . . . B . 1 ASP CB . . . . . . . . . c19602_2mgt 1 . 6 . 2974 . 2 1 2 ASP CG C 11.155 4.096 -10.784 . . . 1.0 . . . . . . . . . . . . B . 1 ASP CG . . . . . . . . . c19602_2mgt 1 . 6 . 2975 . 2 1 2 ASP H H 13.337 3.316 -12.629 . . . 1.0 . . . . . . . . . . . . B . 1 ASP H . . . . . . . . . c19602_2mgt 1 . 6 . 2976 . 2 1 2 ASP HA H 13.483 3.106 -9.797 . . . 1.0 . . . . . . . . . . . . B . 1 ASP HA . . . . . . . . . c19602_2mgt 1 . 6 . 2977 . 2 1 2 ASP HB2 H 11.405 2.268 -11.839 . . . 1.0 . . . . . . . . . . . . B . 1 ASP HB2 . . . . . . . . . c19602_2mgt 1 . 6 . 2978 . 2 1 2 ASP HB3 H 11.188 2.107 -10.083 . . . 1.0 . . . . . . . . . . . . B . 1 ASP HB3 . . . . . . . . . c19602_2mgt 1 . 6 . 2979 . 2 1 2 ASP N N 13.893 3.035 -11.834 . . . 1.0 . . . . . . . . . . . . B . 1 ASP N . . . . . . . . . c19602_2mgt 1 . 6 . 2980 . 2 1 2 ASP O O 13.382 0.701 -9.194 . . . 1.0 . . . . . . . . . . . . B . 1 ASP O . . . . . . . . . c19602_2mgt 1 . 6 . 2981 . 2 1 2 ASP OD1 O 11.973 5.011 -10.404 . . . 1.0 . . . . . . . . . . . . B . 1 ASP OD1 . . . . . . . . . c19602_2mgt 1 . 6 . 2982 . 2 1 2 ASP OD2 O 9.996 4.276 -11.072 . . . 1.0 . . . . . . . . . . . . B . 1 ASP OD2 . . . . . . . . . c19602_2mgt 1 . 6 . 2983 . 2 1 3 ALA C C 14.392 -1.751 -10.150 . . . 1.0 . . . . . . . . . . . . B . 2 ALA C . . . . . . . . . c19602_2mgt 1 . 6 . 2984 . 2 1 3 ALA CA C 13.588 -1.203 -11.326 . . . 1.0 . . . . . . . . . . . . B . 2 ALA CA . . . . . . . . . c19602_2mgt 1 . 6 . 2985 . 2 1 3 ALA CB C 14.093 -1.794 -12.643 . . . 1.0 . . . . . . . . . . . . B . 2 ALA CB . . . . . . . . . c19602_2mgt 1 . 6 . 2986 . 2 1 3 ALA H H 13.668 0.656 -12.328 . . . 1.0 . . . . . . . . . . . . B . 2 ALA H . . . . . . . . . c19602_2mgt 1 . 6 . 2987 . 2 1 3 ALA HA H 12.546 -1.483 -11.197 . . . 1.0 . . . . . . . . . . . . B . 2 ALA HA . . . . . . . . . c19602_2mgt 1 . 6 . 2988 . 2 1 3 ALA HB1 H 15.124 -1.488 -12.819 . . . 1.0 . . . . . . . . . . . . B . 2 ALA HB1 . . . . . . . . . c19602_2mgt 1 . 6 . 2989 . 2 1 3 ALA HB2 H 14.049 -2.882 -12.594 . . . 1.0 . . . . . . . . . . . . B . 2 ALA HB2 . . . . . . . . . c19602_2mgt 1 . 6 . 2990 . 2 1 3 ALA HB3 H 13.470 -1.450 -13.466 . . . 1.0 . . . . . . . . . . . . B . 2 ALA HB3 . . . . . . . . . c19602_2mgt 1 . 6 . 2991 . 2 1 3 ALA N N 13.648 0.250 -11.404 . . . 1.0 . . . . . . . . . . . . B . 2 ALA N . . . . . . . . . c19602_2mgt 1 . 6 . 2992 . 2 1 3 ALA O O 13.867 -2.549 -9.382 . . . 1.0 . . . . . . . . . . . . B . 2 ALA O . . . . . . . . . c19602_2mgt 1 . 6 . 2993 . 2 1 4 GLU C C 16.184 -1.629 -7.546 . . . 1.0 . . . . . . . . . . . . B . 3 GLU C . . . . . . . . . c19602_2mgt 1 . 6 . 2994 . 2 1 4 GLU CA C 16.603 -1.718 -9.009 . . . 1.0 . . . . . . . . . . . . B . 3 GLU CA . . . . . . . . . c19602_2mgt 1 . 6 . 2995 . 2 1 4 GLU CB C 17.902 -0.929 -9.206 . . . 1.0 . . . . . . . . . . . . B . 3 GLU CB . . . . . . . . . c19602_2mgt 1 . 6 . 2996 . 2 1 4 GLU CD C 18.897 1.393 -9.281 . . . 1.0 . . . . . . . . . . . . B . 3 GLU CD . . . . . . . . . c19602_2mgt 1 . 6 . 2997 . 2 1 4 GLU CG C 17.720 0.549 -8.834 . . . 1.0 . . . . . . . . . . . . B . 3 GLU CG . . . . . . . . . c19602_2mgt 1 . 6 . 2998 . 2 1 4 GLU H H 15.947 -0.576 -10.652 . . . 1.0 . . . . . . . . . . . . B . 3 GLU H . . . . . . . . . c19602_2mgt 1 . 6 . 2999 . 2 1 4 GLU HA H 16.783 -2.766 -9.216 . . . 1.0 . . . . . . . . . . . . B . 3 GLU HA . . . . . . . . . c19602_2mgt 1 . 6 . 3000 . 2 1 4 GLU HB2 H 18.682 -1.357 -8.576 . . . 1.0 . . . . . . . . . . . . B . 3 GLU HB2 . . . . . . . . . c19602_2mgt 1 . 6 . 3001 . 2 1 4 GLU HB3 H 18.213 -1.018 -10.247 . . . 1.0 . . . . . . . . . . . . B . 3 GLU HB3 . . . . . . . . . c19602_2mgt 1 . 6 . 3002 . 2 1 4 GLU HG2 H 16.817 0.937 -9.305 . . . 1.0 . . . . . . . . . . . . B . 3 GLU HG2 . . . . . . . . . c19602_2mgt 1 . 6 . 3003 . 2 1 4 GLU HG3 H 17.616 0.642 -7.751 . . . 1.0 . . . . . . . . . . . . B . 3 GLU HG3 . . . . . . . . . c19602_2mgt 1 . 6 . 3004 . 2 1 4 GLU N N 15.625 -1.263 -9.985 . . . 1.0 . . . . . . . . . . . . B . 3 GLU N . . . . . . . . . c19602_2mgt 1 . 6 . 3005 . 2 1 4 GLU O O 16.763 -2.352 -6.742 . . . 1.0 . . . . . . . . . . . . B . 3 GLU O . . . . . . . . . c19602_2mgt 1 . 6 . 3006 . 2 1 4 GLU OE1 O 19.036 1.554 -10.517 . . . 1.0 . . . . . . . . . . . . B . 3 GLU OE1 . . . . . . . . . c19602_2mgt 1 . 6 . 3007 . 2 1 4 GLU OE2 O 19.625 1.898 -8.415 . . . 1.0 . . . . . . . . . . . . B . 3 GLU OE2 . . . . . . . . . c19602_2mgt 1 . 6 . 3008 . 2 1 5 PHE C C 13.195 -1.024 -5.804 . . . 1.0 . . . . . . . . . . . . B . 4 PHE C . . . . . . . . . c19602_2mgt 1 . 6 . 3009 . 2 1 5 PHE CA C 14.680 -0.660 -5.846 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CA . . . . . . . . . c19602_2mgt 1 . 6 . 3010 . 2 1 5 PHE CB C 14.944 0.744 -5.313 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CB . . . . . . . . . c19602_2mgt 1 . 6 . 3011 . 2 1 5 PHE CD1 C 12.889 2.109 -5.851 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CD1 . . . . . . . . . c19602_2mgt 1 . 6 . 3012 . 2 1 5 PHE CD2 C 14.992 2.667 -6.935 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CD2 . . . . . . . . . c19602_2mgt 1 . 6 . 3013 . 2 1 5 PHE CE1 C 12.268 3.198 -6.484 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CE1 . . . . . . . . . c19602_2mgt 1 . 6 . 3014 . 2 1 5 PHE CE2 C 14.388 3.782 -7.534 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CE2 . . . . . . . . . c19602_2mgt 1 . 6 . 3015 . 2 1 5 PHE CG C 14.255 1.860 -6.059 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CG . . . . . . . . . c19602_2mgt 1 . 6 . 3016 . 2 1 5 PHE CZ C 13.025 4.051 -7.307 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CZ . . . . . . . . . c19602_2mgt 1 . 6 . 3017 . 2 1 5 PHE H H 14.830 -0.154 -7.895 . . . 1.0 . . . . . . . . . . . . B . 4 PHE H . . . . . . . . . c19602_2mgt 1 . 6 . 3018 . 2 1 5 PHE HA H 15.198 -1.354 -5.190 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HA . . . . . . . . . c19602_2mgt 1 . 6 . 3019 . 2 1 5 PHE HB2 H 14.627 0.792 -4.275 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HB2 . . . . . . . . . c19602_2mgt 1 . 6 . 3020 . 2 1 5 PHE HB3 H 16.021 0.916 -5.329 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HB3 . . . . . . . . . c19602_2mgt 1 . 6 . 3021 . 2 1 5 PHE HD1 H 12.324 1.446 -5.214 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HD1 . . . . . . . . . c19602_2mgt 1 . 6 . 3022 . 2 1 5 PHE HD2 H 16.022 2.419 -7.138 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HD2 . . . . . . . . . c19602_2mgt 1 . 6 . 3023 . 2 1 5 PHE HE1 H 11.216 3.383 -6.328 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HE1 . . . . . . . . . c19602_2mgt 1 . 6 . 3024 . 2 1 5 PHE HE2 H 14.967 4.418 -8.184 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HE2 . . . . . . . . . c19602_2mgt 1 . 6 . 3025 . 2 1 5 PHE HZ H 12.556 4.899 -7.781 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HZ . . . . . . . . . c19602_2mgt 1 . 6 . 3026 . 2 1 5 PHE N N 15.223 -0.766 -7.194 . . . 1.0 . . . . . . . . . . . . B . 4 PHE N . . . . . . . . . c19602_2mgt 1 . 6 . 3027 . 2 1 5 PHE O O 12.686 -1.373 -4.741 . . . 1.0 . . . . . . . . . . . . B . 4 PHE O . . . . . . . . . c19602_2mgt 1 . 6 . 3028 . 2 1 6 ARG C C 11.498 -3.163 -7.310 . . . 1.0 . . . . . . . . . . . . B . 5 ARG C . . . . . . . . . c19602_2mgt 1 . 6 . 3029 . 2 1 6 ARG CA C 11.232 -1.667 -7.145 . . . 1.0 . . . . . . . . . . . . B . 5 ARG CA . . . . . . . . . c19602_2mgt 1 . 6 . 3030 . 2 1 6 ARG CB C 10.508 -1.046 -8.348 . . . 1.0 . . . . . . . . . . . . B . 5 ARG CB . . . . . . . . . c19602_2mgt 1 . 6 . 3031 . 2 1 6 ARG CD C 9.174 0.644 -6.885 . . . 1.0 . . . . . . . . . . . . B . 5 ARG CD . . . . . . . . . c19602_2mgt 1 . 6 . 3032 . 2 1 6 ARG CG C 10.051 0.404 -8.120 . . . 1.0 . . . . . . . . . . . . B . 5 ARG CG . . . . . . . . . c19602_2mgt 1 . 6 . 3033 . 2 1 6 ARG CZ C 6.878 -0.224 -7.402 . . . 1.0 . . . . . . . . . . . . B . 5 ARG CZ . . . . . . . . . c19602_2mgt 1 . 6 . 3034 . 2 1 6 ARG H H 12.981 -0.691 -7.792 . . . 1.0 . . . . . . . . . . . . B . 5 ARG H . . . . . . . . . c19602_2mgt 1 . 6 . 3035 . 2 1 6 ARG HA H 10.620 -1.532 -6.256 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HA . . . . . . . . . c19602_2mgt 1 . 6 . 3036 . 2 1 6 ARG HB2 H 11.173 -1.073 -9.212 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HB2 . . . . . . . . . c19602_2mgt 1 . 6 . 3037 . 2 1 6 ARG HB3 H 9.633 -1.651 -8.585 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HB3 . . . . . . . . . c19602_2mgt 1 . 6 . 3038 . 2 1 6 ARG HD2 H 9.790 0.549 -5.997 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HD2 . . . . . . . . . c19602_2mgt 1 . 6 . 3039 . 2 1 6 ARG HD3 H 8.785 1.661 -6.903 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HD3 . . . . . . . . . c19602_2mgt 1 . 6 . 3040 . 2 1 6 ARG HE H 8.236 -1.137 -6.234 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HE . . . . . . . . . c19602_2mgt 1 . 6 . 3041 . 2 1 6 ARG HG2 H 10.926 1.048 -8.043 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HG2 . . . . . . . . . c19602_2mgt 1 . 6 . 3042 . 2 1 6 ARG HG3 H 9.485 0.706 -8.993 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HG3 . . . . . . . . . c19602_2mgt 1 . 6 . 3043 . 2 1 6 ARG HH11 H 7.194 1.572 -8.305 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HH11 . . . . . . . . . c19602_2mgt 1 . 6 . 3044 . 2 1 6 ARG HH12 H 5.631 0.850 -8.599 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HH12 . . . . . . . . . c19602_2mgt 1 . 6 . 3045 . 2 1 6 ARG HH21 H 6.230 -2.013 -6.683 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HH21 . . . . . . . . . c19602_2mgt 1 . 6 . 3046 . 2 1 6 ARG HH22 H 5.094 -1.156 -7.692 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HH22 . . . . . . . . . c19602_2mgt 1 . 6 . 3047 . 2 1 6 ARG N N 12.514 -1.015 -6.956 . . . 1.0 . . . . . . . . . . . . B . 5 ARG N . . . . . . . . . c19602_2mgt 1 . 6 . 3048 . 2 1 6 ARG NE N 8.066 -0.313 -6.792 . . . 1.0 . . . . . . . . . . . . B . 5 ARG NE . . . . . . . . . c19602_2mgt 1 . 6 . 3049 . 2 1 6 ARG NH1 N 6.544 0.813 -8.170 . . . 1.0 . . . . . . . . . . . . B . 5 ARG NH1 . . . . . . . . . c19602_2mgt 1 . 6 . 3050 . 2 1 6 ARG NH2 N 5.996 -1.204 -7.238 . . . 1.0 . . . . . . . . . . . . B . 5 ARG NH2 . . . . . . . . . c19602_2mgt 1 . 6 . 3051 . 2 1 6 ARG O O 11.361 -3.714 -8.396 . . . 1.0 . . . . . . . . . . . . B . 5 ARG O . . . . . . . . . c19602_2mgt 1 . 6 . 3052 . 2 1 7 ARG C C 11.264 -6.068 -5.661 . . . 1.0 . . . . . . . . . . . . B . 6 ARG C . . . . . . . . . c19602_2mgt 1 . 6 . 3053 . 2 1 7 ARG CA C 12.395 -5.170 -6.143 . . . 1.0 . . . . . . . . . . . . B . 6 ARG CA . . . . . . . . . c19602_2mgt 1 . 6 . 3054 . 2 1 7 ARG CB C 13.566 -5.225 -5.151 . . . 1.0 . . . . . . . . . . . . B . 6 ARG CB . . . . . . . . . c19602_2mgt 1 . 6 . 3055 . 2 1 7 ARG CD C 15.581 -5.222 -6.773 . . . 1.0 . . . . . . . . . . . . B . 6 ARG CD . . . . . . . . . c19602_2mgt 1 . 6 . 3056 . 2 1 7 ARG CG C 14.845 -4.524 -5.623 . . . 1.0 . . . . . . . . . . . . B . 6 ARG CG . . . . . . . . . c19602_2mgt 1 . 6 . 3057 . 2 1 7 ARG CZ C 15.142 -5.609 -9.212 . . . 1.0 . . . . . . . . . . . . B . 6 ARG CZ . . . . . . . . . c19602_2mgt 1 . 6 . 3058 . 2 1 7 ARG H H 12.032 -3.262 -5.374 . . . 1.0 . . . . . . . . . . . . B . 6 ARG H . . . . . . . . . c19602_2mgt 1 . 6 . 3059 . 2 1 7 ARG HA H 12.721 -5.503 -7.123 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HA . . . . . . . . . c19602_2mgt 1 . 6 . 3060 . 2 1 7 ARG HB2 H 13.253 -4.724 -4.232 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HB2 . . . . . . . . . c19602_2mgt 1 . 6 . 3061 . 2 1 7 ARG HB3 H 13.801 -6.263 -4.924 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HB3 . . . . . . . . . c19602_2mgt 1 . 6 . 3062 . 2 1 7 ARG HD2 H 16.615 -4.884 -6.774 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HD2 . . . . . . . . . c19602_2mgt 1 . 6 . 3063 . 2 1 7 ARG HD3 H 15.585 -6.295 -6.599 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HD3 . . . . . . . . . c19602_2mgt 1 . 6 . 3064 . 2 1 7 ARG HE H 14.498 -4.024 -8.145 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HE . . . . . . . . . c19602_2mgt 1 . 6 . 3065 . 2 1 7 ARG HG2 H 14.603 -3.501 -5.903 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HG2 . . . . . . . . . c19602_2mgt 1 . 6 . 3066 . 2 1 7 ARG HG3 H 15.528 -4.488 -4.777 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HG3 . . . . . . . . . c19602_2mgt 1 . 6 . 3067 . 2 1 7 ARG HH11 H 16.207 -7.139 -8.396 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HH11 . . . . . . . . . c19602_2mgt 1 . 6 . 3068 . 2 1 7 ARG HH12 H 15.879 -7.284 -10.106 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HH12 . . . . . . . . . c19602_2mgt 1 . 6 . 3069 . 2 1 7 ARG HH21 H 14.079 -4.294 -10.343 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HH21 . . . . . . . . . c19602_2mgt 1 . 6 . 3070 . 2 1 7 ARG HH22 H 14.676 -5.705 -11.189 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HH22 . . . . . . . . . c19602_2mgt 1 . 6 . 3071 . 2 1 7 ARG N N 11.936 -3.798 -6.221 . . . 1.0 . . . . . . . . . . . . B . 6 ARG N . . . . . . . . . c19602_2mgt 1 . 6 . 3072 . 2 1 7 ARG NE N 15.005 -4.896 -8.085 . . . 1.0 . . . . . . . . . . . . B . 6 ARG NE . . . . . . . . . c19602_2mgt 1 . 6 . 3073 . 2 1 7 ARG NH1 N 15.810 -6.761 -9.245 . . . 1.0 . . . . . . . . . . . . B . 6 ARG NH1 . . . . . . . . . c19602_2mgt 1 . 6 . 3074 . 2 1 7 ARG NH2 N 14.594 -5.163 -10.341 . . . 1.0 . . . . . . . . . . . . B . 6 ARG NH2 . . . . . . . . . c19602_2mgt 1 . 6 . 3075 . 2 1 7 ARG O O 10.466 -5.658 -4.823 . . . 1.0 . . . . . . . . . . . . B . 6 ARG O . . . . . . . . . c19602_2mgt 1 . 6 . 3076 . 2 1 8 ASP C C 10.554 -8.719 -4.199 . . . 1.0 . . . . . . . . . . . . B . 7 ASP C . . . . . . . . . c19602_2mgt 1 . 6 . 3077 . 2 1 8 ASP CA C 10.316 -8.353 -5.674 . . . 1.0 . . . . . . . . . . . . B . 7 ASP CA . . . . . . . . . c19602_2mgt 1 . 6 . 3078 . 2 1 8 ASP CB C 10.454 -9.584 -6.581 . . . 1.0 . . . . . . . . . . . . B . 7 ASP CB . . . . . . . . . c19602_2mgt 1 . 6 . 3079 . 2 1 8 ASP CG C 11.593 -10.531 -6.198 . . . 1.0 . . . . . . . . . . . . B . 7 ASP CG . . . . . . . . . c19602_2mgt 1 . 6 . 3080 . 2 1 8 ASP H H 11.939 -7.594 -6.815 . . . 1.0 . . . . . . . . . . . . B . 7 ASP H . . . . . . . . . c19602_2mgt 1 . 6 . 3081 . 2 1 8 ASP HA H 9.301 -7.971 -5.779 . . . 1.0 . . . . . . . . . . . . B . 7 ASP HA . . . . . . . . . c19602_2mgt 1 . 6 . 3082 . 2 1 8 ASP HB2 H 9.518 -10.135 -6.521 . . . 1.0 . . . . . . . . . . . . B . 7 ASP HB2 . . . . . . . . . c19602_2mgt 1 . 6 . 3083 . 2 1 8 ASP HB3 H 10.595 -9.262 -7.611 . . . 1.0 . . . . . . . . . . . . B . 7 ASP HB3 . . . . . . . . . c19602_2mgt 1 . 6 . 3084 . 2 1 8 ASP N N 11.242 -7.318 -6.139 . . . 1.0 . . . . . . . . . . . . B . 7 ASP N . . . . . . . . . c19602_2mgt 1 . 6 . 3085 . 2 1 8 ASP O O 9.703 -9.329 -3.561 . . . 1.0 . . . . . . . . . . . . B . 7 ASP O . . . . . . . . . c19602_2mgt 1 . 6 . 3086 . 2 1 8 ASP OD1 O 12.690 -10.060 -5.856 . . . 1.0 . . . . . . . . . . . . B . 7 ASP OD1 . . . . . . . . . c19602_2mgt 1 . 6 . 3087 . 2 1 8 ASP OD2 O 11.343 -11.752 -6.240 . . . 1.0 . . . . . . . . . . . . B . 7 ASP OD2 . . . . . . . . . c19602_2mgt 1 . 6 . 3088 . 2 1 9 SER C C 11.499 -7.972 -1.209 . . . 1.0 . . . . . . . . . . . . B . 8 SER C . . . . . . . . . c19602_2mgt 1 . 6 . 3089 . 2 1 9 SER CA C 12.284 -8.589 -2.372 . . . 1.0 . . . . . . . . . . . . B . 8 SER CA . . . . . . . . . c19602_2mgt 1 . 6 . 3090 . 2 1 9 SER CB C 13.713 -8.038 -2.352 . . . 1.0 . . . . . . . . . . . . B . 8 SER CB . . . . . . . . . c19602_2mgt 1 . 6 . 3091 . 2 1 9 SER H H 12.365 -7.910 -4.345 . . . 1.0 . . . . . . . . . . . . B . 8 SER H . . . . . . . . . c19602_2mgt 1 . 6 . 3092 . 2 1 9 SER HA H 12.322 -9.668 -2.233 . . . 1.0 . . . . . . . . . . . . B . 8 SER HA . . . . . . . . . c19602_2mgt 1 . 6 . 3093 . 2 1 9 SER HB2 H 13.681 -6.948 -2.331 . . . 1.0 . . . . . . . . . . . . B . 8 SER HB2 . . . . . . . . . c19602_2mgt 1 . 6 . 3094 . 2 1 9 SER HB3 H 14.222 -8.399 -1.462 . . . 1.0 . . . . . . . . . . . . B . 8 SER HB3 . . . . . . . . . c19602_2mgt 1 . 6 . 3095 . 2 1 9 SER HG H 14.496 -9.405 -3.483 . . . 1.0 . . . . . . . . . . . . B . 8 SER HG . . . . . . . . . c19602_2mgt 1 . 6 . 3096 . 2 1 9 SER N N 11.725 -8.328 -3.687 . . . 1.0 . . . . . . . . . . . . B . 8 SER N . . . . . . . . . c19602_2mgt 1 . 6 . 3097 . 2 1 9 SER O O 11.963 -8.053 -0.079 . . . 1.0 . . . . . . . . . . . . B . 8 SER O . . . . . . . . . c19602_2mgt 1 . 6 . 3098 . 2 1 9 SER OG O 14.433 -8.443 -3.492 . . . 1.0 . . . . . . . . . . . . B . 8 SER OG . . . . . . . . . c19602_2mgt 1 . 6 . 3099 . 2 1 10 GLY C C 8.019 -7.105 -1.050 . . . 1.0 . . . . . . . . . . . . B . 9 GLY C . . . . . . . . . c19602_2mgt 1 . 6 . 3100 . 2 1 10 GLY CA C 9.412 -6.885 -0.456 . . . 1.0 . . . . . . . . . . . . B . 9 GLY CA . . . . . . . . . c19602_2mgt 1 . 6 . 3101 . 2 1 10 GLY H H 10.014 -7.298 -2.415 . . . 1.0 . . . . . . . . . . . . B . 9 GLY H . . . . . . . . . c19602_2mgt 1 . 6 . 3102 . 2 1 10 GLY HA2 H 9.527 -7.438 0.474 . . . 1.0 . . . . . . . . . . . . B . 9 GLY HA2 . . . . . . . . . c19602_2mgt 1 . 6 . 3103 . 2 1 10 GLY HA3 H 9.609 -5.835 -0.244 . . . 1.0 . . . . . . . . . . . . B . 9 GLY HA3 . . . . . . . . . c19602_2mgt 1 . 6 . 3104 . 2 1 10 GLY N N 10.348 -7.342 -1.461 . . . 1.0 . . . . . . . . . . . . B . 9 GLY N . . . . . . . . . c19602_2mgt 1 . 6 . 3105 . 2 1 10 GLY O O 7.621 -8.242 -1.258 . . . 1.0 . . . . . . . . . . . . B . 9 GLY O . . . . . . . . . c19602_2mgt 1 . 6 . 3106 . 2 1 11 TYR C C 6.306 -3.866 -1.511 . . . 1.0 . . . . . . . . . . . . B . 10 TYR C . . . . . . . . . c19602_2mgt 1 . 6 . 3107 . 2 1 11 TYR CA C 7.552 -4.676 -1.219 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CA . . . . . . . . . c19602_2mgt 1 . 6 . 3108 . 2 1 11 TYR CB C 8.658 -4.239 -2.189 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CB . . . . . . . . . c19602_2mgt 1 . 6 . 3109 . 2 1 11 TYR CD1 C 9.594 -2.554 -0.540 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CD1 . . . . . . . . . c19602_2mgt 1 . 6 . 3110 . 2 1 11 TYR CD2 C 11.124 -3.851 -1.921 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CD2 . . . . . . . . . c19602_2mgt 1 . 6 . 3111 . 2 1 11 TYR CE1 C 10.675 -1.886 0.046 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CE1 . . . . . . . . . c19602_2mgt 1 . 6 . 3112 . 2 1 11 TYR CE2 C 12.211 -3.186 -1.341 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CE2 . . . . . . . . . c19602_2mgt 1 . 6 . 3113 . 2 1 11 TYR CG C 9.815 -3.528 -1.533 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CG . . . . . . . . . c19602_2mgt 1 . 6 . 3114 . 2 1 11 TYR CZ C 11.989 -2.184 -0.369 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CZ . . . . . . . . . c19602_2mgt 1 . 6 . 3115 . 2 1 11 TYR H H 6.425 -6.260 -1.925 . . . 1.0 . . . . . . . . . . . . B . 10 TYR H . . . . . . . . . c19602_2mgt 1 . 6 . 3116 . 2 1 11 TYR HA H 7.859 -4.516 -0.186 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HA . . . . . . . . . c19602_2mgt 1 . 6 . 3117 . 2 1 11 TYR HB2 H 9.049 -5.107 -2.712 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HB2 . . . . . . . . . c19602_2mgt 1 . 6 . 3118 . 2 1 11 TYR HB3 H 8.237 -3.594 -2.957 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HB3 . . . . . . . . . c19602_2mgt 1 . 6 . 3119 . 2 1 11 TYR HD1 H 8.598 -2.299 -0.233 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HD1 . . . . . . . . . c19602_2mgt 1 . 6 . 3120 . 2 1 11 TYR HD2 H 11.297 -4.612 -2.663 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HD2 . . . . . . . . . c19602_2mgt 1 . 6 . 3121 . 2 1 11 TYR HE1 H 10.491 -1.145 0.803 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HE1 . . . . . . . . . c19602_2mgt 1 . 6 . 3122 . 2 1 11 TYR HE2 H 13.212 -3.451 -1.638 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HE2 . . . . . . . . . c19602_2mgt 1 . 6 . 3123 . 2 1 11 TYR HH H 13.882 -1.780 -0.205 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HH . . . . . . . . . c19602_2mgt 1 . 6 . 3124 . 2 1 11 TYR N N 7.252 -6.073 -1.388 . . . 1.0 . . . . . . . . . . . . B . 10 TYR N . . . . . . . . . c19602_2mgt 1 . 6 . 3125 . 2 1 11 TYR O O 5.565 -4.168 -2.442 . . . 1.0 . . . . . . . . . . . . B . 10 TYR O . . . . . . . . . c19602_2mgt 1 . 6 . 3126 . 2 1 11 TYR OH O 13.039 -1.508 0.164 . . . 1.0 . . . . . . . . . . . . B . 10 TYR OH . . . . . . . . . c19602_2mgt 1 . 6 . 3127 . 2 1 12 GLU C C 6.217 -0.396 -0.874 . . . 1.0 . . . . . . . . . . . . B . 11 GLU C . . . . . . . . . c19602_2mgt 1 . 6 . 3128 . 2 1 12 GLU CA C 5.356 -1.640 -1.122 . . . 1.0 . . . . . . . . . . . . B . 11 GLU CA . . . . . . . . . c19602_2mgt 1 . 6 . 3129 . 2 1 12 GLU CB C 4.065 -1.673 -0.312 . . . 1.0 . . . . . . . . . . . . B . 11 GLU CB . . . . . . . . . c19602_2mgt 1 . 6 . 3130 . 2 1 12 GLU CD C 2.068 -0.197 0.137 . . . 1.0 . . . . . . . . . . . . B . 11 GLU CD . . . . . . . . . c19602_2mgt 1 . 6 . 3131 . 2 1 12 GLU CG C 3.067 -0.677 -0.896 . . . 1.0 . . . . . . . . . . . . B . 11 GLU CG . . . . . . . . . c19602_2mgt 1 . 6 . 3132 . 2 1 12 GLU H H 6.779 -2.650 0.024 . . . 1.0 . . . . . . . . . . . . B . 11 GLU H . . . . . . . . . c19602_2mgt 1 . 6 . 3133 . 2 1 12 GLU HA H 5.114 -1.710 -2.180 . . . 1.0 . . . . . . . . . . . . B . 11 GLU HA . . . . . . . . . c19602_2mgt 1 . 6 . 3134 . 2 1 12 GLU HB2 H 3.630 -2.672 -0.344 . . . 1.0 . . . . . . . . . . . . B . 11 GLU HB2 . . . . . . . . . c19602_2mgt 1 . 6 . 3135 . 2 1 12 GLU HB3 H 4.292 -1.423 0.725 . . . 1.0 . . . . . . . . . . . . B . 11 GLU HB3 . . . . . . . . . c19602_2mgt 1 . 6 . 3136 . 2 1 12 GLU HG2 H 3.598 0.202 -1.270 . . . 1.0 . . . . . . . . . . . . B . 11 GLU HG2 . . . . . . . . . c19602_2mgt 1 . 6 . 3137 . 2 1 12 GLU HG3 H 2.540 -1.136 -1.731 . . . 1.0 . . . . . . . . . . . . B . 11 GLU HG3 . . . . . . . . . c19602_2mgt 1 . 6 . 3138 . 2 1 12 GLU N N 6.163 -2.776 -0.765 . . . 1.0 . . . . . . . . . . . . B . 11 GLU N . . . . . . . . . c19602_2mgt 1 . 6 . 3139 . 2 1 12 GLU O O 6.007 0.341 0.088 . . . 1.0 . . . . . . . . . . . . B . 11 GLU O . . . . . . . . . c19602_2mgt 1 . 6 . 3140 . 2 1 12 GLU OE1 O 1.755 -0.967 1.085 . . . 1.0 . . . . . . . . . . . . B . 11 GLU OE1 . . . . . . . . . c19602_2mgt 1 . 6 . 3141 . 2 1 12 GLU OE2 O 1.654 0.952 0.015 . . . 1.0 . . . . . . . . . . . . B . 11 GLU OE2 . . . . . . . . . c19602_2mgt 1 . 6 . 3142 . 2 1 13 VAL C C 7.907 2.121 -1.233 . . . 1.0 . . . . . . . . . . . . B . 12 VAL C . . . . . . . . . c19602_2mgt 1 . 6 . 3143 . 2 1 13 VAL CA C 8.332 0.726 -1.681 . . . 1.0 . . . . . . . . . . . . B . 12 VAL CA . . . . . . . . . c19602_2mgt 1 . 6 . 3144 . 2 1 13 VAL CB C 9.008 0.776 -3.073 . . . 1.0 . . . . . . . . . . . . B . 12 VAL CB . . . . . . . . . c19602_2mgt 1 . 6 . 3145 . 2 1 13 VAL CG1 C 9.888 2.015 -3.269 . . . 1.0 . . . . . . . . . . . . B . 12 VAL CG1 . . . . . . . . . c19602_2mgt 1 . 6 . 3146 . 2 1 13 VAL CG2 C 9.892 -0.462 -3.270 . . . 1.0 . . . . . . . . . . . . B . 12 VAL CG2 . . . . . . . . . c19602_2mgt 1 . 6 . 3147 . 2 1 13 VAL H H 7.270 -0.875 -2.512 . . . 1.0 . . . . . . . . . . . . B . 12 VAL H . . . . . . . . . c19602_2mgt 1 . 6 . 3148 . 2 1 13 VAL HA H 9.064 0.353 -0.974 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HA . . . . . . . . . c19602_2mgt 1 . 6 . 3149 . 2 1 13 VAL HB H 8.239 0.795 -3.848 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HB . . . . . . . . . c19602_2mgt 1 . 6 . 3150 . 2 1 13 VAL HG11 H 9.275 2.915 -3.274 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HG11 . . . . . . . . . c19602_2mgt 1 . 6 . 3151 . 2 1 13 VAL HG12 H 10.616 2.066 -2.461 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HG12 . . . . . . . . . c19602_2mgt 1 . 6 . 3152 . 2 1 13 VAL HG13 H 10.401 1.962 -4.226 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HG13 . . . . . . . . . c19602_2mgt 1 . 6 . 3153 . 2 1 13 VAL HG21 H 10.374 -0.421 -4.240 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HG21 . . . . . . . . . c19602_2mgt 1 . 6 . 3154 . 2 1 13 VAL HG22 H 10.661 -0.498 -2.499 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HG22 . . . . . . . . . c19602_2mgt 1 . 6 . 3155 . 2 1 13 VAL HG23 H 9.284 -1.363 -3.228 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HG23 . . . . . . . . . c19602_2mgt 1 . 6 . 3156 . 2 1 13 VAL N N 7.222 -0.223 -1.745 . . . 1.0 . . . . . . . . . . . . B . 12 VAL N . . . . . . . . . c19602_2mgt 1 . 6 . 3157 . 2 1 13 VAL O O 8.649 2.781 -0.504 . . . 1.0 . . . . . . . . . . . . B . 12 VAL O . . . . . . . . . c19602_2mgt 1 . 6 . 3158 . 2 1 14 HIS C C 6.131 4.480 -0.225 . . . 1.0 . . . . . . . . . . . . B . 13 HIS C . . . . . . . . . c19602_2mgt 1 . 6 . 3159 . 2 1 14 HIS CA C 6.329 3.951 -1.637 . . . 1.0 . . . . . . . . . . . . B . 13 HIS CA . . . . . . . . . c19602_2mgt 1 . 6 . 3160 . 2 1 14 HIS CB C 5.048 4.127 -2.444 . . . 1.0 . . . . . . . . . . . . B . 13 HIS CB . . . . . . . . . c19602_2mgt 1 . 6 . 3161 . 2 1 14 HIS CD2 C 6.262 3.803 -4.682 . . . 1.0 . . . . . . . . . . . . B . 13 HIS CD2 . . . . . . . . . c19602_2mgt 1 . 6 . 3162 . 2 1 14 HIS CE1 C 4.911 2.367 -5.627 . . . 1.0 . . . . . . . . . . . . B . 13 HIS CE1 . . . . . . . . . c19602_2mgt 1 . 6 . 3163 . 2 1 14 HIS CG C 5.191 3.620 -3.851 . . . 1.0 . . . . . . . . . . . . B . 13 HIS CG . . . . . . . . . c19602_2mgt 1 . 6 . 3164 . 2 1 14 HIS H H 6.168 1.944 -2.255 . . . 1.0 . . . . . . . . . . . . B . 13 HIS H . . . . . . . . . c19602_2mgt 1 . 6 . 3165 . 2 1 14 HIS HA H 7.127 4.529 -2.103 . . . 1.0 . . . . . . . . . . . . B . 13 HIS HA . . . . . . . . . c19602_2mgt 1 . 6 . 3166 . 2 1 14 HIS HB2 H 4.251 3.577 -1.950 . . . 1.0 . . . . . . . . . . . . B . 13 HIS HB2 . . . . . . . . . c19602_2mgt 1 . 6 . 3167 . 2 1 14 HIS HB3 H 4.770 5.177 -2.457 . . . 1.0 . . . . . . . . . . . . B . 13 HIS HB3 . . . . . . . . . c19602_2mgt 1 . 6 . 3168 . 2 1 14 HIS HD1 H 3.505 2.346 -4.070 . . . 1.0 . . . . . . . . . . . . B . 13 HIS HD1 . . . . . . . . . c19602_2mgt 1 . 6 . 3169 . 2 1 14 HIS HD2 H 7.131 4.411 -4.477 . . . 1.0 . . . . . . . . . . . . B . 13 HIS HD2 . . . . . . . . . c19602_2mgt 1 . 6 . 3170 . 2 1 14 HIS HE1 H 4.485 1.659 -6.318 . . . 1.0 . . . . . . . . . . . . B . 13 HIS HE1 . . . . . . . . . c19602_2mgt 1 . 6 . 3171 . 2 1 14 HIS N N 6.733 2.563 -1.691 . . . 1.0 . . . . . . . . . . . . B . 13 HIS N . . . . . . . . . c19602_2mgt 1 . 6 . 3172 . 2 1 14 HIS ND1 N 4.358 2.723 -4.461 . . . 1.0 . . . . . . . . . . . . B . 13 HIS ND1 . . . . . . . . . c19602_2mgt 1 . 6 . 3173 . 2 1 14 HIS NE2 N 6.082 2.989 -5.802 . . . 1.0 . . . . . . . . . . . . B . 13 HIS NE2 . . . . . . . . . c19602_2mgt 1 . 6 . 3174 . 2 1 14 HIS O O 6.214 5.687 -0.061 . . . 1.0 . . . . . . . . . . . . B . 13 HIS O . . . . . . . . . c19602_2mgt 1 . 6 . 3175 . 2 1 15 HIS C C 6.722 2.936 3.041 . . . 1.0 . . . . . . . . . . . . B . 14 HIS C . . . . . . . . . c19602_2mgt 1 . 6 . 3176 . 2 1 15 HIS CA C 6.053 4.016 2.183 . . . 1.0 . . . . . . . . . . . . B . 14 HIS CA . . . . . . . . . c19602_2mgt 1 . 6 . 3177 . 2 1 15 HIS CB C 4.704 4.481 2.753 . . . 1.0 . . . . . . . . . . . . B . 14 HIS CB . . . . . . . . . c19602_2mgt 1 . 6 . 3178 . 2 1 15 HIS CD2 C 2.713 2.983 2.150 . . . 1.0 . . . . . . . . . . . . B . 14 HIS CD2 . . . . . . . . . c19602_2mgt 1 . 6 . 3179 . 2 1 15 HIS CE1 C 2.616 1.728 3.945 . . . 1.0 . . . . . . . . . . . . B . 14 HIS CE1 . . . . . . . . . c19602_2mgt 1 . 6 . 3180 . 2 1 15 HIS CG C 3.714 3.374 2.991 . . . 1.0 . . . . . . . . . . . . B . 14 HIS CG . . . . . . . . . c19602_2mgt 1 . 6 . 3181 . 2 1 15 HIS H H 5.859 2.632 0.570 . . . 1.0 . . . . . . . . . . . . B . 14 HIS H . . . . . . . . . c19602_2mgt 1 . 6 . 3182 . 2 1 15 HIS HA H 6.724 4.875 2.225 . . . 1.0 . . . . . . . . . . . . B . 14 HIS HA . . . . . . . . . c19602_2mgt 1 . 6 . 3183 . 2 1 15 HIS HB2 H 4.887 4.980 3.704 . . . 1.0 . . . . . . . . . . . . B . 14 HIS HB2 . . . . . . . . . c19602_2mgt 1 . 6 . 3184 . 2 1 15 HIS HB3 H 4.261 5.216 2.081 . . . 1.0 . . . . . . . . . . . . B . 14 HIS HB3 . . . . . . . . . c19602_2mgt 1 . 6 . 3185 . 2 1 15 HIS HD1 H 4.237 2.632 4.919 . . . 1.0 . . . . . . . . . . . . B . 14 HIS HD1 . . . . . . . . . c19602_2mgt 1 . 6 . 3186 . 2 1 15 HIS HD2 H 2.490 3.412 1.184 . . . 1.0 . . . . . . . . . . . . B . 14 HIS HD2 . . . . . . . . . c19602_2mgt 1 . 6 . 3187 . 2 1 15 HIS HE1 H 2.306 0.991 4.671 . . . 1.0 . . . . . . . . . . . . B . 14 HIS HE1 . . . . . . . . . c19602_2mgt 1 . 6 . 3188 . 2 1 15 HIS N N 5.931 3.620 0.782 . . . 1.0 . . . . . . . . . . . . B . 14 HIS N . . . . . . . . . c19602_2mgt 1 . 6 . 3189 . 2 1 15 HIS ND1 N 3.637 2.578 4.109 . . . 1.0 . . . . . . . . . . . . B . 14 HIS ND1 . . . . . . . . . c19602_2mgt 1 . 6 . 3190 . 2 1 15 HIS NE2 N 2.019 1.939 2.765 . . . 1.0 . . . . . . . . . . . . B . 14 HIS NE2 . . . . . . . . . c19602_2mgt 1 . 6 . 3191 . 2 1 15 HIS O O 6.848 3.131 4.247 . . . 1.0 . . . . . . . . . . . . B . 14 HIS O . . . . . . . . . c19602_2mgt 1 . 6 . 3192 . 2 1 16 GLN C C 9.582 1.469 2.772 . . . 1.0 . . . . . . . . . . . . B . 15 GLN C . . . . . . . . . c19602_2mgt 1 . 6 . 3193 . 2 1 16 GLN CA C 8.165 0.937 3.038 . . . 1.0 . . . . . . . . . . . . B . 15 GLN CA . . . . . . . . . c19602_2mgt 1 . 6 . 3194 . 2 1 16 GLN CB C 7.957 -0.500 2.541 . . . 1.0 . . . . . . . . . . . . B . 15 GLN CB . . . . . . . . . c19602_2mgt 1 . 6 . 3195 . 2 1 16 GLN CD C 6.398 -2.510 2.503 . . . 1.0 . . . . . . . . . . . . B . 15 GLN CD . . . . . . . . . c19602_2mgt 1 . 6 . 3196 . 2 1 16 GLN CG C 6.613 -1.082 3.001 . . . 1.0 . . . . . . . . . . . . B . 15 GLN CG . . . . . . . . . c19602_2mgt 1 . 6 . 3197 . 2 1 16 GLN H H 7.025 1.701 1.453 . . . 1.0 . . . . . . . . . . . . B . 15 GLN H . . . . . . . . . c19602_2mgt 1 . 6 . 3198 . 2 1 16 GLN HA H 7.999 0.936 4.107 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HA . . . . . . . . . c19602_2mgt 1 . 6 . 3199 . 2 1 16 GLN HB2 H 8.032 -0.524 1.454 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HB2 . . . . . . . . . c19602_2mgt 1 . 6 . 3200 . 2 1 16 GLN HB3 H 8.740 -1.137 2.949 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HB3 . . . . . . . . . c19602_2mgt 1 . 6 . 3201 . 2 1 16 GLN HE21 H 4.499 -2.534 3.221 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HE21 . . . . . . . . . c19602_2mgt 1 . 6 . 3202 . 2 1 16 GLN HE22 H 5.022 -3.999 2.413 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HE22 . . . . . . . . . c19602_2mgt 1 . 6 . 3203 . 2 1 16 GLN HG2 H 6.582 -1.084 4.091 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HG2 . . . . . . . . . c19602_2mgt 1 . 6 . 3204 . 2 1 16 GLN HG3 H 5.794 -0.457 2.642 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HG3 . . . . . . . . . c19602_2mgt 1 . 6 . 3205 . 2 1 16 GLN N N 7.192 1.834 2.436 . . . 1.0 . . . . . . . . . . . . B . 15 GLN N . . . . . . . . . c19602_2mgt 1 . 6 . 3206 . 2 1 16 GLN NE2 N 5.206 -3.055 2.723 . . . 1.0 . . . . . . . . . . . . B . 15 GLN NE2 . . . . . . . . . c19602_2mgt 1 . 6 . 3207 . 2 1 16 GLN O O 9.754 2.659 2.508 . . . 1.0 . . . . . . . . . . . . B . 15 GLN O . . . . . . . . . c19602_2mgt 1 . 6 . 3208 . 2 1 16 GLN OE1 O 7.285 -3.123 1.918 . . . 1.0 . . . . . . . . . . . . B . 15 GLN OE1 . . . . . . . . . c19602_2mgt 1 . 6 . 3209 . 2 1 17 LYS C C 12.442 1.487 1.368 . . . 1.0 . . . . . . . . . . . . B . 16 LYS C . . . . . . . . . c19602_2mgt 1 . 6 . 3210 . 2 1 17 LYS CA C 12.010 1.006 2.765 . . . 1.0 . . . . . . . . . . . . B . 16 LYS CA . . . . . . . . . c19602_2mgt 1 . 6 . 3211 . 2 1 17 LYS CB C 12.917 -0.137 3.260 . . . 1.0 . . . . . . . . . . . . B . 16 LYS CB . . . . . . . . . c19602_2mgt 1 . 6 . 3212 . 2 1 17 LYS CD C 13.599 -1.632 5.172 . . . 1.0 . . . . . . . . . . . . B . 16 LYS CD . . . . . . . . . c19602_2mgt 1 . 6 . 3213 . 2 1 17 LYS CE C 13.141 -2.352 6.439 . . . 1.0 . . . . . . . . . . . . B . 16 LYS CE . . . . . . . . . c19602_2mgt 1 . 6 . 3214 . 2 1 17 LYS CG C 12.545 -0.643 4.655 . . . 1.0 . . . . . . . . . . . . B . 16 LYS CG . . . . . . . . . c19602_2mgt 1 . 6 . 3215 . 2 1 17 LYS H H 10.417 -0.359 3.062 . . . 1.0 . . . . . . . . . . . . B . 16 LYS H . . . . . . . . . c19602_2mgt 1 . 6 . 3216 . 2 1 17 LYS HA H 12.139 1.847 3.442 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HA . . . . . . . . . c19602_2mgt 1 . 6 . 3217 . 2 1 17 LYS HB2 H 12.852 -0.979 2.575 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HB2 . . . . . . . . . c19602_2mgt 1 . 6 . 3218 . 2 1 17 LYS HB3 H 13.949 0.213 3.281 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HB3 . . . . . . . . . c19602_2mgt 1 . 6 . 3219 . 2 1 17 LYS HD2 H 13.809 -2.378 4.406 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HD2 . . . . . . . . . c19602_2mgt 1 . 6 . 3220 . 2 1 17 LYS HD3 H 14.517 -1.085 5.388 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HD3 . . . . . . . . . c19602_2mgt 1 . 6 . 3221 . 2 1 17 LYS HE2 H 13.975 -2.927 6.838 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HE2 . . . . . . . . . c19602_2mgt 1 . 6 . 3222 . 2 1 17 LYS HE3 H 12.831 -1.622 7.185 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HE3 . . . . . . . . . c19602_2mgt 1 . 6 . 3223 . 2 1 17 LYS HG2 H 12.475 0.203 5.331 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HG2 . . . . . . . . . c19602_2mgt 1 . 6 . 3224 . 2 1 17 LYS HG3 H 11.576 -1.136 4.601 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HG3 . . . . . . . . . c19602_2mgt 1 . 6 . 3225 . 2 1 17 LYS HZ1 H 11.233 -2.755 5.812 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HZ1 . . . . . . . . . c19602_2mgt 1 . 6 . 3226 . 2 1 17 LYS HZ2 H 12.313 -3.941 5.458 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HZ2 . . . . . . . . . c19602_2mgt 1 . 6 . 3227 . 2 1 17 LYS HZ3 H 11.770 -3.768 7.000 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HZ3 . . . . . . . . . c19602_2mgt 1 . 6 . 3228 . 2 1 17 LYS N N 10.606 0.611 2.852 . . . 1.0 . . . . . . . . . . . . B . 16 LYS N . . . . . . . . . c19602_2mgt 1 . 6 . 3229 . 2 1 17 LYS NZ N 12.029 -3.271 6.160 . . . 1.0 . . . . . . . . . . . . B . 16 LYS NZ . . . . . . . . . c19602_2mgt 1 . 6 . 3230 . 2 1 17 LYS O O 13.609 1.811 1.189 . . . 1.0 . . . . . . . . . . . . B . 16 LYS O . . . . . . . . . c19602_2mgt 1 . 6 . 3231 . 2 1 18 NH2 HN1 H 10.588 1.322 0.540 . . . 1.0 . . . . . . . . . . . . B . 17 NH2 HN1 . . . . . . . . . c19602_2mgt 1 . 6 . 3232 . 2 1 18 NH2 HN2 H 11.848 1.883 -0.538 . . . 1.0 . . . . . . . . . . . . B . 17 NH2 HN2 . . . . . . . . . c19602_2mgt 1 . 6 . 3233 . 2 1 18 NH2 N N 11.555 1.551 0.370 . . . 1.0 . . . . . . . . . . . . B . 17 NH2 N . . . . . . . . . c19602_2mgt 1 . 6 . 3234 . 3 2 1 ZN ZN Zn 0.699 0.680 1.807 . . . 1.0 . . . . . . . . . . . . A . 101 ZN ZN . . . . . . . . . c19602_2mgt 1 . 7 . 3235 . 1 1 1 ACE C C -12.571 -4.531 -0.011 . . . 1.0 . . . . . . . . . . . . A . 0 ACE C . . . . . . . . . c19602_2mgt 1 . 7 . 3236 . 1 1 1 ACE CH3 C -11.228 -4.801 0.646 . . . 1.0 . . . . . . . . . . . . A . 0 ACE CH3 . . . . . . . . . c19602_2mgt 1 . 7 . 3237 . 1 1 1 ACE H1 H -10.426 -4.620 -0.070 . . . 1.0 . . . . . . . . . . . . A . 0 ACE H1 . . . . . . . . . c19602_2mgt 1 . 7 . 3238 . 1 1 1 ACE H2 H -11.106 -4.151 1.512 . . . 1.0 . . . . . . . . . . . . A . 0 ACE H2 . . . . . . . . . c19602_2mgt 1 . 7 . 3239 . 1 1 1 ACE H3 H -11.190 -5.838 0.975 . . . 1.0 . . . . . . . . . . . . A . 0 ACE H3 . . . . . . . . . c19602_2mgt 1 . 7 . 3240 . 1 1 1 ACE O O -12.629 -4.331 -1.221 . . . 1.0 . . . . . . . . . . . . A . 0 ACE O . . . . . . . . . c19602_2mgt 1 . 7 . 3241 . 1 1 2 ASP C C -15.492 -3.060 0.040 . . . 1.0 . . . . . . . . . . . . A . 1 ASP C . . . . . . . . . c19602_2mgt 1 . 7 . 3242 . 1 1 2 ASP CA C -15.025 -4.492 0.349 . . . 1.0 . . . . . . . . . . . . A . 1 ASP CA . . . . . . . . . c19602_2mgt 1 . 7 . 3243 . 1 1 2 ASP CB C -15.914 -5.175 1.402 . . . 1.0 . . . . . . . . . . . . A . 1 ASP CB . . . . . . . . . c19602_2mgt 1 . 7 . 3244 . 1 1 2 ASP CG C -17.178 -5.806 0.821 . . . 1.0 . . . . . . . . . . . . A . 1 ASP CG . . . . . . . . . c19602_2mgt 1 . 7 . 3245 . 1 1 2 ASP H H -13.491 -4.727 1.779 . . . 1.0 . . . . . . . . . . . . A . 1 ASP H . . . . . . . . . c19602_2mgt 1 . 7 . 3246 . 1 1 2 ASP HA H -15.083 -5.075 -0.569 . . . 1.0 . . . . . . . . . . . . A . 1 ASP HA . . . . . . . . . c19602_2mgt 1 . 7 . 3247 . 1 1 2 ASP HB2 H -15.363 -5.977 1.887 . . . 1.0 . . . . . . . . . . . . A . 1 ASP HB2 . . . . . . . . . c19602_2mgt 1 . 7 . 3248 . 1 1 2 ASP HB3 H -16.182 -4.457 2.177 . . . 1.0 . . . . . . . . . . . . A . 1 ASP HB3 . . . . . . . . . c19602_2mgt 1 . 7 . 3249 . 1 1 2 ASP N N -13.638 -4.550 0.795 . . . 1.0 . . . . . . . . . . . . A . 1 ASP N . . . . . . . . . c19602_2mgt 1 . 7 . 3250 . 1 1 2 ASP O O -14.754 -2.104 0.265 . . . 1.0 . . . . . . . . . . . . A . 1 ASP O . . . . . . . . . c19602_2mgt 1 . 7 . 3251 . 1 1 2 ASP OD1 O -17.398 -5.734 -0.407 . . . 1.0 . . . . . . . . . . . . A . 1 ASP OD1 . . . . . . . . . c19602_2mgt 1 . 7 . 3252 . 1 1 2 ASP OD2 O -17.936 -6.374 1.621 . . . 1.0 . . . . . . . . . . . . A . 1 ASP OD2 . . . . . . . . . c19602_2mgt 1 . 7 . 3253 . 1 1 3 ALA C C -17.347 -0.553 -0.078 . . . 1.0 . . . . . . . . . . . . A . 2 ALA C . . . . . . . . . c19602_2mgt 1 . 7 . 3254 . 1 1 3 ALA CA C -17.280 -1.716 -1.067 . . . 1.0 . . . . . . . . . . . . A . 2 ALA CA . . . . . . . . . c19602_2mgt 1 . 7 . 3255 . 1 1 3 ALA CB C -18.676 -2.034 -1.610 . . . 1.0 . . . . . . . . . . . . A . 2 ALA CB . . . . . . . . . c19602_2mgt 1 . 7 . 3256 . 1 1 3 ALA H H -17.264 -3.772 -0.623 . . . 1.0 . . . . . . . . . . . . A . 2 ALA H . . . . . . . . . c19602_2mgt 1 . 7 . 3257 . 1 1 3 ALA HA H -16.646 -1.425 -1.899 . . . 1.0 . . . . . . . . . . . . A . 2 ALA HA . . . . . . . . . c19602_2mgt 1 . 7 . 3258 . 1 1 3 ALA HB1 H -19.102 -1.143 -2.070 . . . 1.0 . . . . . . . . . . . . A . 2 ALA HB1 . . . . . . . . . c19602_2mgt 1 . 7 . 3259 . 1 1 3 ALA HB2 H -18.612 -2.828 -2.352 . . . 1.0 . . . . . . . . . . . . A . 2 ALA HB2 . . . . . . . . . c19602_2mgt 1 . 7 . 3260 . 1 1 3 ALA HB3 H -19.330 -2.358 -0.801 . . . 1.0 . . . . . . . . . . . . A . 2 ALA HB3 . . . . . . . . . c19602_2mgt 1 . 7 . 3261 . 1 1 3 ALA N N -16.717 -2.933 -0.493 . . . 1.0 . . . . . . . . . . . . A . 2 ALA N . . . . . . . . . c19602_2mgt 1 . 7 . 3262 . 1 1 3 ALA O O -17.015 0.571 -0.436 . . . 1.0 . . . . . . . . . . . . A . 2 ALA O . . . . . . . . . c19602_2mgt 1 . 7 . 3263 . 1 1 4 GLU C C -16.346 0.661 2.654 . . . 1.0 . . . . . . . . . . . . A . 3 GLU C . . . . . . . . . c19602_2mgt 1 . 7 . 3264 . 1 1 4 GLU CA C -17.720 0.063 2.314 . . . 1.0 . . . . . . . . . . . . A . 3 GLU CA . . . . . . . . . c19602_2mgt 1 . 7 . 3265 . 1 1 4 GLU CB C -18.240 -0.740 3.509 . . . 1.0 . . . . . . . . . . . . A . 3 GLU CB . . . . . . . . . c19602_2mgt 1 . 7 . 3266 . 1 1 4 GLU CD C -17.879 -2.895 4.752 . . . 1.0 . . . . . . . . . . . . A . 3 GLU CD . . . . . . . . . c19602_2mgt 1 . 7 . 3267 . 1 1 4 GLU CG C -17.244 -1.850 3.872 . . . 1.0 . . . . . . . . . . . . A . 3 GLU CG . . . . . . . . . c19602_2mgt 1 . 7 . 3268 . 1 1 4 GLU H H -17.986 -1.798 1.360 . . . 1.0 . . . . . . . . . . . . A . 3 GLU H . . . . . . . . . c19602_2mgt 1 . 7 . 3269 . 1 1 4 GLU HA H -18.404 0.883 2.112 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HA . . . . . . . . . c19602_2mgt 1 . 7 . 3270 . 1 1 4 GLU HB2 H -18.375 -0.081 4.366 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HB2 . . . . . . . . . c19602_2mgt 1 . 7 . 3271 . 1 1 4 GLU HB3 H -19.204 -1.179 3.255 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HB3 . . . . . . . . . c19602_2mgt 1 . 7 . 3272 . 1 1 4 GLU HG2 H -16.867 -2.349 2.978 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HG2 . . . . . . . . . c19602_2mgt 1 . 7 . 3273 . 1 1 4 GLU HG3 H -16.405 -1.405 4.394 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HG3 . . . . . . . . . c19602_2mgt 1 . 7 . 3274 . 1 1 4 GLU N N -17.721 -0.842 1.168 . . . 1.0 . . . . . . . . . . . . A . 3 GLU N . . . . . . . . . c19602_2mgt 1 . 7 . 3275 . 1 1 4 GLU O O -16.277 1.604 3.434 . . . 1.0 . . . . . . . . . . . . A . 3 GLU O . . . . . . . . . c19602_2mgt 1 . 7 . 3276 . 1 1 4 GLU OE1 O -17.874 -2.673 5.981 . . . 1.0 . . . . . . . . . . . . A . 3 GLU OE1 . . . . . . . . . c19602_2mgt 1 . 7 . 3277 . 1 1 4 GLU OE2 O -18.368 -3.893 4.211 . . . 1.0 . . . . . . . . . . . . A . 3 GLU OE2 . . . . . . . . . c19602_2mgt 1 . 7 . 3278 . 1 1 5 PHE C C -13.319 1.249 1.053 . . . 1.0 . . . . . . . . . . . . A . 4 PHE C . . . . . . . . . c19602_2mgt 1 . 7 . 3279 . 1 1 5 PHE CA C -13.902 0.608 2.306 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CA . . . . . . . . . c19602_2mgt 1 . 7 . 3280 . 1 1 5 PHE CB C -13.015 -0.538 2.792 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CB . . . . . . . . . c19602_2mgt 1 . 7 . 3281 . 1 1 5 PHE CD1 C -13.925 -0.526 5.155 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CD1 . . . . . . . . . c19602_2mgt 1 . 7 . 3282 . 1 1 5 PHE CD2 C -13.757 -2.647 3.979 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CD2 . . . . . . . . . c19602_2mgt 1 . 7 . 3283 . 1 1 5 PHE CE1 C -14.437 -1.190 6.281 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CE1 . . . . . . . . . c19602_2mgt 1 . 7 . 3284 . 1 1 5 PHE CE2 C -14.274 -3.312 5.103 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CE2 . . . . . . . . . c19602_2mgt 1 . 7 . 3285 . 1 1 5 PHE CG C -13.572 -1.255 4.005 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CG . . . . . . . . . c19602_2mgt 1 . 7 . 3286 . 1 1 5 PHE CZ C -14.606 -2.585 6.260 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CZ . . . . . . . . . c19602_2mgt 1 . 7 . 3287 . 1 1 5 PHE H H -15.370 -0.725 1.560 . . . 1.0 . . . . . . . . . . . . A . 4 PHE H . . . . . . . . . c19602_2mgt 1 . 7 . 3288 . 1 1 5 PHE HA H -13.909 1.382 3.071 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HA . . . . . . . . . c19602_2mgt 1 . 7 . 3289 . 1 1 5 PHE HB2 H -12.877 -1.251 1.978 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HB2 . . . . . . . . . c19602_2mgt 1 . 7 . 3290 . 1 1 5 PHE HB3 H -12.033 -0.140 3.049 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HB3 . . . . . . . . . c19602_2mgt 1 . 7 . 3291 . 1 1 5 PHE HD1 H -13.819 0.546 5.168 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HD1 . . . . . . . . . c19602_2mgt 1 . 7 . 3292 . 1 1 5 PHE HD2 H -13.501 -3.201 3.092 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HD2 . . . . . . . . . c19602_2mgt 1 . 7 . 3293 . 1 1 5 PHE HE1 H -14.694 -0.624 7.162 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HE1 . . . . . . . . . c19602_2mgt 1 . 7 . 3294 . 1 1 5 PHE HE2 H -14.422 -4.378 5.072 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HE2 . . . . . . . . . c19602_2mgt 1 . 7 . 3295 . 1 1 5 PHE HZ H -15.004 -3.095 7.125 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HZ . . . . . . . . . c19602_2mgt 1 . 7 . 3296 . 1 1 5 PHE N N -15.258 0.115 2.107 . . . 1.0 . . . . . . . . . . . . A . 4 PHE N . . . . . . . . . c19602_2mgt 1 . 7 . 3297 . 1 1 5 PHE O O -12.310 1.931 1.172 . . . 1.0 . . . . . . . . . . . . A . 4 PHE O . . . . . . . . . c19602_2mgt 1 . 7 . 3298 . 1 1 6 ARG C C -13.854 3.231 -1.419 . . . 1.0 . . . . . . . . . . . . A . 5 ARG C . . . . . . . . . c19602_2mgt 1 . 7 . 3299 . 1 1 6 ARG CA C -13.507 1.731 -1.367 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CA . . . . . . . . . c19602_2mgt 1 . 7 . 3300 . 1 1 6 ARG CB C -14.074 0.965 -2.572 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CB . . . . . . . . . c19602_2mgt 1 . 7 . 3301 . 1 1 6 ARG CD C -12.393 -0.973 -2.168 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CD . . . . . . . . . c19602_2mgt 1 . 7 . 3302 . 1 1 6 ARG CG C -13.796 -0.549 -2.610 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CG . . . . . . . . . c19602_2mgt 1 . 7 . 3303 . 1 1 6 ARG CZ C -10.296 -0.904 -3.549 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CZ . . . . . . . . . c19602_2mgt 1 . 7 . 3304 . 1 1 6 ARG H H -14.790 0.542 -0.163 . . . 1.0 . . . . . . . . . . . . A . 5 ARG H . . . . . . . . . c19602_2mgt 1 . 7 . 3305 . 1 1 6 ARG HA H -12.421 1.657 -1.405 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HA . . . . . . . . . c19602_2mgt 1 . 7 . 3306 . 1 1 6 ARG HB2 H -15.149 1.114 -2.576 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HB2 . . . . . . . . . c19602_2mgt 1 . 7 . 3307 . 1 1 6 ARG HB3 H -13.665 1.401 -3.482 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HB3 . . . . . . . . . c19602_2mgt 1 . 7 . 3308 . 1 1 6 ARG HD2 H -12.249 -0.712 -1.121 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HD2 . . . . . . . . . c19602_2mgt 1 . 7 . 3309 . 1 1 6 ARG HD3 H -12.313 -2.053 -2.253 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HD3 . . . . . . . . . c19602_2mgt 1 . 7 . 3310 . 1 1 6 ARG HE H -11.423 0.686 -3.051 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HE . . . . . . . . . c19602_2mgt 1 . 7 . 3311 . 1 1 6 ARG HG2 H -14.510 -1.043 -1.962 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HG2 . . . . . . . . . c19602_2mgt 1 . 7 . 3312 . 1 1 6 ARG HG3 H -13.972 -0.910 -3.623 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HG3 . . . . . . . . . c19602_2mgt 1 . 7 . 3313 . 1 1 6 ARG HH11 H -10.793 -2.815 -3.063 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH11 . . . . . . . . . c19602_2mgt 1 . 7 . 3314 . 1 1 6 ARG HH12 H -9.318 -2.627 -3.983 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH12 . . . . . . . . . c19602_2mgt 1 . 7 . 3315 . 1 1 6 ARG HH21 H -9.524 0.847 -4.231 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH21 . . . . . . . . . c19602_2mgt 1 . 7 . 3316 . 1 1 6 ARG HH22 H -8.619 -0.588 -4.656 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH22 . . . . . . . . . c19602_2mgt 1 . 7 . 3317 . 1 1 6 ARG N N -13.953 1.106 -0.121 . . . 1.0 . . . . . . . . . . . . A . 5 ARG N . . . . . . . . . c19602_2mgt 1 . 7 . 3318 . 1 1 6 ARG NE N -11.349 -0.318 -2.965 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NE . . . . . . . . . c19602_2mgt 1 . 7 . 3319 . 1 1 6 ARG NH1 N -10.108 -2.220 -3.506 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NH1 . . . . . . . . . c19602_2mgt 1 . 7 . 3320 . 1 1 6 ARG NH2 N -9.408 -0.157 -4.198 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NH2 . . . . . . . . . c19602_2mgt 1 . 7 . 3321 . 1 1 6 ARG O O -14.136 3.765 -2.489 . . . 1.0 . . . . . . . . . . . . A . 5 ARG O . . . . . . . . . c19602_2mgt 1 . 7 . 3322 . 1 1 7 ARG C C -13.122 6.244 -0.291 . . . 1.0 . . . . . . . . . . . . A . 6 ARG C . . . . . . . . . c19602_2mgt 1 . 7 . 3323 . 1 1 7 ARG CA C -14.266 5.266 -0.007 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CA . . . . . . . . . c19602_2mgt 1 . 7 . 3324 . 1 1 7 ARG CB C -14.681 5.407 1.467 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CB . . . . . . . . . c19602_2mgt 1 . 7 . 3325 . 1 1 7 ARG CD C -17.005 4.251 1.348 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CD . . . . . . . . . c19602_2mgt 1 . 7 . 3326 . 1 1 7 ARG CG C -15.629 4.327 2.002 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CG . . . . . . . . . c19602_2mgt 1 . 7 . 3327 . 1 1 7 ARG CZ C -17.374 3.843 -1.103 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CZ . . . . . . . . . c19602_2mgt 1 . 7 . 3328 . 1 1 7 ARG H H -13.626 3.367 0.573 . . . 1.0 . . . . . . . . . . . . A . 6 ARG H . . . . . . . . . c19602_2mgt 1 . 7 . 3329 . 1 1 7 ARG HA H -15.123 5.491 -0.630 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HA . . . . . . . . . c19602_2mgt 1 . 7 . 3330 . 1 1 7 ARG HB2 H -13.781 5.365 2.081 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HB2 . . . . . . . . . c19602_2mgt 1 . 7 . 3331 . 1 1 7 ARG HB3 H -15.143 6.383 1.619 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HB3 . . . . . . . . . c19602_2mgt 1 . 7 . 3332 . 1 1 7 ARG HD2 H -17.679 3.756 2.044 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HD2 . . . . . . . . . c19602_2mgt 1 . 7 . 3333 . 1 1 7 ARG HD3 H -17.373 5.256 1.171 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HD3 . . . . . . . . . c19602_2mgt 1 . 7 . 3334 . 1 1 7 ARG HE H -16.756 2.476 0.237 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HE . . . . . . . . . c19602_2mgt 1 . 7 . 3335 . 1 1 7 ARG HG2 H -15.141 3.359 1.938 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HG2 . . . . . . . . . c19602_2mgt 1 . 7 . 3336 . 1 1 7 ARG HG3 H -15.795 4.545 3.048 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HG3 . . . . . . . . . c19602_2mgt 1 . 7 . 3337 . 1 1 7 ARG HH11 H -17.758 5.792 -0.644 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH11 . . . . . . . . . c19602_2mgt 1 . 7 . 3338 . 1 1 7 ARG HH12 H -18.002 5.354 -2.319 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH12 . . . . . . . . . c19602_2mgt 1 . 7 . 3339 . 1 1 7 ARG HH21 H -17.135 1.981 -1.891 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH21 . . . . . . . . . c19602_2mgt 1 . 7 . 3340 . 1 1 7 ARG HH22 H -17.657 3.212 -3.016 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH22 . . . . . . . . . c19602_2mgt 1 . 7 . 3341 . 1 1 7 ARG N N -13.865 3.892 -0.254 . . . 1.0 . . . . . . . . . . . . A . 6 ARG N . . . . . . . . . c19602_2mgt 1 . 7 . 3342 . 1 1 7 ARG NE N -17.006 3.448 0.122 . . . 1.0 . . . . . . . . . . . . A . 6 ARG NE . . . . . . . . . c19602_2mgt 1 . 7 . 3343 . 1 1 7 ARG NH1 N -17.737 5.099 -1.379 . . . 1.0 . . . . . . . . . . . . A . 6 ARG NH1 . . . . . . . . . c19602_2mgt 1 . 7 . 3344 . 1 1 7 ARG NH2 N -17.378 2.943 -2.084 . . . 1.0 . . . . . . . . . . . . A . 6 ARG NH2 . . . . . . . . . c19602_2mgt 1 . 7 . 3345 . 1 1 7 ARG O O -11.951 5.871 -0.245 . . . 1.0 . . . . . . . . . . . . A . 6 ARG O . . . . . . . . . c19602_2mgt 1 . 7 . 3346 . 1 1 8 ASP C C -11.885 8.770 1.015 . . . 1.0 . . . . . . . . . . . . A . 7 ASP C . . . . . . . . . c19602_2mgt 1 . 7 . 3347 . 1 1 8 ASP CA C -12.452 8.596 -0.404 . . . 1.0 . . . . . . . . . . . . A . 7 ASP CA . . . . . . . . . c19602_2mgt 1 . 7 . 3348 . 1 1 8 ASP CB C -13.075 9.906 -0.890 . . . 1.0 . . . . . . . . . . . . A . 7 ASP CB . . . . . . . . . c19602_2mgt 1 . 7 . 3349 . 1 1 8 ASP CG C -13.891 10.605 0.195 . . . 1.0 . . . . . . . . . . . . A . 7 ASP CG . . . . . . . . . c19602_2mgt 1 . 7 . 3350 . 1 1 8 ASP H H -14.419 7.793 -0.494 . . . 1.0 . . . . . . . . . . . . A . 7 ASP H . . . . . . . . . c19602_2mgt 1 . 7 . 3351 . 1 1 8 ASP HA H -11.636 8.337 -1.079 . . . 1.0 . . . . . . . . . . . . A . 7 ASP HA . . . . . . . . . c19602_2mgt 1 . 7 . 3352 . 1 1 8 ASP HB2 H -12.267 10.569 -1.191 . . . 1.0 . . . . . . . . . . . . A . 7 ASP HB2 . . . . . . . . . c19602_2mgt 1 . 7 . 3353 . 1 1 8 ASP HB3 H -13.699 9.715 -1.759 . . . 1.0 . . . . . . . . . . . . A . 7 ASP HB3 . . . . . . . . . c19602_2mgt 1 . 7 . 3354 . 1 1 8 ASP N N -13.445 7.528 -0.464 . . . 1.0 . . . . . . . . . . . . A . 7 ASP N . . . . . . . . . c19602_2mgt 1 . 7 . 3355 . 1 1 8 ASP O O -10.849 9.398 1.182 . . . 1.0 . . . . . . . . . . . . A . 7 ASP O . . . . . . . . . c19602_2mgt 1 . 7 . 3356 . 1 1 8 ASP OD1 O -15.079 10.261 0.364 . . . 1.0 . . . . . . . . . . . . A . 7 ASP OD1 . . . . . . . . . c19602_2mgt 1 . 7 . 3357 . 1 1 8 ASP OD2 O -13.307 11.476 0.865 . . . 1.0 . . . . . . . . . . . . A . 7 ASP OD2 . . . . . . . . . c19602_2mgt 1 . 7 . 3358 . 1 1 9 SER C C -11.015 7.764 3.964 . . . 1.0 . . . . . . . . . . . . A . 8 SER C . . . . . . . . . c19602_2mgt 1 . 7 . 3359 . 1 1 9 SER CA C -12.326 8.391 3.453 . . . 1.0 . . . . . . . . . . . . A . 8 SER CA . . . . . . . . . c19602_2mgt 1 . 7 . 3360 . 1 1 9 SER CB C -13.522 7.818 4.229 . . . 1.0 . . . . . . . . . . . . A . 8 SER CB . . . . . . . . . c19602_2mgt 1 . 7 . 3361 . 1 1 9 SER H H -13.471 7.834 1.784 . . . 1.0 . . . . . . . . . . . . A . 8 SER H . . . . . . . . . c19602_2mgt 1 . 7 . 3362 . 1 1 9 SER HA H -12.267 9.459 3.655 . . . 1.0 . . . . . . . . . . . . A . 8 SER HA . . . . . . . . . c19602_2mgt 1 . 7 . 3363 . 1 1 9 SER HB2 H -13.524 6.733 4.138 . . . 1.0 . . . . . . . . . . . . A . 8 SER HB2 . . . . . . . . . c19602_2mgt 1 . 7 . 3364 . 1 1 9 SER HB3 H -13.421 8.083 5.282 . . . 1.0 . . . . . . . . . . . . A . 8 SER HB3 . . . . . . . . . c19602_2mgt 1 . 7 . 3365 . 1 1 9 SER HG H -15.373 8.345 4.484 . . . 1.0 . . . . . . . . . . . . A . 8 SER HG . . . . . . . . . c19602_2mgt 1 . 7 . 3366 . 1 1 9 SER N N -12.581 8.239 2.025 . . . 1.0 . . . . . . . . . . . . A . 8 SER N . . . . . . . . . c19602_2mgt 1 . 7 . 3367 . 1 1 9 SER O O -10.853 7.630 5.173 . . . 1.0 . . . . . . . . . . . . A . 8 SER O . . . . . . . . . c19602_2mgt 1 . 7 . 3368 . 1 1 9 SER OG O -14.753 8.318 3.748 . . . 1.0 . . . . . . . . . . . . A . 8 SER OG . . . . . . . . . c19602_2mgt 1 . 7 . 3369 . 1 1 10 GLY C C -7.810 7.406 2.317 . . . 1.0 . . . . . . . . . . . . A . 9 GLY C . . . . . . . . . c19602_2mgt 1 . 7 . 3370 . 1 1 10 GLY CA C -8.725 7.017 3.477 . . . 1.0 . . . . . . . . . . . . A . 9 GLY CA . . . . . . . . . c19602_2mgt 1 . 7 . 3371 . 1 1 10 GLY H H -10.232 7.477 2.101 . . . 1.0 . . . . . . . . . . . . A . 9 GLY H . . . . . . . . . c19602_2mgt 1 . 7 . 3372 . 1 1 10 GLY HA2 H -8.422 7.543 4.382 . . . 1.0 . . . . . . . . . . . . A . 9 GLY HA2 . . . . . . . . . c19602_2mgt 1 . 7 . 3373 . 1 1 10 GLY HA3 H -8.697 5.953 3.694 . . . 1.0 . . . . . . . . . . . . A . 9 GLY HA3 . . . . . . . . . c19602_2mgt 1 . 7 . 3374 . 1 1 10 GLY N N -10.075 7.376 3.095 . . . 1.0 . . . . . . . . . . . . A . 9 GLY N . . . . . . . . . c19602_2mgt 1 . 7 . 3375 . 1 1 10 GLY O O -7.772 8.574 1.948 . . . 1.0 . . . . . . . . . . . . A . 9 GLY O . . . . . . . . . c19602_2mgt 1 . 7 . 3376 . 1 1 11 TYR C C -5.966 4.374 1.178 . . . 1.0 . . . . . . . . . . . . A . 10 TYR C . . . . . . . . . c19602_2mgt 1 . 7 . 3377 . 1 1 11 TYR CA C -7.097 5.058 1.929 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CA . . . . . . . . . c19602_2mgt 1 . 7 . 3378 . 1 1 11 TYR CB C -8.425 4.464 1.436 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CB . . . . . . . . . c19602_2mgt 1 . 7 . 3379 . 1 1 11 TYR CD1 C -8.561 2.708 3.252 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CD1 . . . . . . . . . c19602_2mgt 1 . 7 . 3380 . 1 1 11 TYR CD2 C -10.560 3.966 2.671 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CD2 . . . . . . . . . c19602_2mgt 1 . 7 . 3381 . 1 1 11 TYR CE1 C -9.278 1.985 4.209 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CE1 . . . . . . . . . c19602_2mgt 1 . 7 . 3382 . 1 1 11 TYR CE2 C -11.293 3.232 3.613 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CE2 . . . . . . . . . c19602_2mgt 1 . 7 . 3383 . 1 1 11 TYR CG C -9.196 3.696 2.480 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CG . . . . . . . . . c19602_2mgt 1 . 7 . 3384 . 1 1 11 TYR CZ C -10.657 2.226 4.371 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CZ . . . . . . . . . c19602_2mgt 1 . 7 . 3385 . 1 1 11 TYR H H -6.623 6.747 0.843 . . . 1.0 . . . . . . . . . . . . A . 10 TYR H . . . . . . . . . c19602_2mgt 1 . 7 . 3386 . 1 1 11 TYR HA H -6.970 4.875 2.996 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HA . . . . . . . . . c19602_2mgt 1 . 7 . 3387 . 1 1 11 TYR HB2 H -9.063 5.248 1.034 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HB2 . . . . . . . . . c19602_2mgt 1 . 7 . 3388 . 1 1 11 TYR HB3 H -8.222 3.791 0.607 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HB3 . . . . . . . . . c19602_2mgt 1 . 7 . 3389 . 1 1 11 TYR HD1 H -7.522 2.484 3.103 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HD1 . . . . . . . . . c19602_2mgt 1 . 7 . 3390 . 1 1 11 TYR HD2 H -11.049 4.728 2.084 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HD2 . . . . . . . . . c19602_2mgt 1 . 7 . 3391 . 1 1 11 TYR HE1 H -8.769 1.250 4.808 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HE1 . . . . . . . . . c19602_2mgt 1 . 7 . 3392 . 1 1 11 TYR HE2 H -12.342 3.439 3.750 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HE2 . . . . . . . . . c19602_2mgt 1 . 7 . 3393 . 1 1 11 TYR HH H -10.833 0.863 5.748 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HH . . . . . . . . . c19602_2mgt 1 . 7 . 3394 . 1 1 11 TYR N N -7.076 6.481 1.696 . . . 1.0 . . . . . . . . . . . . A . 10 TYR N . . . . . . . . . c19602_2mgt 1 . 7 . 3395 . 1 1 11 TYR O O -5.614 4.743 0.057 . . . 1.0 . . . . . . . . . . . . A . 10 TYR O . . . . . . . . . c19602_2mgt 1 . 7 . 3396 . 1 1 11 TYR OH O -11.371 1.501 5.270 . . . 1.0 . . . . . . . . . . . . A . 10 TYR OH . . . . . . . . . c19602_2mgt 1 . 7 . 3397 . 1 1 12 GLU C C -5.571 0.907 1.644 . . . 1.0 . . . . . . . . . . . . A . 11 GLU C . . . . . . . . . c19602_2mgt 1 . 7 . 3398 . 1 1 12 GLU CA C -4.913 2.177 1.072 . . . 1.0 . . . . . . . . . . . . A . 11 GLU CA . . . . . . . . . c19602_2mgt 1 . 7 . 3399 . 1 1 12 GLU CB C -3.398 2.266 1.260 . . . 1.0 . . . . . . . . . . . . A . 11 GLU CB . . . . . . . . . c19602_2mgt 1 . 7 . 3400 . 1 1 12 GLU CD C -1.355 0.978 0.552 . . . 1.0 . . . . . . . . . . . . A . 11 GLU CD . . . . . . . . . c19602_2mgt 1 . 7 . 3401 . 1 1 12 GLU CG C -2.680 1.563 0.107 . . . 1.0 . . . . . . . . . . . . A . 11 GLU CG . . . . . . . . . c19602_2mgt 1 . 7 . 3402 . 1 1 12 GLU H H -5.810 3.084 2.719 . . . 1.0 . . . . . . . . . . . . A . 11 GLU H . . . . . . . . . c19602_2mgt 1 . 7 . 3403 . 1 1 12 GLU HA H -5.147 2.271 0.012 . . . 1.0 . . . . . . . . . . . . A . 11 GLU HA . . . . . . . . . c19602_2mgt 1 . 7 . 3404 . 1 1 12 GLU HB2 H -3.086 3.312 1.262 . . . 1.0 . . . . . . . . . . . . A . 11 GLU HB2 . . . . . . . . . c19602_2mgt 1 . 7 . 3405 . 1 1 12 GLU HB3 H -3.127 1.840 2.223 . . . 1.0 . . . . . . . . . . . . A . 11 GLU HB3 . . . . . . . . . c19602_2mgt 1 . 7 . 3406 . 1 1 12 GLU HG2 H -3.299 0.752 -0.263 . . . 1.0 . . . . . . . . . . . . A . 11 GLU HG2 . . . . . . . . . c19602_2mgt 1 . 7 . 3407 . 1 1 12 GLU HG3 H -2.519 2.271 -0.706 . . . 1.0 . . . . . . . . . . . . A . 11 GLU HG3 . . . . . . . . . c19602_2mgt 1 . 7 . 3408 . 1 1 12 GLU N N -5.516 3.277 1.773 . . . 1.0 . . . . . . . . . . . . A . 11 GLU N . . . . . . . . . c19602_2mgt 1 . 7 . 3409 . 1 1 12 GLU O O -5.139 0.370 2.662 . . . 1.0 . . . . . . . . . . . . A . 11 GLU O . . . . . . . . . c19602_2mgt 1 . 7 . 3410 . 1 1 12 GLU OE1 O -0.575 1.720 1.179 . . . 1.0 . . . . . . . . . . . . A . 11 GLU OE1 . . . . . . . . . c19602_2mgt 1 . 7 . 3411 . 1 1 12 GLU OE2 O -1.140 -0.222 0.304 . . . 1.0 . . . . . . . . . . . . A . 11 GLU OE2 . . . . . . . . . c19602_2mgt 1 . 7 . 3412 . 1 1 13 VAL C C -7.049 -1.903 1.668 . . . 1.0 . . . . . . . . . . . . A . 12 VAL C . . . . . . . . . c19602_2mgt 1 . 7 . 3413 . 1 1 13 VAL CA C -7.650 -0.513 1.452 . . . 1.0 . . . . . . . . . . . . A . 12 VAL CA . . . . . . . . . c19602_2mgt 1 . 7 . 3414 . 1 1 13 VAL CB C -8.808 -0.557 0.431 . . . 1.0 . . . . . . . . . . . . A . 12 VAL CB . . . . . . . . . c19602_2mgt 1 . 7 . 3415 . 1 1 13 VAL CG1 C -9.720 -1.784 0.556 . . . 1.0 . . . . . . . . . . . . A . 12 VAL CG1 . . . . . . . . . c19602_2mgt 1 . 7 . 3416 . 1 1 13 VAL CG2 C -9.686 0.674 0.642 . . . 1.0 . . . . . . . . . . . . A . 12 VAL CG2 . . . . . . . . . c19602_2mgt 1 . 7 . 3417 . 1 1 13 VAL H H -6.952 1.010 0.187 . . . 1.0 . . . . . . . . . . . . A . 12 VAL H . . . . . . . . . c19602_2mgt 1 . 7 . 3418 . 1 1 13 VAL HA H -8.068 -0.190 2.402 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HA . . . . . . . . . c19602_2mgt 1 . 7 . 3419 . 1 1 13 VAL HB H -8.401 -0.542 -0.582 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HB . . . . . . . . . c19602_2mgt 1 . 7 . 3420 . 1 1 13 VAL HG11 H -10.564 -1.699 -0.123 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HG11 . . . . . . . . . c19602_2mgt 1 . 7 . 3421 . 1 1 13 VAL HG12 H -9.166 -2.681 0.283 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HG12 . . . . . . . . . c19602_2mgt 1 . 7 . 3422 . 1 1 13 VAL HG13 H -10.090 -1.871 1.579 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HG13 . . . . . . . . . c19602_2mgt 1 . 7 . 3423 . 1 1 13 VAL HG21 H -10.129 0.637 1.635 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HG21 . . . . . . . . . c19602_2mgt 1 . 7 . 3424 . 1 1 13 VAL HG22 H -9.090 1.577 0.549 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HG22 . . . . . . . . . c19602_2mgt 1 . 7 . 3425 . 1 1 13 VAL HG23 H -10.465 0.687 -0.120 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HG23 . . . . . . . . . c19602_2mgt 1 . 7 . 3426 . 1 1 13 VAL N N -6.679 0.495 1.011 . . . 1.0 . . . . . . . . . . . . A . 12 VAL N . . . . . . . . . c19602_2mgt 1 . 7 . 3427 . 1 1 13 VAL O O -7.618 -2.703 2.407 . . . 1.0 . . . . . . . . . . . . A . 12 VAL O . . . . . . . . . c19602_2mgt 1 . 7 . 3428 . 1 1 14 HIS C C -4.742 -3.552 2.787 . . . 1.0 . . . . . . . . . . . . A . 13 HIS C . . . . . . . . . c19602_2mgt 1 . 7 . 3429 . 1 1 14 HIS CA C -5.225 -3.465 1.331 . . . 1.0 . . . . . . . . . . . . A . 13 HIS CA . . . . . . . . . c19602_2mgt 1 . 7 . 3430 . 1 1 14 HIS CB C -4.093 -3.661 0.313 . . . 1.0 . . . . . . . . . . . . A . 13 HIS CB . . . . . . . . . c19602_2mgt 1 . 7 . 3431 . 1 1 14 HIS CD2 C -5.847 -4.022 -1.565 . . . 1.0 . . . . . . . . . . . . A . 13 HIS CD2 . . . . . . . . . c19602_2mgt 1 . 7 . 3432 . 1 1 14 HIS CE1 C -4.566 -4.916 -3.102 . . . 1.0 . . . . . . . . . . . . A . 13 HIS CE1 . . . . . . . . . c19602_2mgt 1 . 7 . 3433 . 1 1 14 HIS CG C -4.566 -4.040 -1.077 . . . 1.0 . . . . . . . . . . . . A . 13 HIS CG . . . . . . . . . c19602_2mgt 1 . 7 . 3434 . 1 1 14 HIS H H -5.447 -1.533 0.470 . . . 1.0 . . . . . . . . . . . . A . 13 HIS H . . . . . . . . . c19602_2mgt 1 . 7 . 3435 . 1 1 14 HIS HA H -5.968 -4.248 1.189 . . . 1.0 . . . . . . . . . . . . A . 13 HIS HA . . . . . . . . . c19602_2mgt 1 . 7 . 3436 . 1 1 14 HIS HB2 H -3.492 -2.754 0.264 . . . 1.0 . . . . . . . . . . . . A . 13 HIS HB2 . . . . . . . . . c19602_2mgt 1 . 7 . 3437 . 1 1 14 HIS HB3 H -3.441 -4.459 0.666 . . . 1.0 . . . . . . . . . . . . A . 13 HIS HB3 . . . . . . . . . c19602_2mgt 1 . 7 . 3438 . 1 1 14 HIS HD1 H -2.791 -4.764 -2.003 . . . 1.0 . . . . . . . . . . . . A . 13 HIS HD1 . . . . . . . . . c19602_2mgt 1 . 7 . 3439 . 1 1 14 HIS HD2 H -6.730 -3.691 -1.037 . . . 1.0 . . . . . . . . . . . . A . 13 HIS HD2 . . . . . . . . . c19602_2mgt 1 . 7 . 3440 . 1 1 14 HIS HE1 H -4.221 -5.386 -4.012 . . . 1.0 . . . . . . . . . . . . A . 13 HIS HE1 . . . . . . . . . c19602_2mgt 1 . 7 . 3441 . 1 1 14 HIS N N -5.894 -2.204 1.077 . . . 1.0 . . . . . . . . . . . . A . 13 HIS N . . . . . . . . . c19602_2mgt 1 . 7 . 3442 . 1 1 14 HIS ND1 N -3.783 -4.581 -2.069 . . . 1.0 . . . . . . . . . . . . A . 13 HIS ND1 . . . . . . . . . c19602_2mgt 1 . 7 . 3443 . 1 1 14 HIS NE2 N -5.840 -4.596 -2.839 . . . 1.0 . . . . . . . . . . . . A . 13 HIS NE2 . . . . . . . . . c19602_2mgt 1 . 7 . 3444 . 1 1 14 HIS O O -4.521 -4.655 3.270 . . . 1.0 . . . . . . . . . . . . A . 13 HIS O . . . . . . . . . c19602_2mgt 1 . 7 . 3445 . 1 1 15 HIS C C -5.538 -2.246 5.843 . . . 1.0 . . . . . . . . . . . . A . 14 HIS C . . . . . . . . . c19602_2mgt 1 . 7 . 3446 . 1 1 15 HIS CA C -4.320 -2.395 4.931 . . . 1.0 . . . . . . . . . . . . A . 14 HIS CA . . . . . . . . . c19602_2mgt 1 . 7 . 3447 . 1 1 15 HIS CB C -3.303 -1.291 5.179 . . . 1.0 . . . . . . . . . . . . A . 14 HIS CB . . . . . . . . . c19602_2mgt 1 . 7 . 3448 . 1 1 15 HIS CD2 C -1.458 -0.578 3.569 . . . 1.0 . . . . . . . . . . . . A . 14 HIS CD2 . . . . . . . . . c19602_2mgt 1 . 7 . 3449 . 1 1 15 HIS CE1 C -0.335 -2.454 3.396 . . . 1.0 . . . . . . . . . . . . A . 14 HIS CE1 . . . . . . . . . c19602_2mgt 1 . 7 . 3450 . 1 1 15 HIS CG C -2.050 -1.499 4.379 . . . 1.0 . . . . . . . . . . . . A . 14 HIS CG . . . . . . . . . c19602_2mgt 1 . 7 . 3451 . 1 1 15 HIS H H -4.846 -1.543 3.066 . . . 1.0 . . . . . . . . . . . . A . 14 HIS H . . . . . . . . . c19602_2mgt 1 . 7 . 3452 . 1 1 15 HIS HA H -3.850 -3.338 5.196 . . . 1.0 . . . . . . . . . . . . A . 14 HIS HA . . . . . . . . . c19602_2mgt 1 . 7 . 3453 . 1 1 15 HIS HB2 H -3.751 -0.335 4.917 . . . 1.0 . . . . . . . . . . . . A . 14 HIS HB2 . . . . . . . . . c19602_2mgt 1 . 7 . 3454 . 1 1 15 HIS HB3 H -3.034 -1.276 6.230 . . . 1.0 . . . . . . . . . . . . A . 14 HIS HB3 . . . . . . . . . c19602_2mgt 1 . 7 . 3455 . 1 1 15 HIS HD1 H -1.530 -3.538 4.739 . . . 1.0 . . . . . . . . . . . . A . 14 HIS HD1 . . . . . . . . . c19602_2mgt 1 . 7 . 3456 . 1 1 15 HIS HD2 H -1.787 0.440 3.430 . . . 1.0 . . . . . . . . . . . . A . 14 HIS HD2 . . . . . . . . . c19602_2mgt 1 . 7 . 3457 . 1 1 15 HIS HE1 H 0.411 -3.180 3.112 . . . 1.0 . . . . . . . . . . . . A . 14 HIS HE1 . . . . . . . . . c19602_2mgt 1 . 7 . 3458 . 1 1 15 HIS N N -4.649 -2.428 3.511 . . . 1.0 . . . . . . . . . . . . A . 14 HIS N . . . . . . . . . c19602_2mgt 1 . 7 . 3459 . 1 1 15 HIS ND1 N -1.337 -2.670 4.258 . . . 1.0 . . . . . . . . . . . . A . 14 HIS ND1 . . . . . . . . . c19602_2mgt 1 . 7 . 3460 . 1 1 15 HIS NE2 N -0.371 -1.194 2.950 . . . 1.0 . . . . . . . . . . . . A . 14 HIS NE2 . . . . . . . . . c19602_2mgt 1 . 7 . 3461 . 1 1 15 HIS O O -5.388 -2.468 7.042 . . . 1.0 . . . . . . . . . . . . A . 14 HIS O . . . . . . . . . c19602_2mgt 1 . 7 . 3462 . 1 1 16 GLN C C -8.010 -3.830 6.228 . . . 1.0 . . . . . . . . . . . . A . 15 GLN C . . . . . . . . . c19602_2mgt 1 . 7 . 3463 . 1 1 16 GLN CA C -7.984 -2.323 5.979 . . . 1.0 . . . . . . . . . . . . A . 15 GLN CA . . . . . . . . . c19602_2mgt 1 . 7 . 3464 . 1 1 16 GLN CB C -9.167 -1.950 5.083 . . . 1.0 . . . . . . . . . . . . A . 15 GLN CB . . . . . . . . . c19602_2mgt 1 . 7 . 3465 . 1 1 16 GLN CD C -10.806 -1.249 6.902 . . . 1.0 . . . . . . . . . . . . A . 15 GLN CD . . . . . . . . . c19602_2mgt 1 . 7 . 3466 . 1 1 16 GLN CG C -10.521 -2.191 5.748 . . . 1.0 . . . . . . . . . . . . A . 15 GLN CG . . . . . . . . . c19602_2mgt 1 . 7 . 3467 . 1 1 16 GLN H H -6.820 -1.766 4.324 . . . 1.0 . . . . . . . . . . . . A . 15 GLN H . . . . . . . . . c19602_2mgt 1 . 7 . 3468 . 1 1 16 GLN HA H -8.045 -1.779 6.913 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HA . . . . . . . . . c19602_2mgt 1 . 7 . 3469 . 1 1 16 GLN HB2 H -9.086 -0.917 4.758 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HB2 . . . . . . . . . c19602_2mgt 1 . 7 . 3470 . 1 1 16 GLN HB3 H -9.149 -2.580 4.207 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HB3 . . . . . . . . . c19602_2mgt 1 . 7 . 3471 . 1 1 16 GLN HE21 H -12.324 -2.420 7.562 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HE21 . . . . . . . . . c19602_2mgt 1 . 7 . 3472 . 1 1 16 GLN HE22 H -12.032 -0.969 8.490 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HE22 . . . . . . . . . c19602_2mgt 1 . 7 . 3473 . 1 1 16 GLN HG2 H -11.282 -2.058 4.991 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HG2 . . . . . . . . . c19602_2mgt 1 . 7 . 3474 . 1 1 16 GLN HG3 H -10.580 -3.214 6.109 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HG3 . . . . . . . . . c19602_2mgt 1 . 7 . 3475 . 1 1 16 GLN N N -6.739 -1.977 5.305 . . . 1.0 . . . . . . . . . . . . A . 15 GLN N . . . . . . . . . c19602_2mgt 1 . 7 . 3476 . 1 1 16 GLN NE2 N -11.798 -1.571 7.715 . . . 1.0 . . . . . . . . . . . . A . 15 GLN NE2 . . . . . . . . . c19602_2mgt 1 . 7 . 3477 . 1 1 16 GLN O O -8.397 -4.281 7.301 . . . 1.0 . . . . . . . . . . . . A . 15 GLN O . . . . . . . . . c19602_2mgt 1 . 7 . 3478 . 1 1 16 GLN OE1 O -10.141 -0.239 7.073 . . . 1.0 . . . . . . . . . . . . A . 15 GLN OE1 . . . . . . . . . c19602_2mgt 1 . 7 . 3479 . 1 1 17 LYS C C -6.134 -6.467 5.948 . . . 1.0 . . . . . . . . . . . . A . 16 LYS C . . . . . . . . . c19602_2mgt 1 . 7 . 3480 . 1 1 17 LYS CA C -7.408 -6.021 5.212 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CA . . . . . . . . . c19602_2mgt 1 . 7 . 3481 . 1 1 17 LYS CB C -7.428 -6.427 3.734 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CB . . . . . . . . . c19602_2mgt 1 . 7 . 3482 . 1 1 17 LYS CD C -7.761 -8.139 1.995 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CD . . . . . . . . . c19602_2mgt 1 . 7 . 3483 . 1 1 17 LYS CE C -7.785 -9.613 1.628 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CE . . . . . . . . . c19602_2mgt 1 . 7 . 3484 . 1 1 17 LYS CG C -7.464 -7.932 3.478 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CG . . . . . . . . . c19602_2mgt 1 . 7 . 3485 . 1 1 17 LYS H H -7.320 -4.104 4.361 . . . 1.0 . . . . . . . . . . . . A . 16 LYS H . . . . . . . . . c19602_2mgt 1 . 7 . 3486 . 1 1 17 LYS HA H -8.266 -6.469 5.711 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HA . . . . . . . . . c19602_2mgt 1 . 7 . 3487 . 1 1 17 LYS HB2 H -8.313 -5.983 3.276 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HB2 . . . . . . . . . c19602_2mgt 1 . 7 . 3488 . 1 1 17 LYS HB3 H -6.562 -6.011 3.229 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HB3 . . . . . . . . . c19602_2mgt 1 . 7 . 3489 . 1 1 17 LYS HD2 H -8.729 -7.696 1.757 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HD2 . . . . . . . . . c19602_2mgt 1 . 7 . 3490 . 1 1 17 LYS HD3 H -6.993 -7.643 1.405 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HD3 . . . . . . . . . c19602_2mgt 1 . 7 . 3491 . 1 1 17 LYS HE2 H -6.809 -10.058 1.826 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HE2 . . . . . . . . . c19602_2mgt 1 . 7 . 3492 . 1 1 17 LYS HE3 H -8.537 -10.122 2.231 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HE3 . . . . . . . . . c19602_2mgt 1 . 7 . 3493 . 1 1 17 LYS HG2 H -6.503 -8.380 3.727 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HG2 . . . . . . . . . c19602_2mgt 1 . 7 . 3494 . 1 1 17 LYS HG3 H -8.250 -8.387 4.075 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HG3 . . . . . . . . . c19602_2mgt 1 . 7 . 3495 . 1 1 17 LYS HZ1 H -7.395 -9.317 -0.356 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HZ1 . . . . . . . . . c19602_2mgt 1 . 7 . 3496 . 1 1 17 LYS HZ2 H -8.175 -10.731 -0.035 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HZ2 . . . . . . . . . c19602_2mgt 1 . 7 . 3497 . 1 1 17 LYS HZ3 H -9.001 -9.307 0.015 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HZ3 . . . . . . . . . c19602_2mgt 1 . 7 . 3498 . 1 1 17 LYS N N -7.566 -4.581 5.217 . . . 1.0 . . . . . . . . . . . . A . 16 LYS N . . . . . . . . . c19602_2mgt 1 . 7 . 3499 . 1 1 17 LYS NZ N -8.114 -9.752 0.204 . . . 1.0 . . . . . . . . . . . . A . 16 LYS NZ . . . . . . . . . c19602_2mgt 1 . 7 . 3500 . 1 1 17 LYS O O -5.945 -7.656 6.157 . . . 1.0 . . . . . . . . . . . . A . 16 LYS O . . . . . . . . . c19602_2mgt 1 . 7 . 3501 . 1 1 18 NH2 HN1 H -4.424 -5.845 6.863 . . . 1.0 . . . . . . . . . . . . A . 17 NH2 HN1 . . . . . . . . . c19602_2mgt 1 . 7 . 3502 . 1 1 18 NH2 HN2 H -5.438 -4.571 6.220 . . . 1.0 . . . . . . . . . . . . A . 17 NH2 HN2 . . . . . . . . . c19602_2mgt 1 . 7 . 3503 . 1 1 18 NH2 N N -5.257 -5.552 6.372 . . . 1.0 . . . . . . . . . . . . A . 17 NH2 N . . . . . . . . . c19602_2mgt 1 . 7 . 3504 . 2 1 1 ACE C C 9.359 9.087 -4.107 . . . 1.0 . . . . . . . . . . . . B . 0 ACE C . . . . . . . . . c19602_2mgt 1 . 7 . 3505 . 2 1 1 ACE CH3 C 8.213 9.235 -3.111 . . . 1.0 . . . . . . . . . . . . B . 0 ACE CH3 . . . . . . . . . c19602_2mgt 1 . 7 . 3506 . 2 1 1 ACE H1 H 7.405 9.815 -3.560 . . . 1.0 . . . . . . . . . . . . B . 0 ACE H1 . . . . . . . . . c19602_2mgt 1 . 7 . 3507 . 2 1 1 ACE H2 H 7.828 8.254 -2.846 . . . 1.0 . . . . . . . . . . . . B . 0 ACE H2 . . . . . . . . . c19602_2mgt 1 . 7 . 3508 . 2 1 1 ACE H3 H 8.560 9.749 -2.214 . . . 1.0 . . . . . . . . . . . . B . 0 ACE H3 . . . . . . . . . c19602_2mgt 1 . 7 . 3509 . 2 1 1 ACE O O 9.169 9.383 -5.280 . . . 1.0 . . . . . . . . . . . . B . 0 ACE O . . . . . . . . . c19602_2mgt 1 . 7 . 3510 . 2 1 2 ASP C C 12.033 7.364 -5.212 . . . 1.0 . . . . . . . . . . . . B . 1 ASP C . . . . . . . . . c19602_2mgt 1 . 7 . 3511 . 2 1 2 ASP CA C 11.775 8.655 -4.435 . . . 1.0 . . . . . . . . . . . . B . 1 ASP CA . . . . . . . . . c19602_2mgt 1 . 7 . 3512 . 2 1 2 ASP CB C 12.962 8.931 -3.516 . . . 1.0 . . . . . . . . . . . . B . 1 ASP CB . . . . . . . . . c19602_2mgt 1 . 7 . 3513 . 2 1 2 ASP CG C 12.885 10.324 -2.935 . . . 1.0 . . . . . . . . . . . . B . 1 ASP CG . . . . . . . . . c19602_2mgt 1 . 7 . 3514 . 2 1 2 ASP H H 10.617 8.381 -2.677 . . . 1.0 . . . . . . . . . . . . B . 1 ASP H . . . . . . . . . c19602_2mgt 1 . 7 . 3515 . 2 1 2 ASP HA H 11.721 9.471 -5.156 . . . 1.0 . . . . . . . . . . . . B . 1 ASP HA . . . . . . . . . c19602_2mgt 1 . 7 . 3516 . 2 1 2 ASP HB2 H 13.003 8.193 -2.721 . . . 1.0 . . . . . . . . . . . . B . 1 ASP HB2 . . . . . . . . . c19602_2mgt 1 . 7 . 3517 . 2 1 2 ASP HB3 H 13.879 8.866 -4.088 . . . 1.0 . . . . . . . . . . . . B . 1 ASP HB3 . . . . . . . . . c19602_2mgt 1 . 7 . 3518 . 2 1 2 ASP N N 10.539 8.645 -3.649 . . . 1.0 . . . . . . . . . . . . B . 1 ASP N . . . . . . . . . c19602_2mgt 1 . 7 . 3519 . 2 1 2 ASP O O 11.715 6.267 -4.762 . . . 1.0 . . . . . . . . . . . . B . 1 ASP O . . . . . . . . . c19602_2mgt 1 . 7 . 3520 . 2 1 2 ASP OD1 O 13.204 11.270 -3.661 . . . 1.0 . . . . . . . . . . . . B . 1 ASP OD1 . . . . . . . . . c19602_2mgt 1 . 7 . 3521 . 2 1 2 ASP OD2 O 12.481 10.435 -1.757 . . . 1.0 . . . . . . . . . . . . B . 1 ASP OD2 . . . . . . . . . c19602_2mgt 1 . 7 . 3522 . 2 1 3 ALA C C 13.906 5.372 -6.712 . . . 1.0 . . . . . . . . . . . . B . 2 ALA C . . . . . . . . . c19602_2mgt 1 . 7 . 3523 . 2 1 3 ALA CA C 13.003 6.450 -7.305 . . . 1.0 . . . . . . . . . . . . B . 2 ALA CA . . . . . . . . . c19602_2mgt 1 . 7 . 3524 . 2 1 3 ALA CB C 13.666 7.076 -8.529 . . . 1.0 . . . . . . . . . . . . B . 2 ALA CB . . . . . . . . . c19602_2mgt 1 . 7 . 3525 . 2 1 3 ALA H H 12.956 8.452 -6.643 . . . 1.0 . . . . . . . . . . . . B . 2 ALA H . . . . . . . . . c19602_2mgt 1 . 7 . 3526 . 2 1 3 ALA HA H 12.075 5.973 -7.606 . . . 1.0 . . . . . . . . . . . . B . 2 ALA HA . . . . . . . . . c19602_2mgt 1 . 7 . 3527 . 2 1 3 ALA HB1 H 12.991 7.800 -8.979 . . . 1.0 . . . . . . . . . . . . B . 2 ALA HB1 . . . . . . . . . c19602_2mgt 1 . 7 . 3528 . 2 1 3 ALA HB2 H 14.590 7.574 -8.235 . . . 1.0 . . . . . . . . . . . . B . 2 ALA HB2 . . . . . . . . . c19602_2mgt 1 . 7 . 3529 . 2 1 3 ALA HB3 H 13.886 6.298 -9.258 . . . 1.0 . . . . . . . . . . . . B . 2 ALA HB3 . . . . . . . . . c19602_2mgt 1 . 7 . 3530 . 2 1 3 ALA N N 12.688 7.518 -6.367 . . . 1.0 . . . . . . . . . . . . B . 2 ALA N . . . . . . . . . c19602_2mgt 1 . 7 . 3531 . 2 1 3 ALA O O 13.739 4.202 -7.034 . . . 1.0 . . . . . . . . . . . . B . 2 ALA O . . . . . . . . . c19602_2mgt 1 . 7 . 3532 . 2 1 4 GLU C C 14.897 3.842 -4.209 . . . 1.0 . . . . . . . . . . . . B . 3 GLU C . . . . . . . . . c19602_2mgt 1 . 7 . 3533 . 2 1 4 GLU CA C 15.670 4.853 -5.055 . . . 1.0 . . . . . . . . . . . . B . 3 GLU CA . . . . . . . . . c19602_2mgt 1 . 7 . 3534 . 2 1 4 GLU CB C 16.603 5.694 -4.183 . . . 1.0 . . . . . . . . . . . . B . 3 GLU CB . . . . . . . . . c19602_2mgt 1 . 7 . 3535 . 2 1 4 GLU CD C 16.614 7.575 -2.491 . . . 1.0 . . . . . . . . . . . . B . 3 GLU CD . . . . . . . . . c19602_2mgt 1 . 7 . 3536 . 2 1 4 GLU CG C 15.800 6.470 -3.131 . . . 1.0 . . . . . . . . . . . . B . 3 GLU CG . . . . . . . . . c19602_2mgt 1 . 7 . 3537 . 2 1 4 GLU H H 14.888 6.737 -5.600 . . . 1.0 . . . . . . . . . . . . B . 3 GLU H . . . . . . . . . c19602_2mgt 1 . 7 . 3538 . 2 1 4 GLU HA H 16.273 4.293 -5.755 . . . 1.0 . . . . . . . . . . . . B . 3 GLU HA . . . . . . . . . c19602_2mgt 1 . 7 . 3539 . 2 1 4 GLU HB2 H 17.326 5.048 -3.685 . . . 1.0 . . . . . . . . . . . . B . 3 GLU HB2 . . . . . . . . . c19602_2mgt 1 . 7 . 3540 . 2 1 4 GLU HB3 H 17.141 6.385 -4.829 . . . 1.0 . . . . . . . . . . . . B . 3 GLU HB3 . . . . . . . . . c19602_2mgt 1 . 7 . 3541 . 2 1 4 GLU HG2 H 14.926 6.918 -3.601 . . . 1.0 . . . . . . . . . . . . B . 3 GLU HG2 . . . . . . . . . c19602_2mgt 1 . 7 . 3542 . 2 1 4 GLU HG3 H 15.457 5.780 -2.364 . . . 1.0 . . . . . . . . . . . . B . 3 GLU HG3 . . . . . . . . . c19602_2mgt 1 . 7 . 3543 . 2 1 4 GLU N N 14.814 5.753 -5.814 . . . 1.0 . . . . . . . . . . . . B . 3 GLU N . . . . . . . . . c19602_2mgt 1 . 7 . 3544 . 2 1 4 GLU O O 15.429 2.777 -3.925 . . . 1.0 . . . . . . . . . . . . B . 3 GLU O . . . . . . . . . c19602_2mgt 1 . 7 . 3545 . 2 1 4 GLU OE1 O 16.805 8.613 -3.138 . . . 1.0 . . . . . . . . . . . . B . 3 GLU OE1 . . . . . . . . . c19602_2mgt 1 . 7 . 3546 . 2 1 4 GLU OE2 O 17.041 7.368 -1.334 . . . 1.0 . . . . . . . . . . . . B . 3 GLU OE2 . . . . . . . . . c19602_2mgt 1 . 7 . 3547 . 2 1 5 PHE C C 11.858 2.474 -4.045 . . . 1.0 . . . . . . . . . . . . B . 4 PHE C . . . . . . . . . c19602_2mgt 1 . 7 . 3548 . 2 1 5 PHE CA C 12.805 3.200 -3.110 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CA . . . . . . . . . c19602_2mgt 1 . 7 . 3549 . 2 1 5 PHE CB C 12.013 3.926 -2.031 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CB . . . . . . . . . c19602_2mgt 1 . 7 . 3550 . 2 1 5 PHE CD1 C 13.956 4.145 -0.432 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CD1 . . . . . . . . . c19602_2mgt 1 . 7 . 3551 . 2 1 5 PHE CD2 C 12.662 6.124 -0.999 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CD2 . . . . . . . . . c19602_2mgt 1 . 7 . 3552 . 2 1 5 PHE CE1 C 14.791 4.928 0.385 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CE1 . . . . . . . . . c19602_2mgt 1 . 7 . 3553 . 2 1 5 PHE CE2 C 13.498 6.908 -0.187 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CE2 . . . . . . . . . c19602_2mgt 1 . 7 . 3554 . 2 1 5 PHE CG C 12.885 4.746 -1.113 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CG . . . . . . . . . c19602_2mgt 1 . 7 . 3555 . 2 1 5 PHE CZ C 14.558 6.308 0.513 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CZ . . . . . . . . . c19602_2mgt 1 . 7 . 3556 . 2 1 5 PHE H H 13.273 5.047 -4.053 . . . 1.0 . . . . . . . . . . . . B . 4 PHE H . . . . . . . . . c19602_2mgt 1 . 7 . 3557 . 2 1 5 PHE HA H 13.424 2.445 -2.627 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HA . . . . . . . . . c19602_2mgt 1 . 7 . 3558 . 2 1 5 PHE HB2 H 11.275 4.571 -2.509 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HB2 . . . . . . . . . c19602_2mgt 1 . 7 . 3559 . 2 1 5 PHE HB3 H 11.480 3.186 -1.436 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HB3 . . . . . . . . . c19602_2mgt 1 . 7 . 3560 . 2 1 5 PHE HD1 H 14.147 3.089 -0.563 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HD1 . . . . . . . . . c19602_2mgt 1 . 7 . 3561 . 2 1 5 PHE HD2 H 11.860 6.572 -1.563 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HD2 . . . . . . . . . c19602_2mgt 1 . 7 . 3562 . 2 1 5 PHE HE1 H 15.616 4.469 0.908 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HE1 . . . . . . . . . c19602_2mgt 1 . 7 . 3563 . 2 1 5 PHE HE2 H 13.337 7.970 -0.113 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HE2 . . . . . . . . . c19602_2mgt 1 . 7 . 3564 . 2 1 5 PHE HZ H 15.204 6.911 1.132 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HZ . . . . . . . . . c19602_2mgt 1 . 7 . 3565 . 2 1 5 PHE N N 13.656 4.143 -3.818 . . . 1.0 . . . . . . . . . . . . B . 4 PHE N . . . . . . . . . c19602_2mgt 1 . 7 . 3566 . 2 1 5 PHE O O 11.354 1.430 -3.650 . . . 1.0 . . . . . . . . . . . . B . 4 PHE O . . . . . . . . . c19602_2mgt 1 . 7 . 3567 . 2 1 6 ARG C C 11.467 1.143 -6.927 . . . 1.0 . . . . . . . . . . . . B . 5 ARG C . . . . . . . . . c19602_2mgt 1 . 7 . 3568 . 2 1 6 ARG CA C 10.804 2.368 -6.279 . . . 1.0 . . . . . . . . . . . . B . 5 ARG CA . . . . . . . . . c19602_2mgt 1 . 7 . 3569 . 2 1 6 ARG CB C 10.352 3.440 -7.279 . . . 1.0 . . . . . . . . . . . . B . 5 ARG CB . . . . . . . . . c19602_2mgt 1 . 7 . 3570 . 2 1 6 ARG CD C 7.830 3.158 -6.796 . . . 1.0 . . . . . . . . . . . . B . 5 ARG CD . . . . . . . . . c19602_2mgt 1 . 7 . 3571 . 2 1 6 ARG CG C 8.955 3.142 -7.848 . . . 1.0 . . . . . . . . . . . . B . 5 ARG CG . . . . . . . . . c19602_2mgt 1 . 7 . 3572 . 2 1 6 ARG CZ C 7.020 5.505 -6.490 . . . 1.0 . . . . . . . . . . . . B . 5 ARG CZ . . . . . . . . . c19602_2mgt 1 . 7 . 3573 . 2 1 6 ARG H H 12.087 3.849 -5.533 . . . 1.0 . . . . . . . . . . . . B . 5 ARG H . . . . . . . . . c19602_2mgt 1 . 7 . 3574 . 2 1 6 ARG HA H 9.929 2.017 -5.754 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HA . . . . . . . . . c19602_2mgt 1 . 7 . 3575 . 2 1 6 ARG HB2 H 10.328 4.410 -6.783 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HB2 . . . . . . . . . c19602_2mgt 1 . 7 . 3576 . 2 1 6 ARG HB3 H 11.073 3.506 -8.094 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HB3 . . . . . . . . . c19602_2mgt 1 . 7 . 3577 . 2 1 6 ARG HD2 H 6.877 2.932 -7.260 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HD2 . . . . . . . . . c19602_2mgt 1 . 7 . 3578 . 2 1 6 ARG HD3 H 7.991 2.385 -6.049 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HD3 . . . . . . . . . c19602_2mgt 1 . 7 . 3579 . 2 1 6 ARG HE H 8.370 4.553 -5.319 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HE . . . . . . . . . c19602_2mgt 1 . 7 . 3580 . 2 1 6 ARG HG2 H 8.730 3.883 -8.616 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HG2 . . . . . . . . . c19602_2mgt 1 . 7 . 3581 . 2 1 6 ARG HG3 H 8.981 2.163 -8.317 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HG3 . . . . . . . . . c19602_2mgt 1 . 7 . 3582 . 2 1 6 ARG HH11 H 6.092 4.596 -8.060 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HH11 . . . . . . . . . c19602_2mgt 1 . 7 . 3583 . 2 1 6 ARG HH12 H 5.655 6.270 -7.794 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HH12 . . . . . . . . . c19602_2mgt 1 . 7 . 3584 . 2 1 6 ARG HH21 H 7.789 6.708 -5.045 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HH21 . . . . . . . . . c19602_2mgt 1 . 7 . 3585 . 2 1 6 ARG HH22 H 6.599 7.455 -6.084 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HH22 . . . . . . . . . c19602_2mgt 1 . 7 . 3586 . 2 1 6 ARG N N 11.647 2.980 -5.270 . . . 1.0 . . . . . . . . . . . . B . 5 ARG N . . . . . . . . . c19602_2mgt 1 . 7 . 3587 . 2 1 6 ARG NE N 7.752 4.447 -6.112 . . . 1.0 . . . . . . . . . . . . B . 5 ARG NE . . . . . . . . . c19602_2mgt 1 . 7 . 3588 . 2 1 6 ARG NH1 N 6.180 5.450 -7.528 . . . 1.0 . . . . . . . . . . . . B . 5 ARG NH1 . . . . . . . . . c19602_2mgt 1 . 7 . 3589 . 2 1 6 ARG NH2 N 7.145 6.648 -5.820 . . . 1.0 . . . . . . . . . . . . B . 5 ARG NH2 . . . . . . . . . c19602_2mgt 1 . 7 . 3590 . 2 1 6 ARG O O 11.275 0.876 -8.107 . . . 1.0 . . . . . . . . . . . . B . 5 ARG O . . . . . . . . . c19602_2mgt 1 . 7 . 3591 . 2 1 7 ARG C C 11.962 -1.996 -6.304 . . . 1.0 . . . . . . . . . . . . B . 6 ARG C . . . . . . . . . c19602_2mgt 1 . 7 . 3592 . 2 1 7 ARG CA C 12.920 -0.830 -6.517 . . . 1.0 . . . . . . . . . . . . B . 6 ARG CA . . . . . . . . . c19602_2mgt 1 . 7 . 3593 . 2 1 7 ARG CB C 14.171 -1.033 -5.648 . . . 1.0 . . . . . . . . . . . . B . 6 ARG CB . . . . . . . . . c19602_2mgt 1 . 7 . 3594 . 2 1 7 ARG CD C 15.649 0.492 -7.107 . . . 1.0 . . . . . . . . . . . . B . 6 ARG CD . . . . . . . . . c19602_2mgt 1 . 7 . 3595 . 2 1 7 ARG CG C 15.157 0.138 -5.700 . . . 1.0 . . . . . . . . . . . . B . 6 ARG CG . . . . . . . . . c19602_2mgt 1 . 7 . 3596 . 2 1 7 ARG CZ C 14.391 1.576 -8.989 . . . 1.0 . . . . . . . . . . . . B . 6 ARG CZ . . . . . . . . . c19602_2mgt 1 . 7 . 3597 . 2 1 7 ARG H H 12.419 0.717 -5.202 . . . 1.0 . . . . . . . . . . . . B . 6 ARG H . . . . . . . . . c19602_2mgt 1 . 7 . 3598 . 2 1 7 ARG HA H 13.214 -0.772 -7.558 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HA . . . . . . . . . c19602_2mgt 1 . 7 . 3599 . 2 1 7 ARG HB2 H 13.859 -1.154 -4.609 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HB2 . . . . . . . . . c19602_2mgt 1 . 7 . 3600 . 2 1 7 ARG HB3 H 14.684 -1.941 -5.964 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HB3 . . . . . . . . . c19602_2mgt 1 . 7 . 3601 . 2 1 7 ARG HD2 H 16.676 0.845 -7.046 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HD2 . . . . . . . . . c19602_2mgt 1 . 7 . 3602 . 2 1 7 ARG HD3 H 15.639 -0.410 -7.714 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HD3 . . . . . . . . . c19602_2mgt 1 . 7 . 3603 . 2 1 7 ARG HE H 14.607 2.345 -7.128 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HE . . . . . . . . . c19602_2mgt 1 . 7 . 3604 . 2 1 7 ARG HG2 H 14.659 1.001 -5.274 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HG2 . . . . . . . . . c19602_2mgt 1 . 7 . 3605 . 2 1 7 ARG HG3 H 16.015 -0.112 -5.078 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HG3 . . . . . . . . . c19602_2mgt 1 . 7 . 3606 . 2 1 7 ARG HH11 H 15.189 -0.217 -9.535 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HH11 . . . . . . . . . c19602_2mgt 1 . 7 . 3607 . 2 1 7 ARG HH12 H 14.290 0.621 -10.779 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HH12 . . . . . . . . . c19602_2mgt 1 . 7 . 3608 . 2 1 7 ARG HH21 H 13.453 3.376 -8.807 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HH21 . . . . . . . . . c19602_2mgt 1 . 7 . 3609 . 2 1 7 ARG HH22 H 13.306 2.609 -10.371 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HH22 . . . . . . . . . c19602_2mgt 1 . 7 . 3610 . 2 1 7 ARG N N 12.275 0.412 -6.153 . . . 1.0 . . . . . . . . . . . . B . 6 ARG N . . . . . . . . . c19602_2mgt 1 . 7 . 3611 . 2 1 7 ARG NE N 14.838 1.557 -7.723 . . . 1.0 . . . . . . . . . . . . B . 6 ARG NE . . . . . . . . . c19602_2mgt 1 . 7 . 3612 . 2 1 7 ARG NH1 N 14.643 0.576 -9.835 . . . 1.0 . . . . . . . . . . . . B . 6 ARG NH1 . . . . . . . . . c19602_2mgt 1 . 7 . 3613 . 2 1 7 ARG NH2 N 13.670 2.609 -9.428 . . . 1.0 . . . . . . . . . . . . B . 6 ARG NH2 . . . . . . . . . c19602_2mgt 1 . 7 . 3614 . 2 1 7 ARG O O 11.068 -1.913 -5.469 . . . 1.0 . . . . . . . . . . . . B . 6 ARG O . . . . . . . . . c19602_2mgt 1 . 7 . 3615 . 2 1 8 ASP C C 11.971 -5.011 -5.392 . . . 1.0 . . . . . . . . . . . . B . 7 ASP C . . . . . . . . . c19602_2mgt 1 . 7 . 3616 . 2 1 8 ASP CA C 11.583 -4.408 -6.752 . . . 1.0 . . . . . . . . . . . . B . 7 ASP CA . . . . . . . . . c19602_2mgt 1 . 7 . 3617 . 2 1 8 ASP CB C 12.034 -5.362 -7.863 . . . 1.0 . . . . . . . . . . . . B . 7 ASP CB . . . . . . . . . c19602_2mgt 1 . 7 . 3618 . 2 1 8 ASP CG C 13.447 -5.891 -7.637 . . . 1.0 . . . . . . . . . . . . B . 7 ASP CG . . . . . . . . . c19602_2mgt 1 . 7 . 3619 . 2 1 8 ASP H H 12.972 -3.097 -7.659 . . . 1.0 . . . . . . . . . . . . B . 7 ASP H . . . . . . . . . c19602_2mgt 1 . 7 . 3620 . 2 1 8 ASP HA H 10.501 -4.293 -6.803 . . . 1.0 . . . . . . . . . . . . B . 7 ASP HA . . . . . . . . . c19602_2mgt 1 . 7 . 3621 . 2 1 8 ASP HB2 H 11.344 -6.202 -7.890 . . . 1.0 . . . . . . . . . . . . B . 7 ASP HB2 . . . . . . . . . c19602_2mgt 1 . 7 . 3622 . 2 1 8 ASP HB3 H 12.001 -4.843 -8.818 . . . 1.0 . . . . . . . . . . . . B . 7 ASP HB3 . . . . . . . . . c19602_2mgt 1 . 7 . 3623 . 2 1 8 ASP N N 12.210 -3.110 -6.996 . . . 1.0 . . . . . . . . . . . . B . 7 ASP N . . . . . . . . . c19602_2mgt 1 . 7 . 3624 . 2 1 8 ASP O O 11.405 -6.015 -4.978 . . . 1.0 . . . . . . . . . . . . B . 7 ASP O . . . . . . . . . c19602_2mgt 1 . 7 . 3625 . 2 1 8 ASP OD1 O 14.390 -5.082 -7.702 . . . 1.0 . . . . . . . . . . . . B . 7 ASP OD1 . . . . . . . . . c19602_2mgt 1 . 7 . 3626 . 2 1 8 ASP OD2 O 13.565 -7.105 -7.369 . . . 1.0 . . . . . . . . . . . . B . 7 ASP OD2 . . . . . . . . . c19602_2mgt 1 . 7 . 3627 . 2 1 9 SER C C 12.962 -4.840 -2.289 . . . 1.0 . . . . . . . . . . . . B . 8 SER C . . . . . . . . . c19602_2mgt 1 . 7 . 3628 . 2 1 9 SER CA C 13.721 -4.983 -3.618 . . . 1.0 . . . . . . . . . . . . B . 8 SER CA . . . . . . . . . c19602_2mgt 1 . 7 . 3629 . 2 1 9 SER CB C 15.093 -4.309 -3.571 . . . 1.0 . . . . . . . . . . . . B . 8 SER CB . . . . . . . . . c19602_2mgt 1 . 7 . 3630 . 2 1 9 SER H H 13.442 -3.682 -5.235 . . . 1.0 . . . . . . . . . . . . B . 8 SER H . . . . . . . . . c19602_2mgt 1 . 7 . 3631 . 2 1 9 SER HA H 13.876 -6.039 -3.818 . . . 1.0 . . . . . . . . . . . . B . 8 SER HA . . . . . . . . . c19602_2mgt 1 . 7 . 3632 . 2 1 9 SER HB2 H 14.970 -3.263 -3.289 . . . 1.0 . . . . . . . . . . . . B . 8 SER HB2 . . . . . . . . . c19602_2mgt 1 . 7 . 3633 . 2 1 9 SER HB3 H 15.721 -4.813 -2.835 . . . 1.0 . . . . . . . . . . . . B . 8 SER HB3 . . . . . . . . . c19602_2mgt 1 . 7 . 3634 . 2 1 9 SER HG H 16.534 -3.862 -4.789 . . . 1.0 . . . . . . . . . . . . B . 8 SER HG . . . . . . . . . c19602_2mgt 1 . 7 . 3635 . 2 1 9 SER N N 12.989 -4.437 -4.748 . . . 1.0 . . . . . . . . . . . . B . 8 SER N . . . . . . . . . c19602_2mgt 1 . 7 . 3636 . 2 1 9 SER O O 13.436 -4.188 -1.360 . . . 1.0 . . . . . . . . . . . . B . 8 SER O . . . . . . . . . c19602_2mgt 1 . 7 . 3637 . 2 1 9 SER OG O 15.714 -4.366 -4.837 . . . 1.0 . . . . . . . . . . . . B . 8 SER OG . . . . . . . . . c19602_2mgt 1 . 7 . 3638 . 2 1 10 GLY C C 9.624 -6.169 -1.460 . . . 1.0 . . . . . . . . . . . . B . 9 GLY C . . . . . . . . . c19602_2mgt 1 . 7 . 3639 . 2 1 10 GLY CA C 10.895 -5.424 -1.060 . . . 1.0 . . . . . . . . . . . . B . 9 GLY CA . . . . . . . . . c19602_2mgt 1 . 7 . 3640 . 2 1 10 GLY H H 11.387 -5.889 -3.029 . . . 1.0 . . . . . . . . . . . . B . 9 GLY H . . . . . . . . . c19602_2mgt 1 . 7 . 3641 . 2 1 10 GLY HA2 H 11.378 -5.919 -0.222 . . . 1.0 . . . . . . . . . . . . B . 9 GLY HA2 . . . . . . . . . c19602_2mgt 1 . 7 . 3642 . 2 1 10 GLY HA3 H 10.709 -4.397 -0.764 . . . 1.0 . . . . . . . . . . . . B . 9 GLY HA3 . . . . . . . . . c19602_2mgt 1 . 7 . 3643 . 2 1 10 GLY N N 11.768 -5.435 -2.210 . . . 1.0 . . . . . . . . . . . . B . 9 GLY N . . . . . . . . . c19602_2mgt 1 . 7 . 3644 . 2 1 10 GLY O O 9.689 -7.354 -1.768 . . . 1.0 . . . . . . . . . . . . B . 9 GLY O . . . . . . . . . c19602_2mgt 1 . 7 . 3645 . 2 1 11 TYR C C 6.688 -3.922 -1.150 . . . 1.0 . . . . . . . . . . . . B . 10 TYR C . . . . . . . . . c19602_2mgt 1 . 7 . 3646 . 2 1 11 TYR CA C 8.190 -4.145 -1.210 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CA . . . . . . . . . c19602_2mgt 1 . 7 . 3647 . 2 1 11 TYR CB C 8.789 -3.234 -2.301 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CB . . . . . . . . . c19602_2mgt 1 . 7 . 3648 . 2 1 11 TYR CD1 C 9.430 -1.328 -0.752 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CD1 . . . . . . . . . c19602_2mgt 1 . 7 . 3649 . 2 1 11 TYR CD2 C 11.039 -2.102 -2.390 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CD2 . . . . . . . . . c19602_2mgt 1 . 7 . 3650 . 2 1 11 TYR CE1 C 10.329 -0.346 -0.314 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CE1 . . . . . . . . . c19602_2mgt 1 . 7 . 3651 . 2 1 11 TYR CE2 C 11.945 -1.116 -1.973 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CE2 . . . . . . . . . c19602_2mgt 1 . 7 . 3652 . 2 1 11 TYR CG C 9.774 -2.203 -1.795 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CG . . . . . . . . . c19602_2mgt 1 . 7 . 3653 . 2 1 11 TYR CZ C 11.591 -0.224 -0.938 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CZ . . . . . . . . . c19602_2mgt 1 . 7 . 3654 . 2 1 11 TYR H H 7.695 -6.003 -1.965 . . . 1.0 . . . . . . . . . . . . B . 10 TYR H . . . . . . . . . c19602_2mgt 1 . 7 . 3655 . 2 1 11 TYR HA H 8.614 -3.904 -0.239 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HA . . . . . . . . . c19602_2mgt 1 . 7 . 3656 . 2 1 11 TYR HB2 H 9.272 -3.840 -3.071 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HB2 . . . . . . . . . c19602_2mgt 1 . 7 . 3657 . 2 1 11 TYR HB3 H 7.981 -2.712 -2.811 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HB3 . . . . . . . . . c19602_2mgt 1 . 7 . 3658 . 2 1 11 TYR HD1 H 8.464 -1.391 -0.292 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HD1 . . . . . . . . . c19602_2mgt 1 . 7 . 3659 . 2 1 11 TYR HD2 H 11.316 -2.791 -3.167 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HD2 . . . . . . . . . c19602_2mgt 1 . 7 . 3660 . 2 1 11 TYR HE1 H 10.044 0.304 0.497 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HE1 . . . . . . . . . c19602_2mgt 1 . 7 . 3661 . 2 1 11 TYR HE2 H 12.918 -1.058 -2.431 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HE2 . . . . . . . . . c19602_2mgt 1 . 7 . 3662 . 2 1 11 TYR HH H 12.135 1.260 0.193 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HH . . . . . . . . . c19602_2mgt 1 . 7 . 3663 . 2 1 11 TYR N N 8.456 -5.533 -1.508 . . . 1.0 . . . . . . . . . . . . B . 10 TYR N . . . . . . . . . c19602_2mgt 1 . 7 . 3664 . 2 1 11 TYR O O 5.915 -4.587 -1.837 . . . 1.0 . . . . . . . . . . . . B . 10 TYR O . . . . . . . . . c19602_2mgt 1 . 7 . 3665 . 2 1 11 TYR OH O 12.482 0.719 -0.523 . . . 1.0 . . . . . . . . . . . . B . 10 TYR OH . . . . . . . . . c19602_2mgt 1 . 7 . 3666 . 2 1 12 GLU C C 5.974 -0.526 -0.654 . . . 1.0 . . . . . . . . . . . . B . 11 GLU C . . . . . . . . . c19602_2mgt 1 . 7 . 3667 . 2 1 12 GLU CA C 5.381 -1.904 -0.938 . . . 1.0 . . . . . . . . . . . . B . 11 GLU CA . . . . . . . . . c19602_2mgt 1 . 7 . 3668 . 2 1 12 GLU CB C 4.038 -2.092 -0.261 . . . 1.0 . . . . . . . . . . . . B . 11 GLU CB . . . . . . . . . c19602_2mgt 1 . 7 . 3669 . 2 1 12 GLU CD C 1.942 -0.759 -0.023 . . . 1.0 . . . . . . . . . . . . B . 11 GLU CD . . . . . . . . . c19602_2mgt 1 . 7 . 3670 . 2 1 12 GLU CG C 2.951 -1.317 -1.001 . . . 1.0 . . . . . . . . . . . . B . 11 GLU CG . . . . . . . . . c19602_2mgt 1 . 7 . 3671 . 2 1 12 GLU H H 6.987 -2.486 0.224 . . . 1.0 . . . . . . . . . . . . B . 11 GLU H . . . . . . . . . c19602_2mgt 1 . 7 . 3672 . 2 1 12 GLU HA H 5.268 -2.048 -2.010 . . . 1.0 . . . . . . . . . . . . B . 11 GLU HA . . . . . . . . . c19602_2mgt 1 . 7 . 3673 . 2 1 12 GLU HB2 H 3.781 -3.146 -0.246 . . . 1.0 . . . . . . . . . . . . B . 11 GLU HB2 . . . . . . . . . c19602_2mgt 1 . 7 . 3674 . 2 1 12 GLU HB3 H 4.124 -1.742 0.764 . . . 1.0 . . . . . . . . . . . . B . 11 GLU HB3 . . . . . . . . . c19602_2mgt 1 . 7 . 3675 . 2 1 12 GLU HG2 H 3.395 -0.480 -1.544 . . . 1.0 . . . . . . . . . . . . B . 11 GLU HG2 . . . . . . . . . c19602_2mgt 1 . 7 . 3676 . 2 1 12 GLU HG3 H 2.451 -1.972 -1.711 . . . 1.0 . . . . . . . . . . . . B . 11 GLU HG3 . . . . . . . . . c19602_2mgt 1 . 7 . 3677 . 2 1 12 GLU N N 6.321 -2.869 -0.427 . . . 1.0 . . . . . . . . . . . . B . 11 GLU N . . . . . . . . . c19602_2mgt 1 . 7 . 3678 . 2 1 12 GLU O O 6.172 -0.153 0.501 . . . 1.0 . . . . . . . . . . . . B . 11 GLU O . . . . . . . . . c19602_2mgt 1 . 7 . 3679 . 2 1 12 GLU OE1 O 1.567 -1.485 0.924 . . . 1.0 . . . . . . . . . . . . B . 11 GLU OE1 . . . . . . . . . c19602_2mgt 1 . 7 . 3680 . 2 1 12 GLU OE2 O 1.594 0.416 -0.163 . . . 1.0 . . . . . . . . . . . . B . 11 GLU OE2 . . . . . . . . . c19602_2mgt 1 . 7 . 3681 . 2 1 13 VAL C C 6.573 2.565 -0.987 . . . 1.0 . . . . . . . . . . . . B . 12 VAL C . . . . . . . . . c19602_2mgt 1 . 7 . 3682 . 2 1 13 VAL CA C 7.183 1.357 -1.701 . . . 1.0 . . . . . . . . . . . . B . 12 VAL CA . . . . . . . . . c19602_2mgt 1 . 7 . 3683 . 2 1 13 VAL CB C 7.657 1.658 -3.134 . . . 1.0 . . . . . . . . . . . . B . 12 VAL CB . . . . . . . . . c19602_2mgt 1 . 7 . 3684 . 2 1 13 VAL CG1 C 8.521 2.921 -3.171 . . . 1.0 . . . . . . . . . . . . B . 12 VAL CG1 . . . . . . . . . c19602_2mgt 1 . 7 . 3685 . 2 1 13 VAL CG2 C 8.476 0.462 -3.640 . . . 1.0 . . . . . . . . . . . . B . 12 VAL CG2 . . . . . . . . . c19602_2mgt 1 . 7 . 3686 . 2 1 13 VAL H H 6.084 -0.173 -2.638 . . . 1.0 . . . . . . . . . . . . B . 12 VAL H . . . . . . . . . c19602_2mgt 1 . 7 . 3687 . 2 1 13 VAL HA H 8.070 1.091 -1.136 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HA . . . . . . . . . c19602_2mgt 1 . 7 . 3688 . 2 1 13 VAL HB H 6.801 1.805 -3.790 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HB . . . . . . . . . c19602_2mgt 1 . 7 . 3689 . 2 1 13 VAL HG11 H 9.286 2.879 -2.396 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HG11 . . . . . . . . . c19602_2mgt 1 . 7 . 3690 . 2 1 13 VAL HG12 H 9.003 3.033 -4.134 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HG12 . . . . . . . . . c19602_2mgt 1 . 7 . 3691 . 2 1 13 VAL HG13 H 7.885 3.791 -3.014 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HG13 . . . . . . . . . c19602_2mgt 1 . 7 . 3692 . 2 1 13 VAL HG21 H 8.841 0.651 -4.642 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HG21 . . . . . . . . . c19602_2mgt 1 . 7 . 3693 . 2 1 13 VAL HG22 H 9.307 0.283 -2.968 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HG22 . . . . . . . . . c19602_2mgt 1 . 7 . 3694 . 2 1 13 VAL HG23 H 7.862 -0.434 -3.679 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HG23 . . . . . . . . . c19602_2mgt 1 . 7 . 3695 . 2 1 13 VAL N N 6.301 0.198 -1.724 . . . 1.0 . . . . . . . . . . . . B . 12 VAL N . . . . . . . . . c19602_2mgt 1 . 7 . 3696 . 2 1 13 VAL O O 7.329 3.434 -0.555 . . . 1.0 . . . . . . . . . . . . B . 12 VAL O . . . . . . . . . c19602_2mgt 1 . 7 . 3697 . 2 1 14 HIS C C 5.147 3.554 1.519 . . . 1.0 . . . . . . . . . . . . B . 13 HIS C . . . . . . . . . c19602_2mgt 1 . 7 . 3698 . 2 1 14 HIS CA C 4.659 3.640 0.065 . . . 1.0 . . . . . . . . . . . . B . 13 HIS CA . . . . . . . . . c19602_2mgt 1 . 7 . 3699 . 2 1 14 HIS CB C 3.123 3.569 0.063 . . . 1.0 . . . . . . . . . . . . B . 13 HIS CB . . . . . . . . . c19602_2mgt 1 . 7 . 3700 . 2 1 14 HIS CD2 C 2.749 4.389 -2.348 . . . 1.0 . . . . . . . . . . . . B . 13 HIS CD2 . . . . . . . . . c19602_2mgt 1 . 7 . 3701 . 2 1 14 HIS CE1 C 1.165 3.000 -2.963 . . . 1.0 . . . . . . . . . . . . B . 13 HIS CE1 . . . . . . . . . c19602_2mgt 1 . 7 . 3702 . 2 1 14 HIS CG C 2.458 3.580 -1.284 . . . 1.0 . . . . . . . . . . . . B . 13 HIS CG . . . . . . . . . c19602_2mgt 1 . 7 . 3703 . 2 1 14 HIS H H 4.656 1.874 -1.135 . . . 1.0 . . . . . . . . . . . . B . 13 HIS H . . . . . . . . . c19602_2mgt 1 . 7 . 3704 . 2 1 14 HIS HA H 4.982 4.589 -0.361 . . . 1.0 . . . . . . . . . . . . B . 13 HIS HA . . . . . . . . . c19602_2mgt 1 . 7 . 3705 . 2 1 14 HIS HB2 H 2.827 2.660 0.580 . . . 1.0 . . . . . . . . . . . . B . 13 HIS HB2 . . . . . . . . . c19602_2mgt 1 . 7 . 3706 . 2 1 14 HIS HB3 H 2.736 4.415 0.632 . . . 1.0 . . . . . . . . . . . . B . 13 HIS HB3 . . . . . . . . . c19602_2mgt 1 . 7 . 3707 . 2 1 14 HIS HD1 H 1.033 2.006 -1.122 . . . 1.0 . . . . . . . . . . . . B . 13 HIS HD1 . . . . . . . . . c19602_2mgt 1 . 7 . 3708 . 2 1 14 HIS HD2 H 3.506 5.156 -2.378 . . . 1.0 . . . . . . . . . . . . B . 13 HIS HD2 . . . . . . . . . c19602_2mgt 1 . 7 . 3709 . 2 1 14 HIS HE1 H 0.441 2.462 -3.555 . . . 1.0 . . . . . . . . . . . . B . 13 HIS HE1 . . . . . . . . . c19602_2mgt 1 . 7 . 3710 . 2 1 14 HIS N N 5.251 2.602 -0.764 . . . 1.0 . . . . . . . . . . . . B . 13 HIS N . . . . . . . . . c19602_2mgt 1 . 7 . 3711 . 2 1 14 HIS ND1 N 1.446 2.740 -1.681 . . . 1.0 . . . . . . . . . . . . B . 13 HIS ND1 . . . . . . . . . c19602_2mgt 1 . 7 . 3712 . 2 1 14 HIS NE2 N 1.932 4.003 -3.412 . . . 1.0 . . . . . . . . . . . . B . 13 HIS NE2 . . . . . . . . . c19602_2mgt 1 . 7 . 3713 . 2 1 14 HIS O O 4.954 4.515 2.258 . . . 1.0 . . . . . . . . . . . . B . 13 HIS O . . . . . . . . . c19602_2mgt 1 . 7 . 3714 . 2 1 15 HIS C C 7.582 1.554 3.380 . . . 1.0 . . . . . . . . . . . . B . 14 HIS C . . . . . . . . . c19602_2mgt 1 . 7 . 3715 . 2 1 15 HIS CA C 6.214 2.235 3.313 . . . 1.0 . . . . . . . . . . . . B . 14 HIS CA . . . . . . . . . c19602_2mgt 1 . 7 . 3716 . 2 1 15 HIS CB C 5.173 1.450 4.132 . . . 1.0 . . . . . . . . . . . . B . 14 HIS CB . . . . . . . . . c19602_2mgt 1 . 7 . 3717 . 2 1 15 HIS CD2 C 3.075 0.758 2.884 . . . 1.0 . . . . . . . . . . . . B . 14 HIS CD2 . . . . . . . . . c19602_2mgt 1 . 7 . 3718 . 2 1 15 HIS CE1 C 1.744 2.419 3.372 . . . 1.0 . . . . . . . . . . . . B . 14 HIS CE1 . . . . . . . . . c19602_2mgt 1 . 7 . 3719 . 2 1 15 HIS CG C 3.751 1.619 3.695 . . . 1.0 . . . . . . . . . . . . B . 14 HIS CG . . . . . . . . . c19602_2mgt 1 . 7 . 3720 . 2 1 15 HIS H H 5.895 1.673 1.292 . . . 1.0 . . . . . . . . . . . . B . 14 HIS H . . . . . . . . . c19602_2mgt 1 . 7 . 3721 . 2 1 15 HIS HA H 6.321 3.215 3.777 . . . 1.0 . . . . . . . . . . . . B . 14 HIS HA . . . . . . . . . c19602_2mgt 1 . 7 . 3722 . 2 1 15 HIS HB2 H 5.384 0.383 4.100 . . . 1.0 . . . . . . . . . . . . B . 14 HIS HB2 . . . . . . . . . c19602_2mgt 1 . 7 . 3723 . 2 1 15 HIS HB3 H 5.250 1.758 5.169 . . . 1.0 . . . . . . . . . . . . B . 14 HIS HB3 . . . . . . . . . c19602_2mgt 1 . 7 . 3724 . 2 1 15 HIS HD1 H 3.116 3.449 4.585 . . . 1.0 . . . . . . . . . . . . B . 14 HIS HD1 . . . . . . . . . c19602_2mgt 1 . 7 . 3725 . 2 1 15 HIS HD2 H 3.474 -0.152 2.467 . . . 1.0 . . . . . . . . . . . . B . 14 HIS HD2 . . . . . . . . . c19602_2mgt 1 . 7 . 3726 . 2 1 15 HIS HE1 H 0.869 3.043 3.439 . . . 1.0 . . . . . . . . . . . . B . 14 HIS HE1 . . . . . . . . . c19602_2mgt 1 . 7 . 3727 . 2 1 15 HIS N N 5.769 2.437 1.941 . . . 1.0 . . . . . . . . . . . . B . 14 HIS N . . . . . . . . . c19602_2mgt 1 . 7 . 3728 . 2 1 15 HIS ND1 N 2.909 2.659 3.990 . . . 1.0 . . . . . . . . . . . . B . 14 HIS ND1 . . . . . . . . . c19602_2mgt 1 . 7 . 3729 . 2 1 15 HIS NE2 N 1.797 1.273 2.687 . . . 1.0 . . . . . . . . . . . . B . 14 HIS NE2 . . . . . . . . . c19602_2mgt 1 . 7 . 3730 . 2 1 15 HIS O O 8.543 2.194 3.794 . . . 1.0 . . . . . . . . . . . . B . 14 HIS O . . . . . . . . . c19602_2mgt 1 . 7 . 3731 . 2 1 16 GLN C C 8.889 -1.875 2.710 . . . 1.0 . . . . . . . . . . . . B . 15 GLN C . . . . . . . . . c19602_2mgt 1 . 7 . 3732 . 2 1 16 GLN CA C 8.696 -0.633 3.576 . . . 1.0 . . . . . . . . . . . . B . 15 GLN CA . . . . . . . . . c19602_2mgt 1 . 7 . 3733 . 2 1 16 GLN CB C 8.327 -1.082 5.000 . . . 1.0 . . . . . . . . . . . . B . 15 GLN CB . . . . . . . . . c19602_2mgt 1 . 7 . 3734 . 2 1 16 GLN CD C 8.428 -0.584 7.461 . . . 1.0 . . . . . . . . . . . . B . 15 GLN CD . . . . . . . . . c19602_2mgt 1 . 7 . 3735 . 2 1 16 GLN CG C 8.521 0.007 6.060 . . . 1.0 . . . . . . . . . . . . B . 15 GLN CG . . . . . . . . . c19602_2mgt 1 . 7 . 3736 . 2 1 16 GLN H H 6.861 -0.197 2.661 . . . 1.0 . . . . . . . . . . . . B . 15 GLN H . . . . . . . . . c19602_2mgt 1 . 7 . 3737 . 2 1 16 GLN HA H 9.641 -0.098 3.605 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HA . . . . . . . . . c19602_2mgt 1 . 7 . 3738 . 2 1 16 GLN HB2 H 7.297 -1.435 5.017 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HB2 . . . . . . . . . c19602_2mgt 1 . 7 . 3739 . 2 1 16 GLN HB3 H 8.959 -1.922 5.269 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HB3 . . . . . . . . . c19602_2mgt 1 . 7 . 3740 . 2 1 16 GLN HE21 H 10.406 -0.336 7.842 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HE21 . . . . . . . . . c19602_2mgt 1 . 7 . 3741 . 2 1 16 GLN HE22 H 9.469 -1.064 9.129 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HE22 . . . . . . . . . c19602_2mgt 1 . 7 . 3742 . 2 1 16 GLN HG2 H 9.493 0.478 5.917 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HG2 . . . . . . . . . c19602_2mgt 1 . 7 . 3743 . 2 1 16 GLN HG3 H 7.746 0.763 5.952 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HG3 . . . . . . . . . c19602_2mgt 1 . 7 . 3744 . 2 1 16 GLN N N 7.667 0.257 3.056 . . . 1.0 . . . . . . . . . . . . B . 15 GLN N . . . . . . . . . c19602_2mgt 1 . 7 . 3745 . 2 1 16 GLN NE2 N 9.525 -0.666 8.203 . . . 1.0 . . . . . . . . . . . . B . 15 GLN NE2 . . . . . . . . . c19602_2mgt 1 . 7 . 3746 . 2 1 16 GLN O O 8.032 -2.267 1.925 . . . 1.0 . . . . . . . . . . . . B . 15 GLN O . . . . . . . . . c19602_2mgt 1 . 7 . 3747 . 2 1 16 GLN OE1 O 7.359 -0.995 7.877 . . . 1.0 . . . . . . . . . . . . B . 15 GLN OE1 . . . . . . . . . c19602_2mgt 1 . 7 . 3748 . 2 1 17 LYS C C 9.881 -4.978 2.626 . . . 1.0 . . . . . . . . . . . . B . 16 LYS C . . . . . . . . . c19602_2mgt 1 . 7 . 3749 . 2 1 17 LYS CA C 10.475 -3.667 2.127 . . . 1.0 . . . . . . . . . . . . B . 16 LYS CA . . . . . . . . . c19602_2mgt 1 . 7 . 3750 . 2 1 17 LYS CB C 11.998 -3.743 2.174 . . . 1.0 . . . . . . . . . . . . B . 16 LYS CB . . . . . . . . . c19602_2mgt 1 . 7 . 3751 . 2 1 17 LYS CD C 14.096 -2.582 1.503 . . . 1.0 . . . . . . . . . . . . B . 16 LYS CD . . . . . . . . . c19602_2mgt 1 . 7 . 3752 . 2 1 17 LYS CE C 14.644 -1.363 0.774 . . . 1.0 . . . . . . . . . . . . B . 16 LYS CE . . . . . . . . . c19602_2mgt 1 . 7 . 3753 . 2 1 17 LYS CG C 12.582 -2.556 1.411 . . . 1.0 . . . . . . . . . . . . B . 16 LYS CG . . . . . . . . . c19602_2mgt 1 . 7 . 3754 . 2 1 17 LYS H H 10.674 -2.165 3.602 . . . 1.0 . . . . . . . . . . . . B . 16 LYS H . . . . . . . . . c19602_2mgt 1 . 7 . 3755 . 2 1 17 LYS HA H 10.169 -3.523 1.095 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HA . . . . . . . . . c19602_2mgt 1 . 7 . 3756 . 2 1 17 LYS HB2 H 12.338 -3.732 3.211 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HB2 . . . . . . . . . c19602_2mgt 1 . 7 . 3757 . 2 1 17 LYS HB3 H 12.332 -4.669 1.703 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HB3 . . . . . . . . . c19602_2mgt 1 . 7 . 3758 . 2 1 17 LYS HD2 H 14.386 -2.538 2.551 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HD2 . . . . . . . . . c19602_2mgt 1 . 7 . 3759 . 2 1 17 LYS HD3 H 14.482 -3.496 1.049 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HD3 . . . . . . . . . c19602_2mgt 1 . 7 . 3760 . 2 1 17 LYS HE2 H 14.265 -1.346 -0.248 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HE2 . . . . . . . . . c19602_2mgt 1 . 7 . 3761 . 2 1 17 LYS HE3 H 14.315 -0.462 1.293 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HE3 . . . . . . . . . c19602_2mgt 1 . 7 . 3762 . 2 1 17 LYS HG2 H 12.276 -2.621 0.367 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HG2 . . . . . . . . . c19602_2mgt 1 . 7 . 3763 . 2 1 17 LYS HG3 H 12.222 -1.616 1.830 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HG3 . . . . . . . . . c19602_2mgt 1 . 7 . 3764 . 2 1 17 LYS HZ1 H 16.458 -1.557 1.685 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HZ1 . . . . . . . . . c19602_2mgt 1 . 7 . 3765 . 2 1 17 LYS HZ2 H 16.411 -2.162 0.156 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HZ2 . . . . . . . . . c19602_2mgt 1 . 7 . 3766 . 2 1 17 LYS HZ3 H 16.468 -0.533 0.393 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HZ3 . . . . . . . . . c19602_2mgt 1 . 7 . 3767 . 2 1 17 LYS N N 10.038 -2.520 2.902 . . . 1.0 . . . . . . . . . . . . B . 16 LYS N . . . . . . . . . c19602_2mgt 1 . 7 . 3768 . 2 1 17 LYS NZ N 16.107 -1.405 0.750 . . . 1.0 . . . . . . . . . . . . B . 16 LYS NZ . . . . . . . . . c19602_2mgt 1 . 7 . 3769 . 2 1 17 LYS O O 9.662 -5.872 1.819 . . . 1.0 . . . . . . . . . . . . B . 16 LYS O . . . . . . . . . c19602_2mgt 1 . 7 . 3770 . 2 1 18 NH2 HN1 H 9.802 -4.351 4.556 . . . 1.0 . . . . . . . . . . . . B . 17 NH2 HN1 . . . . . . . . . c19602_2mgt 1 . 7 . 3771 . 2 1 18 NH2 HN2 H 9.219 -5.974 4.269 . . . 1.0 . . . . . . . . . . . . B . 17 NH2 HN2 . . . . . . . . . c19602_2mgt 1 . 7 . 3772 . 2 1 18 NH2 N N 9.607 -5.110 3.921 . . . 1.0 . . . . . . . . . . . . B . 17 NH2 N . . . . . . . . . c19602_2mgt 1 . 7 . 3773 . 3 2 1 ZN ZN Zn 0.517 0.080 1.591 . . . 1.0 . . . . . . . . . . . . A . 101 ZN ZN . . . . . . . . . c19602_2mgt 1 . 8 . 3774 . 1 1 1 ACE C C -10.225 -3.658 -2.775 . . . 1.0 . . . . . . . . . . . . A . 0 ACE C . . . . . . . . . c19602_2mgt 1 . 8 . 3775 . 1 1 1 ACE CH3 C -8.881 -3.872 -2.105 . . . 1.0 . . . . . . . . . . . . A . 0 ACE CH3 . . . . . . . . . c19602_2mgt 1 . 8 . 3776 . 1 1 1 ACE H1 H -8.202 -4.347 -2.812 . . . 1.0 . . . . . . . . . . . . A . 0 ACE H1 . . . . . . . . . c19602_2mgt 1 . 8 . 3777 . 1 1 1 ACE H2 H -8.476 -2.907 -1.806 . . . 1.0 . . . . . . . . . . . . A . 0 ACE H2 . . . . . . . . . c19602_2mgt 1 . 8 . 3778 . 1 1 1 ACE H3 H -8.985 -4.513 -1.229 . . . 1.0 . . . . . . . . . . . . A . 0 ACE H3 . . . . . . . . . c19602_2mgt 1 . 8 . 3779 . 1 1 1 ACE O O -10.263 -3.141 -3.883 . . . 1.0 . . . . . . . . . . . . A . 0 ACE O . . . . . . . . . c19602_2mgt 1 . 8 . 3780 . 1 1 2 ASP C C -13.217 -2.726 -2.999 . . . 1.0 . . . . . . . . . . . . A . 1 ASP C . . . . . . . . . c19602_2mgt 1 . 8 . 3781 . 1 1 2 ASP CA C -12.645 -4.125 -2.733 . . . 1.0 . . . . . . . . . . . . A . 1 ASP CA . . . . . . . . . c19602_2mgt 1 . 8 . 3782 . 1 1 2 ASP CB C -13.569 -4.973 -1.850 . . . 1.0 . . . . . . . . . . . . A . 1 ASP CB . . . . . . . . . c19602_2mgt 1 . 8 . 3783 . 1 1 2 ASP CG C -14.633 -5.731 -2.624 . . . 1.0 . . . . . . . . . . . . A . 1 ASP CG . . . . . . . . . c19602_2mgt 1 . 8 . 3784 . 1 1 2 ASP H H -11.225 -4.449 -1.200 . . . 1.0 . . . . . . . . . . . . A . 1 ASP H . . . . . . . . . c19602_2mgt 1 . 8 . 3785 . 1 1 2 ASP HA H -12.537 -4.643 -3.684 . . . 1.0 . . . . . . . . . . . . A . 1 ASP HA . . . . . . . . . c19602_2mgt 1 . 8 . 3786 . 1 1 2 ASP HB2 H -12.976 -5.735 -1.346 . . . 1.0 . . . . . . . . . . . . A . 1 ASP HB2 . . . . . . . . . c19602_2mgt 1 . 8 . 3787 . 1 1 2 ASP HB3 H -14.046 -4.350 -1.095 . . . 1.0 . . . . . . . . . . . . A . 1 ASP HB3 . . . . . . . . . c19602_2mgt 1 . 8 . 3788 . 1 1 2 ASP N N -11.321 -4.065 -2.128 . . . 1.0 . . . . . . . . . . . . A . 1 ASP N . . . . . . . . . c19602_2mgt 1 . 8 . 3789 . 1 1 2 ASP O O -12.883 -1.776 -2.293 . . . 1.0 . . . . . . . . . . . . A . 1 ASP O . . . . . . . . . c19602_2mgt 1 . 8 . 3790 . 1 1 2 ASP OD1 O -14.969 -5.327 -3.761 . . . 1.0 . . . . . . . . . . . . A . 1 ASP OD1 . . . . . . . . . c19602_2mgt 1 . 8 . 3791 . 1 1 2 ASP OD2 O -15.112 -6.729 -2.080 . . . 1.0 . . . . . . . . . . . . A . 1 ASP OD2 . . . . . . . . . c19602_2mgt 1 . 8 . 3792 . 1 1 3 ALA C C -15.247 -0.478 -3.521 . . . 1.0 . . . . . . . . . . . . A . 2 ALA C . . . . . . . . . c19602_2mgt 1 . 8 . 3793 . 1 1 3 ALA CA C -14.606 -1.378 -4.571 . . . 1.0 . . . . . . . . . . . . A . 2 ALA CA . . . . . . . . . c19602_2mgt 1 . 8 . 3794 . 1 1 3 ALA CB C -15.643 -1.708 -5.649 . . . 1.0 . . . . . . . . . . . . A . 2 ALA CB . . . . . . . . . c19602_2mgt 1 . 8 . 3795 . 1 1 3 ALA H H -14.334 -3.471 -4.510 . . . 1.0 . . . . . . . . . . . . A . 2 ALA H . . . . . . . . . c19602_2mgt 1 . 8 . 3796 . 1 1 3 ALA HA H -13.784 -0.830 -5.024 . . . 1.0 . . . . . . . . . . . . A . 2 ALA HA . . . . . . . . . c19602_2mgt 1 . 8 . 3797 . 1 1 3 ALA HB1 H -15.183 -2.277 -6.452 . . . 1.0 . . . . . . . . . . . . A . 2 ALA HB1 . . . . . . . . . c19602_2mgt 1 . 8 . 3798 . 1 1 3 ALA HB2 H -16.457 -2.289 -5.217 . . . 1.0 . . . . . . . . . . . . A . 2 ALA HB2 . . . . . . . . . c19602_2mgt 1 . 8 . 3799 . 1 1 3 ALA HB3 H -16.053 -0.787 -6.058 . . . 1.0 . . . . . . . . . . . . A . 2 ALA HB3 . . . . . . . . . c19602_2mgt 1 . 8 . 3800 . 1 1 3 ALA N N -14.078 -2.623 -4.023 . . . 1.0 . . . . . . . . . . . . A . 2 ALA N . . . . . . . . . c19602_2mgt 1 . 8 . 3801 . 1 1 3 ALA O O -14.975 0.716 -3.502 . . . 1.0 . . . . . . . . . . . . A . 2 ALA O . . . . . . . . . c19602_2mgt 1 . 8 . 3802 . 1 1 4 GLU C C -15.825 0.361 -0.580 . . . 1.0 . . . . . . . . . . . . A . 3 GLU C . . . . . . . . . c19602_2mgt 1 . 8 . 3803 . 1 1 4 GLU CA C -16.754 -0.336 -1.569 . . . 1.0 . . . . . . . . . . . . A . 3 GLU CA . . . . . . . . . c19602_2mgt 1 . 8 . 3804 . 1 1 4 GLU CB C -17.666 -1.314 -0.836 . . . 1.0 . . . . . . . . . . . . A . 3 GLU CB . . . . . . . . . c19602_2mgt 1 . 8 . 3805 . 1 1 4 GLU CD C -17.745 -3.519 0.349 . . . 1.0 . . . . . . . . . . . . A . 3 GLU CD . . . . . . . . . c19602_2mgt 1 . 8 . 3806 . 1 1 4 GLU CG C -16.850 -2.396 -0.118 . . . 1.0 . . . . . . . . . . . . A . 3 GLU CG . . . . . . . . . c19602_2mgt 1 . 8 . 3807 . 1 1 4 GLU H H -16.236 -2.043 -2.712 . . . 1.0 . . . . . . . . . . . . A . 3 GLU H . . . . . . . . . c19602_2mgt 1 . 8 . 3808 . 1 1 4 GLU HA H -17.376 0.433 -2.014 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HA . . . . . . . . . c19602_2mgt 1 . 8 . 3809 . 1 1 4 GLU HB2 H -18.262 -0.774 -0.102 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HB2 . . . . . . . . . c19602_2mgt 1 . 8 . 3810 . 1 1 4 GLU HB3 H -18.338 -1.769 -1.564 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HB3 . . . . . . . . . c19602_2mgt 1 . 8 . 3811 . 1 1 4 GLU HG2 H -16.103 -2.818 -0.792 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HG2 . . . . . . . . . c19602_2mgt 1 . 8 . 3812 . 1 1 4 GLU HG3 H -16.343 -1.952 0.736 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HG3 . . . . . . . . . c19602_2mgt 1 . 8 . 3813 . 1 1 4 GLU N N -16.062 -1.051 -2.635 . . . 1.0 . . . . . . . . . . . . A . 3 GLU N . . . . . . . . . c19602_2mgt 1 . 8 . 3814 . 1 1 4 GLU O O -16.304 1.215 0.149 . . . 1.0 . . . . . . . . . . . . A . 3 GLU O . . . . . . . . . c19602_2mgt 1 . 8 . 3815 . 1 1 4 GLU OE1 O -18.304 -4.201 -0.517 . . . 1.0 . . . . . . . . . . . . A . 3 GLU OE1 . . . . . . . . . c19602_2mgt 1 . 8 . 3816 . 1 1 4 GLU OE2 O -17.852 -3.704 1.581 . . . 1.0 . . . . . . . . . . . . A . 3 GLU OE2 . . . . . . . . . c19602_2mgt 1 . 8 . 3817 . 1 1 5 PHE C C -12.612 1.603 -0.477 . . . 1.0 . . . . . . . . . . . . A . 4 PHE C . . . . . . . . . c19602_2mgt 1 . 8 . 3818 . 1 1 5 PHE CA C -13.543 0.675 0.303 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CA . . . . . . . . . c19602_2mgt 1 . 8 . 3819 . 1 1 5 PHE CB C -12.731 -0.381 1.044 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CB . . . . . . . . . c19602_2mgt 1 . 8 . 3820 . 1 1 5 PHE CD1 C -14.259 -0.966 2.960 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CD1 . . . . . . . . . c19602_2mgt 1 . 8 . 3821 . 1 1 5 PHE CD2 C -13.656 -2.698 1.357 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CD2 . . . . . . . . . c19602_2mgt 1 . 8 . 3822 . 1 1 5 PHE CE1 C -15.036 -1.893 3.671 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CE1 . . . . . . . . . c19602_2mgt 1 . 8 . 3823 . 1 1 5 PHE CE2 C -14.442 -3.625 2.058 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CE2 . . . . . . . . . c19602_2mgt 1 . 8 . 3824 . 1 1 5 PHE CG C -13.564 -1.373 1.810 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CG . . . . . . . . . c19602_2mgt 1 . 8 . 3825 . 1 1 5 PHE CZ C -15.134 -3.220 3.215 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CZ . . . . . . . . . c19602_2mgt 1 . 8 . 3826 . 1 1 5 PHE H H -14.218 -0.737 -1.130 . . . 1.0 . . . . . . . . . . . . A . 4 PHE H . . . . . . . . . c19602_2mgt 1 . 8 . 3827 . 1 1 5 PHE HA H -14.054 1.281 1.043 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HA . . . . . . . . . c19602_2mgt 1 . 8 . 3828 . 1 1 5 PHE HB2 H -12.121 -0.914 0.320 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HB2 . . . . . . . . . c19602_2mgt 1 . 8 . 3829 . 1 1 5 PHE HB3 H -12.080 0.119 1.758 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HB3 . . . . . . . . . c19602_2mgt 1 . 8 . 3830 . 1 1 5 PHE HD1 H -14.199 0.064 3.286 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HD1 . . . . . . . . . c19602_2mgt 1 . 8 . 3831 . 1 1 5 PHE HD2 H -13.136 -2.989 0.458 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HD2 . . . . . . . . . c19602_2mgt 1 . 8 . 3832 . 1 1 5 PHE HE1 H -15.565 -1.586 4.559 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HE1 . . . . . . . . . c19602_2mgt 1 . 8 . 3833 . 1 1 5 PHE HE2 H -14.519 -4.638 1.699 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HE2 . . . . . . . . . c19602_2mgt 1 . 8 . 3834 . 1 1 5 PHE HZ H -15.746 -3.927 3.754 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HZ . . . . . . . . . c19602_2mgt 1 . 8 . 3835 . 1 1 5 PHE N N -14.533 0.019 -0.541 . . . 1.0 . . . . . . . . . . . . A . 4 PHE N . . . . . . . . . c19602_2mgt 1 . 8 . 3836 . 1 1 5 PHE O O -11.918 2.397 0.148 . . . 1.0 . . . . . . . . . . . . A . 4 PHE O . . . . . . . . . c19602_2mgt 1 . 8 . 3837 . 1 1 6 ARG C C -12.469 3.902 -2.669 . . . 1.0 . . . . . . . . . . . . A . 5 ARG C . . . . . . . . . c19602_2mgt 1 . 8 . 3838 . 1 1 6 ARG CA C -11.861 2.485 -2.665 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CA . . . . . . . . . c19602_2mgt 1 . 8 . 3839 . 1 1 6 ARG CB C -11.750 1.902 -4.083 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CB . . . . . . . . . c19602_2mgt 1 . 8 . 3840 . 1 1 6 ARG CD C -9.559 0.640 -3.575 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CD . . . . . . . . . c19602_2mgt 1 . 8 . 3841 . 1 1 6 ARG CG C -10.969 0.582 -4.175 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CG . . . . . . . . . c19602_2mgt 1 . 8 . 3842 . 1 1 6 ARG CZ C -7.961 1.544 -5.278 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CZ . . . . . . . . . c19602_2mgt 1 . 8 . 3843 . 1 1 6 ARG H H -13.202 0.885 -2.284 . . . 1.0 . . . . . . . . . . . . A . 5 ARG H . . . . . . . . . c19602_2mgt 1 . 8 . 3844 . 1 1 6 ARG HA H -10.857 2.587 -2.255 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HA . . . . . . . . . c19602_2mgt 1 . 8 . 3845 . 1 1 6 ARG HB2 H -12.752 1.745 -4.476 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HB2 . . . . . . . . . c19602_2mgt 1 . 8 . 3846 . 1 1 6 ARG HB3 H -11.249 2.628 -4.721 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HB3 . . . . . . . . . c19602_2mgt 1 . 8 . 3847 . 1 1 6 ARG HD2 H -9.622 0.847 -2.508 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HD2 . . . . . . . . . c19602_2mgt 1 . 8 . 3848 . 1 1 6 ARG HD3 H -9.074 -0.329 -3.693 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HD3 . . . . . . . . . c19602_2mgt 1 . 8 . 3849 . 1 1 6 ARG HE H -8.833 2.612 -3.807 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HE . . . . . . . . . c19602_2mgt 1 . 8 . 3850 . 1 1 6 ARG HG2 H -11.524 -0.205 -3.675 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HG2 . . . . . . . . . c19602_2mgt 1 . 8 . 3851 . 1 1 6 ARG HG3 H -10.888 0.317 -5.228 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HG3 . . . . . . . . . c19602_2mgt 1 . 8 . 3852 . 1 1 6 ARG HH11 H -8.321 -0.438 -5.562 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH11 . . . . . . . . . c19602_2mgt 1 . 8 . 3853 . 1 1 6 ARG HH12 H -7.208 0.295 -6.695 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH12 . . . . . . . . . c19602_2mgt 1 . 8 . 3854 . 1 1 6 ARG HH21 H -7.418 3.506 -5.317 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH21 . . . . . . . . . c19602_2mgt 1 . 8 . 3855 . 1 1 6 ARG HH22 H -6.718 2.509 -6.568 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH22 . . . . . . . . . c19602_2mgt 1 . 8 . 3856 . 1 1 6 ARG N N -12.610 1.557 -1.816 . . . 1.0 . . . . . . . . . . . . A . 5 ARG N . . . . . . . . . c19602_2mgt 1 . 8 . 3857 . 1 1 6 ARG NE N -8.753 1.689 -4.210 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NE . . . . . . . . . c19602_2mgt 1 . 8 . 3858 . 1 1 6 ARG NH1 N -7.810 0.370 -5.888 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NH1 . . . . . . . . . c19602_2mgt 1 . 8 . 3859 . 1 1 6 ARG NH2 N -7.308 2.602 -5.753 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NH2 . . . . . . . . . c19602_2mgt 1 . 8 . 3860 . 1 1 6 ARG O O -12.183 4.690 -3.567 . . . 1.0 . . . . . . . . . . . . A . 5 ARG O . . . . . . . . . c19602_2mgt 1 . 8 . 3861 . 1 1 7 ARG C C -12.995 6.609 -1.136 . . . 1.0 . . . . . . . . . . . . A . 6 ARG C . . . . . . . . . c19602_2mgt 1 . 8 . 3862 . 1 1 7 ARG CA C -13.978 5.493 -1.483 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CA . . . . . . . . . c19602_2mgt 1 . 8 . 3863 . 1 1 7 ARG CB C -15.022 5.366 -0.363 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CB . . . . . . . . . c19602_2mgt 1 . 8 . 3864 . 1 1 7 ARG CD C -16.828 4.229 -1.839 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CD . . . . . . . . . c19602_2mgt 1 . 8 . 3865 . 1 1 7 ARG CG C -16.002 4.208 -0.544 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CG . . . . . . . . . c19602_2mgt 1 . 8 . 3866 . 1 1 7 ARG CZ C -15.934 3.891 -4.168 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CZ . . . . . . . . . c19602_2mgt 1 . 8 . 3867 . 1 1 7 ARG H H -13.474 3.529 -0.959 . . . 1.0 . . . . . . . . . . . . A . 6 ARG H . . . . . . . . . c19602_2mgt 1 . 8 . 3868 . 1 1 7 ARG HA H -14.488 5.733 -2.409 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HA . . . . . . . . . c19602_2mgt 1 . 8 . 3869 . 1 1 7 ARG HB2 H -14.502 5.214 0.585 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HB2 . . . . . . . . . c19602_2mgt 1 . 8 . 3870 . 1 1 7 ARG HB3 H -15.594 6.290 -0.294 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HB3 . . . . . . . . . c19602_2mgt 1 . 8 . 3871 . 1 1 7 ARG HD2 H -17.794 3.767 -1.640 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HD2 . . . . . . . . . c19602_2mgt 1 . 8 . 3872 . 1 1 7 ARG HD3 H -17.019 5.257 -2.135 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HD3 . . . . . . . . . c19602_2mgt 1 . 8 . 3873 . 1 1 7 ARG HE H -15.976 2.496 -2.709 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HE . . . . . . . . . c19602_2mgt 1 . 8 . 3874 . 1 1 7 ARG HG2 H -15.416 3.297 -0.496 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HG2 . . . . . . . . . c19602_2mgt 1 . 8 . 3875 . 1 1 7 ARG HG3 H -16.690 4.217 0.300 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HG3 . . . . . . . . . c19602_2mgt 1 . 8 . 3876 . 1 1 7 ARG HH11 H -16.525 5.821 -3.904 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH11 . . . . . . . . . c19602_2mgt 1 . 8 . 3877 . 1 1 7 ARG HH12 H -15.961 5.417 -5.510 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH12 . . . . . . . . . c19602_2mgt 1 . 8 . 3878 . 1 1 7 ARG HH21 H -15.297 2.075 -4.822 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH21 . . . . . . . . . c19602_2mgt 1 . 8 . 3879 . 1 1 7 ARG HH22 H -15.297 3.346 -6.020 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH22 . . . . . . . . . c19602_2mgt 1 . 8 . 3880 . 1 1 7 ARG N N -13.301 4.224 -1.669 . . . 1.0 . . . . . . . . . . . . A . 6 ARG N . . . . . . . . . c19602_2mgt 1 . 8 . 3881 . 1 1 7 ARG NE N -16.191 3.461 -2.922 . . . 1.0 . . . . . . . . . . . . A . 6 ARG NE . . . . . . . . . c19602_2mgt 1 . 8 . 3882 . 1 1 7 ARG NH1 N -16.149 5.146 -4.555 . . . 1.0 . . . . . . . . . . . . A . 6 ARG NH1 . . . . . . . . . c19602_2mgt 1 . 8 . 3883 . 1 1 7 ARG NH2 N -15.450 3.042 -5.069 . . . 1.0 . . . . . . . . . . . . A . 6 ARG NH2 . . . . . . . . . c19602_2mgt 1 . 8 . 3884 . 1 1 7 ARG O O -11.840 6.357 -0.801 . . . 1.0 . . . . . . . . . . . . A . 6 ARG O . . . . . . . . . c19602_2mgt 1 . 8 . 3885 . 1 1 8 ASP C C -12.286 9.058 0.700 . . . 1.0 . . . . . . . . . . . . A . 7 ASP C . . . . . . . . . c19602_2mgt 1 . 8 . 3886 . 1 1 8 ASP CA C -12.787 9.055 -0.758 . . . 1.0 . . . . . . . . . . . . A . 7 ASP CA . . . . . . . . . c19602_2mgt 1 . 8 . 3887 . 1 1 8 ASP CB C -13.764 10.217 -0.957 . . . 1.0 . . . . . . . . . . . . A . 7 ASP CB . . . . . . . . . c19602_2mgt 1 . 8 . 3888 . 1 1 8 ASP CG C -13.081 11.551 -0.745 . . . 1.0 . . . . . . . . . . . . A . 7 ASP CG . . . . . . . . . c19602_2mgt 1 . 8 . 3889 . 1 1 8 ASP H H -14.471 7.960 -1.406 . . . 1.0 . . . . . . . . . . . . A . 7 ASP H . . . . . . . . . c19602_2mgt 1 . 8 . 3890 . 1 1 8 ASP HA H -11.935 9.178 -1.429 . . . 1.0 . . . . . . . . . . . . A . 7 ASP HA . . . . . . . . . c19602_2mgt 1 . 8 . 3891 . 1 1 8 ASP HB2 H -14.188 10.191 -1.959 . . . 1.0 . . . . . . . . . . . . A . 7 ASP HB2 . . . . . . . . . c19602_2mgt 1 . 8 . 3892 . 1 1 8 ASP HB3 H -14.578 10.127 -0.240 . . . 1.0 . . . . . . . . . . . . A . 7 ASP HB3 . . . . . . . . . c19602_2mgt 1 . 8 . 3893 . 1 1 8 ASP N N -13.502 7.845 -1.142 . . . 1.0 . . . . . . . . . . . . A . 7 ASP N . . . . . . . . . c19602_2mgt 1 . 8 . 3894 . 1 1 8 ASP O O -11.478 9.904 1.081 . . . 1.0 . . . . . . . . . . . . A . 7 ASP O . . . . . . . . . c19602_2mgt 1 . 8 . 3895 . 1 1 8 ASP OD1 O -12.020 11.759 -1.373 . . . 1.0 . . . . . . . . . . . . A . 7 ASP OD1 . . . . . . . . . c19602_2mgt 1 . 8 . 3896 . 1 1 8 ASP OD2 O -13.594 12.338 0.060 . . . 1.0 . . . . . . . . . . . . A . 7 ASP OD2 . . . . . . . . . c19602_2mgt 1 . 8 . 3897 . 1 1 9 SER C C -11.254 7.872 3.507 . . . 1.0 . . . . . . . . . . . . A . 8 SER C . . . . . . . . . c19602_2mgt 1 . 8 . 3898 . 1 1 9 SER CA C -12.663 8.139 2.969 . . . 1.0 . . . . . . . . . . . . A . 8 SER CA . . . . . . . . . c19602_2mgt 1 . 8 . 3899 . 1 1 9 SER CB C -13.609 7.081 3.541 . . . 1.0 . . . . . . . . . . . . A . 8 SER CB . . . . . . . . . c19602_2mgt 1 . 8 . 3900 . 1 1 9 SER H H -13.460 7.483 1.148 . . . 1.0 . . . . . . . . . . . . A . 8 SER H . . . . . . . . . c19602_2mgt 1 . 8 . 3901 . 1 1 9 SER HA H -12.982 9.118 3.324 . . . 1.0 . . . . . . . . . . . . A . 8 SER HA . . . . . . . . . c19602_2mgt 1 . 8 . 3902 . 1 1 9 SER HB2 H -13.211 6.090 3.321 . . . 1.0 . . . . . . . . . . . . A . 8 SER HB2 . . . . . . . . . c19602_2mgt 1 . 8 . 3903 . 1 1 9 SER HB3 H -13.686 7.208 4.620 . . . 1.0 . . . . . . . . . . . . A . 8 SER HB3 . . . . . . . . . c19602_2mgt 1 . 8 . 3904 . 1 1 9 SER HG H -15.251 8.055 3.167 . . . 1.0 . . . . . . . . . . . . A . 8 SER HG . . . . . . . . . c19602_2mgt 1 . 8 . 3905 . 1 1 9 SER N N -12.785 8.131 1.522 . . . 1.0 . . . . . . . . . . . . A . 8 SER N . . . . . . . . . c19602_2mgt 1 . 8 . 3906 . 1 1 9 SER O O -11.084 7.988 4.717 . . . 1.0 . . . . . . . . . . . . A . 8 SER O . . . . . . . . . c19602_2mgt 1 . 8 . 3907 . 1 1 9 SER OG O -14.894 7.181 2.977 . . . 1.0 . . . . . . . . . . . . A . 8 SER OG . . . . . . . . . c19602_2mgt 1 . 8 . 3908 . 1 1 10 GLY C C -7.906 7.476 2.087 . . . 1.0 . . . . . . . . . . . . A . 9 GLY C . . . . . . . . . c19602_2mgt 1 . 8 . 3909 . 1 1 10 GLY CA C -8.952 7.084 3.129 . . . 1.0 . . . . . . . . . . . . A . 9 GLY CA . . . . . . . . . c19602_2mgt 1 . 8 . 3910 . 1 1 10 GLY H H -10.425 7.442 1.678 . . . 1.0 . . . . . . . . . . . . A . 9 GLY H . . . . . . . . . c19602_2mgt 1 . 8 . 3911 . 1 1 10 GLY HA2 H -8.708 7.546 4.082 . . . 1.0 . . . . . . . . . . . . A . 9 GLY HA2 . . . . . . . . . c19602_2mgt 1 . 8 . 3912 . 1 1 10 GLY HA3 H -8.972 6.008 3.288 . . . 1.0 . . . . . . . . . . . . A . 9 GLY HA3 . . . . . . . . . c19602_2mgt 1 . 8 . 3913 . 1 1 10 GLY N N -10.271 7.488 2.676 . . . 1.0 . . . . . . . . . . . . A . 9 GLY N . . . . . . . . . c19602_2mgt 1 . 8 . 3914 . 1 1 10 GLY O O -7.737 8.661 1.825 . . . 1.0 . . . . . . . . . . . . A . 9 GLY O . . . . . . . . . c19602_2mgt 1 . 8 . 3915 . 1 1 11 TYR C C -5.910 4.500 1.074 . . . 1.0 . . . . . . . . . . . . A . 10 TYR C . . . . . . . . . c19602_2mgt 1 . 8 . 3916 . 1 1 11 TYR CA C -7.137 5.126 1.729 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CA . . . . . . . . . c19602_2mgt 1 . 8 . 3917 . 1 1 11 TYR CB C -8.396 4.453 1.171 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CB . . . . . . . . . c19602_2mgt 1 . 8 . 3918 . 1 1 11 TYR CD1 C -8.509 2.695 2.998 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CD1 . . . . . . . . . c19602_2mgt 1 . 8 . 3919 . 1 1 11 TYR CD2 C -10.545 3.797 2.267 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CD2 . . . . . . . . . c19602_2mgt 1 . 8 . 3920 . 1 1 11 TYR CE1 C -9.236 1.916 3.905 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CE1 . . . . . . . . . c19602_2mgt 1 . 8 . 3921 . 1 1 11 TYR CE2 C -11.284 2.995 3.142 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CE2 . . . . . . . . . c19602_2mgt 1 . 8 . 3922 . 1 1 11 TYR CG C -9.159 3.627 2.171 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CG . . . . . . . . . c19602_2mgt 1 . 8 . 3923 . 1 1 11 TYR CZ C -10.637 2.050 3.968 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CZ . . . . . . . . . c19602_2mgt 1 . 8 . 3924 . 1 1 11 TYR H H -6.669 6.822 0.654 . . . 1.0 . . . . . . . . . . . . A . 10 TYR H . . . . . . . . . c19602_2mgt 1 . 8 . 3925 . 1 1 11 TYR HA H -7.077 4.975 2.806 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HA . . . . . . . . . c19602_2mgt 1 . 8 . 3926 . 1 1 11 TYR HB2 H -9.076 5.205 0.783 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HB2 . . . . . . . . . c19602_2mgt 1 . 8 . 3927 . 1 1 11 TYR HB3 H -8.132 3.825 0.324 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HB3 . . . . . . . . . c19602_2mgt 1 . 8 . 3928 . 1 1 11 TYR HD1 H -7.448 2.565 2.934 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HD1 . . . . . . . . . c19602_2mgt 1 . 8 . 3929 . 1 1 11 TYR HD2 H -11.048 4.521 1.642 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HD2 . . . . . . . . . c19602_2mgt 1 . 8 . 3930 . 1 1 11 TYR HE1 H -8.724 1.215 4.539 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HE1 . . . . . . . . . c19602_2mgt 1 . 8 . 3931 . 1 1 11 TYR HE2 H -12.347 3.117 3.169 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HE2 . . . . . . . . . c19602_2mgt 1 . 8 . 3932 . 1 1 11 TYR HH H -12.293 1.476 4.810 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HH . . . . . . . . . c19602_2mgt 1 . 8 . 3933 . 1 1 11 TYR N N -7.175 6.544 1.472 . . . 1.0 . . . . . . . . . . . . A . 10 TYR N . . . . . . . . . c19602_2mgt 1 . 8 . 3934 . 1 1 11 TYR O O -5.514 4.858 -0.033 . . . 1.0 . . . . . . . . . . . . A . 10 TYR O . . . . . . . . . c19602_2mgt 1 . 8 . 3935 . 1 1 11 TYR OH O -11.353 1.283 4.833 . . . 1.0 . . . . . . . . . . . . A . 10 TYR OH . . . . . . . . . c19602_2mgt 1 . 8 . 3936 . 1 1 12 GLU C C -5.603 1.104 1.721 . . . 1.0 . . . . . . . . . . . . A . 11 GLU C . . . . . . . . . c19602_2mgt 1 . 8 . 3937 . 1 1 12 GLU CA C -4.879 2.299 1.089 . . . 1.0 . . . . . . . . . . . . A . 11 GLU CA . . . . . . . . . c19602_2mgt 1 . 8 . 3938 . 1 1 12 GLU CB C -3.371 2.239 1.296 . . . 1.0 . . . . . . . . . . . . A . 11 GLU CB . . . . . . . . . c19602_2mgt 1 . 8 . 3939 . 1 1 12 GLU CD C -1.410 0.715 0.868 . . . 1.0 . . . . . . . . . . . . A . 11 GLU CD . . . . . . . . . c19602_2mgt 1 . 8 . 3940 . 1 1 12 GLU CG C -2.792 1.135 0.411 . . . 1.0 . . . . . . . . . . . . A . 11 GLU CG . . . . . . . . . c19602_2mgt 1 . 8 . 3941 . 1 1 12 GLU H H -5.699 3.327 2.693 . . . 1.0 . . . . . . . . . . . . A . 11 GLU H . . . . . . . . . c19602_2mgt 1 . 8 . 3942 . 1 1 12 GLU HA H -5.092 2.352 0.022 . . . 1.0 . . . . . . . . . . . . A . 11 GLU HA . . . . . . . . . c19602_2mgt 1 . 8 . 3943 . 1 1 12 GLU HB2 H -2.926 3.194 1.019 . . . 1.0 . . . . . . . . . . . . A . 11 GLU HB2 . . . . . . . . . c19602_2mgt 1 . 8 . 3944 . 1 1 12 GLU HB3 H -3.152 2.048 2.346 . . . 1.0 . . . . . . . . . . . . A . 11 GLU HB3 . . . . . . . . . c19602_2mgt 1 . 8 . 3945 . 1 1 12 GLU HG2 H -3.438 0.257 0.446 . . . 1.0 . . . . . . . . . . . . A . 11 GLU HG2 . . . . . . . . . c19602_2mgt 1 . 8 . 3946 . 1 1 12 GLU HG3 H -2.747 1.484 -0.620 . . . 1.0 . . . . . . . . . . . . A . 11 GLU HG3 . . . . . . . . . c19602_2mgt 1 . 8 . 3947 . 1 1 12 GLU N N -5.400 3.471 1.742 . . . 1.0 . . . . . . . . . . . . A . 11 GLU N . . . . . . . . . c19602_2mgt 1 . 8 . 3948 . 1 1 12 GLU O O -5.295 0.692 2.833 . . . 1.0 . . . . . . . . . . . . A . 11 GLU O . . . . . . . . . c19602_2mgt 1 . 8 . 3949 . 1 1 12 GLU OE1 O -0.678 1.537 1.447 . . . 1.0 . . . . . . . . . . . . A . 11 GLU OE1 . . . . . . . . . c19602_2mgt 1 . 8 . 3950 . 1 1 12 GLU OE2 O -1.100 -0.473 0.648 . . . 1.0 . . . . . . . . . . . . A . 11 GLU OE2 . . . . . . . . . c19602_2mgt 1 . 8 . 3951 . 1 1 13 VAL C C -6.707 -1.786 1.799 . . . 1.0 . . . . . . . . . . . . A . 12 VAL C . . . . . . . . . c19602_2mgt 1 . 8 . 3952 . 1 1 13 VAL CA C -7.476 -0.497 1.505 . . . 1.0 . . . . . . . . . . . . A . 12 VAL CA . . . . . . . . . c19602_2mgt 1 . 8 . 3953 . 1 1 13 VAL CB C -8.587 -0.733 0.463 . . . 1.0 . . . . . . . . . . . . A . 12 VAL CB . . . . . . . . . c19602_2mgt 1 . 8 . 3954 . 1 1 13 VAL CG1 C -9.446 -1.973 0.752 . . . 1.0 . . . . . . . . . . . . A . 12 VAL CG1 . . . . . . . . . c19602_2mgt 1 . 8 . 3955 . 1 1 13 VAL CG2 C -9.511 0.485 0.429 . . . 1.0 . . . . . . . . . . . . A . 12 VAL CG2 . . . . . . . . . c19602_2mgt 1 . 8 . 3956 . 1 1 13 VAL H H -6.799 0.928 0.104 . . . 1.0 . . . . . . . . . . . . A . 12 VAL H . . . . . . . . . c19602_2mgt 1 . 8 . 3957 . 1 1 13 VAL HA H -7.938 -0.159 2.428 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HA . . . . . . . . . c19602_2mgt 1 . 8 . 3958 . 1 1 13 VAL HB H -8.139 -0.858 -0.521 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HB . . . . . . . . . c19602_2mgt 1 . 8 . 3959 . 1 1 13 VAL HG11 H -9.879 -1.900 1.750 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HG11 . . . . . . . . . c19602_2mgt 1 . 8 . 3960 . 1 1 13 VAL HG12 H -10.239 -2.058 0.013 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HG12 . . . . . . . . . c19602_2mgt 1 . 8 . 3961 . 1 1 13 VAL HG13 H -8.839 -2.873 0.682 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HG13 . . . . . . . . . c19602_2mgt 1 . 8 . 3962 . 1 1 13 VAL HG21 H -8.959 1.391 0.199 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HG21 . . . . . . . . . c19602_2mgt 1 . 8 . 3963 . 1 1 13 VAL HG22 H -10.255 0.332 -0.347 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HG22 . . . . . . . . . c19602_2mgt 1 . 8 . 3964 . 1 1 13 VAL HG23 H -9.985 0.610 1.400 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HG23 . . . . . . . . . c19602_2mgt 1 . 8 . 3965 . 1 1 13 VAL N N -6.600 0.565 1.022 . . . 1.0 . . . . . . . . . . . . A . 12 VAL N . . . . . . . . . c19602_2mgt 1 . 8 . 3966 . 1 1 13 VAL O O -7.161 -2.572 2.628 . . . 1.0 . . . . . . . . . . . . A . 12 VAL O . . . . . . . . . c19602_2mgt 1 . 8 . 3967 . 1 1 14 HIS C C -4.348 -3.773 2.444 . . . 1.0 . . . . . . . . . . . . A . 13 HIS C . . . . . . . . . c19602_2mgt 1 . 8 . 3968 . 1 1 14 HIS CA C -4.887 -3.285 1.092 . . . 1.0 . . . . . . . . . . . . A . 13 HIS CA . . . . . . . . . c19602_2mgt 1 . 8 . 3969 . 1 1 14 HIS CB C -3.767 -3.247 0.043 . . . 1.0 . . . . . . . . . . . . A . 13 HIS CB . . . . . . . . . c19602_2mgt 1 . 8 . 3970 . 1 1 14 HIS CD2 C -5.456 -3.481 -1.903 . . . 1.0 . . . . . . . . . . . . A . 13 HIS CD2 . . . . . . . . . c19602_2mgt 1 . 8 . 3971 . 1 1 14 HIS CE1 C -4.299 -2.577 -3.522 . . . 1.0 . . . . . . . . . . . . A . 13 HIS CE1 . . . . . . . . . c19602_2mgt 1 . 8 . 3972 . 1 1 14 HIS CG C -4.234 -3.132 -1.392 . . . 1.0 . . . . . . . . . . . . A . 13 HIS CG . . . . . . . . . c19602_2mgt 1 . 8 . 3973 . 1 1 14 HIS H H -5.242 -1.293 0.488 . . . 1.0 . . . . . . . . . . . . A . 13 HIS H . . . . . . . . . c19602_2mgt 1 . 8 . 3974 . 1 1 14 HIS HA H -5.638 -4.001 0.773 . . . 1.0 . . . . . . . . . . . . A . 13 HIS HA . . . . . . . . . c19602_2mgt 1 . 8 . 3975 . 1 1 14 HIS HB2 H -3.096 -2.418 0.267 . . . 1.0 . . . . . . . . . . . . A . 13 HIS HB2 . . . . . . . . . c19602_2mgt 1 . 8 . 3976 . 1 1 14 HIS HB3 H -3.188 -4.160 0.130 . . . 1.0 . . . . . . . . . . . . A . 13 HIS HB3 . . . . . . . . . c19602_2mgt 1 . 8 . 3977 . 1 1 14 HIS HD1 H -2.579 -2.222 -2.374 . . . 1.0 . . . . . . . . . . . . A . 13 HIS HD1 . . . . . . . . . c19602_2mgt 1 . 8 . 3978 . 1 1 14 HIS HD2 H -6.270 -3.917 -1.348 . . . 1.0 . . . . . . . . . . . . A . 13 HIS HD2 . . . . . . . . . c19602_2mgt 1 . 8 . 3979 . 1 1 14 HIS HE1 H -4.005 -2.176 -4.480 . . . 1.0 . . . . . . . . . . . . A . 13 HIS HE1 . . . . . . . . . c19602_2mgt 1 . 8 . 3980 . 1 1 14 HIS N N -5.563 -1.999 1.134 . . . 1.0 . . . . . . . . . . . . A . 13 HIS N . . . . . . . . . c19602_2mgt 1 . 8 . 3981 . 1 1 14 HIS ND1 N -3.518 -2.587 -2.431 . . . 1.0 . . . . . . . . . . . . A . 13 HIS ND1 . . . . . . . . . c19602_2mgt 1 . 8 . 3982 . 1 1 14 HIS NE2 N -5.502 -3.105 -3.250 . . . 1.0 . . . . . . . . . . . . A . 13 HIS NE2 . . . . . . . . . c19602_2mgt 1 . 8 . 3983 . 1 1 14 HIS O O -4.012 -4.951 2.537 . . . 1.0 . . . . . . . . . . . . A . 13 HIS O . . . . . . . . . c19602_2mgt 1 . 8 . 3984 . 1 1 15 HIS C C -5.019 -3.189 5.860 . . . 1.0 . . . . . . . . . . . . A . 14 HIS C . . . . . . . . . c19602_2mgt 1 . 8 . 3985 . 1 1 15 HIS CA C -3.884 -3.316 4.832 . . . 1.0 . . . . . . . . . . . . A . 14 HIS CA . . . . . . . . . c19602_2mgt 1 . 8 . 3986 . 1 1 15 HIS CB C -2.670 -2.493 5.292 . . . 1.0 . . . . . . . . . . . . A . 14 HIS CB . . . . . . . . . c19602_2mgt 1 . 8 . 3987 . 1 1 15 HIS CD2 C -0.961 -1.306 3.806 . . . 1.0 . . . . . . . . . . . . A . 14 HIS CD2 . . . . . . . . . c19602_2mgt 1 . 8 . 3988 . 1 1 15 HIS CE1 C -0.005 -3.033 2.855 . . . 1.0 . . . . . . . . . . . . A . 14 HIS CE1 . . . . . . . . . c19602_2mgt 1 . 8 . 3989 . 1 1 15 HIS CG C -1.537 -2.438 4.309 . . . 1.0 . . . . . . . . . . . . A . 14 HIS CG . . . . . . . . . c19602_2mgt 1 . 8 . 3990 . 1 1 15 HIS H H -4.590 -1.964 3.335 . . . 1.0 . . . . . . . . . . . . A . 14 HIS H . . . . . . . . . c19602_2mgt 1 . 8 . 3991 . 1 1 15 HIS HA H -3.582 -4.364 4.824 . . . 1.0 . . . . . . . . . . . . A . 14 HIS HA . . . . . . . . . c19602_2mgt 1 . 8 . 3992 . 1 1 15 HIS HB2 H -2.990 -1.478 5.514 . . . 1.0 . . . . . . . . . . . . A . 14 HIS HB2 . . . . . . . . . c19602_2mgt 1 . 8 . 3993 . 1 1 15 HIS HB3 H -2.283 -2.925 6.213 . . . 1.0 . . . . . . . . . . . . A . 14 HIS HB3 . . . . . . . . . c19602_2mgt 1 . 8 . 3994 . 1 1 15 HIS HD1 H -1.111 -4.484 3.890 . . . 1.0 . . . . . . . . . . . . A . 14 HIS HD1 . . . . . . . . . c19602_2mgt 1 . 8 . 3995 . 1 1 15 HIS HD2 H -1.229 -0.292 4.067 . . . 1.0 . . . . . . . . . . . . A . 14 HIS HD2 . . . . . . . . . c19602_2mgt 1 . 8 . 3996 . 1 1 15 HIS HE1 H 0.621 -3.640 2.219 . . . 1.0 . . . . . . . . . . . . A . 14 HIS HE1 . . . . . . . . . c19602_2mgt 1 . 8 . 3997 . 1 1 15 HIS N N -4.291 -2.921 3.479 . . . 1.0 . . . . . . . . . . . . A . 14 HIS N . . . . . . . . . c19602_2mgt 1 . 8 . 3998 . 1 1 15 HIS ND1 N -0.905 -3.509 3.727 . . . 1.0 . . . . . . . . . . . . A . 14 HIS ND1 . . . . . . . . . c19602_2mgt 1 . 8 . 3999 . 1 1 15 HIS NE2 N 0.019 -1.695 2.890 . . . 1.0 . . . . . . . . . . . . A . 14 HIS NE2 . . . . . . . . . c19602_2mgt 1 . 8 . 4000 . 1 1 15 HIS O O -4.736 -3.230 7.051 . . . 1.0 . . . . . . . . . . . . A . 14 HIS O . . . . . . . . . c19602_2mgt 1 . 8 . 4001 . 1 1 16 GLN C C -8.625 -3.555 6.040 . . . 1.0 . . . . . . . . . . . . A . 15 GLN C . . . . . . . . . c19602_2mgt 1 . 8 . 4002 . 1 1 16 GLN CA C -7.383 -2.731 6.366 . . . 1.0 . . . . . . . . . . . . A . 15 GLN CA . . . . . . . . . c19602_2mgt 1 . 8 . 4003 . 1 1 16 GLN CB C -7.683 -1.229 6.346 . . . 1.0 . . . . . . . . . . . . A . 15 GLN CB . . . . . . . . . c19602_2mgt 1 . 8 . 4004 . 1 1 16 GLN CD C -6.853 1.031 7.176 . . . 1.0 . . . . . . . . . . . . A . 15 GLN CD . . . . . . . . . c19602_2mgt 1 . 8 . 4005 . 1 1 16 GLN CG C -6.693 -0.479 7.245 . . . 1.0 . . . . . . . . . . . . A . 15 GLN CG . . . . . . . . . c19602_2mgt 1 . 8 . 4006 . 1 1 16 GLN H H -6.492 -2.980 4.470 . . . 1.0 . . . . . . . . . . . . A . 15 GLN H . . . . . . . . . c19602_2mgt 1 . 8 . 4007 . 1 1 16 GLN HA H -7.093 -3.003 7.376 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HA . . . . . . . . . c19602_2mgt 1 . 8 . 4008 . 1 1 16 GLN HB2 H -7.634 -0.847 5.324 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HB2 . . . . . . . . . c19602_2mgt 1 . 8 . 4009 . 1 1 16 GLN HB3 H -8.688 -1.073 6.729 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HB3 . . . . . . . . . c19602_2mgt 1 . 8 . 4010 . 1 1 16 GLN HE21 H -8.856 0.917 7.487 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HE21 . . . . . . . . . c19602_2mgt 1 . 8 . 4011 . 1 1 16 GLN HE22 H -8.222 2.530 7.247 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HE22 . . . . . . . . . c19602_2mgt 1 . 8 . 4012 . 1 1 16 GLN HG2 H -6.850 -0.800 8.275 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HG2 . . . . . . . . . c19602_2mgt 1 . 8 . 4013 . 1 1 16 GLN HG3 H -5.671 -0.722 6.953 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HG3 . . . . . . . . . c19602_2mgt 1 . 8 . 4014 . 1 1 16 GLN N N -6.282 -3.002 5.453 . . . 1.0 . . . . . . . . . . . . A . 15 GLN N . . . . . . . . . c19602_2mgt 1 . 8 . 4015 . 1 1 16 GLN NE2 N -8.075 1.534 7.319 . . . 1.0 . . . . . . . . . . . . A . 15 GLN NE2 . . . . . . . . . c19602_2mgt 1 . 8 . 4016 . 1 1 16 GLN O O -9.001 -4.411 6.836 . . . 1.0 . . . . . . . . . . . . A . 15 GLN O . . . . . . . . . c19602_2mgt 1 . 8 . 4017 . 1 1 16 GLN OE1 O -5.875 1.745 6.994 . . . 1.0 . . . . . . . . . . . . A . 15 GLN OE1 . . . . . . . . . c19602_2mgt 1 . 8 . 4018 . 1 1 17 LYS C C -10.600 -4.732 3.412 . . . 1.0 . . . . . . . . . . . . A . 16 LYS C . . . . . . . . . c19602_2mgt 1 . 8 . 4019 . 1 1 17 LYS CA C -10.613 -3.840 4.642 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CA . . . . . . . . . c19602_2mgt 1 . 8 . 4020 . 1 1 17 LYS CB C -11.622 -2.704 4.462 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CB . . . . . . . . . c19602_2mgt 1 . 8 . 4021 . 1 1 17 LYS CD C -12.340 -2.626 6.919 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CD . . . . . . . . . c19602_2mgt 1 . 8 . 4022 . 1 1 17 LYS CE C -12.798 -1.631 7.979 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CE . . . . . . . . . c19602_2mgt 1 . 8 . 4023 . 1 1 17 LYS CG C -11.837 -1.835 5.707 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CG . . . . . . . . . c19602_2mgt 1 . 8 . 4024 . 1 1 17 LYS H H -8.925 -2.602 4.269 . . . 1.0 . . . . . . . . . . . . A . 16 LYS H . . . . . . . . . c19602_2mgt 1 . 8 . 4025 . 1 1 17 LYS HA H -10.941 -4.457 5.476 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HA . . . . . . . . . c19602_2mgt 1 . 8 . 4026 . 1 1 17 LYS HB2 H -11.299 -2.064 3.642 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HB2 . . . . . . . . . c19602_2mgt 1 . 8 . 4027 . 1 1 17 LYS HB3 H -12.577 -3.146 4.196 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HB3 . . . . . . . . . c19602_2mgt 1 . 8 . 4028 . 1 1 17 LYS HD2 H -13.184 -3.252 6.625 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HD2 . . . . . . . . . c19602_2mgt 1 . 8 . 4029 . 1 1 17 LYS HD3 H -11.540 -3.247 7.324 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HD3 . . . . . . . . . c19602_2mgt 1 . 8 . 4030 . 1 1 17 LYS HE2 H -11.975 -0.966 8.228 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HE2 . . . . . . . . . c19602_2mgt 1 . 8 . 4031 . 1 1 17 LYS HE3 H -13.613 -1.040 7.564 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HE3 . . . . . . . . . c19602_2mgt 1 . 8 . 4032 . 1 1 17 LYS HG2 H -10.910 -1.327 5.970 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HG2 . . . . . . . . . c19602_2mgt 1 . 8 . 4033 . 1 1 17 LYS HG3 H -12.579 -1.078 5.455 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HG3 . . . . . . . . . c19602_2mgt 1 . 8 . 4034 . 1 1 17 LYS HZ1 H -14.045 -2.901 8.970 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HZ1 . . . . . . . . . c19602_2mgt 1 . 8 . 4035 . 1 1 17 LYS HZ2 H -12.525 -2.842 9.601 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HZ2 . . . . . . . . . c19602_2mgt 1 . 8 . 4036 . 1 1 17 LYS HZ3 H -13.572 -1.602 9.867 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HZ3 . . . . . . . . . c19602_2mgt 1 . 8 . 4037 . 1 1 17 LYS N N -9.291 -3.287 4.914 . . . 1.0 . . . . . . . . . . . . A . 16 LYS N . . . . . . . . . c19602_2mgt 1 . 8 . 4038 . 1 1 17 LYS NZ N -13.270 -2.293 9.196 . . . 1.0 . . . . . . . . . . . . A . 16 LYS NZ . . . . . . . . . c19602_2mgt 1 . 8 . 4039 . 1 1 17 LYS O O -9.759 -4.578 2.533 . . . 1.0 . . . . . . . . . . . . A . 16 LYS O . . . . . . . . . c19602_2mgt 1 . 8 . 4040 . 1 1 18 NH2 HN1 H -11.601 -6.270 2.534 . . . 1.0 . . . . . . . . . . . . A . 17 NH2 HN1 . . . . . . . . . c19602_2mgt 1 . 8 . 4041 . 1 1 18 NH2 HN2 H -12.241 -5.738 4.073 . . . 1.0 . . . . . . . . . . . . A . 17 NH2 HN2 . . . . . . . . . c19602_2mgt 1 . 8 . 4042 . 1 1 18 NH2 N N -11.555 -5.657 3.336 . . . 1.0 . . . . . . . . . . . . A . 17 NH2 N . . . . . . . . . c19602_2mgt 1 . 8 . 4043 . 2 1 1 ACE C C 13.607 6.778 -3.868 . . . 1.0 . . . . . . . . . . . . B . 0 ACE C . . . . . . . . . c19602_2mgt 1 . 8 . 4044 . 2 1 1 ACE CH3 C 12.399 7.076 -2.997 . . . 1.0 . . . . . . . . . . . . B . 0 ACE CH3 . . . . . . . . . c19602_2mgt 1 . 8 . 4045 . 2 1 1 ACE H1 H 12.154 6.193 -2.410 . . . 1.0 . . . . . . . . . . . . B . 0 ACE H1 . . . . . . . . . c19602_2mgt 1 . 8 . 4046 . 2 1 1 ACE H2 H 12.616 7.906 -2.329 . . . 1.0 . . . . . . . . . . . . B . 0 ACE H2 . . . . . . . . . c19602_2mgt 1 . 8 . 4047 . 2 1 1 ACE H3 H 11.551 7.348 -3.625 . . . 1.0 . . . . . . . . . . . . B . 0 ACE H3 . . . . . . . . . c19602_2mgt 1 . 8 . 4048 . 2 1 1 ACE O O 13.439 6.406 -5.023 . . . 1.0 . . . . . . . . . . . . B . 0 ACE O . . . . . . . . . c19602_2mgt 1 . 8 . 4049 . 2 1 2 ASP C C 16.254 5.234 -4.362 . . . 1.0 . . . . . . . . . . . . B . 1 ASP C . . . . . . . . . c19602_2mgt 1 . 8 . 4050 . 2 1 2 ASP CA C 16.068 6.724 -4.045 . . . 1.0 . . . . . . . . . . . . B . 1 ASP CA . . . . . . . . . c19602_2mgt 1 . 8 . 4051 . 2 1 2 ASP CB C 17.245 7.290 -3.231 . . . 1.0 . . . . . . . . . . . . B . 1 ASP CB . . . . . . . . . c19602_2mgt 1 . 8 . 4052 . 2 1 2 ASP CG C 18.428 7.721 -4.095 . . . 1.0 . . . . . . . . . . . . B . 1 ASP CG . . . . . . . . . c19602_2mgt 1 . 8 . 4053 . 2 1 2 ASP H H 14.886 7.213 -2.355 . . . 1.0 . . . . . . . . . . . . B . 1 ASP H . . . . . . . . . c19602_2mgt 1 . 8 . 4054 . 2 1 2 ASP HA H 16.003 7.277 -4.984 . . . 1.0 . . . . . . . . . . . . B . 1 ASP HA . . . . . . . . . c19602_2mgt 1 . 8 . 4055 . 2 1 2 ASP HB2 H 16.904 8.164 -2.674 . . . 1.0 . . . . . . . . . . . . B . 1 ASP HB2 . . . . . . . . . c19602_2mgt 1 . 8 . 4056 . 2 1 2 ASP HB3 H 17.589 6.540 -2.519 . . . 1.0 . . . . . . . . . . . . B . 1 ASP HB3 . . . . . . . . . c19602_2mgt 1 . 8 . 4057 . 2 1 2 ASP N N 14.818 6.944 -3.325 . . . 1.0 . . . . . . . . . . . . B . 1 ASP N . . . . . . . . . c19602_2mgt 1 . 8 . 4058 . 2 1 2 ASP O O 15.846 4.379 -3.579 . . . 1.0 . . . . . . . . . . . . B . 1 ASP O . . . . . . . . . c19602_2mgt 1 . 8 . 4059 . 2 1 2 ASP OD1 O 18.640 7.114 -5.160 . . . 1.0 . . . . . . . . . . . . B . 1 ASP OD1 . . . . . . . . . c19602_2mgt 1 . 8 . 4060 . 2 1 2 ASP OD2 O 19.111 8.682 -3.693 . . . 1.0 . . . . . . . . . . . . B . 1 ASP OD2 . . . . . . . . . c19602_2mgt 1 . 8 . 4061 . 2 1 3 ALA C C 17.468 2.538 -5.168 . . . 1.0 . . . . . . . . . . . . B . 2 ALA C . . . . . . . . . c19602_2mgt 1 . 8 . 4062 . 2 1 3 ALA CA C 17.012 3.632 -6.127 . . . 1.0 . . . . . . . . . . . . B . 2 ALA CA . . . . . . . . . c19602_2mgt 1 . 8 . 4063 . 2 1 3 ALA CB C 17.992 3.746 -7.294 . . . 1.0 . . . . . . . . . . . . B . 2 ALA CB . . . . . . . . . c19602_2mgt 1 . 8 . 4064 . 2 1 3 ALA H H 17.237 5.724 -6.048 . . . 1.0 . . . . . . . . . . . . B . 2 ALA H . . . . . . . . . c19602_2mgt 1 . 8 . 4065 . 2 1 3 ALA HA H 16.042 3.350 -6.524 . . . 1.0 . . . . . . . . . . . . B . 2 ALA HA . . . . . . . . . c19602_2mgt 1 . 8 . 4066 . 2 1 3 ALA HB1 H 18.127 2.766 -7.751 . . . 1.0 . . . . . . . . . . . . B . 2 ALA HB1 . . . . . . . . . c19602_2mgt 1 . 8 . 4067 . 2 1 3 ALA HB2 H 17.599 4.439 -8.036 . . . 1.0 . . . . . . . . . . . . B . 2 ALA HB2 . . . . . . . . . c19602_2mgt 1 . 8 . 4068 . 2 1 3 ALA HB3 H 18.956 4.105 -6.939 . . . 1.0 . . . . . . . . . . . . B . 2 ALA HB3 . . . . . . . . . c19602_2mgt 1 . 8 . 4069 . 2 1 3 ALA N N 16.878 4.948 -5.513 . . . 1.0 . . . . . . . . . . . . B . 2 ALA N . . . . . . . . . c19602_2mgt 1 . 8 . 4070 . 2 1 3 ALA O O 16.852 1.478 -5.131 . . . 1.0 . . . . . . . . . . . . B . 2 ALA O . . . . . . . . . c19602_2mgt 1 . 8 . 4071 . 2 1 4 GLU C C 18.158 1.236 -2.463 . . . 1.0 . . . . . . . . . . . . B . 3 GLU C . . . . . . . . . c19602_2mgt 1 . 8 . 4072 . 2 1 4 GLU CA C 19.138 1.931 -3.409 . . . 1.0 . . . . . . . . . . . . B . 3 GLU CA . . . . . . . . . c19602_2mgt 1 . 8 . 4073 . 2 1 4 GLU CB C 20.165 2.733 -2.597 . . . 1.0 . . . . . . . . . . . . B . 3 GLU CB . . . . . . . . . c19602_2mgt 1 . 8 . 4074 . 2 1 4 GLU CD C 20.465 4.965 -1.430 . . . 1.0 . . . . . . . . . . . . B . 3 GLU CD . . . . . . . . . c19602_2mgt 1 . 8 . 4075 . 2 1 4 GLU CG C 19.493 3.882 -1.835 . . . 1.0 . . . . . . . . . . . . B . 3 GLU CG . . . . . . . . . c19602_2mgt 1 . 8 . 4076 . 2 1 4 GLU H H 18.934 3.732 -4.483 . . . 1.0 . . . . . . . . . . . . B . 3 GLU H . . . . . . . . . c19602_2mgt 1 . 8 . 4077 . 2 1 4 GLU HA H 19.668 1.158 -3.958 . . . 1.0 . . . . . . . . . . . . B . 3 GLU HA . . . . . . . . . c19602_2mgt 1 . 8 . 4078 . 2 1 4 GLU HB2 H 20.665 2.076 -1.884 . . . 1.0 . . . . . . . . . . . . B . 3 GLU HB2 . . . . . . . . . c19602_2mgt 1 . 8 . 4079 . 2 1 4 GLU HB3 H 20.922 3.128 -3.268 . . . 1.0 . . . . . . . . . . . . B . 3 GLU HB3 . . . . . . . . . c19602_2mgt 1 . 8 . 4080 . 2 1 4 GLU HG2 H 18.724 4.361 -2.441 . . . 1.0 . . . . . . . . . . . . B . 3 GLU HG2 . . . . . . . . . c19602_2mgt 1 . 8 . 4081 . 2 1 4 GLU HG3 H 19.027 3.464 -0.945 . . . 1.0 . . . . . . . . . . . . B . 3 GLU HG3 . . . . . . . . . c19602_2mgt 1 . 8 . 4082 . 2 1 4 GLU N N 18.511 2.820 -4.381 . . . 1.0 . . . . . . . . . . . . B . 3 GLU N . . . . . . . . . c19602_2mgt 1 . 8 . 4083 . 2 1 4 GLU O O 18.417 0.094 -2.111 . . . 1.0 . . . . . . . . . . . . B . 3 GLU O . . . . . . . . . c19602_2mgt 1 . 8 . 4084 . 2 1 4 GLU OE1 O 20.993 5.643 -2.334 . . . 1.0 . . . . . . . . . . . . B . 3 GLU OE1 . . . . . . . . . c19602_2mgt 1 . 8 . 4085 . 2 1 4 GLU OE2 O 20.635 5.146 -0.216 . . . 1.0 . . . . . . . . . . . . B . 3 GLU OE2 . . . . . . . . . c19602_2mgt 1 . 8 . 4086 . 2 1 5 PHE C C 14.661 1.217 -1.892 . . . 1.0 . . . . . . . . . . . . B . 4 PHE C . . . . . . . . . c19602_2mgt 1 . 8 . 4087 . 2 1 5 PHE CA C 16.025 1.319 -1.203 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CA . . . . . . . . . c19602_2mgt 1 . 8 . 4088 . 2 1 5 PHE CB C 15.947 2.137 0.078 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CB . . . . . . . . . c19602_2mgt 1 . 8 . 4089 . 2 1 5 PHE CD1 C 13.918 3.632 0.064 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CD1 . . . . . . . . . c19602_2mgt 1 . 8 . 4090 . 2 1 5 PHE CD2 C 16.098 4.612 -0.383 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CD2 . . . . . . . . . c19602_2mgt 1 . 8 . 4091 . 2 1 5 PHE CE1 C 13.328 4.899 -0.059 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CE1 . . . . . . . . . c19602_2mgt 1 . 8 . 4092 . 2 1 5 PHE CE2 C 15.515 5.883 -0.470 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CE2 . . . . . . . . . c19602_2mgt 1 . 8 . 4093 . 2 1 5 PHE CG C 15.307 3.493 -0.082 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CG . . . . . . . . . c19602_2mgt 1 . 8 . 4094 . 2 1 5 PHE CZ C 14.131 6.025 -0.301 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CZ . . . . . . . . . c19602_2mgt 1 . 8 . 4095 . 2 1 5 PHE H H 16.916 2.836 -2.379 . . . 1.0 . . . . . . . . . . . . B . 4 PHE H . . . . . . . . . c19602_2mgt 1 . 8 . 4096 . 2 1 5 PHE HA H 16.307 0.312 -0.917 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HA . . . . . . . . . c19602_2mgt 1 . 8 . 4097 . 2 1 5 PHE HB2 H 15.372 1.567 0.800 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HB2 . . . . . . . . . c19602_2mgt 1 . 8 . 4098 . 2 1 5 PHE HB3 H 16.952 2.257 0.482 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HB3 . . . . . . . . . c19602_2mgt 1 . 8 . 4099 . 2 1 5 PHE HD1 H 13.313 2.761 0.265 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HD1 . . . . . . . . . c19602_2mgt 1 . 8 . 4100 . 2 1 5 PHE HD2 H 17.154 4.493 -0.540 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HD2 . . . . . . . . . c19602_2mgt 1 . 8 . 4101 . 2 1 5 PHE HE1 H 12.263 5.009 0.045 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HE1 . . . . . . . . . c19602_2mgt 1 . 8 . 4102 . 2 1 5 PHE HE2 H 16.127 6.747 -0.669 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HE2 . . . . . . . . . c19602_2mgt 1 . 8 . 4103 . 2 1 5 PHE HZ H 13.688 7.001 -0.373 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HZ . . . . . . . . . c19602_2mgt 1 . 8 . 4104 . 2 1 5 PHE N N 17.055 1.885 -2.070 . . . 1.0 . . . . . . . . . . . . B . 4 PHE N . . . . . . . . . c19602_2mgt 1 . 8 . 4105 . 2 1 5 PHE O O 13.762 0.574 -1.350 . . . 1.0 . . . . . . . . . . . . B . 4 PHE O . . . . . . . . . c19602_2mgt 1 . 8 . 4106 . 2 1 6 ARG C C 13.682 0.285 -4.782 . . . 1.0 . . . . . . . . . . . . B . 5 ARG C . . . . . . . . . c19602_2mgt 1 . 8 . 4107 . 2 1 6 ARG CA C 13.432 1.593 -4.017 . . . 1.0 . . . . . . . . . . . . B . 5 ARG CA . . . . . . . . . c19602_2mgt 1 . 8 . 4108 . 2 1 6 ARG CB C 13.291 2.854 -4.882 . . . 1.0 . . . . . . . . . . . . B . 5 ARG CB . . . . . . . . . c19602_2mgt 1 . 8 . 4109 . 2 1 6 ARG CD C 10.730 2.621 -5.026 . . . 1.0 . . . . . . . . . . . . B . 5 ARG CD . . . . . . . . . c19602_2mgt 1 . 8 . 4110 . 2 1 6 ARG CG C 12.048 2.852 -5.770 . . . 1.0 . . . . . . . . . . . . B . 5 ARG CG . . . . . . . . . c19602_2mgt 1 . 8 . 4111 . 2 1 6 ARG CZ C 9.791 4.803 -4.294 . . . 1.0 . . . . . . . . . . . . B . 5 ARG CZ . . . . . . . . . c19602_2mgt 1 . 8 . 4112 . 2 1 6 ARG H H 15.297 2.341 -3.459 . . . 1.0 . . . . . . . . . . . . B . 5 ARG H . . . . . . . . . c19602_2mgt 1 . 8 . 4113 . 2 1 6 ARG HA H 12.525 1.483 -3.437 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HA . . . . . . . . . c19602_2mgt 1 . 8 . 4114 . 2 1 6 ARG HB2 H 13.245 3.721 -4.224 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HB2 . . . . . . . . . c19602_2mgt 1 . 8 . 4115 . 2 1 6 ARG HB3 H 14.169 2.958 -5.517 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HB3 . . . . . . . . . c19602_2mgt 1 . 8 . 4116 . 2 1 6 ARG HD2 H 9.917 2.575 -5.743 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HD2 . . . . . . . . . c19602_2mgt 1 . 8 . 4117 . 2 1 6 ARG HD3 H 10.756 1.665 -4.509 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HD3 . . . . . . . . . c19602_2mgt 1 . 8 . 4118 . 2 1 6 ARG HE H 10.706 3.462 -3.091 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HE . . . . . . . . . c19602_2mgt 1 . 8 . 4119 . 2 1 6 ARG HG2 H 12.003 3.803 -6.301 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HG2 . . . . . . . . . c19602_2mgt 1 . 8 . 4120 . 2 1 6 ARG HG3 H 12.159 2.059 -6.499 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HG3 . . . . . . . . . c19602_2mgt 1 . 8 . 4121 . 2 1 6 ARG HH11 H 9.738 4.604 -6.317 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HH11 . . . . . . . . . c19602_2mgt 1 . 8 . 4122 . 2 1 6 ARG HH12 H 8.999 6.058 -5.690 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HH12 . . . . . . . . . c19602_2mgt 1 . 8 . 4123 . 2 1 6 ARG HH21 H 9.671 5.321 -2.333 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HH21 . . . . . . . . . c19602_2mgt 1 . 8 . 4124 . 2 1 6 ARG HH22 H 8.944 6.445 -3.455 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HH22 . . . . . . . . . c19602_2mgt 1 . 8 . 4125 . 2 1 6 ARG N N 14.529 1.800 -3.093 . . . 1.0 . . . . . . . . . . . . B . 5 ARG N . . . . . . . . . c19602_2mgt 1 . 8 . 4126 . 2 1 6 ARG NE N 10.448 3.668 -4.045 . . . 1.0 . . . . . . . . . . . . B . 5 ARG NE . . . . . . . . . c19602_2mgt 1 . 8 . 4127 . 2 1 6 ARG NH1 N 9.484 5.186 -5.533 . . . 1.0 . . . . . . . . . . . . B . 5 ARG NH1 . . . . . . . . . c19602_2mgt 1 . 8 . 4128 . 2 1 6 ARG NH2 N 9.429 5.577 -3.279 . . . 1.0 . . . . . . . . . . . . B . 5 ARG NH2 . . . . . . . . . c19602_2mgt 1 . 8 . 4129 . 2 1 6 ARG O O 13.815 0.263 -6.001 . . . 1.0 . . . . . . . . . . . . B . 5 ARG O . . . . . . . . . c19602_2mgt 1 . 8 . 4130 . 2 1 7 ARG C C 13.097 -2.970 -4.907 . . . 1.0 . . . . . . . . . . . . B . 6 ARG C . . . . . . . . . c19602_2mgt 1 . 8 . 4131 . 2 1 7 ARG CA C 14.273 -2.115 -4.423 . . . 1.0 . . . . . . . . . . . . B . 6 ARG CA . . . . . . . . . c19602_2mgt 1 . 8 . 4132 . 2 1 7 ARG CB C 14.945 -2.755 -3.199 . . . 1.0 . . . . . . . . . . . . B . 6 ARG CB . . . . . . . . . c19602_2mgt 1 . 8 . 4133 . 2 1 7 ARG CD C 17.452 -2.332 -3.702 . . . 1.0 . . . . . . . . . . . . B . 6 ARG CD . . . . . . . . . c19602_2mgt 1 . 8 . 4134 . 2 1 7 ARG CG C 16.268 -2.110 -2.759 . . . 1.0 . . . . . . . . . . . . B . 6 ARG CG . . . . . . . . . c19602_2mgt 1 . 8 . 4135 . 2 1 7 ARG CZ C 17.859 -1.595 -6.047 . . . 1.0 . . . . . . . . . . . . B . 6 ARG CZ . . . . . . . . . c19602_2mgt 1 . 8 . 4136 . 2 1 7 ARG H H 13.697 -0.680 -3.024 . . . 1.0 . . . . . . . . . . . . B . 6 ARG H . . . . . . . . . c19602_2mgt 1 . 8 . 4137 . 2 1 7 ARG HA H 14.996 -2.015 -5.223 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HA . . . . . . . . . c19602_2mgt 1 . 8 . 4138 . 2 1 7 ARG HB2 H 14.262 -2.640 -2.361 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HB2 . . . . . . . . . c19602_2mgt 1 . 8 . 4139 . 2 1 7 ARG HB3 H 15.100 -3.817 -3.371 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HB3 . . . . . . . . . c19602_2mgt 1 . 8 . 4140 . 2 1 7 ARG HD2 H 18.376 -2.229 -3.133 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HD2 . . . . . . . . . c19602_2mgt 1 . 8 . 4141 . 2 1 7 ARG HD3 H 17.414 -3.340 -4.098 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HD3 . . . . . . . . . c19602_2mgt 1 . 8 . 4142 . 2 1 7 ARG HE H 17.194 -0.410 -4.557 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HE . . . . . . . . . c19602_2mgt 1 . 8 . 4143 . 2 1 7 ARG HG2 H 16.116 -1.044 -2.622 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HG2 . . . . . . . . . c19602_2mgt 1 . 8 . 4144 . 2 1 7 ARG HG3 H 16.539 -2.530 -1.793 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HG3 . . . . . . . . . c19602_2mgt 1 . 8 . 4145 . 2 1 7 ARG HH11 H 18.265 -3.569 -5.762 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HH11 . . . . . . . . . c19602_2mgt 1 . 8 . 4146 . 2 1 7 ARG HH12 H 18.518 -2.976 -7.386 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HH12 . . . . . . . . . c19602_2mgt 1 . 8 . 4147 . 2 1 7 ARG HH21 H 17.511 0.308 -6.687 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HH21 . . . . . . . . . c19602_2mgt 1 . 8 . 4148 . 2 1 7 ARG HH22 H 18.105 -0.803 -7.902 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HH22 . . . . . . . . . c19602_2mgt 1 . 8 . 4149 . 2 1 7 ARG N N 13.820 -0.798 -4.016 . . . 1.0 . . . . . . . . . . . . B . 6 ARG N . . . . . . . . . c19602_2mgt 1 . 8 . 4150 . 2 1 7 ARG NE N 17.480 -1.350 -4.788 . . . 1.0 . . . . . . . . . . . . B . 6 ARG NE . . . . . . . . . c19602_2mgt 1 . 8 . 4151 . 2 1 7 ARG NH1 N 18.256 -2.808 -6.425 . . . 1.0 . . . . . . . . . . . . B . 6 ARG NH1 . . . . . . . . . c19602_2mgt 1 . 8 . 4152 . 2 1 7 ARG NH2 N 17.833 -0.613 -6.948 . . . 1.0 . . . . . . . . . . . . B . 6 ARG NH2 . . . . . . . . . c19602_2mgt 1 . 8 . 4153 . 2 1 7 ARG O O 11.951 -2.718 -4.545 . . . 1.0 . . . . . . . . . . . . B . 6 ARG O . . . . . . . . . c19602_2mgt 1 . 8 . 4154 . 2 1 8 ASP C C 12.084 -6.058 -5.104 . . . 1.0 . . . . . . . . . . . . B . 7 ASP C . . . . . . . . . c19602_2mgt 1 . 8 . 4155 . 2 1 8 ASP CA C 12.378 -4.975 -6.154 . . . 1.0 . . . . . . . . . . . . B . 7 ASP CA . . . . . . . . . c19602_2mgt 1 . 8 . 4156 . 2 1 8 ASP CB C 12.838 -5.606 -7.474 . . . 1.0 . . . . . . . . . . . . B . 7 ASP CB . . . . . . . . . c19602_2mgt 1 . 8 . 4157 . 2 1 8 ASP CG C 13.818 -6.764 -7.308 . . . 1.0 . . . . . . . . . . . . B . 7 ASP CG . . . . . . . . . c19602_2mgt 1 . 8 . 4158 . 2 1 8 ASP H H 14.341 -4.170 -5.970 . . . 1.0 . . . . . . . . . . . . B . 7 ASP H . . . . . . . . . c19602_2mgt 1 . 8 . 4159 . 2 1 8 ASP HA H 11.452 -4.435 -6.355 . . . 1.0 . . . . . . . . . . . . B . 7 ASP HA . . . . . . . . . c19602_2mgt 1 . 8 . 4160 . 2 1 8 ASP HB2 H 11.961 -5.989 -7.986 . . . 1.0 . . . . . . . . . . . . B . 7 ASP HB2 . . . . . . . . . c19602_2mgt 1 . 8 . 4161 . 2 1 8 ASP HB3 H 13.291 -4.835 -8.094 . . . 1.0 . . . . . . . . . . . . B . 7 ASP HB3 . . . . . . . . . c19602_2mgt 1 . 8 . 4162 . 2 1 8 ASP N N 13.380 -4.009 -5.701 . . . 1.0 . . . . . . . . . . . . B . 7 ASP N . . . . . . . . . c19602_2mgt 1 . 8 . 4163 . 2 1 8 ASP O O 11.158 -6.841 -5.281 . . . 1.0 . . . . . . . . . . . . B . 7 ASP O . . . . . . . . . c19602_2mgt 1 . 8 . 4164 . 2 1 8 ASP OD1 O 13.366 -7.870 -6.956 . . . 1.0 . . . . . . . . . . . . B . 7 ASP OD1 . . . . . . . . . c19602_2mgt 1 . 8 . 4165 . 2 1 8 ASP OD2 O 15.018 -6.543 -7.552 . . . 1.0 . . . . . . . . . . . . B . 7 ASP OD2 . . . . . . . . . c19602_2mgt 1 . 8 . 4166 . 2 1 9 SER C C 11.770 -7.127 -2.039 . . . 1.0 . . . . . . . . . . . . B . 8 SER C . . . . . . . . . c19602_2mgt 1 . 8 . 4167 . 2 1 9 SER CA C 12.936 -7.182 -3.040 . . . 1.0 . . . . . . . . . . . . B . 8 SER CA . . . . . . . . . c19602_2mgt 1 . 8 . 4168 . 2 1 9 SER CB C 14.284 -7.133 -2.311 . . . 1.0 . . . . . . . . . . . . B . 8 SER CB . . . . . . . . . c19602_2mgt 1 . 8 . 4169 . 2 1 9 SER H H 13.694 -5.501 -4.062 . . . 1.0 . . . . . . . . . . . . B . 8 SER H . . . . . . . . . c19602_2mgt 1 . 8 . 4170 . 2 1 9 SER HA H 12.874 -8.131 -3.566 . . . 1.0 . . . . . . . . . . . . B . 8 SER HA . . . . . . . . . c19602_2mgt 1 . 8 . 4171 . 2 1 9 SER HB2 H 14.362 -6.196 -1.758 . . . 1.0 . . . . . . . . . . . . B . 8 SER HB2 . . . . . . . . . c19602_2mgt 1 . 8 . 4172 . 2 1 9 SER HB3 H 14.355 -7.965 -1.611 . . . 1.0 . . . . . . . . . . . . B . 8 SER HB3 . . . . . . . . . c19602_2mgt 1 . 8 . 4173 . 2 1 9 SER HG H 15.408 -8.131 -3.546 . . . 1.0 . . . . . . . . . . . . B . 8 SER HG . . . . . . . . . c19602_2mgt 1 . 8 . 4174 . 2 1 9 SER N N 12.908 -6.131 -4.054 . . . 1.0 . . . . . . . . . . . . B . 8 SER N . . . . . . . . . c19602_2mgt 1 . 8 . 4175 . 2 1 9 SER O O 11.966 -7.403 -0.860 . . . 1.0 . . . . . . . . . . . . B . 8 SER O . . . . . . . . . c19602_2mgt 1 . 8 . 4176 . 2 1 9 SER OG O 15.344 -7.225 -3.234 . . . 1.0 . . . . . . . . . . . . B . 8 SER OG . . . . . . . . . c19602_2mgt 1 . 8 . 4177 . 2 1 10 GLY C C 8.213 -6.589 -2.726 . . . 1.0 . . . . . . . . . . . . B . 9 GLY C . . . . . . . . . c19602_2mgt 1 . 8 . 4178 . 2 1 10 GLY CA C 9.345 -6.722 -1.709 . . . 1.0 . . . . . . . . . . . . B . 9 GLY CA . . . . . . . . . c19602_2mgt 1 . 8 . 4179 . 2 1 10 GLY H H 10.462 -6.507 -3.459 . . . 1.0 . . . . . . . . . . . . B . 9 GLY H . . . . . . . . . c19602_2mgt 1 . 8 . 4180 . 2 1 10 GLY HA2 H 9.233 -7.640 -1.135 . . . 1.0 . . . . . . . . . . . . B . 9 GLY HA2 . . . . . . . . . c19602_2mgt 1 . 8 . 4181 . 2 1 10 GLY HA3 H 9.382 -5.895 -1.004 . . . 1.0 . . . . . . . . . . . . B . 9 GLY HA3 . . . . . . . . . c19602_2mgt 1 . 8 . 4182 . 2 1 10 GLY N N 10.567 -6.757 -2.484 . . . 1.0 . . . . . . . . . . . . B . 9 GLY N . . . . . . . . . c19602_2mgt 1 . 8 . 4183 . 2 1 10 GLY O O 7.982 -7.531 -3.470 . . . 1.0 . . . . . . . . . . . . B . 9 GLY O . . . . . . . . . c19602_2mgt 1 . 8 . 4184 . 2 1 11 TYR C C 6.529 -3.287 -2.270 . . . 1.0 . . . . . . . . . . . . B . 10 TYR C . . . . . . . . . c19602_2mgt 1 . 8 . 4185 . 2 1 11 TYR CA C 7.691 -4.244 -2.070 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CA . . . . . . . . . c19602_2mgt 1 . 8 . 4186 . 2 1 11 TYR CB C 8.978 -3.541 -2.510 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CB . . . . . . . . . c19602_2mgt 1 . 8 . 4187 . 2 1 11 TYR CD1 C 9.636 -2.829 -0.161 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CD1 . . . . . . . . . c19602_2mgt 1 . 8 . 4188 . 2 1 11 TYR CD2 C 11.325 -3.737 -1.659 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CD2 . . . . . . . . . c19602_2mgt 1 . 8 . 4189 . 2 1 11 TYR CE1 C 10.617 -2.597 0.814 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CE1 . . . . . . . . . c19602_2mgt 1 . 8 . 4190 . 2 1 11 TYR CE2 C 12.304 -3.527 -0.685 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CE2 . . . . . . . . . c19602_2mgt 1 . 8 . 4191 . 2 1 11 TYR CG C 9.997 -3.370 -1.411 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CG . . . . . . . . . c19602_2mgt 1 . 8 . 4192 . 2 1 11 TYR CZ C 11.965 -2.924 0.542 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CZ . . . . . . . . . c19602_2mgt 1 . 8 . 4193 . 2 1 11 TYR H H 6.874 -5.369 -3.602 . . . 1.0 . . . . . . . . . . . . B . 10 TYR H . . . . . . . . . c19602_2mgt 1 . 8 . 4194 . 2 1 11 TYR HA H 7.740 -4.500 -1.014 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HA . . . . . . . . . c19602_2mgt 1 . 8 . 4195 . 2 1 11 TYR HB2 H 9.437 -4.068 -3.341 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HB2 . . . . . . . . . c19602_2mgt 1 . 8 . 4196 . 2 1 11 TYR HB3 H 8.728 -2.562 -2.909 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HB3 . . . . . . . . . c19602_2mgt 1 . 8 . 4197 . 2 1 11 TYR HD1 H 8.615 -2.562 0.047 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HD1 . . . . . . . . . c19602_2mgt 1 . 8 . 4198 . 2 1 11 TYR HD2 H 11.593 -4.193 -2.596 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HD2 . . . . . . . . . c19602_2mgt 1 . 8 . 4199 . 2 1 11 TYR HE1 H 10.338 -2.180 1.767 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HE1 . . . . . . . . . c19602_2mgt 1 . 8 . 4200 . 2 1 11 TYR HE2 H 13.310 -3.858 -0.871 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HE2 . . . . . . . . . c19602_2mgt 1 . 8 . 4201 . 2 1 11 TYR HH H 13.803 -2.980 1.168 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HH . . . . . . . . . c19602_2mgt 1 . 8 . 4202 . 2 1 11 TYR N N 7.508 -5.459 -2.827 . . . 1.0 . . . . . . . . . . . . B . 10 TYR N . . . . . . . . . c19602_2mgt 1 . 8 . 4203 . 2 1 11 TYR O O 5.863 -3.288 -3.302 . . . 1.0 . . . . . . . . . . . . B . 10 TYR O . . . . . . . . . c19602_2mgt 1 . 8 . 4204 . 2 1 11 TYR OH O 12.936 -2.692 1.468 . . . 1.0 . . . . . . . . . . . . B . 10 TYR OH . . . . . . . . . c19602_2mgt 1 . 8 . 4205 . 2 1 12 GLU C C 6.324 -0.066 -0.676 . . . 1.0 . . . . . . . . . . . . B . 11 GLU C . . . . . . . . . c19602_2mgt 1 . 8 . 4206 . 2 1 12 GLU CA C 5.563 -1.212 -1.364 . . . 1.0 . . . . . . . . . . . . B . 11 GLU CA . . . . . . . . . c19602_2mgt 1 . 8 . 4207 . 2 1 12 GLU CB C 4.214 -1.540 -0.727 . . . 1.0 . . . . . . . . . . . . B . 11 GLU CB . . . . . . . . . c19602_2mgt 1 . 8 . 4208 . 2 1 12 GLU CD C 2.008 -0.477 -0.149 . . . 1.0 . . . . . . . . . . . . B . 11 GLU CD . . . . . . . . . c19602_2mgt 1 . 8 . 4209 . 2 1 12 GLU CG C 3.140 -0.545 -1.158 . . . 1.0 . . . . . . . . . . . . B . 11 GLU CG . . . . . . . . . c19602_2mgt 1 . 8 . 4210 . 2 1 12 GLU H H 6.934 -2.503 -0.455 . . . 1.0 . . . . . . . . . . . . B . 11 GLU H . . . . . . . . . c19602_2mgt 1 . 8 . 4211 . 2 1 12 GLU HA H 5.414 -0.963 -2.412 . . . 1.0 . . . . . . . . . . . . B . 11 GLU HA . . . . . . . . . c19602_2mgt 1 . 8 . 4212 . 2 1 12 GLU HB2 H 3.887 -2.531 -1.041 . . . 1.0 . . . . . . . . . . . . B . 11 GLU HB2 . . . . . . . . . c19602_2mgt 1 . 8 . 4213 . 2 1 12 GLU HB3 H 4.329 -1.539 0.356 . . . 1.0 . . . . . . . . . . . . B . 11 GLU HB3 . . . . . . . . . c19602_2mgt 1 . 8 . 4214 . 2 1 12 GLU HG2 H 3.583 0.447 -1.260 . . . 1.0 . . . . . . . . . . . . B . 11 GLU HG2 . . . . . . . . . c19602_2mgt 1 . 8 . 4215 . 2 1 12 GLU HG3 H 2.732 -0.850 -2.120 . . . 1.0 . . . . . . . . . . . . B . 11 GLU HG3 . . . . . . . . . c19602_2mgt 1 . 8 . 4216 . 2 1 12 GLU N N 6.390 -2.390 -1.297 . . . 1.0 . . . . . . . . . . . . B . 11 GLU N . . . . . . . . . c19602_2mgt 1 . 8 . 4217 . 2 1 12 GLU O O 5.885 0.465 0.345 . . . 1.0 . . . . . . . . . . . . B . 11 GLU O . . . . . . . . . c19602_2mgt 1 . 8 . 4218 . 2 1 12 GLU OE1 O 1.603 -1.517 0.402 . . . 1.0 . . . . . . . . . . . . B . 11 GLU OE1 . . . . . . . . . c19602_2mgt 1 . 8 . 4219 . 2 1 12 GLU OE2 O 1.542 0.655 0.069 . . . 1.0 . . . . . . . . . . . . B . 11 GLU OE2 . . . . . . . . . c19602_2mgt 1 . 8 . 4220 . 2 1 13 VAL C C 7.879 2.605 -0.424 . . . 1.0 . . . . . . . . . . . . B . 12 VAL C . . . . . . . . . c19602_2mgt 1 . 8 . 4221 . 2 1 13 VAL CA C 8.484 1.221 -0.703 . . . 1.0 . . . . . . . . . . . . B . 12 VAL CA . . . . . . . . . c19602_2mgt 1 . 8 . 4222 . 2 1 13 VAL CB C 9.700 1.342 -1.652 . . . 1.0 . . . . . . . . . . . . B . 12 VAL CB . . . . . . . . . c19602_2mgt 1 . 8 . 4223 . 2 1 13 VAL CG1 C 10.741 2.358 -1.142 . . . 1.0 . . . . . . . . . . . . B . 12 VAL CG1 . . . . . . . . . c19602_2mgt 1 . 8 . 4224 . 2 1 13 VAL CG2 C 10.420 0.001 -1.809 . . . 1.0 . . . . . . . . . . . . B . 12 VAL CG2 . . . . . . . . . c19602_2mgt 1 . 8 . 4225 . 2 1 13 VAL H H 7.772 -0.215 -2.072 . . . 1.0 . . . . . . . . . . . . B . 12 VAL H . . . . . . . . . c19602_2mgt 1 . 8 . 4226 . 2 1 13 VAL HA H 8.852 0.794 0.220 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HA . . . . . . . . . c19602_2mgt 1 . 8 . 4227 . 2 1 13 VAL HB H 9.341 1.658 -2.630 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HB . . . . . . . . . c19602_2mgt 1 . 8 . 4228 . 2 1 13 VAL HG11 H 10.981 2.157 -0.100 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HG11 . . . . . . . . . c19602_2mgt 1 . 8 . 4229 . 2 1 13 VAL HG12 H 11.653 2.305 -1.727 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HG12 . . . . . . . . . c19602_2mgt 1 . 8 . 4230 . 2 1 13 VAL HG13 H 10.359 3.371 -1.236 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HG13 . . . . . . . . . c19602_2mgt 1 . 8 . 4231 . 2 1 13 VAL HG21 H 10.803 -0.331 -0.848 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HG21 . . . . . . . . . c19602_2mgt 1 . 8 . 4232 . 2 1 13 VAL HG22 H 9.728 -0.733 -2.204 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HG22 . . . . . . . . . c19602_2mgt 1 . 8 . 4233 . 2 1 13 VAL HG23 H 11.242 0.090 -2.513 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HG23 . . . . . . . . . c19602_2mgt 1 . 8 . 4234 . 2 1 13 VAL N N 7.500 0.272 -1.232 . . . 1.0 . . . . . . . . . . . . B . 12 VAL N . . . . . . . . . c19602_2mgt 1 . 8 . 4235 . 2 1 13 VAL O O 8.430 3.363 0.371 . . . 1.0 . . . . . . . . . . . . B . 12 VAL O . . . . . . . . . c19602_2mgt 1 . 8 . 4236 . 2 1 14 HIS C C 5.643 4.477 0.611 . . . 1.0 . . . . . . . . . . . . B . 13 HIS C . . . . . . . . . c19602_2mgt 1 . 8 . 4237 . 2 1 14 HIS CA C 6.106 4.237 -0.835 . . . 1.0 . . . . . . . . . . . . B . 13 HIS CA . . . . . . . . . c19602_2mgt 1 . 8 . 4238 . 2 1 14 HIS CB C 4.958 4.409 -1.826 . . . 1.0 . . . . . . . . . . . . B . 13 HIS CB . . . . . . . . . c19602_2mgt 1 . 8 . 4239 . 2 1 14 HIS CD2 C 5.784 3.480 -4.070 . . . 1.0 . . . . . . . . . . . . B . 13 HIS CD2 . . . . . . . . . c19602_2mgt 1 . 8 . 4240 . 2 1 14 HIS CE1 C 6.312 5.349 -5.079 . . . 1.0 . . . . . . . . . . . . B . 13 HIS CE1 . . . . . . . . . c19602_2mgt 1 . 8 . 4241 . 2 1 14 HIS CG C 5.461 4.516 -3.237 . . . 1.0 . . . . . . . . . . . . B . 13 HIS CG . . . . . . . . . c19602_2mgt 1 . 8 . 4242 . 2 1 14 HIS H H 6.305 2.296 -1.677 . . . 1.0 . . . . . . . . . . . . B . 13 HIS H . . . . . . . . . c19602_2mgt 1 . 8 . 4243 . 2 1 14 HIS HA H 6.877 4.974 -1.058 . . . 1.0 . . . . . . . . . . . . B . 13 HIS HA . . . . . . . . . c19602_2mgt 1 . 8 . 4244 . 2 1 14 HIS HB2 H 4.272 3.566 -1.741 . . . 1.0 . . . . . . . . . . . . B . 13 HIS HB2 . . . . . . . . . c19602_2mgt 1 . 8 . 4245 . 2 1 14 HIS HB3 H 4.416 5.323 -1.581 . . . 1.0 . . . . . . . . . . . . B . 13 HIS HB3 . . . . . . . . . c19602_2mgt 1 . 8 . 4246 . 2 1 14 HIS HD1 H 5.710 6.615 -3.516 . . . 1.0 . . . . . . . . . . . . B . 13 HIS HD1 . . . . . . . . . c19602_2mgt 1 . 8 . 4247 . 2 1 14 HIS HD2 H 5.674 2.428 -3.847 . . . 1.0 . . . . . . . . . . . . B . 13 HIS HD2 . . . . . . . . . c19602_2mgt 1 . 8 . 4248 . 2 1 14 HIS HE1 H 6.682 6.058 -5.806 . . . 1.0 . . . . . . . . . . . . B . 13 HIS HE1 . . . . . . . . . c19602_2mgt 1 . 8 . 4249 . 2 1 14 HIS N N 6.740 2.944 -1.038 . . . 1.0 . . . . . . . . . . . . B . 13 HIS N . . . . . . . . . c19602_2mgt 1 . 8 . 4250 . 2 1 14 HIS ND1 N 5.802 5.679 -3.885 . . . 1.0 . . . . . . . . . . . . B . 13 HIS ND1 . . . . . . . . . c19602_2mgt 1 . 8 . 4251 . 2 1 14 HIS NE2 N 6.323 4.018 -5.237 . . . 1.0 . . . . . . . . . . . . B . 13 HIS NE2 . . . . . . . . . c19602_2mgt 1 . 8 . 4252 . 2 1 14 HIS O O 5.414 5.629 0.971 . . . 1.0 . . . . . . . . . . . . B . 13 HIS O . . . . . . . . . c19602_2mgt 1 . 8 . 4253 . 2 1 15 HIS C C 6.486 2.545 3.619 . . . 1.0 . . . . . . . . . . . . B . 14 HIS C . . . . . . . . . c19602_2mgt 1 . 8 . 4254 . 2 1 15 HIS CA C 5.661 3.625 2.905 . . . 1.0 . . . . . . . . . . . . B . 14 HIS CA . . . . . . . . . c19602_2mgt 1 . 8 . 4255 . 2 1 15 HIS CB C 4.267 3.803 3.514 . . . 1.0 . . . . . . . . . . . . B . 14 HIS CB . . . . . . . . . c19602_2mgt 1 . 8 . 4256 . 2 1 15 HIS CD2 C 2.506 2.236 2.514 . . . 1.0 . . . . . . . . . . . . B . 14 HIS CD2 . . . . . . . . . c19602_2mgt 1 . 8 . 4257 . 2 1 15 HIS CE1 C 2.356 0.748 4.114 . . . 1.0 . . . . . . . . . . . . B . 14 HIS CE1 . . . . . . . . . c19602_2mgt 1 . 8 . 4258 . 2 1 15 HIS CG C 3.404 2.572 3.487 . . . 1.0 . . . . . . . . . . . . B . 14 HIS CG . . . . . . . . . c19602_2mgt 1 . 8 . 4259 . 2 1 15 HIS H H 5.744 2.506 1.097 . . . 1.0 . . . . . . . . . . . . B . 14 HIS H . . . . . . . . . c19602_2mgt 1 . 8 . 4260 . 2 1 15 HIS HA H 6.189 4.560 3.078 . . . 1.0 . . . . . . . . . . . . B . 14 HIS HA . . . . . . . . . c19602_2mgt 1 . 8 . 4261 . 2 1 15 HIS HB2 H 4.381 4.120 4.551 . . . 1.0 . . . . . . . . . . . . B . 14 HIS HB2 . . . . . . . . . c19602_2mgt 1 . 8 . 4262 . 2 1 15 HIS HB3 H 3.748 4.606 2.989 . . . 1.0 . . . . . . . . . . . . B . 14 HIS HB3 . . . . . . . . . c19602_2mgt 1 . 8 . 4263 . 2 1 15 HIS HD1 H 3.822 1.611 5.345 . . . 1.0 . . . . . . . . . . . . B . 14 HIS HD1 . . . . . . . . . c19602_2mgt 1 . 8 . 4264 . 2 1 15 HIS HD2 H 2.314 2.794 1.610 . . . 1.0 . . . . . . . . . . . . B . 14 HIS HD2 . . . . . . . . . c19602_2mgt 1 . 8 . 4265 . 2 1 15 HIS HE1 H 2.041 -0.096 4.708 . . . 1.0 . . . . . . . . . . . . B . 14 HIS HE1 . . . . . . . . . c19602_2mgt 1 . 8 . 4266 . 2 1 15 HIS N N 5.591 3.440 1.457 . . . 1.0 . . . . . . . . . . . . B . 14 HIS N . . . . . . . . . c19602_2mgt 1 . 8 . 4267 . 2 1 15 HIS ND1 N 3.297 1.630 4.482 . . . 1.0 . . . . . . . . . . . . B . 14 HIS ND1 . . . . . . . . . c19602_2mgt 1 . 8 . 4268 . 2 1 15 HIS NE2 N 1.846 1.073 2.917 . . . 1.0 . . . . . . . . . . . . B . 14 HIS NE2 . . . . . . . . . c19602_2mgt 1 . 8 . 4269 . 2 1 15 HIS O O 6.609 2.616 4.838 . . . 1.0 . . . . . . . . . . . . B . 14 HIS O . . . . . . . . . c19602_2mgt 1 . 8 . 4270 . 2 1 16 GLN C C 9.482 1.167 3.220 . . . 1.0 . . . . . . . . . . . . B . 15 GLN C . . . . . . . . . c19602_2mgt 1 . 8 . 4271 . 2 1 16 GLN CA C 8.061 0.644 3.439 . . . 1.0 . . . . . . . . . . . . B . 15 GLN CA . . . . . . . . . c19602_2mgt 1 . 8 . 4272 . 2 1 16 GLN CB C 7.865 -0.745 2.819 . . . 1.0 . . . . . . . . . . . . B . 15 GLN CB . . . . . . . . . c19602_2mgt 1 . 8 . 4273 . 2 1 16 GLN CD C 6.322 -2.751 2.757 . . . 1.0 . . . . . . . . . . . . B . 15 GLN CD . . . . . . . . . c19602_2mgt 1 . 8 . 4274 . 2 1 16 GLN CG C 6.494 -1.308 3.205 . . . 1.0 . . . . . . . . . . . . B . 15 GLN CG . . . . . . . . . c19602_2mgt 1 . 8 . 4275 . 2 1 16 GLN H H 6.930 1.536 1.907 . . . 1.0 . . . . . . . . . . . . B . 15 GLN H . . . . . . . . . c19602_2mgt 1 . 8 . 4276 . 2 1 16 GLN HA H 7.905 0.551 4.510 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HA . . . . . . . . . c19602_2mgt 1 . 8 . 4277 . 2 1 16 GLN HB2 H 7.963 -0.694 1.736 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HB2 . . . . . . . . . c19602_2mgt 1 . 8 . 4278 . 2 1 16 GLN HB3 H 8.629 -1.416 3.204 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HB3 . . . . . . . . . c19602_2mgt 1 . 8 . 4279 . 2 1 16 GLN HE21 H 6.040 -3.379 4.671 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HE21 . . . . . . . . . c19602_2mgt 1 . 8 . 4280 . 2 1 16 GLN HE22 H 5.965 -4.629 3.446 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HE22 . . . . . . . . . c19602_2mgt 1 . 8 . 4281 . 2 1 16 GLN HG2 H 6.413 -1.258 4.288 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HG2 . . . . . . . . . c19602_2mgt 1 . 8 . 4282 . 2 1 16 GLN HG3 H 5.693 -0.710 2.772 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HG3 . . . . . . . . . c19602_2mgt 1 . 8 . 4283 . 2 1 16 GLN N N 7.082 1.581 2.900 . . . 1.0 . . . . . . . . . . . . B . 15 GLN N . . . . . . . . . c19602_2mgt 1 . 8 . 4284 . 2 1 16 GLN NE2 N 6.078 -3.659 3.700 . . . 1.0 . . . . . . . . . . . . B . 15 GLN NE2 . . . . . . . . . c19602_2mgt 1 . 8 . 4285 . 2 1 16 GLN O O 9.701 2.116 2.474 . . . 1.0 . . . . . . . . . . . . B . 15 GLN O . . . . . . . . . c19602_2mgt 1 . 8 . 4286 . 2 1 16 GLN OE1 O 6.414 -3.047 1.573 . . . 1.0 . . . . . . . . . . . . B . 15 GLN OE1 . . . . . . . . . c19602_2mgt 1 . 8 . 4287 . 2 1 17 LYS C C 12.644 0.662 2.653 . . . 1.0 . . . . . . . . . . . . B . 16 LYS C . . . . . . . . . c19602_2mgt 1 . 8 . 4288 . 2 1 17 LYS CA C 11.847 1.020 3.922 . . . 1.0 . . . . . . . . . . . . B . 16 LYS CA . . . . . . . . . c19602_2mgt 1 . 8 . 4289 . 2 1 17 LYS CB C 12.520 0.484 5.196 . . . 1.0 . . . . . . . . . . . . B . 16 LYS CB . . . . . . . . . c19602_2mgt 1 . 8 . 4290 . 2 1 17 LYS CD C 12.341 0.292 7.739 . . . 1.0 . . . . . . . . . . . . B . 16 LYS CD . . . . . . . . . c19602_2mgt 1 . 8 . 4291 . 2 1 17 LYS CE C 13.816 0.620 7.942 . . . 1.0 . . . . . . . . . . . . B . 16 LYS CE . . . . . . . . . c19602_2mgt 1 . 8 . 4292 . 2 1 17 LYS CG C 11.829 0.988 6.478 . . . 1.0 . . . . . . . . . . . . B . 16 LYS CG . . . . . . . . . c19602_2mgt 1 . 8 . 4293 . 2 1 17 LYS H H 10.232 -0.241 4.463 . . . 1.0 . . . . . . . . . . . . B . 16 LYS H . . . . . . . . . c19602_2mgt 1 . 8 . 4294 . 2 1 17 LYS HA H 11.827 2.107 3.993 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HA . . . . . . . . . c19602_2mgt 1 . 8 . 4295 . 2 1 17 LYS HB2 H 12.509 -0.606 5.173 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HB2 . . . . . . . . . c19602_2mgt 1 . 8 . 4296 . 2 1 17 LYS HB3 H 13.559 0.815 5.210 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HB3 . . . . . . . . . c19602_2mgt 1 . 8 . 4297 . 2 1 17 LYS HD2 H 11.773 0.644 8.600 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HD2 . . . . . . . . . c19602_2mgt 1 . 8 . 4298 . 2 1 17 LYS HD3 H 12.208 -0.787 7.644 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HD3 . . . . . . . . . c19602_2mgt 1 . 8 . 4299 . 2 1 17 LYS HE2 H 14.378 0.327 7.056 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HE2 . . . . . . . . . c19602_2mgt 1 . 8 . 4300 . 2 1 17 LYS HE3 H 13.924 1.692 8.088 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HE3 . . . . . . . . . c19602_2mgt 1 . 8 . 4301 . 2 1 17 LYS HG2 H 11.985 2.062 6.574 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HG2 . . . . . . . . . c19602_2mgt 1 . 8 . 4302 . 2 1 17 LYS HG3 H 10.760 0.811 6.417 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HG3 . . . . . . . . . c19602_2mgt 1 . 8 . 4303 . 2 1 17 LYS HZ1 H 13.896 0.223 9.941 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HZ1 . . . . . . . . . c19602_2mgt 1 . 8 . 4304 . 2 1 17 LYS HZ2 H 14.233 -1.072 8.979 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HZ2 . . . . . . . . . c19602_2mgt 1 . 8 . 4305 . 2 1 17 LYS HZ3 H 15.354 0.112 9.177 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HZ3 . . . . . . . . . c19602_2mgt 1 . 8 . 4306 . 2 1 17 LYS N N 10.464 0.549 3.879 . . . 1.0 . . . . . . . . . . . . B . 16 LYS N . . . . . . . . . c19602_2mgt 1 . 8 . 4307 . 2 1 17 LYS NZ N 14.365 -0.079 9.101 . . . 1.0 . . . . . . . . . . . . B . 16 LYS NZ . . . . . . . . . c19602_2mgt 1 . 8 . 4308 . 2 1 17 LYS O O 13.866 0.748 2.649 . . . 1.0 . . . . . . . . . . . . B . 16 LYS O . . . . . . . . . c19602_2mgt 1 . 8 . 4309 . 2 1 18 NH2 HN1 H 10.989 0.178 1.576 . . . 1.0 . . . . . . . . . . . . B . 17 NH2 HN1 . . . . . . . . . c19602_2mgt 1 . 8 . 4310 . 2 1 18 NH2 HN2 H 12.515 0.001 0.736 . . . 1.0 . . . . . . . . . . . . B . 17 NH2 HN2 . . . . . . . . . c19602_2mgt 1 . 8 . 4311 . 2 1 18 NH2 N N 11.996 0.246 1.566 . . . 1.0 . . . . . . . . . . . . B . 17 NH2 N . . . . . . . . . c19602_2mgt 1 . 8 . 4312 . 3 2 1 ZN ZN Zn 0.638 -0.113 1.715 . . . 1.0 . . . . . . . . . . . . A . 101 ZN ZN . . . . . . . . . c19602_2mgt 1 . 9 . 4313 . 1 1 1 ACE C C -11.357 -6.484 0.071 . . . 1.0 . . . . . . . . . . . . A . 0 ACE C . . . . . . . . . c19602_2mgt 1 . 9 . 4314 . 1 1 1 ACE CH3 C -9.936 -5.960 0.178 . . . 1.0 . . . . . . . . . . . . A . 0 ACE CH3 . . . . . . . . . c19602_2mgt 1 . 9 . 4315 . 1 1 1 ACE H1 H -9.782 -5.186 -0.569 . . . 1.0 . . . . . . . . . . . . A . 0 ACE H1 . . . . . . . . . c19602_2mgt 1 . 9 . 4316 . 1 1 1 ACE H2 H -9.787 -5.528 1.166 . . . 1.0 . . . . . . . . . . . . A . 0 ACE H2 . . . . . . . . . c19602_2mgt 1 . 9 . 4317 . 1 1 1 ACE H3 H -9.224 -6.769 0.016 . . . 1.0 . . . . . . . . . . . . A . 0 ACE H3 . . . . . . . . . c19602_2mgt 1 . 9 . 4318 . 1 1 1 ACE O O -11.557 -7.672 -0.155 . . . 1.0 . . . . . . . . . . . . A . 0 ACE O . . . . . . . . . c19602_2mgt 1 . 9 . 4319 . 1 1 2 ASP C C -14.598 -4.648 0.074 . . . 1.0 . . . . . . . . . . . . A . 1 ASP C . . . . . . . . . c19602_2mgt 1 . 9 . 4320 . 1 1 2 ASP CA C -13.761 -5.922 0.196 . . . 1.0 . . . . . . . . . . . . A . 1 ASP CA . . . . . . . . . c19602_2mgt 1 . 9 . 4321 . 1 1 2 ASP CB C -14.166 -6.748 1.433 . . . 1.0 . . . . . . . . . . . . A . 1 ASP CB . . . . . . . . . c19602_2mgt 1 . 9 . 4322 . 1 1 2 ASP CG C -15.101 -7.875 1.025 . . . 1.0 . . . . . . . . . . . . A . 1 ASP CG . . . . . . . . . c19602_2mgt 1 . 9 . 4323 . 1 1 2 ASP H H -12.099 -4.627 0.401 . . . 1.0 . . . . . . . . . . . . A . 1 ASP H . . . . . . . . . c19602_2mgt 1 . 9 . 4324 . 1 1 2 ASP HA H -13.937 -6.525 -0.695 . . . 1.0 . . . . . . . . . . . . A . 1 ASP HA . . . . . . . . . c19602_2mgt 1 . 9 . 4325 . 1 1 2 ASP HB2 H -13.288 -7.180 1.915 . . . 1.0 . . . . . . . . . . . . A . 1 ASP HB2 . . . . . . . . . c19602_2mgt 1 . 9 . 4326 . 1 1 2 ASP HB3 H -14.662 -6.111 2.164 . . . 1.0 . . . . . . . . . . . . A . 1 ASP HB3 . . . . . . . . . c19602_2mgt 1 . 9 . 4327 . 1 1 2 ASP N N -12.339 -5.593 0.228 . . . 1.0 . . . . . . . . . . . . A . 1 ASP N . . . . . . . . . c19602_2mgt 1 . 9 . 4328 . 1 1 2 ASP O O -14.100 -3.568 0.380 . . . 1.0 . . . . . . . . . . . . A . 1 ASP O . . . . . . . . . c19602_2mgt 1 . 9 . 4329 . 1 1 2 ASP OD1 O -16.212 -7.557 0.569 . . . 1.0 . . . . . . . . . . . . A . 1 ASP OD1 . . . . . . . . . c19602_2mgt 1 . 9 . 4330 . 1 1 2 ASP OD2 O -14.690 -9.048 1.125 . . . 1.0 . . . . . . . . . . . . A . 1 ASP OD2 . . . . . . . . . c19602_2mgt 1 . 9 . 4331 . 1 1 3 ALA C C -16.893 -2.661 0.456 . . . 1.0 . . . . . . . . . . . . A . 2 ALA C . . . . . . . . . c19602_2mgt 1 . 9 . 4332 . 1 1 3 ALA CA C -16.752 -3.669 -0.684 . . . 1.0 . . . . . . . . . . . . A . 2 ALA CA . . . . . . . . . c19602_2mgt 1 . 9 . 4333 . 1 1 3 ALA CB C -18.134 -4.219 -1.056 . . . 1.0 . . . . . . . . . . . . A . 2 ALA CB . . . . . . . . . c19602_2mgt 1 . 9 . 4334 . 1 1 3 ALA H H -16.206 -5.709 -0.557 . . . 1.0 . . . . . . . . . . . . A . 2 ALA H . . . . . . . . . c19602_2mgt 1 . 9 . 4335 . 1 1 3 ALA HA H -16.339 -3.153 -1.547 . . . 1.0 . . . . . . . . . . . . A . 2 ALA HA . . . . . . . . . c19602_2mgt 1 . 9 . 4336 . 1 1 3 ALA HB1 H -18.541 -4.808 -0.235 . . . 1.0 . . . . . . . . . . . . A . 2 ALA HB1 . . . . . . . . . c19602_2mgt 1 . 9 . 4337 . 1 1 3 ALA HB2 H -18.807 -3.386 -1.254 . . . 1.0 . . . . . . . . . . . . A . 2 ALA HB2 . . . . . . . . . c19602_2mgt 1 . 9 . 4338 . 1 1 3 ALA HB3 H -18.069 -4.841 -1.945 . . . 1.0 . . . . . . . . . . . . A . 2 ALA HB3 . . . . . . . . . c19602_2mgt 1 . 9 . 4339 . 1 1 3 ALA N N -15.860 -4.780 -0.361 . . . 1.0 . . . . . . . . . . . . A . 2 ALA N . . . . . . . . . c19602_2mgt 1 . 9 . 4340 . 1 1 3 ALA O O -16.795 -1.462 0.220 . . . 1.0 . . . . . . . . . . . . A . 2 ALA O . . . . . . . . . c19602_2mgt 1 . 9 . 4341 . 1 1 4 GLU C C -15.944 -1.559 3.236 . . . 1.0 . . . . . . . . . . . . A . 3 GLU C . . . . . . . . . c19602_2mgt 1 . 9 . 4342 . 1 1 4 GLU CA C -17.206 -2.353 2.902 . . . 1.0 . . . . . . . . . . . . A . 3 GLU CA . . . . . . . . . c19602_2mgt 1 . 9 . 4343 . 1 1 4 GLU CB C -17.558 -3.284 4.066 . . . 1.0 . . . . . . . . . . . . A . 3 GLU CB . . . . . . . . . c19602_2mgt 1 . 9 . 4344 . 1 1 4 GLU CD C -16.848 -5.372 5.266 . . . 1.0 . . . . . . . . . . . . A . 3 GLU CD . . . . . . . . . c19602_2mgt 1 . 9 . 4345 . 1 1 4 GLU CG C -16.388 -4.220 4.398 . . . 1.0 . . . . . . . . . . . . A . 3 GLU CG . . . . . . . . . c19602_2mgt 1 . 9 . 4346 . 1 1 4 GLU H H -17.145 -4.153 1.791 . . . 1.0 . . . . . . . . . . . . A . 3 GLU H . . . . . . . . . c19602_2mgt 1 . 9 . 4347 . 1 1 4 GLU HA H -18.021 -1.645 2.772 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HA . . . . . . . . . c19602_2mgt 1 . 9 . 4348 . 1 1 4 GLU HB2 H -17.797 -2.690 4.947 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HB2 . . . . . . . . . c19602_2mgt 1 . 9 . 4349 . 1 1 4 GLU HB3 H -18.437 -3.868 3.798 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HB3 . . . . . . . . . c19602_2mgt 1 . 9 . 4350 . 1 1 4 GLU HG2 H -15.970 -4.636 3.480 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HG2 . . . . . . . . . c19602_2mgt 1 . 9 . 4351 . 1 1 4 GLU HG3 H -15.611 -3.658 4.906 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HG3 . . . . . . . . . c19602_2mgt 1 . 9 . 4352 . 1 1 4 GLU N N -17.081 -3.151 1.686 . . . 1.0 . . . . . . . . . . . . A . 3 GLU N . . . . . . . . . c19602_2mgt 1 . 9 . 4353 . 1 1 4 GLU O O -16.032 -0.632 4.030 . . . 1.0 . . . . . . . . . . . . A . 3 GLU O . . . . . . . . . c19602_2mgt 1 . 9 . 4354 . 1 1 4 GLU OE1 O -17.399 -6.317 4.721 . . . 1.0 . . . . . . . . . . . . A . 3 GLU OE1 . . . . . . . . . c19602_2mgt 1 . 9 . 4355 . 1 1 4 GLU OE2 O -16.624 -5.278 6.511 . . . 1.0 . . . . . . . . . . . . A . 3 GLU OE2 . . . . . . . . . c19602_2mgt 1 . 9 . 4356 . 1 1 5 PHE C C -13.206 -0.355 1.580 . . . 1.0 . . . . . . . . . . . . A . 4 PHE C . . . . . . . . . c19602_2mgt 1 . 9 . 4357 . 1 1 5 PHE CA C -13.533 -1.205 2.798 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CA . . . . . . . . . c19602_2mgt 1 . 9 . 4358 . 1 1 5 PHE CB C -12.397 -2.195 3.050 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CB . . . . . . . . . c19602_2mgt 1 . 9 . 4359 . 1 1 5 PHE CD1 C -13.015 -2.778 5.440 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CD1 . . . . . . . . . c19602_2mgt 1 . 9 . 4360 . 1 1 5 PHE CD2 C -12.661 -4.566 3.831 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CD2 . . . . . . . . . c19602_2mgt 1 . 9 . 4361 . 1 1 5 PHE CE1 C -13.286 -3.727 6.439 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CE1 . . . . . . . . . c19602_2mgt 1 . 9 . 4362 . 1 1 5 PHE CE2 C -12.941 -5.516 4.821 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CE2 . . . . . . . . . c19602_2mgt 1 . 9 . 4363 . 1 1 5 PHE CG C -12.682 -3.200 4.140 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CG . . . . . . . . . c19602_2mgt 1 . 9 . 4364 . 1 1 5 PHE CZ C -13.240 -5.095 6.127 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CZ . . . . . . . . . c19602_2mgt 1 . 9 . 4365 . 1 1 5 PHE H H -14.794 -2.734 2.064 . . . 1.0 . . . . . . . . . . . . A . 4 PHE H . . . . . . . . . c19602_2mgt 1 . 9 . 4366 . 1 1 5 PHE HA H -13.595 -0.536 3.649 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HA . . . . . . . . . c19602_2mgt 1 . 9 . 4367 . 1 1 5 PHE HB2 H -12.189 -2.725 2.121 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HB2 . . . . . . . . . c19602_2mgt 1 . 9 . 4368 . 1 1 5 PHE HB3 H -11.499 -1.639 3.322 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HB3 . . . . . . . . . c19602_2mgt 1 . 9 . 4369 . 1 1 5 PHE HD1 H -13.082 -1.726 5.662 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HD1 . . . . . . . . . c19602_2mgt 1 . 9 . 4370 . 1 1 5 PHE HD2 H -12.446 -4.879 2.824 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HD2 . . . . . . . . . c19602_2mgt 1 . 9 . 4371 . 1 1 5 PHE HE1 H -13.541 -3.406 7.438 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HE1 . . . . . . . . . c19602_2mgt 1 . 9 . 4372 . 1 1 5 PHE HE2 H -12.934 -6.566 4.573 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HE2 . . . . . . . . . c19602_2mgt 1 . 9 . 4373 . 1 1 5 PHE HZ H -13.454 -5.825 6.887 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HZ . . . . . . . . . c19602_2mgt 1 . 9 . 4374 . 1 1 5 PHE N N -14.794 -1.917 2.657 . . . 1.0 . . . . . . . . . . . . A . 4 PHE N . . . . . . . . . c19602_2mgt 1 . 9 . 4375 . 1 1 5 PHE O O -12.410 0.562 1.730 . . . 1.0 . . . . . . . . . . . . A . 4 PHE O . . . . . . . . . c19602_2mgt 1 . 9 . 4376 . 1 1 6 ARG C C -14.377 1.586 -0.661 . . . 1.0 . . . . . . . . . . . . A . 5 ARG C . . . . . . . . . c19602_2mgt 1 . 9 . 4377 . 1 1 6 ARG CA C -13.664 0.228 -0.788 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CA . . . . . . . . . c19602_2mgt 1 . 9 . 4378 . 1 1 6 ARG CB C -14.129 -0.541 -2.036 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CB . . . . . . . . . c19602_2mgt 1 . 9 . 4379 . 1 1 6 ARG CD C -11.858 -1.763 -2.180 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CD . . . . . . . . . c19602_2mgt 1 . 9 . 4380 . 1 1 6 ARG CG C -13.372 -1.827 -2.407 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CG . . . . . . . . . c19602_2mgt 1 . 9 . 4381 . 1 1 6 ARG CZ C -10.041 -0.587 -3.453 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CZ . . . . . . . . . c19602_2mgt 1 . 9 . 4382 . 1 1 6 ARG H H -14.472 -1.368 0.354 . . . 1.0 . . . . . . . . . . . . A . 5 ARG H . . . . . . . . . c19602_2mgt 1 . 9 . 4383 . 1 1 6 ARG HA H -12.604 0.447 -0.891 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HA . . . . . . . . . c19602_2mgt 1 . 9 . 4384 . 1 1 6 ARG HB2 H -15.180 -0.783 -1.902 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HB2 . . . . . . . . . c19602_2mgt 1 . 9 . 4385 . 1 1 6 ARG HB3 H -14.035 0.128 -2.889 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HB3 . . . . . . . . . c19602_2mgt 1 . 9 . 4386 . 1 1 6 ARG HD2 H -11.662 -1.646 -1.116 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HD2 . . . . . . . . . c19602_2mgt 1 . 9 . 4387 . 1 1 6 ARG HD3 H -11.409 -2.698 -2.501 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HD3 . . . . . . . . . c19602_2mgt 1 . 9 . 4388 . 1 1 6 ARG HE H -11.823 0.201 -2.964 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HE . . . . . . . . . c19602_2mgt 1 . 9 . 4389 . 1 1 6 ARG HG2 H -13.774 -2.658 -1.840 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HG2 . . . . . . . . . c19602_2mgt 1 . 9 . 4390 . 1 1 6 ARG HG3 H -13.562 -2.040 -3.459 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HG3 . . . . . . . . . c19602_2mgt 1 . 9 . 4391 . 1 1 6 ARG HH11 H -9.508 -2.506 -3.024 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH11 . . . . . . . . . c19602_2mgt 1 . 9 . 4392 . 1 1 6 ARG HH12 H -8.309 -1.569 -3.879 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH12 . . . . . . . . . c19602_2mgt 1 . 9 . 4393 . 1 1 6 ARG HH21 H -10.244 1.347 -4.048 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH21 . . . . . . . . . c19602_2mgt 1 . 9 . 4394 . 1 1 6 ARG HH22 H -8.713 0.593 -4.436 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH22 . . . . . . . . . c19602_2mgt 1 . 9 . 4395 . 1 1 6 ARG N N -13.827 -0.593 0.413 . . . 1.0 . . . . . . . . . . . . A . 5 ARG N . . . . . . . . . c19602_2mgt 1 . 9 . 4396 . 1 1 6 ARG NE N -11.260 -0.636 -2.905 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NE . . . . . . . . . c19602_2mgt 1 . 9 . 4397 . 1 1 6 ARG NH1 N -9.218 -1.634 -3.442 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NH1 . . . . . . . . . c19602_2mgt 1 . 9 . 4398 . 1 1 6 ARG NH2 N -9.636 0.541 -4.030 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NH2 . . . . . . . . . c19602_2mgt 1 . 9 . 4399 . 1 1 6 ARG O O -14.964 2.096 -1.613 . . . 1.0 . . . . . . . . . . . . A . 5 ARG O . . . . . . . . . c19602_2mgt 1 . 9 . 4400 . 1 1 7 ARG C C -13.984 4.567 0.552 . . . 1.0 . . . . . . . . . . . . A . 6 ARG C . . . . . . . . . c19602_2mgt 1 . 9 . 4401 . 1 1 7 ARG CA C -14.912 3.418 0.929 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CA . . . . . . . . . c19602_2mgt 1 . 9 . 4402 . 1 1 7 ARG CB C -15.169 3.422 2.442 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CB . . . . . . . . . c19602_2mgt 1 . 9 . 4403 . 1 1 7 ARG CD C -17.342 2.011 2.376 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CD . . . . . . . . . c19602_2mgt 1 . 9 . 4404 . 1 1 7 ARG CG C -15.942 2.206 2.964 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CG . . . . . . . . . c19602_2mgt 1 . 9 . 4405 . 1 1 7 ARG CZ C -17.931 1.696 -0.040 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CZ . . . . . . . . . c19602_2mgt 1 . 9 . 4406 . 1 1 7 ARG H H -13.863 1.662 1.280 . . . 1.0 . . . . . . . . . . . . A . 6 ARG H . . . . . . . . . c19602_2mgt 1 . 9 . 4407 . 1 1 7 ARG HA H -15.862 3.535 0.418 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HA . . . . . . . . . c19602_2mgt 1 . 9 . 4408 . 1 1 7 ARG HB2 H -14.209 3.442 2.958 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HB2 . . . . . . . . . c19602_2mgt 1 . 9 . 4409 . 1 1 7 ARG HB3 H -15.722 4.324 2.699 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HB3 . . . . . . . . . c19602_2mgt 1 . 9 . 4410 . 1 1 7 ARG HD2 H -17.918 1.400 3.070 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HD2 . . . . . . . . . c19602_2mgt 1 . 9 . 4411 . 1 1 7 ARG HD3 H -17.820 2.983 2.281 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HD3 . . . . . . . . . c19602_2mgt 1 . 9 . 4412 . 1 1 7 ARG HE H -16.833 0.421 1.075 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HE . . . . . . . . . c19602_2mgt 1 . 9 . 4413 . 1 1 7 ARG HG2 H -15.342 1.322 2.773 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HG2 . . . . . . . . . c19602_2mgt 1 . 9 . 4414 . 1 1 7 ARG HG3 H -16.048 2.314 4.043 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HG3 . . . . . . . . . c19602_2mgt 1 . 9 . 4415 . 1 1 7 ARG HH11 H -18.779 3.396 0.705 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH11 . . . . . . . . . c19602_2mgt 1 . 9 . 4416 . 1 1 7 ARG HH12 H -19.121 3.061 -0.974 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH12 . . . . . . . . . c19602_2mgt 1 . 9 . 4417 . 1 1 7 ARG HH21 H -17.288 0.076 -1.087 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH21 . . . . . . . . . c19602_2mgt 1 . 9 . 4418 . 1 1 7 ARG HH22 H -18.279 1.205 -1.983 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH22 . . . . . . . . . c19602_2mgt 1 . 9 . 4419 . 1 1 7 ARG N N -14.338 2.157 0.543 . . . 1.0 . . . . . . . . . . . . A . 6 ARG N . . . . . . . . . c19602_2mgt 1 . 9 . 4420 . 1 1 7 ARG NE N -17.326 1.304 1.091 . . . 1.0 . . . . . . . . . . . . A . 6 ARG NE . . . . . . . . . c19602_2mgt 1 . 9 . 4421 . 1 1 7 ARG NH1 N -18.661 2.813 -0.111 . . . 1.0 . . . . . . . . . . . . A . 6 ARG NH1 . . . . . . . . . c19602_2mgt 1 . 9 . 4422 . 1 1 7 ARG NH2 N -17.806 0.942 -1.131 . . . 1.0 . . . . . . . . . . . . A . 6 ARG NH2 . . . . . . . . . c19602_2mgt 1 . 9 . 4423 . 1 1 7 ARG O O -12.803 4.391 0.245 . . . 1.0 . . . . . . . . . . . . A . 6 ARG O . . . . . . . . . c19602_2mgt 1 . 9 . 4424 . 1 1 8 ASP C C -13.021 7.457 1.560 . . . 1.0 . . . . . . . . . . . . A . 7 ASP C . . . . . . . . . c19602_2mgt 1 . 9 . 4425 . 1 1 8 ASP CA C -13.903 7.023 0.387 . . . 1.0 . . . . . . . . . . . . A . 7 ASP CA . . . . . . . . . c19602_2mgt 1 . 9 . 4426 . 1 1 8 ASP CB C -15.021 8.042 0.173 . . . 1.0 . . . . . . . . . . . . A . 7 ASP CB . . . . . . . . . c19602_2mgt 1 . 9 . 4427 . 1 1 8 ASP CG C -14.461 9.429 -0.052 . . . 1.0 . . . . . . . . . . . . A . 7 ASP CG . . . . . . . . . c19602_2mgt 1 . 9 . 4428 . 1 1 8 ASP H H -15.532 5.804 0.894 . . . 1.0 . . . . . . . . . . . . A . 7 ASP H . . . . . . . . . c19602_2mgt 1 . 9 . 4429 . 1 1 8 ASP HA H -13.296 6.951 -0.516 . . . 1.0 . . . . . . . . . . . . A . 7 ASP HA . . . . . . . . . c19602_2mgt 1 . 9 . 4430 . 1 1 8 ASP HB2 H -15.645 7.747 -0.663 . . . 1.0 . . . . . . . . . . . . A . 7 ASP HB2 . . . . . . . . . c19602_2mgt 1 . 9 . 4431 . 1 1 8 ASP HB3 H -15.649 8.078 1.073 . . . 1.0 . . . . . . . . . . . . A . 7 ASP HB3 . . . . . . . . . c19602_2mgt 1 . 9 . 4432 . 1 1 8 ASP N N -14.556 5.761 0.635 . . . 1.0 . . . . . . . . . . . . A . 7 ASP N . . . . . . . . . c19602_2mgt 1 . 9 . 4433 . 1 1 8 ASP O O -12.003 8.103 1.346 . . . 1.0 . . . . . . . . . . . . A . 7 ASP O . . . . . . . . . c19602_2mgt 1 . 9 . 4434 . 1 1 8 ASP OD1 O -13.945 9.631 -1.224 . . . 1.0 . . . . . . . . . . . . A . 7 ASP OD1 . . . . . . . . . c19602_2mgt 1 . 9 . 4435 . 1 1 8 ASP OD2 O -14.488 10.229 0.837 . . . 1.0 . . . . . . . . . . . . A . 7 ASP OD2 . . . . . . . . . c19602_2mgt 1 . 9 . 4436 . 1 1 9 SER C C -11.579 7.349 4.489 . . . 1.0 . . . . . . . . . . . . A . 8 SER C . . . . . . . . . c19602_2mgt 1 . 9 . 4437 . 1 1 9 SER CA C -12.945 7.831 3.985 . . . 1.0 . . . . . . . . . . . . A . 8 SER CA . . . . . . . . . c19602_2mgt 1 . 9 . 4438 . 1 1 9 SER CB C -13.989 7.710 5.098 . . . 1.0 . . . . . . . . . . . . A . 8 SER CB . . . . . . . . . c19602_2mgt 1 . 9 . 4439 . 1 1 9 SER H H -14.264 6.596 2.907 . . . 1.0 . . . . . . . . . . . . A . 8 SER H . . . . . . . . . c19602_2mgt 1 . 9 . 4440 . 1 1 9 SER HA H -12.850 8.886 3.733 . . . 1.0 . . . . . . . . . . . . A . 8 SER HA . . . . . . . . . c19602_2mgt 1 . 9 . 4441 . 1 1 9 SER HB2 H -13.979 6.689 5.474 . . . 1.0 . . . . . . . . . . . . A . 8 SER HB2 . . . . . . . . . c19602_2mgt 1 . 9 . 4442 . 1 1 9 SER HB3 H -13.728 8.394 5.904 . . . 1.0 . . . . . . . . . . . . A . 8 SER HB3 . . . . . . . . . c19602_2mgt 1 . 9 . 4443 . 1 1 9 SER HG H -15.303 8.909 4.309 . . . 1.0 . . . . . . . . . . . . A . 8 SER HG . . . . . . . . . c19602_2mgt 1 . 9 . 4444 . 1 1 9 SER N N -13.426 7.143 2.795 . . . 1.0 . . . . . . . . . . . . A . 8 SER N . . . . . . . . . c19602_2mgt 1 . 9 . 4445 . 1 1 9 SER O O -11.198 7.718 5.595 . . . 1.0 . . . . . . . . . . . . A . 8 SER O . . . . . . . . . c19602_2mgt 1 . 9 . 4446 . 1 1 9 SER OG O -15.292 8.009 4.650 . . . 1.0 . . . . . . . . . . . . A . 8 SER OG . . . . . . . . . c19602_2mgt 1 . 9 . 4447 . 1 1 10 GLY C C -8.638 6.731 2.877 . . . 1.0 . . . . . . . . . . . . A . 9 GLY C . . . . . . . . . c19602_2mgt 1 . 9 . 4448 . 1 1 10 GLY CA C -9.472 6.175 4.025 . . . 1.0 . . . . . . . . . . . . A . 9 GLY CA . . . . . . . . . c19602_2mgt 1 . 9 . 4449 . 1 1 10 GLY H H -11.147 6.308 2.789 . . . 1.0 . . . . . . . . . . . . A . 9 GLY H . . . . . . . . . c19602_2mgt 1 . 9 . 4450 . 1 1 10 GLY HA2 H -9.131 6.604 4.966 . . . 1.0 . . . . . . . . . . . . A . 9 GLY HA2 . . . . . . . . . c19602_2mgt 1 . 9 . 4451 . 1 1 10 GLY HA3 H -9.399 5.094 4.090 . . . 1.0 . . . . . . . . . . . . A . 9 GLY HA3 . . . . . . . . . c19602_2mgt 1 . 9 . 4452 . 1 1 10 GLY N N -10.843 6.531 3.728 . . . 1.0 . . . . . . . . . . . . A . 9 GLY N . . . . . . . . . c19602_2mgt 1 . 9 . 4453 . 1 1 10 GLY O O -8.711 7.926 2.616 . . . 1.0 . . . . . . . . . . . . A . 9 GLY O . . . . . . . . . c19602_2mgt 1 . 9 . 4454 . 1 1 11 TYR C C -6.514 4.026 1.448 . . . 1.0 . . . . . . . . . . . . A . 10 TYR C . . . . . . . . . c19602_2mgt 1 . 9 . 4455 . 1 1 11 TYR CA C -7.703 4.502 2.269 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CA . . . . . . . . . c19602_2mgt 1 . 9 . 4456 . 1 1 11 TYR CB C -8.965 3.774 1.784 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CB . . . . . . . . . c19602_2mgt 1 . 9 . 4457 . 1 1 11 TYR CD1 C -8.798 1.905 3.489 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CD1 . . . . . . . . . c19602_2mgt 1 . 9 . 4458 . 1 1 11 TYR CD2 C -10.950 2.977 3.106 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CD2 . . . . . . . . . c19602_2mgt 1 . 9 . 4459 . 1 1 11 TYR CE1 C -9.383 1.017 4.397 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CE1 . . . . . . . . . c19602_2mgt 1 . 9 . 4460 . 1 1 11 TYR CE2 C -11.543 2.099 4.023 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CE2 . . . . . . . . . c19602_2mgt 1 . 9 . 4461 . 1 1 11 TYR CG C -9.581 2.863 2.818 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CG . . . . . . . . . c19602_2mgt 1 . 9 . 4462 . 1 1 11 TYR CZ C -10.770 1.088 4.634 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CZ . . . . . . . . . c19602_2mgt 1 . 9 . 4463 . 1 1 11 TYR H H -7.485 6.304 1.298 . . . 1.0 . . . . . . . . . . . . A . 10 TYR H . . . . . . . . . c19602_2mgt 1 . 9 . 4464 . 1 1 11 TYR HA H -7.515 4.268 3.315 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HA . . . . . . . . . c19602_2mgt 1 . 9 . 4465 . 1 1 11 TYR HB2 H -9.715 4.495 1.463 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HB2 . . . . . . . . . c19602_2mgt 1 . 9 . 4466 . 1 1 11 TYR HB3 H -8.726 3.187 0.900 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HB3 . . . . . . . . . c19602_2mgt 1 . 9 . 4467 . 1 1 11 TYR HD1 H -7.748 1.819 3.285 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HD1 . . . . . . . . . c19602_2mgt 1 . 9 . 4468 . 1 1 11 TYR HD2 H -11.547 3.733 2.618 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HD2 . . . . . . . . . c19602_2mgt 1 . 9 . 4469 . 1 1 11 TYR HE1 H -8.774 0.279 4.898 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HE1 . . . . . . . . . c19602_2mgt 1 . 9 . 4470 . 1 1 11 TYR HE2 H -12.594 2.188 4.236 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HE2 . . . . . . . . . c19602_2mgt 1 . 9 . 4471 . 1 1 11 TYR HH H -12.294 0.356 5.593 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HH . . . . . . . . . c19602_2mgt 1 . 9 . 4472 . 1 1 11 TYR N N -7.869 5.927 2.142 . . . 1.0 . . . . . . . . . . . . A . 10 TYR N . . . . . . . . . c19602_2mgt 1 . 9 . 4473 . 1 1 11 TYR O O -6.196 4.560 0.387 . . . 1.0 . . . . . . . . . . . . A . 10 TYR O . . . . . . . . . c19602_2mgt 1 . 9 . 4474 . 1 1 11 TYR OH O -11.353 0.198 5.478 . . . 1.0 . . . . . . . . . . . . A . 10 TYR OH . . . . . . . . . c19602_2mgt 1 . 9 . 4475 . 1 1 12 GLU C C -5.578 0.592 1.608 . . . 1.0 . . . . . . . . . . . . A . 11 GLU C . . . . . . . . . c19602_2mgt 1 . 9 . 4476 . 1 1 12 GLU CA C -5.187 1.997 1.137 . . . 1.0 . . . . . . . . . . . . A . 11 GLU CA . . . . . . . . . c19602_2mgt 1 . 9 . 4477 . 1 1 12 GLU CB C -3.704 2.314 1.286 . . . 1.0 . . . . . . . . . . . . A . 11 GLU CB . . . . . . . . . c19602_2mgt 1 . 9 . 4478 . 1 1 12 GLU CD C -1.515 1.391 0.540 . . . 1.0 . . . . . . . . . . . . A . 11 GLU CD . . . . . . . . . c19602_2mgt 1 . 9 . 4479 . 1 1 12 GLU CG C -2.947 1.649 0.141 . . . 1.0 . . . . . . . . . . . . A . 11 GLU CG . . . . . . . . . c19602_2mgt 1 . 9 . 4480 . 1 1 12 GLU H H -6.204 2.608 2.846 . . . 1.0 . . . . . . . . . . . . A . 11 GLU H . . . . . . . . . c19602_2mgt 1 . 9 . 4481 . 1 1 12 GLU HA H -5.479 2.125 0.096 . . . 1.0 . . . . . . . . . . . . A . 11 GLU HA . . . . . . . . . c19602_2mgt 1 . 9 . 4482 . 1 1 12 GLU HB2 H -3.549 3.388 1.220 . . . 1.0 . . . . . . . . . . . . A . 11 GLU HB2 . . . . . . . . . c19602_2mgt 1 . 9 . 4483 . 1 1 12 GLU HB3 H -3.348 1.966 2.257 . . . 1.0 . . . . . . . . . . . . A . 11 GLU HB3 . . . . . . . . . c19602_2mgt 1 . 9 . 4484 . 1 1 12 GLU HG2 H -3.424 0.705 -0.111 . . . 1.0 . . . . . . . . . . . . A . 11 GLU HG2 . . . . . . . . . c19602_2mgt 1 . 9 . 4485 . 1 1 12 GLU HG3 H -2.964 2.301 -0.733 . . . 1.0 . . . . . . . . . . . . A . 11 GLU HG3 . . . . . . . . . c19602_2mgt 1 . 9 . 4486 . 1 1 12 GLU N N -5.945 2.924 1.924 . . . 1.0 . . . . . . . . . . . . A . 11 GLU N . . . . . . . . . c19602_2mgt 1 . 9 . 4487 . 1 1 12 GLU O O -4.851 -0.066 2.353 . . . 1.0 . . . . . . . . . . . . A . 11 GLU O . . . . . . . . . c19602_2mgt 1 . 9 . 4488 . 1 1 12 GLU OE1 O -0.810 2.298 0.932 . . . 1.0 . . . . . . . . . . . . A . 11 GLU OE1 . . . . . . . . . c19602_2mgt 1 . 9 . 4489 . 1 1 12 GLU OE2 O -1.154 0.173 0.456 . . . 1.0 . . . . . . . . . . . . A . 11 GLU OE2 . . . . . . . . . c19602_2mgt 1 . 9 . 4490 . 1 1 13 VAL C C -6.592 -2.275 1.443 . . . 1.0 . . . . . . . . . . . . A . 12 VAL C . . . . . . . . . c19602_2mgt 1 . 9 . 4491 . 1 1 13 VAL CA C -7.481 -1.046 1.567 . . . 1.0 . . . . . . . . . . . . A . 12 VAL CA . . . . . . . . . c19602_2mgt 1 . 9 . 4492 . 1 1 13 VAL CB C -8.724 -1.236 0.673 . . . 1.0 . . . . . . . . . . . . A . 12 VAL CB . . . . . . . . . c19602_2mgt 1 . 9 . 4493 . 1 1 13 VAL CG1 C -9.441 -2.571 0.933 . . . 1.0 . . . . . . . . . . . . A . 12 VAL CG1 . . . . . . . . . c19602_2mgt 1 . 9 . 4494 . 1 1 13 VAL CG2 C -9.723 -0.111 0.920 . . . 1.0 . . . . . . . . . . . . A . 12 VAL CG2 . . . . . . . . . c19602_2mgt 1 . 9 . 4495 . 1 1 13 VAL H H -7.290 0.788 0.565 . . . 1.0 . . . . . . . . . . . . A . 12 VAL H . . . . . . . . . c19602_2mgt 1 . 9 . 4496 . 1 1 13 VAL HA H -7.804 -0.934 2.598 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HA . . . . . . . . . c19602_2mgt 1 . 9 . 4497 . 1 1 13 VAL HB H -8.423 -1.216 -0.374 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HB . . . . . . . . . c19602_2mgt 1 . 9 . 4498 . 1 1 13 VAL HG11 H -8.818 -3.391 0.584 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HG11 . . . . . . . . . c19602_2mgt 1 . 9 . 4499 . 1 1 13 VAL HG12 H -9.637 -2.693 1.998 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HG12 . . . . . . . . . c19602_2mgt 1 . 9 . 4500 . 1 1 13 VAL HG13 H -10.383 -2.613 0.389 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HG13 . . . . . . . . . c19602_2mgt 1 . 9 . 4501 . 1 1 13 VAL HG21 H -9.267 0.861 0.748 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HG21 . . . . . . . . . c19602_2mgt 1 . 9 . 4502 . 1 1 13 VAL HG22 H -10.555 -0.218 0.228 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HG22 . . . . . . . . . c19602_2mgt 1 . 9 . 4503 . 1 1 13 VAL HG23 H -10.065 -0.172 1.949 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HG23 . . . . . . . . . c19602_2mgt 1 . 9 . 4504 . 1 1 13 VAL N N -6.779 0.175 1.182 . . . 1.0 . . . . . . . . . . . . A . 12 VAL N . . . . . . . . . c19602_2mgt 1 . 9 . 4505 . 1 1 13 VAL O O -6.722 -3.194 2.243 . . . 1.0 . . . . . . . . . . . . A . 12 VAL O . . . . . . . . . c19602_2mgt 1 . 9 . 4506 . 1 1 14 HIS C C -3.995 -3.933 1.227 . . . 1.0 . . . . . . . . . . . . A . 13 HIS C . . . . . . . . . c19602_2mgt 1 . 9 . 4507 . 1 1 14 HIS CA C -4.897 -3.435 0.096 . . . 1.0 . . . . . . . . . . . . A . 13 HIS CA . . . . . . . . . c19602_2mgt 1 . 9 . 4508 . 1 1 14 HIS CB C -4.062 -3.116 -1.145 . . . 1.0 . . . . . . . . . . . . A . 13 HIS CB . . . . . . . . . c19602_2mgt 1 . 9 . 4509 . 1 1 14 HIS CD2 C -5.798 -2.019 -2.699 . . . 1.0 . . . . . . . . . . . . A . 13 HIS CD2 . . . . . . . . . c19602_2mgt 1 . 9 . 4510 . 1 1 14 HIS CE1 C -5.763 -3.447 -4.356 . . . 1.0 . . . . . . . . . . . . A . 13 HIS CE1 . . . . . . . . . c19602_2mgt 1 . 9 . 4511 . 1 1 14 HIS CG C -4.886 -2.993 -2.398 . . . 1.0 . . . . . . . . . . . . A . 13 HIS CG . . . . . . . . . c19602_2mgt 1 . 9 . 4512 . 1 1 14 HIS H H -5.636 -1.474 -0.152 . . . 1.0 . . . . . . . . . . . . A . 13 HIS H . . . . . . . . . c19602_2mgt 1 . 9 . 4513 . 1 1 14 HIS HA H -5.599 -4.234 -0.142 . . . 1.0 . . . . . . . . . . . . A . 13 HIS HA . . . . . . . . . c19602_2mgt 1 . 9 . 4514 . 1 1 14 HIS HB2 H -3.505 -2.198 -0.973 . . . 1.0 . . . . . . . . . . . . A . 13 HIS HB2 . . . . . . . . . c19602_2mgt 1 . 9 . 4515 . 1 1 14 HIS HB3 H -3.344 -3.920 -1.298 . . . 1.0 . . . . . . . . . . . . A . 13 HIS HB3 . . . . . . . . . c19602_2mgt 1 . 9 . 4516 . 1 1 14 HIS HD1 H -4.316 -4.715 -3.518 . . . 1.0 . . . . . . . . . . . . A . 13 HIS HD1 . . . . . . . . . c19602_2mgt 1 . 9 . 4517 . 1 1 14 HIS HD2 H -6.060 -1.176 -2.077 . . . 1.0 . . . . . . . . . . . . A . 13 HIS HD2 . . . . . . . . . c19602_2mgt 1 . 9 . 4518 . 1 1 14 HIS HE1 H -5.972 -3.947 -5.289 . . . 1.0 . . . . . . . . . . . . A . 13 HIS HE1 . . . . . . . . . c19602_2mgt 1 . 9 . 4519 . 1 1 14 HIS N N -5.698 -2.282 0.450 . . . 1.0 . . . . . . . . . . . . A . 13 HIS N . . . . . . . . . c19602_2mgt 1 . 9 . 4520 . 1 1 14 HIS ND1 N -4.876 -3.878 -3.449 . . . 1.0 . . . . . . . . . . . . A . 13 HIS ND1 . . . . . . . . . c19602_2mgt 1 . 9 . 4521 . 1 1 14 HIS NE2 N -6.346 -2.311 -3.950 . . . 1.0 . . . . . . . . . . . . A . 13 HIS NE2 . . . . . . . . . c19602_2mgt 1 . 9 . 4522 . 1 1 14 HIS O O -3.474 -5.032 1.092 . . . 1.0 . . . . . . . . . . . . A . 13 HIS O . . . . . . . . . c19602_2mgt 1 . 9 . 4523 . 1 1 15 HIS C C -3.831 -3.031 4.845 . . . 1.0 . . . . . . . . . . . . A . 14 HIS C . . . . . . . . . c19602_2mgt 1 . 9 . 4524 . 1 1 15 HIS CA C -3.328 -3.749 3.585 . . . 1.0 . . . . . . . . . . . . A . 14 HIS CA . . . . . . . . . c19602_2mgt 1 . 9 . 4525 . 1 1 15 HIS CB C -1.797 -3.800 3.534 . . . 1.0 . . . . . . . . . . . . A . 14 HIS CB . . . . . . . . . c19602_2mgt 1 . 9 . 4526 . 1 1 15 HIS CD2 C -0.647 -1.765 2.517 . . . 1.0 . . . . . . . . . . . . A . 14 HIS CD2 . . . . . . . . . c19602_2mgt 1 . 9 . 4527 . 1 1 15 HIS CE1 C -0.252 -0.578 4.306 . . . 1.0 . . . . . . . . . . . . A . 14 HIS CE1 . . . . . . . . . c19602_2mgt 1 . 9 . 4528 . 1 1 15 HIS CG C -1.123 -2.459 3.588 . . . 1.0 . . . . . . . . . . . . A . 14 HIS CG . . . . . . . . . c19602_2mgt 1 . 9 . 4529 . 1 1 15 HIS H H -4.276 -2.279 2.374 . . . 1.0 . . . . . . . . . . . . A . 14 HIS H . . . . . . . . . c19602_2mgt 1 . 9 . 4530 . 1 1 15 HIS HA H -3.686 -4.777 3.661 . . . 1.0 . . . . . . . . . . . . A . 14 HIS HA . . . . . . . . . c19602_2mgt 1 . 9 . 4531 . 1 1 15 HIS HB2 H -1.431 -4.417 4.351 . . . 1.0 . . . . . . . . . . . . A . 14 HIS HB2 . . . . . . . . . c19602_2mgt 1 . 9 . 4532 . 1 1 15 HIS HB3 H -1.497 -4.283 2.611 . . . 1.0 . . . . . . . . . . . . A . 14 HIS HB3 . . . . . . . . . c19602_2mgt 1 . 9 . 4533 . 1 1 15 HIS HD1 H -1.090 -1.952 5.659 . . . 1.0 . . . . . . . . . . . . A . 14 HIS HD1 . . . . . . . . . c19602_2mgt 1 . 9 . 4534 . 1 1 15 HIS HD2 H -0.696 -2.091 1.490 . . . 1.0 . . . . . . . . . . . . A . 14 HIS HD2 . . . . . . . . . c19602_2mgt 1 . 9 . 4535 . 1 1 15 HIS HE1 H 0.102 0.198 4.965 . . . 1.0 . . . . . . . . . . . . A . 14 HIS HE1 . . . . . . . . . c19602_2mgt 1 . 9 . 4536 . 1 1 15 HIS N N -3.853 -3.198 2.341 . . . 1.0 . . . . . . . . . . . . A . 14 HIS N . . . . . . . . . c19602_2mgt 1 . 9 . 4537 . 1 1 15 HIS ND1 N -0.854 -1.709 4.706 . . . 1.0 . . . . . . . . . . . . A . 14 HIS ND1 . . . . . . . . . c19602_2mgt 1 . 9 . 4538 . 1 1 15 HIS NE2 N -0.093 -0.568 2.975 . . . 1.0 . . . . . . . . . . . . A . 14 HIS NE2 . . . . . . . . . c19602_2mgt 1 . 9 . 4539 . 1 1 15 HIS O O -3.365 -3.365 5.928 . . . 1.0 . . . . . . . . . . . . A . 14 HIS O . . . . . . . . . c19602_2mgt 1 . 9 . 4540 . 1 1 16 GLN C C -6.484 -2.148 6.531 . . . 1.0 . . . . . . . . . . . . A . 15 GLN C . . . . . . . . . c19602_2mgt 1 . 9 . 4541 . 1 1 16 GLN CA C -5.306 -1.393 5.916 . . . 1.0 . . . . . . . . . . . . A . 15 GLN CA . . . . . . . . . c19602_2mgt 1 . 9 . 4542 . 1 1 16 GLN CB C -5.694 0.041 5.567 . . . 1.0 . . . . . . . . . . . . A . 15 GLN CB . . . . . . . . . c19602_2mgt 1 . 9 . 4543 . 1 1 16 GLN CD C -4.758 2.365 5.100 . . . 1.0 . . . . . . . . . . . . A . 15 GLN CD . . . . . . . . . c19602_2mgt 1 . 9 . 4544 . 1 1 16 GLN CG C -4.444 0.936 5.526 . . . 1.0 . . . . . . . . . . . . A . 15 GLN CG . . . . . . . . . c19602_2mgt 1 . 9 . 4545 . 1 1 16 GLN H H -5.091 -1.771 3.844 . . . 1.0 . . . . . . . . . . . . A . 15 GLN H . . . . . . . . . c19602_2mgt 1 . 9 . 4546 . 1 1 16 GLN HA H -4.535 -1.340 6.678 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HA . . . . . . . . . c19602_2mgt 1 . 9 . 4547 . 1 1 16 GLN HB2 H -6.221 0.060 4.612 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HB2 . . . . . . . . . c19602_2mgt 1 . 9 . 4548 . 1 1 16 GLN HB3 H -6.364 0.419 6.336 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HB3 . . . . . . . . . c19602_2mgt 1 . 9 . 4549 . 1 1 16 GLN HE21 H -2.823 2.942 5.326 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HE21 . . . . . . . . . c19602_2mgt 1 . 9 . 4550 . 1 1 16 GLN HE22 H -3.924 4.183 4.765 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HE22 . . . . . . . . . c19602_2mgt 1 . 9 . 4551 . 1 1 16 GLN HG2 H -4.002 0.966 6.522 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HG2 . . . . . . . . . c19602_2mgt 1 . 9 . 4552 . 1 1 16 GLN HG3 H -3.709 0.519 4.837 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HG3 . . . . . . . . . c19602_2mgt 1 . 9 . 4553 . 1 1 16 GLN N N -4.756 -2.066 4.746 . . . 1.0 . . . . . . . . . . . . A . 15 GLN N . . . . . . . . . c19602_2mgt 1 . 9 . 4554 . 1 1 16 GLN NE2 N -3.754 3.235 5.066 . . . 1.0 . . . . . . . . . . . . A . 15 GLN NE2 . . . . . . . . . c19602_2mgt 1 . 9 . 4555 . 1 1 16 GLN O O -6.576 -2.153 7.754 . . . 1.0 . . . . . . . . . . . . A . 15 GLN O . . . . . . . . . c19602_2mgt 1 . 9 . 4556 . 1 1 16 GLN OE1 O -5.897 2.690 4.798 . . . 1.0 . . . . . . . . . . . . A . 15 GLN OE1 . . . . . . . . . c19602_2mgt 1 . 9 . 4557 . 1 1 17 LYS C C -8.816 -4.764 5.199 . . . 1.0 . . . . . . . . . . . . A . 16 LYS C . . . . . . . . . c19602_2mgt 1 . 9 . 4558 . 1 1 17 LYS CA C -8.419 -3.678 6.211 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CA . . . . . . . . . c19602_2mgt 1 . 9 . 4559 . 1 1 17 LYS CB C -9.685 -2.873 6.546 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CB . . . . . . . . . c19602_2mgt 1 . 9 . 4560 . 1 1 17 LYS CD C -10.949 -1.666 8.351 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CD . . . . . . . . . c19602_2mgt 1 . 9 . 4561 . 1 1 17 LYS CE C -10.814 -0.683 9.506 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CE . . . . . . . . . c19602_2mgt 1 . 9 . 4562 . 1 1 17 LYS CG C -9.565 -1.984 7.789 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CG . . . . . . . . . c19602_2mgt 1 . 9 . 4563 . 1 1 17 LYS H H -7.205 -2.741 4.731 . . . 1.0 . . . . . . . . . . . . A . 16 LYS H . . . . . . . . . c19602_2mgt 1 . 9 . 4564 . 1 1 17 LYS HA H -8.080 -4.187 7.115 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HA . . . . . . . . . c19602_2mgt 1 . 9 . 4565 . 1 1 17 LYS HB2 H -9.972 -2.264 5.688 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HB2 . . . . . . . . . c19602_2mgt 1 . 9 . 4566 . 1 1 17 LYS HB3 H -10.485 -3.591 6.731 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HB3 . . . . . . . . . c19602_2mgt 1 . 9 . 4567 . 1 1 17 LYS HD2 H -11.584 -1.234 7.581 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HD2 . . . . . . . . . c19602_2mgt 1 . 9 . 4568 . 1 1 17 LYS HD3 H -11.410 -2.589 8.707 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HD3 . . . . . . . . . c19602_2mgt 1 . 9 . 4569 . 1 1 17 LYS HE2 H -10.091 -1.065 10.224 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HE2 . . . . . . . . . c19602_2mgt 1 . 9 . 4570 . 1 1 17 LYS HE3 H -10.468 0.278 9.128 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HE3 . . . . . . . . . c19602_2mgt 1 . 9 . 4571 . 1 1 17 LYS HG2 H -9.003 -2.508 8.563 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HG2 . . . . . . . . . c19602_2mgt 1 . 9 . 4572 . 1 1 17 LYS HG3 H -9.051 -1.059 7.528 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HG3 . . . . . . . . . c19602_2mgt 1 . 9 . 4573 . 1 1 17 LYS HZ1 H -12.028 0.167 10.917 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HZ1 . . . . . . . . . c19602_2mgt 1 . 9 . 4574 . 1 1 17 LYS HZ2 H -12.797 -0.206 9.508 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HZ2 . . . . . . . . . c19602_2mgt 1 . 9 . 4575 . 1 1 17 LYS HZ3 H -12.401 -1.399 10.566 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HZ3 . . . . . . . . . c19602_2mgt 1 . 9 . 4576 . 1 1 17 LYS N N -7.338 -2.806 5.729 . . . 1.0 . . . . . . . . . . . . A . 16 LYS N . . . . . . . . . c19602_2mgt 1 . 9 . 4577 . 1 1 17 LYS NZ N -12.105 -0.515 10.177 . . . 1.0 . . . . . . . . . . . . A . 16 LYS NZ . . . . . . . . . c19602_2mgt 1 . 9 . 4578 . 1 1 17 LYS O O -9.459 -5.742 5.565 . . . 1.0 . . . . . . . . . . . . A . 16 LYS O . . . . . . . . . c19602_2mgt 1 . 9 . 4579 . 1 1 18 NH2 HN1 H -8.698 -5.349 3.262 . . . 1.0 . . . . . . . . . . . . A . 17 NH2 HN1 . . . . . . . . . c19602_2mgt 1 . 9 . 4580 . 1 1 18 NH2 HN2 H -7.925 -3.823 3.637 . . . 1.0 . . . . . . . . . . . . A . 17 NH2 HN2 . . . . . . . . . c19602_2mgt 1 . 9 . 4581 . 1 1 18 NH2 N N -8.461 -4.626 3.926 . . . 1.0 . . . . . . . . . . . . A . 17 NH2 N . . . . . . . . . c19602_2mgt 1 . 9 . 4582 . 2 1 1 ACE C C 16.253 4.295 -2.356 . . . 1.0 . . . . . . . . . . . . B . 0 ACE C . . . . . . . . . c19602_2mgt 1 . 9 . 4583 . 2 1 1 ACE CH3 C 16.865 5.263 -3.367 . . . 1.0 . . . . . . . . . . . . B . 0 ACE CH3 . . . . . . . . . c19602_2mgt 1 . 9 . 4584 . 2 1 1 ACE H1 H 17.214 4.717 -4.241 . . . 1.0 . . . . . . . . . . . . B . 0 ACE H1 . . . . . . . . . c19602_2mgt 1 . 9 . 4585 . 2 1 1 ACE H2 H 16.117 5.991 -3.675 . . . 1.0 . . . . . . . . . . . . B . 0 ACE H2 . . . . . . . . . c19602_2mgt 1 . 9 . 4586 . 2 1 1 ACE H3 H 17.708 5.783 -2.916 . . . 1.0 . . . . . . . . . . . . B . 0 ACE H3 . . . . . . . . . c19602_2mgt 1 . 9 . 4587 . 2 1 1 ACE O O 15.078 4.422 -2.038 . . . 1.0 . . . . . . . . . . . . B . 0 ACE O . . . . . . . . . c19602_2mgt 1 . 9 . 4588 . 2 1 2 ASP C C 18.735 1.601 -1.890 . . . 1.0 . . . . . . . . . . . . B . 1 ASP C . . . . . . . . . c19602_2mgt 1 . 9 . 4589 . 2 1 2 ASP CA C 18.413 3.089 -2.066 . . . 1.0 . . . . . . . . . . . . B . 1 ASP CA . . . . . . . . . c19602_2mgt 1 . 9 . 4590 . 2 1 2 ASP CB C 19.268 3.979 -1.152 . . . 1.0 . . . . . . . . . . . . B . 1 ASP CB . . . . . . . . . c19602_2mgt 1 . 9 . 4591 . 2 1 2 ASP CG C 20.533 4.468 -1.848 . . . 1.0 . . . . . . . . . . . . B . 1 ASP CG . . . . . . . . . c19602_2mgt 1 . 9 . 4592 . 2 1 2 ASP H H 16.568 2.723 -1.132 . . . 1.0 . . . . . . . . . . . . B . 1 ASP H . . . . . . . . . c19602_2mgt 1 . 9 . 4593 . 2 1 2 ASP HA H 18.615 3.361 -3.098 . . . 1.0 . . . . . . . . . . . . B . 1 ASP HA . . . . . . . . . c19602_2mgt 1 . 9 . 4594 . 2 1 2 ASP HB2 H 18.691 4.859 -0.873 . . . 1.0 . . . . . . . . . . . . B . 1 ASP HB2 . . . . . . . . . c19602_2mgt 1 . 9 . 4595 . 2 1 2 ASP HB3 H 19.531 3.442 -0.239 . . . 1.0 . . . . . . . . . . . . B . 1 ASP HB3 . . . . . . . . . c19602_2mgt 1 . 9 . 4596 . 2 1 2 ASP N N 17.003 3.330 -1.812 . . . 1.0 . . . . . . . . . . . . B . 1 ASP N . . . . . . . . . c19602_2mgt 1 . 9 . 4597 . 2 1 2 ASP O O 18.118 0.930 -1.064 . . . 1.0 . . . . . . . . . . . . B . 1 ASP O . . . . . . . . . c19602_2mgt 1 . 9 . 4598 . 2 1 2 ASP OD1 O 21.205 3.638 -2.494 . . . 1.0 . . . . . . . . . . . . B . 1 ASP OD1 . . . . . . . . . c19602_2mgt 1 . 9 . 4599 . 2 1 2 ASP OD2 O 20.815 5.675 -1.750 . . . 1.0 . . . . . . . . . . . . B . 1 ASP OD2 . . . . . . . . . c19602_2mgt 1 . 9 . 4600 . 2 1 3 ALA C C 19.926 -1.206 -1.750 . . . 1.0 . . . . . . . . . . . . B . 2 ALA C . . . . . . . . . c19602_2mgt 1 . 9 . 4601 . 2 1 3 ALA CA C 20.081 -0.268 -2.940 . . . 1.0 . . . . . . . . . . . . B . 2 ALA CA . . . . . . . . . c19602_2mgt 1 . 9 . 4602 . 2 1 3 ALA CB C 21.537 -0.292 -3.409 . . . 1.0 . . . . . . . . . . . . B . 2 ALA CB . . . . . . . . . c19602_2mgt 1 . 9 . 4603 . 2 1 3 ALA H H 20.162 1.799 -3.281 . . . 1.0 . . . . . . . . . . . . B . 2 ALA H . . . . . . . . . c19602_2mgt 1 . 9 . 4604 . 2 1 3 ALA HA H 19.463 -0.650 -3.748 . . . 1.0 . . . . . . . . . . . . B . 2 ALA HA . . . . . . . . . c19602_2mgt 1 . 9 . 4605 . 2 1 3 ALA HB1 H 21.826 -1.319 -3.626 . . . 1.0 . . . . . . . . . . . . B . 2 ALA HB1 . . . . . . . . . c19602_2mgt 1 . 9 . 4606 . 2 1 3 ALA HB2 H 21.647 0.314 -4.304 . . . 1.0 . . . . . . . . . . . . B . 2 ALA HB2 . . . . . . . . . c19602_2mgt 1 . 9 . 4607 . 2 1 3 ALA HB3 H 22.190 0.096 -2.628 . . . 1.0 . . . . . . . . . . . . B . 2 ALA HB3 . . . . . . . . . c19602_2mgt 1 . 9 . 4608 . 2 1 3 ALA N N 19.705 1.123 -2.684 . . . 1.0 . . . . . . . . . . . . B . 2 ALA N . . . . . . . . . c19602_2mgt 1 . 9 . 4609 . 2 1 3 ALA O O 19.266 -2.235 -1.873 . . . 1.0 . . . . . . . . . . . . B . 2 ALA O . . . . . . . . . c19602_2mgt 1 . 9 . 4610 . 2 1 4 GLU C C 19.300 -2.210 1.052 . . . 1.0 . . . . . . . . . . . . B . 3 GLU C . . . . . . . . . c19602_2mgt 1 . 9 . 4611 . 2 1 4 GLU CA C 20.632 -1.622 0.600 . . . 1.0 . . . . . . . . . . . . B . 3 GLU CA . . . . . . . . . c19602_2mgt 1 . 9 . 4612 . 2 1 4 GLU CB C 21.301 -0.773 1.690 . . . 1.0 . . . . . . . . . . . . B . 3 GLU CB . . . . . . . . . c19602_2mgt 1 . 9 . 4613 . 2 1 4 GLU CD C 21.197 1.590 2.638 . . . 1.0 . . . . . . . . . . . . B . 3 GLU CD . . . . . . . . . c19602_2mgt 1 . 9 . 4614 . 2 1 4 GLU CG C 20.412 0.396 2.133 . . . 1.0 . . . . . . . . . . . . B . 3 GLU CG . . . . . . . . . c19602_2mgt 1 . 9 . 4615 . 2 1 4 GLU H H 21.014 0.053 -0.619 . . . 1.0 . . . . . . . . . . . . B . 3 GLU H . . . . . . . . . c19602_2mgt 1 . 9 . 4616 . 2 1 4 GLU HA H 21.284 -2.455 0.386 . . . 1.0 . . . . . . . . . . . . B . 3 GLU HA . . . . . . . . . c19602_2mgt 1 . 9 . 4617 . 2 1 4 GLU HB2 H 21.521 -1.402 2.553 . . . 1.0 . . . . . . . . . . . . B . 3 GLU HB2 . . . . . . . . . c19602_2mgt 1 . 9 . 4618 . 2 1 4 GLU HB3 H 22.246 -0.393 1.298 . . . 1.0 . . . . . . . . . . . . B . 3 GLU HB3 . . . . . . . . . c19602_2mgt 1 . 9 . 4619 . 2 1 4 GLU HG2 H 19.818 0.746 1.287 . . . 1.0 . . . . . . . . . . . . B . 3 GLU HG2 . . . . . . . . . c19602_2mgt 1 . 9 . 4620 . 2 1 4 GLU HG3 H 19.739 0.049 2.915 . . . 1.0 . . . . . . . . . . . . B . 3 GLU HG3 . . . . . . . . . c19602_2mgt 1 . 9 . 4621 . 2 1 4 GLU N N 20.528 -0.832 -0.617 . . . 1.0 . . . . . . . . . . . . B . 3 GLU N . . . . . . . . . c19602_2mgt 1 . 9 . 4622 . 2 1 4 GLU O O 19.267 -3.391 1.372 . . . 1.0 . . . . . . . . . . . . B . 3 GLU O . . . . . . . . . c19602_2mgt 1 . 9 . 4623 . 2 1 4 GLU OE1 O 21.924 1.425 3.647 . . . 1.0 . . . . . . . . . . . . B . 3 GLU OE1 . . . . . . . . . c19602_2mgt 1 . 9 . 4624 . 2 1 4 GLU OE2 O 21.066 2.655 2.027 . . . 1.0 . . . . . . . . . . . . B . 3 GLU OE2 . . . . . . . . . c19602_2mgt 1 . 9 . 4625 . 2 1 5 PHE C C 16.002 -2.035 0.087 . . . 1.0 . . . . . . . . . . . . B . 4 PHE C . . . . . . . . . c19602_2mgt 1 . 9 . 4626 . 2 1 5 PHE CA C 16.866 -1.866 1.335 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CA . . . . . . . . . c19602_2mgt 1 . 9 . 4627 . 2 1 5 PHE CB C 16.227 -0.877 2.301 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CB . . . . . . . . . c19602_2mgt 1 . 9 . 4628 . 2 1 5 PHE CD1 C 14.949 0.814 0.920 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CD1 . . . . . . . . . c19602_2mgt 1 . 9 . 4629 . 2 1 5 PHE CD2 C 16.960 1.519 2.096 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CD2 . . . . . . . . . c19602_2mgt 1 . 9 . 4630 . 2 1 5 PHE CE1 C 14.736 2.137 0.500 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CE1 . . . . . . . . . c19602_2mgt 1 . 9 . 4631 . 2 1 5 PHE CE2 C 16.739 2.843 1.694 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CE2 . . . . . . . . . c19602_2mgt 1 . 9 . 4632 . 2 1 5 PHE CG C 16.045 0.515 1.748 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CG . . . . . . . . . c19602_2mgt 1 . 9 . 4633 . 2 1 5 PHE CZ C 15.607 3.155 0.925 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CZ . . . . . . . . . c19602_2mgt 1 . 9 . 4634 . 2 1 5 PHE H H 18.324 -0.462 0.739 . . . 1.0 . . . . . . . . . . . . B . 4 PHE H . . . . . . . . . c19602_2mgt 1 . 9 . 4635 . 2 1 5 PHE HA H 16.912 -2.826 1.840 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HA . . . . . . . . . c19602_2mgt 1 . 9 . 4636 . 2 1 5 PHE HB2 H 15.252 -1.260 2.596 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HB2 . . . . . . . . . c19602_2mgt 1 . 9 . 4637 . 2 1 5 PHE HB3 H 16.845 -0.829 3.197 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HB3 . . . . . . . . . c19602_2mgt 1 . 9 . 4638 . 2 1 5 PHE HD1 H 14.267 0.029 0.626 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HD1 . . . . . . . . . c19602_2mgt 1 . 9 . 4639 . 2 1 5 PHE HD2 H 17.825 1.267 2.684 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HD2 . . . . . . . . . c19602_2mgt 1 . 9 . 4640 . 2 1 5 PHE HE1 H 13.888 2.378 -0.125 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HE1 . . . . . . . . . c19602_2mgt 1 . 9 . 4641 . 2 1 5 PHE HE2 H 17.433 3.616 1.985 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HE2 . . . . . . . . . c19602_2mgt 1 . 9 . 4642 . 2 1 5 PHE HZ H 15.421 4.175 0.637 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HZ . . . . . . . . . c19602_2mgt 1 . 9 . 4643 . 2 1 5 PHE N N 18.215 -1.425 1.019 . . . 1.0 . . . . . . . . . . . . B . 4 PHE N . . . . . . . . . c19602_2mgt 1 . 9 . 4644 . 2 1 5 PHE O O 14.956 -2.664 0.190 . . . 1.0 . . . . . . . . . . . . B . 4 PHE O . . . . . . . . . c19602_2mgt 1 . 9 . 4645 . 2 1 6 ARG C C 16.117 -3.250 -2.865 . . . 1.0 . . . . . . . . . . . . B . 5 ARG C . . . . . . . . . c19602_2mgt 1 . 9 . 4646 . 2 1 6 ARG CA C 15.817 -1.822 -2.380 . . . 1.0 . . . . . . . . . . . . B . 5 ARG CA . . . . . . . . . c19602_2mgt 1 . 9 . 4647 . 2 1 6 ARG CB C 16.231 -0.742 -3.392 . . . 1.0 . . . . . . . . . . . . B . 5 ARG CB . . . . . . . . . c19602_2mgt 1 . 9 . 4648 . 2 1 6 ARG CD C 13.949 0.488 -3.274 . . . 1.0 . . . . . . . . . . . . B . 5 ARG CD . . . . . . . . . c19602_2mgt 1 . 9 . 4649 . 2 1 6 ARG CG C 15.480 0.581 -3.192 . . . 1.0 . . . . . . . . . . . . B . 5 ARG CG . . . . . . . . . c19602_2mgt 1 . 9 . 4650 . 2 1 6 ARG CZ C 13.251 -0.242 -5.580 . . . 1.0 . . . . . . . . . . . . B . 5 ARG CZ . . . . . . . . . c19602_2mgt 1 . 9 . 4651 . 2 1 6 ARG H H 17.295 -1.013 -1.096 . . . 1.0 . . . . . . . . . . . . B . 5 ARG H . . . . . . . . . c19602_2mgt 1 . 9 . 4652 . 2 1 6 ARG HA H 14.738 -1.782 -2.246 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HA . . . . . . . . . c19602_2mgt 1 . 9 . 4653 . 2 1 6 ARG HB2 H 17.299 -0.565 -3.306 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HB2 . . . . . . . . . c19602_2mgt 1 . 9 . 4654 . 2 1 6 ARG HB3 H 16.042 -1.079 -4.411 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HB3 . . . . . . . . . c19602_2mgt 1 . 9 . 4655 . 2 1 6 ARG HD2 H 13.568 0.170 -2.303 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HD2 . . . . . . . . . c19602_2mgt 1 . 9 . 4656 . 2 1 6 ARG HD3 H 13.548 1.479 -3.484 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HD3 . . . . . . . . . c19602_2mgt 1 . 9 . 4657 . 2 1 6 ARG HE H 13.300 -1.411 -3.947 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HE . . . . . . . . . c19602_2mgt 1 . 9 . 4658 . 2 1 6 ARG HG2 H 15.734 0.996 -2.219 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HG2 . . . . . . . . . c19602_2mgt 1 . 9 . 4659 . 2 1 6 ARG HG3 H 15.831 1.271 -3.952 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HG3 . . . . . . . . . c19602_2mgt 1 . 9 . 4660 . 2 1 6 ARG HH11 H 13.781 1.721 -5.538 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HH11 . . . . . . . . . c19602_2mgt 1 . 9 . 4661 . 2 1 6 ARG HH12 H 13.241 1.121 -7.087 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HH12 . . . . . . . . . c19602_2mgt 1 . 9 . 4662 . 2 1 6 ARG HH21 H 12.646 -2.148 -5.961 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HH21 . . . . . . . . . c19602_2mgt 1 . 9 . 4663 . 2 1 6 ARG HH22 H 12.615 -1.065 -7.334 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HH22 . . . . . . . . . c19602_2mgt 1 . 9 . 4664 . 2 1 6 ARG N N 16.433 -1.543 -1.083 . . . 1.0 . . . . . . . . . . . . B . 5 ARG N . . . . . . . . . c19602_2mgt 1 . 9 . 4665 . 2 1 6 ARG NE N 13.476 -0.474 -4.282 . . . 1.0 . . . . . . . . . . . . B . 5 ARG NE . . . . . . . . . c19602_2mgt 1 . 9 . 4666 . 2 1 6 ARG NH1 N 13.453 0.960 -6.114 . . . 1.0 . . . . . . . . . . . . B . 5 ARG NH1 . . . . . . . . . c19602_2mgt 1 . 9 . 4667 . 2 1 6 ARG NH2 N 12.811 -1.233 -6.359 . . . 1.0 . . . . . . . . . . . . B . 5 ARG NH2 . . . . . . . . . c19602_2mgt 1 . 9 . 4668 . 2 1 6 ARG O O 16.185 -3.507 -4.063 . . . 1.0 . . . . . . . . . . . . B . 5 ARG O . . . . . . . . . c19602_2mgt 1 . 9 . 4669 . 2 1 7 ARG C C 14.985 -6.011 -2.889 . . . 1.0 . . . . . . . . . . . . B . 6 ARG C . . . . . . . . . c19602_2mgt 1 . 9 . 4670 . 2 1 7 ARG CA C 16.207 -5.620 -2.053 . . . 1.0 . . . . . . . . . . . . B . 6 ARG CA . . . . . . . . . c19602_2mgt 1 . 9 . 4671 . 2 1 7 ARG CB C 16.079 -6.217 -0.643 . . . 1.0 . . . . . . . . . . . . B . 6 ARG CB . . . . . . . . . c19602_2mgt 1 . 9 . 4672 . 2 1 7 ARG CD C 18.549 -6.081 0.106 . . . 1.0 . . . . . . . . . . . . B . 6 ARG CD . . . . . . . . . c19602_2mgt 1 . 9 . 4673 . 2 1 7 ARG CG C 17.092 -5.721 0.401 . . . 1.0 . . . . . . . . . . . . B . 6 ARG CG . . . . . . . . . c19602_2mgt 1 . 9 . 4674 . 2 1 7 ARG CZ C 20.003 -5.606 -1.872 . . . 1.0 . . . . . . . . . . . . B . 6 ARG CZ . . . . . . . . . c19602_2mgt 1 . 9 . 4675 . 2 1 7 ARG H H 16.211 -3.860 -0.961 . . . 1.0 . . . . . . . . . . . . B . 6 ARG H . . . . . . . . . c19602_2mgt 1 . 9 . 4676 . 2 1 7 ARG HA H 17.128 -5.960 -2.516 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HA . . . . . . . . . c19602_2mgt 1 . 9 . 4677 . 2 1 7 ARG HB2 H 15.095 -5.946 -0.261 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HB2 . . . . . . . . . c19602_2mgt 1 . 9 . 4678 . 2 1 7 ARG HB3 H 16.137 -7.301 -0.710 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HB3 . . . . . . . . . c19602_2mgt 1 . 9 . 4679 . 2 1 7 ARG HD2 H 19.119 -5.958 1.024 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HD2 . . . . . . . . . c19602_2mgt 1 . 9 . 4680 . 2 1 7 ARG HD3 H 18.606 -7.121 -0.196 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HD3 . . . . . . . . . c19602_2mgt 1 . 9 . 4681 . 2 1 7 ARG HE H 19.019 -4.221 -0.786 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HE . . . . . . . . . c19602_2mgt 1 . 9 . 4682 . 2 1 7 ARG HG2 H 16.997 -4.645 0.515 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HG2 . . . . . . . . . c19602_2mgt 1 . 9 . 4683 . 2 1 7 ARG HG3 H 16.823 -6.165 1.359 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HG3 . . . . . . . . . c19602_2mgt 1 . 9 . 4684 . 2 1 7 ARG HH11 H 19.818 -7.609 -1.566 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HH11 . . . . . . . . . c19602_2mgt 1 . 9 . 4685 . 2 1 7 ARG HH12 H 20.891 -7.142 -2.867 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HH12 . . . . . . . . . c19602_2mgt 1 . 9 . 4686 . 2 1 7 ARG HH21 H 20.421 -3.705 -2.453 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HH21 . . . . . . . . . c19602_2mgt 1 . 9 . 4687 . 2 1 7 ARG HH22 H 21.227 -4.964 -3.362 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HH22 . . . . . . . . . c19602_2mgt 1 . 9 . 4688 . 2 1 7 ARG N N 16.251 -4.179 -1.914 . . . 1.0 . . . . . . . . . . . . B . 6 ARG N . . . . . . . . . c19602_2mgt 1 . 9 . 4689 . 2 1 7 ARG NE N 19.167 -5.213 -0.904 . . . 1.0 . . . . . . . . . . . . B . 6 ARG NE . . . . . . . . . c19602_2mgt 1 . 9 . 4690 . 2 1 7 ARG NH1 N 20.265 -6.891 -2.116 . . . 1.0 . . . . . . . . . . . . B . 6 ARG NH1 . . . . . . . . . c19602_2mgt 1 . 9 . 4691 . 2 1 7 ARG NH2 N 20.600 -4.685 -2.622 . . . 1.0 . . . . . . . . . . . . B . 6 ARG NH2 . . . . . . . . . c19602_2mgt 1 . 9 . 4692 . 2 1 7 ARG O O 13.904 -5.472 -2.660 . . . 1.0 . . . . . . . . . . . . B . 6 ARG O . . . . . . . . . c19602_2mgt 1 . 9 . 4693 . 2 1 8 ASP C C 12.782 -7.578 -4.339 . . . 1.0 . . . . . . . . . . . . B . 7 ASP C . . . . . . . . . c19602_2mgt 1 . 9 . 4694 . 2 1 8 ASP CA C 14.155 -7.183 -4.895 . . . 1.0 . . . . . . . . . . . . B . 7 ASP CA . . . . . . . . . c19602_2mgt 1 . 9 . 4695 . 2 1 8 ASP CB C 14.678 -8.262 -5.851 . . . 1.0 . . . . . . . . . . . . B . 7 ASP CB . . . . . . . . . c19602_2mgt 1 . 9 . 4696 . 2 1 8 ASP CG C 14.875 -9.622 -5.195 . . . 1.0 . . . . . . . . . . . . B . 7 ASP CG . . . . . . . . . c19602_2mgt 1 . 9 . 4697 . 2 1 8 ASP H H 16.055 -7.366 -3.955 . . . 1.0 . . . . . . . . . . . . B . 7 ASP H . . . . . . . . . c19602_2mgt 1 . 9 . 4698 . 2 1 8 ASP HA H 14.031 -6.266 -5.469 . . . 1.0 . . . . . . . . . . . . B . 7 ASP HA . . . . . . . . . c19602_2mgt 1 . 9 . 4699 . 2 1 8 ASP HB2 H 13.983 -8.365 -6.680 . . . 1.0 . . . . . . . . . . . . B . 7 ASP HB2 . . . . . . . . . c19602_2mgt 1 . 9 . 4700 . 2 1 8 ASP HB3 H 15.639 -7.939 -6.249 . . . 1.0 . . . . . . . . . . . . B . 7 ASP HB3 . . . . . . . . . c19602_2mgt 1 . 9 . 4701 . 2 1 8 ASP N N 15.152 -6.923 -3.853 . . . 1.0 . . . . . . . . . . . . B . 7 ASP N . . . . . . . . . c19602_2mgt 1 . 9 . 4702 . 2 1 8 ASP O O 11.761 -7.178 -4.891 . . . 1.0 . . . . . . . . . . . . B . 7 ASP O . . . . . . . . . c19602_2mgt 1 . 9 . 4703 . 2 1 8 ASP OD1 O 13.881 -10.370 -5.057 . . . 1.0 . . . . . . . . . . . . B . 7 ASP OD1 . . . . . . . . . c19602_2mgt 1 . 9 . 4704 . 2 1 8 ASP OD2 O 16.030 -9.911 -4.845 . . . 1.0 . . . . . . . . . . . . B . 7 ASP OD2 . . . . . . . . . c19602_2mgt 1 . 9 . 4705 . 2 1 9 SER C C 10.916 -7.895 -1.700 . . . 1.0 . . . . . . . . . . . . B . 8 SER C . . . . . . . . . c19602_2mgt 1 . 9 . 4706 . 2 1 9 SER CA C 11.557 -8.890 -2.659 . . . 1.0 . . . . . . . . . . . . B . 8 SER CA . . . . . . . . . c19602_2mgt 1 . 9 . 4707 . 2 1 9 SER CB C 11.876 -10.192 -1.925 . . . 1.0 . . . . . . . . . . . . B . 8 SER CB . . . . . . . . . c19602_2mgt 1 . 9 . 4708 . 2 1 9 SER H H 13.643 -8.642 -2.862 . . . 1.0 . . . . . . . . . . . . B . 8 SER H . . . . . . . . . c19602_2mgt 1 . 9 . 4709 . 2 1 9 SER HA H 10.859 -9.116 -3.462 . . . 1.0 . . . . . . . . . . . . B . 8 SER HA . . . . . . . . . c19602_2mgt 1 . 9 . 4710 . 2 1 9 SER HB2 H 12.670 -10.011 -1.203 . . . 1.0 . . . . . . . . . . . . B . 8 SER HB2 . . . . . . . . . c19602_2mgt 1 . 9 . 4711 . 2 1 9 SER HB3 H 10.992 -10.537 -1.393 . . . 1.0 . . . . . . . . . . . . B . 8 SER HB3 . . . . . . . . . c19602_2mgt 1 . 9 . 4712 . 2 1 9 SER HG H 12.943 -10.821 -3.428 . . . 1.0 . . . . . . . . . . . . B . 8 SER HG . . . . . . . . . c19602_2mgt 1 . 9 . 4713 . 2 1 9 SER N N 12.762 -8.343 -3.247 . . . 1.0 . . . . . . . . . . . . B . 8 SER N . . . . . . . . . c19602_2mgt 1 . 9 . 4714 . 2 1 9 SER O O 11.588 -7.291 -0.867 . . . 1.0 . . . . . . . . . . . . B . 8 SER O . . . . . . . . . c19602_2mgt 1 . 9 . 4715 . 2 1 9 SER OG O 12.273 -11.189 -2.842 . . . 1.0 . . . . . . . . . . . . B . 8 SER OG . . . . . . . . . c19602_2mgt 1 . 9 . 4716 . 2 1 10 GLY C C 7.399 -6.957 -1.690 . . . 1.0 . . . . . . . . . . . . B . 9 GLY C . . . . . . . . . c19602_2mgt 1 . 9 . 4717 . 2 1 10 GLY CA C 8.710 -7.066 -0.915 . . . 1.0 . . . . . . . . . . . . B . 9 GLY CA . . . . . . . . . c19602_2mgt 1 . 9 . 4718 . 2 1 10 GLY H H 9.122 -8.247 -2.567 . . . 1.0 . . . . . . . . . . . . B . 9 GLY H . . . . . . . . . c19602_2mgt 1 . 9 . 4719 . 2 1 10 GLY HA2 H 8.556 -7.632 0.001 . . . 1.0 . . . . . . . . . . . . B . 9 GLY HA2 . . . . . . . . . c19602_2mgt 1 . 9 . 4720 . 2 1 10 GLY HA3 H 9.143 -6.109 -0.635 . . . 1.0 . . . . . . . . . . . . B . 9 GLY HA3 . . . . . . . . . c19602_2mgt 1 . 9 . 4721 . 2 1 10 GLY N N 9.591 -7.794 -1.795 . . . 1.0 . . . . . . . . . . . . B . 9 GLY N . . . . . . . . . c19602_2mgt 1 . 9 . 4722 . 2 1 10 GLY O O 6.842 -7.990 -2.056 . . . 1.0 . . . . . . . . . . . . B . 9 GLY O . . . . . . . . . c19602_2mgt 1 . 9 . 4723 . 2 1 11 TYR C C 6.268 -3.402 -1.958 . . . 1.0 . . . . . . . . . . . . B . 10 TYR C . . . . . . . . . c19602_2mgt 1 . 9 . 4724 . 2 1 11 TYR CA C 7.301 -4.456 -1.559 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CA . . . . . . . . . c19602_2mgt 1 . 9 . 4725 . 2 1 11 TYR CB C 8.668 -4.075 -2.146 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CB . . . . . . . . . c19602_2mgt 1 . 9 . 4726 . 2 1 11 TYR CD1 C 9.372 -2.894 -0.007 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CD1 . . . . . . . . . c19602_2mgt 1 . 9 . 4727 . 2 1 11 TYR CD2 C 11.037 -4.085 -1.318 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CD2 . . . . . . . . . c19602_2mgt 1 . 9 . 4728 . 2 1 11 TYR CE1 C 10.348 -2.526 0.925 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CE1 . . . . . . . . . c19602_2mgt 1 . 9 . 4729 . 2 1 11 TYR CE2 C 12.026 -3.704 -0.402 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CE2 . . . . . . . . . c19602_2mgt 1 . 9 . 4730 . 2 1 11 TYR CG C 9.710 -3.677 -1.126 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CG . . . . . . . . . c19602_2mgt 1 . 9 . 4731 . 2 1 11 TYR CZ C 11.683 -2.930 0.732 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CZ . . . . . . . . . c19602_2mgt 1 . 9 . 4732 . 2 1 11 TYR H H 6.136 -5.754 -2.671 . . . 1.0 . . . . . . . . . . . . B . 10 TYR H . . . . . . . . . c19602_2mgt 1 . 9 . 4733 . 2 1 11 TYR HA H 7.364 -4.491 -0.475 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HA . . . . . . . . . c19602_2mgt 1 . 9 . 4734 . 2 1 11 TYR HB2 H 9.059 -4.900 -2.738 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HB2 . . . . . . . . . c19602_2mgt 1 . 9 . 4735 . 2 1 11 TYR HB3 H 8.539 -3.248 -2.833 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HB3 . . . . . . . . . c19602_2mgt 1 . 9 . 4736 . 2 1 11 TYR HD1 H 8.365 -2.561 0.147 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HD1 . . . . . . . . . c19602_2mgt 1 . 9 . 4737 . 2 1 11 TYR HD2 H 11.296 -4.706 -2.163 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HD2 . . . . . . . . . c19602_2mgt 1 . 9 . 4738 . 2 1 11 TYR HE1 H 10.074 -1.944 1.788 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HE1 . . . . . . . . . c19602_2mgt 1 . 9 . 4739 . 2 1 11 TYR HE2 H 13.034 -4.048 -0.552 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HE2 . . . . . . . . . c19602_2mgt 1 . 9 . 4740 . 2 1 11 TYR HH H 13.496 -2.914 1.426 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HH . . . . . . . . . c19602_2mgt 1 . 9 . 4741 . 2 1 11 TYR N N 6.881 -5.767 -2.001 . . . 1.0 . . . . . . . . . . . . B . 10 TYR N . . . . . . . . . c19602_2mgt 1 . 9 . 4742 . 2 1 11 TYR O O 5.637 -3.475 -3.010 . . . 1.0 . . . . . . . . . . . . B . 10 TYR O . . . . . . . . . c19602_2mgt 1 . 9 . 4743 . 2 1 11 TYR OH O 12.620 -2.597 1.660 . . . 1.0 . . . . . . . . . . . . B . 10 TYR OH . . . . . . . . . c19602_2mgt 1 . 9 . 4744 . 2 1 12 GLU C C 6.384 -0.037 -0.742 . . . 1.0 . . . . . . . . . . . . B . 11 GLU C . . . . . . . . . c19602_2mgt 1 . 9 . 4745 . 2 1 12 GLU CA C 5.486 -1.129 -1.350 . . . 1.0 . . . . . . . . . . . . B . 11 GLU CA . . . . . . . . . c19602_2mgt 1 . 9 . 4746 . 2 1 12 GLU CB C 4.104 -1.226 -0.703 . . . 1.0 . . . . . . . . . . . . B . 11 GLU CB . . . . . . . . . c19602_2mgt 1 . 9 . 4747 . 2 1 12 GLU CD C 2.072 0.227 -0.146 . . . 1.0 . . . . . . . . . . . . B . 11 GLU CD . . . . . . . . . c19602_2mgt 1 . 9 . 4748 . 2 1 12 GLU CG C 3.228 -0.035 -1.103 . . . 1.0 . . . . . . . . . . . . B . 11 GLU CG . . . . . . . . . c19602_2mgt 1 . 9 . 4749 . 2 1 12 GLU H H 6.670 -2.440 -0.244 . . . 1.0 . . . . . . . . . . . . B . 11 GLU H . . . . . . . . . c19602_2mgt 1 . 9 . 4750 . 2 1 12 GLU HA H 5.378 -0.975 -2.425 . . . 1.0 . . . . . . . . . . . . B . 11 GLU HA . . . . . . . . . c19602_2mgt 1 . 9 . 4751 . 2 1 12 GLU HB2 H 3.613 -2.143 -1.025 . . . 1.0 . . . . . . . . . . . . B . 11 GLU HB2 . . . . . . . . . c19602_2mgt 1 . 9 . 4752 . 2 1 12 GLU HB3 H 4.235 -1.269 0.377 . . . 1.0 . . . . . . . . . . . . B . 11 GLU HB3 . . . . . . . . . c19602_2mgt 1 . 9 . 4753 . 2 1 12 GLU HG2 H 3.835 0.867 -1.140 . . . 1.0 . . . . . . . . . . . . B . 11 GLU HG2 . . . . . . . . . c19602_2mgt 1 . 9 . 4754 . 2 1 12 GLU HG3 H 2.833 -0.202 -2.103 . . . 1.0 . . . . . . . . . . . . B . 11 GLU HG3 . . . . . . . . . c19602_2mgt 1 . 9 . 4755 . 2 1 12 GLU N N 6.177 -2.375 -1.121 . . . 1.0 . . . . . . . . . . . . B . 11 GLU N . . . . . . . . . c19602_2mgt 1 . 9 . 4756 . 2 1 12 GLU O O 6.002 0.642 0.212 . . . 1.0 . . . . . . . . . . . . B . 11 GLU O . . . . . . . . . c19602_2mgt 1 . 9 . 4757 . 2 1 12 GLU OE1 O 2.024 -0.360 0.952 . . . 1.0 . . . . . . . . . . . . B . 11 GLU OE1 . . . . . . . . . c19602_2mgt 1 . 9 . 4758 . 2 1 12 GLU OE2 O 1.254 1.094 -0.506 . . . 1.0 . . . . . . . . . . . . B . 11 GLU OE2 . . . . . . . . . c19602_2mgt 1 . 9 . 4759 . 2 1 13 VAL C C 8.464 2.180 -0.259 . . . 1.0 . . . . . . . . . . . . B . 12 VAL C . . . . . . . . . c19602_2mgt 1 . 9 . 4760 . 2 1 13 VAL CA C 8.782 0.774 -0.770 . . . 1.0 . . . . . . . . . . . . B . 12 VAL CA . . . . . . . . . c19602_2mgt 1 . 9 . 4761 . 2 1 13 VAL CB C 9.832 0.866 -1.901 . . . 1.0 . . . . . . . . . . . . B . 12 VAL CB . . . . . . . . . c19602_2mgt 1 . 9 . 4762 . 2 1 13 VAL CG1 C 10.987 1.814 -1.561 . . . 1.0 . . . . . . . . . . . . B . 12 VAL CG1 . . . . . . . . . c19602_2mgt 1 . 9 . 4763 . 2 1 13 VAL CG2 C 10.468 -0.493 -2.213 . . . 1.0 . . . . . . . . . . . . B . 12 VAL CG2 . . . . . . . . . c19602_2mgt 1 . 9 . 4764 . 2 1 13 VAL H H 7.790 -0.524 -2.082 . . . 1.0 . . . . . . . . . . . . B . 12 VAL H . . . . . . . . . c19602_2mgt 1 . 9 . 4765 . 2 1 13 VAL HA H 9.213 0.193 0.041 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HA . . . . . . . . . c19602_2mgt 1 . 9 . 4766 . 2 1 13 VAL HB H 9.338 1.235 -2.800 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HB . . . . . . . . . c19602_2mgt 1 . 9 . 4767 . 2 1 13 VAL HG11 H 10.622 2.832 -1.447 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HG11 . . . . . . . . . c19602_2mgt 1 . 9 . 4768 . 2 1 13 VAL HG12 H 11.476 1.492 -0.643 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HG12 . . . . . . . . . c19602_2mgt 1 . 9 . 4769 . 2 1 13 VAL HG13 H 11.711 1.813 -2.370 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HG13 . . . . . . . . . c19602_2mgt 1 . 9 . 4770 . 2 1 13 VAL HG21 H 11.074 -0.824 -1.371 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HG21 . . . . . . . . . c19602_2mgt 1 . 9 . 4771 . 2 1 13 VAL HG22 H 9.697 -1.231 -2.412 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HG22 . . . . . . . . . c19602_2mgt 1 . 9 . 4772 . 2 1 13 VAL HG23 H 11.090 -0.407 -3.099 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HG23 . . . . . . . . . c19602_2mgt 1 . 9 . 4773 . 2 1 13 VAL N N 7.614 0.050 -1.271 . . . 1.0 . . . . . . . . . . . . B . 12 VAL N . . . . . . . . . c19602_2mgt 1 . 9 . 4774 . 2 1 13 VAL O O 9.036 2.607 0.741 . . . 1.0 . . . . . . . . . . . . B . 12 VAL O . . . . . . . . . c19602_2mgt 1 . 9 . 4775 . 2 1 14 HIS C C 6.587 4.566 0.619 . . . 1.0 . . . . . . . . . . . . B . 13 HIS C . . . . . . . . . c19602_2mgt 1 . 9 . 4776 . 2 1 14 HIS CA C 7.372 4.324 -0.674 . . . 1.0 . . . . . . . . . . . . B . 13 HIS CA . . . . . . . . . c19602_2mgt 1 . 9 . 4777 . 2 1 14 HIS CB C 6.741 5.011 -1.889 . . . 1.0 . . . . . . . . . . . . B . 13 HIS CB . . . . . . . . . c19602_2mgt 1 . 9 . 4778 . 2 1 14 HIS CD2 C 8.954 4.850 -3.214 . . . 1.0 . . . . . . . . . . . . B . 13 HIS CD2 . . . . . . . . . c19602_2mgt 1 . 9 . 4779 . 2 1 14 HIS CE1 C 8.171 4.924 -5.250 . . . 1.0 . . . . . . . . . . . . B . 13 HIS CE1 . . . . . . . . . c19602_2mgt 1 . 9 . 4780 . 2 1 14 HIS CG C 7.590 4.960 -3.135 . . . 1.0 . . . . . . . . . . . . B . 13 HIS CG . . . . . . . . . c19602_2mgt 1 . 9 . 4781 . 2 1 14 HIS H H 7.141 2.516 -1.762 . . . 1.0 . . . . . . . . . . . . B . 13 HIS H . . . . . . . . . c19602_2mgt 1 . 9 . 4782 . 2 1 14 HIS HA H 8.359 4.763 -0.519 . . . 1.0 . . . . . . . . . . . . B . 13 HIS HA . . . . . . . . . c19602_2mgt 1 . 9 . 4783 . 2 1 14 HIS HB2 H 5.777 4.548 -2.100 . . . 1.0 . . . . . . . . . . . . B . 13 HIS HB2 . . . . . . . . . c19602_2mgt 1 . 9 . 4784 . 2 1 14 HIS HB3 H 6.571 6.060 -1.646 . . . 1.0 . . . . . . . . . . . . B . 13 HIS HB3 . . . . . . . . . c19602_2mgt 1 . 9 . 4785 . 2 1 14 HIS HD1 H 6.151 5.079 -4.697 . . . 1.0 . . . . . . . . . . . . B . 13 HIS HD1 . . . . . . . . . c19602_2mgt 1 . 9 . 4786 . 2 1 14 HIS HD2 H 9.635 4.791 -2.380 . . . 1.0 . . . . . . . . . . . . B . 13 HIS HD2 . . . . . . . . . c19602_2mgt 1 . 9 . 4787 . 2 1 14 HIS HE1 H 8.098 4.900 -6.325 . . . 1.0 . . . . . . . . . . . . B . 13 HIS HE1 . . . . . . . . . c19602_2mgt 1 . 9 . 4788 . 2 1 14 HIS N N 7.593 2.917 -0.953 . . . 1.0 . . . . . . . . . . . . B . 13 HIS N . . . . . . . . . c19602_2mgt 1 . 9 . 4789 . 2 1 14 HIS ND1 N 7.121 5.016 -4.422 . . . 1.0 . . . . . . . . . . . . B . 13 HIS ND1 . . . . . . . . . c19602_2mgt 1 . 9 . 4790 . 2 1 14 HIS NE2 N 9.317 4.821 -4.562 . . . 1.0 . . . . . . . . . . . . B . 13 HIS NE2 . . . . . . . . . c19602_2mgt 1 . 9 . 4791 . 2 1 14 HIS O O 6.473 5.717 1.021 . . . 1.0 . . . . . . . . . . . . B . 13 HIS O . . . . . . . . . c19602_2mgt 1 . 9 . 4792 . 2 1 15 HIS C C 6.163 2.257 3.477 . . . 1.0 . . . . . . . . . . . . B . 14 HIS C . . . . . . . . . c19602_2mgt 1 . 9 . 4793 . 2 1 15 HIS CA C 5.920 3.604 2.768 . . . 1.0 . . . . . . . . . . . . B . 14 HIS CA . . . . . . . . . c19602_2mgt 1 . 9 . 4794 . 2 1 15 HIS CB C 4.612 4.331 3.136 . . . 1.0 . . . . . . . . . . . . B . 14 HIS CB . . . . . . . . . c19602_2mgt 1 . 9 . 4795 . 2 1 15 HIS CD2 C 2.832 2.792 2.106 . . . 1.0 . . . . . . . . . . . . B . 14 HIS CD2 . . . . . . . . . c19602_2mgt 1 . 9 . 4796 . 2 1 15 HIS CE1 C 1.460 2.628 3.806 . . . 1.0 . . . . . . . . . . . . B . 14 HIS CE1 . . . . . . . . . c19602_2mgt 1 . 9 . 4797 . 2 1 15 HIS CG C 3.357 3.507 3.143 . . . 1.0 . . . . . . . . . . . . B . 14 HIS CG . . . . . . . . . c19602_2mgt 1 . 9 . 4798 . 2 1 15 HIS H H 6.201 2.596 0.921 . . . 1.0 . . . . . . . . . . . . B . 14 HIS H . . . . . . . . . c19602_2mgt 1 . 9 . 4799 . 2 1 15 HIS HA H 6.711 4.257 3.132 . . . 1.0 . . . . . . . . . . . . B . 14 HIS HA . . . . . . . . . c19602_2mgt 1 . 9 . 4800 . 2 1 15 HIS HB2 H 4.740 4.757 4.129 . . . 1.0 . . . . . . . . . . . . B . 14 HIS HB2 . . . . . . . . . c19602_2mgt 1 . 9 . 4801 . 2 1 15 HIS HB3 H 4.450 5.168 2.460 . . . 1.0 . . . . . . . . . . . . B . 14 HIS HB3 . . . . . . . . . c19602_2mgt 1 . 9 . 4802 . 2 1 15 HIS HD1 H 2.610 3.795 5.117 . . . 1.0 . . . . . . . . . . . . B . 14 HIS HD1 . . . . . . . . . c19602_2mgt 1 . 9 . 4803 . 2 1 15 HIS HD2 H 3.271 2.682 1.128 . . . 1.0 . . . . . . . . . . . . B . 14 HIS HD2 . . . . . . . . . c19602_2mgt 1 . 9 . 4804 . 2 1 15 HIS HE1 H 0.621 2.361 4.430 . . . 1.0 . . . . . . . . . . . . B . 14 HIS HE1 . . . . . . . . . c19602_2mgt 1 . 9 . 4805 . 2 1 15 HIS N N 6.132 3.521 1.325 . . . 1.0 . . . . . . . . . . . . B . 14 HIS N . . . . . . . . . c19602_2mgt 1 . 9 . 4806 . 2 1 15 HIS ND1 N 2.488 3.390 4.199 . . . 1.0 . . . . . . . . . . . . B . 14 HIS ND1 . . . . . . . . . c19602_2mgt 1 . 9 . 4807 . 2 1 15 HIS NE2 N 1.619 2.245 2.531 . . . 1.0 . . . . . . . . . . . . B . 14 HIS NE2 . . . . . . . . . c19602_2mgt 1 . 9 . 4808 . 2 1 15 HIS O O 5.580 1.998 4.524 . . . 1.0 . . . . . . . . . . . . B . 14 HIS O . . . . . . . . . c19602_2mgt 1 . 9 . 4809 . 2 1 16 GLN C C 9.184 0.415 3.589 . . . 1.0 . . . . . . . . . . . . B . 15 GLN C . . . . . . . . . c19602_2mgt 1 . 9 . 4810 . 2 1 16 GLN CA C 7.658 0.252 3.558 . . . 1.0 . . . . . . . . . . . . B . 15 GLN CA . . . . . . . . . c19602_2mgt 1 . 9 . 4811 . 2 1 16 GLN CB C 7.283 -1.016 2.786 . . . 1.0 . . . . . . . . . . . . B . 15 GLN CB . . . . . . . . . c19602_2mgt 1 . 9 . 4812 . 2 1 16 GLN CD C 5.596 -2.840 2.384 . . . 1.0 . . . . . . . . . . . . B . 15 GLN CD . . . . . . . . . c19602_2mgt 1 . 9 . 4813 . 2 1 16 GLN CG C 5.843 -1.480 3.035 . . . 1.0 . . . . . . . . . . . . B . 15 GLN CG . . . . . . . . . c19602_2mgt 1 . 9 . 4814 . 2 1 16 GLN H H 7.470 1.680 2.046 . . . 1.0 . . . . . . . . . . . . B . 15 GLN H . . . . . . . . . c19602_2mgt 1 . 9 . 4815 . 2 1 16 GLN HA H 7.308 0.162 4.582 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HA . . . . . . . . . c19602_2mgt 1 . 9 . 4816 . 2 1 16 GLN HB2 H 7.454 -0.859 1.723 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HB2 . . . . . . . . . c19602_2mgt 1 . 9 . 4817 . 2 1 16 GLN HB3 H 7.938 -1.827 3.094 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HB3 . . . . . . . . . c19602_2mgt 1 . 9 . 4818 . 2 1 16 GLN HE21 H 3.868 -3.129 3.410 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HE21 . . . . . . . . . c19602_2mgt 1 . 9 . 4819 . 2 1 16 GLN HE22 H 4.308 -4.394 2.282 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HE22 . . . . . . . . . c19602_2mgt 1 . 9 . 4820 . 2 1 16 GLN HG2 H 5.676 -1.570 4.109 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HG2 . . . . . . . . . c19602_2mgt 1 . 9 . 4821 . 2 1 16 GLN HG3 H 5.140 -0.749 2.636 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HG3 . . . . . . . . . c19602_2mgt 1 . 9 . 4822 . 2 1 16 GLN N N 7.051 1.417 2.923 . . . 1.0 . . . . . . . . . . . . B . 15 GLN N . . . . . . . . . c19602_2mgt 1 . 9 . 4823 . 2 1 16 GLN NE2 N 4.512 -3.517 2.738 . . . 1.0 . . . . . . . . . . . . B . 15 GLN NE2 . . . . . . . . . c19602_2mgt 1 . 9 . 4824 . 2 1 16 GLN O O 9.717 1.415 3.134 . . . 1.0 . . . . . . . . . . . . B . 15 GLN O . . . . . . . . . c19602_2mgt 1 . 9 . 4825 . 2 1 16 GLN OE1 O 6.381 -3.306 1.571 . . . 1.0 . . . . . . . . . . . . B . 15 GLN OE1 . . . . . . . . . c19602_2mgt 1 . 9 . 4826 . 2 1 17 LYS C C 11.920 -1.893 4.613 . . . 1.0 . . . . . . . . . . . . B . 16 LYS C . . . . . . . . . c19602_2mgt 1 . 9 . 4827 . 2 1 17 LYS CA C 11.344 -0.496 4.381 . . . 1.0 . . . . . . . . . . . . B . 16 LYS CA . . . . . . . . . c19602_2mgt 1 . 9 . 4828 . 2 1 17 LYS CB C 11.611 0.457 5.559 . . . 1.0 . . . . . . . . . . . . B . 16 LYS CB . . . . . . . . . c19602_2mgt 1 . 9 . 4829 . 2 1 17 LYS CD C 11.111 1.184 7.884 . . . 1.0 . . . . . . . . . . . . B . 16 LYS CD . . . . . . . . . c19602_2mgt 1 . 9 . 4830 . 2 1 17 LYS CE C 10.327 0.913 9.161 . . . 1.0 . . . . . . . . . . . . B . 16 LYS CE . . . . . . . . . c19602_2mgt 1 . 9 . 4831 . 2 1 17 LYS CG C 10.852 0.098 6.845 . . . 1.0 . . . . . . . . . . . . B . 16 LYS CG . . . . . . . . . c19602_2mgt 1 . 9 . 4832 . 2 1 17 LYS H H 9.435 -1.395 4.451 . . . 1.0 . . . . . . . . . . . . B . 16 LYS H . . . . . . . . . c19602_2mgt 1 . 9 . 4833 . 2 1 17 LYS HA H 11.837 -0.087 3.498 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HA . . . . . . . . . c19602_2mgt 1 . 9 . 4834 . 2 1 17 LYS HB2 H 12.676 0.467 5.778 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HB2 . . . . . . . . . c19602_2mgt 1 . 9 . 4835 . 2 1 17 LYS HB3 H 11.333 1.467 5.256 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HB3 . . . . . . . . . c19602_2mgt 1 . 9 . 4836 . 2 1 17 LYS HD2 H 12.177 1.228 8.116 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HD2 . . . . . . . . . c19602_2mgt 1 . 9 . 4837 . 2 1 17 LYS HD3 H 10.786 2.139 7.474 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HD3 . . . . . . . . . c19602_2mgt 1 . 9 . 4838 . 2 1 17 LYS HE2 H 9.282 0.731 8.905 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HE2 . . . . . . . . . c19602_2mgt 1 . 9 . 4839 . 2 1 17 LYS HE3 H 10.734 0.039 9.666 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HE3 . . . . . . . . . c19602_2mgt 1 . 9 . 4840 . 2 1 17 LYS HG2 H 9.780 0.050 6.654 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HG2 . . . . . . . . . c19602_2mgt 1 . 9 . 4841 . 2 1 17 LYS HG3 H 11.195 -0.864 7.225 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HG3 . . . . . . . . . c19602_2mgt 1 . 9 . 4842 . 2 1 17 LYS HZ1 H 11.356 2.245 10.326 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HZ1 . . . . . . . . . c19602_2mgt 1 . 9 . 4843 . 2 1 17 LYS HZ2 H 10.058 2.895 9.559 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HZ2 . . . . . . . . . c19602_2mgt 1 . 9 . 4844 . 2 1 17 LYS HZ3 H 9.833 1.932 10.870 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HZ3 . . . . . . . . . c19602_2mgt 1 . 9 . 4845 . 2 1 17 LYS N N 9.911 -0.568 4.122 . . . 1.0 . . . . . . . . . . . . B . 16 LYS N . . . . . . . . . c19602_2mgt 1 . 9 . 4846 . 2 1 17 LYS NZ N 10.400 2.078 10.049 . . . 1.0 . . . . . . . . . . . . B . 16 LYS NZ . . . . . . . . . c19602_2mgt 1 . 9 . 4847 . 2 1 17 LYS O O 11.191 -2.875 4.690 . . . 1.0 . . . . . . . . . . . . B . 16 LYS O . . . . . . . . . c19602_2mgt 1 . 9 . 4848 . 2 1 18 NH2 HN1 H 13.824 -1.176 4.638 . . . 1.0 . . . . . . . . . . . . B . 17 NH2 HN1 . . . . . . . . . c19602_2mgt 1 . 9 . 4849 . 2 1 18 NH2 HN2 H 13.664 -2.906 4.841 . . . 1.0 . . . . . . . . . . . . B . 17 NH2 HN2 . . . . . . . . . c19602_2mgt 1 . 9 . 4850 . 2 1 18 NH2 N N 13.242 -1.998 4.707 . . . 1.0 . . . . . . . . . . . . B . 17 NH2 N . . . . . . . . . c19602_2mgt 1 . 9 . 4851 . 3 2 1 ZN ZN Zn 0.510 0.822 1.519 . . . 1.0 . . . . . . . . . . . . A . 101 ZN ZN . . . . . . . . . c19602_2mgt 1 . 10 . 4852 . 1 1 1 ACE C C -16.707 -5.713 1.117 . . . 1.0 . . . . . . . . . . . . A . 0 ACE C . . . . . . . . . c19602_2mgt 1 . 10 . 4853 . 1 1 1 ACE CH3 C -17.096 -6.922 0.284 . . . 1.0 . . . . . . . . . . . . A . 0 ACE CH3 . . . . . . . . . c19602_2mgt 1 . 10 . 4854 . 1 1 1 ACE H1 H -17.405 -6.603 -0.706 . . . 1.0 . . . . . . . . . . . . A . 0 ACE H1 . . . . . . . . . c19602_2mgt 1 . 10 . 4855 . 1 1 1 ACE H2 H -16.241 -7.591 0.190 . . . 1.0 . . . . . . . . . . . . A . 0 ACE H2 . . . . . . . . . c19602_2mgt 1 . 10 . 4856 . 1 1 1 ACE H3 H -17.916 -7.454 0.764 . . . 1.0 . . . . . . . . . . . . A . 0 ACE H3 . . . . . . . . . c19602_2mgt 1 . 10 . 4857 . 1 1 1 ACE O O -17.344 -5.449 2.132 . . . 1.0 . . . . . . . . . . . . A . 0 ACE O . . . . . . . . . c19602_2mgt 1 . 10 . 4858 . 1 1 2 ASP C C -15.457 -2.552 1.192 . . . 1.0 . . . . . . . . . . . . A . 1 ASP C . . . . . . . . . c19602_2mgt 1 . 10 . 4859 . 1 1 2 ASP CA C -14.939 -3.969 1.441 . . . 1.0 . . . . . . . . . . . . A . 1 ASP CA . . . . . . . . . c19602_2mgt 1 . 10 . 4860 . 1 1 2 ASP CB C -13.450 -4.032 1.059 . . . 1.0 . . . . . . . . . . . . A . 1 ASP CB . . . . . . . . . c19602_2mgt 1 . 10 . 4861 . 1 1 2 ASP CG C -12.717 -5.181 1.732 . . . 1.0 . . . . . . . . . . . . A . 1 ASP CG . . . . . . . . . c19602_2mgt 1 . 10 . 4862 . 1 1 2 ASP H H -15.219 -5.294 -0.173 . . . 1.0 . . . . . . . . . . . . A . 1 ASP H . . . . . . . . . c19602_2mgt 1 . 10 . 4863 . 1 1 2 ASP HA H -15.050 -4.153 2.509 . . . 1.0 . . . . . . . . . . . . A . 1 ASP HA . . . . . . . . . c19602_2mgt 1 . 10 . 4864 . 1 1 2 ASP HB2 H -13.350 -4.116 -0.024 . . . 1.0 . . . . . . . . . . . . A . 1 ASP HB2 . . . . . . . . . c19602_2mgt 1 . 10 . 4865 . 1 1 2 ASP HB3 H -12.962 -3.113 1.365 . . . 1.0 . . . . . . . . . . . . A . 1 ASP HB3 . . . . . . . . . c19602_2mgt 1 . 10 . 4866 . 1 1 2 ASP N N -15.642 -5.018 0.701 . . . 1.0 . . . . . . . . . . . . A . 1 ASP N . . . . . . . . . c19602_2mgt 1 . 10 . 4867 . 1 1 2 ASP O O -14.903 -1.619 1.763 . . . 1.0 . . . . . . . . . . . . A . 1 ASP O . . . . . . . . . c19602_2mgt 1 . 10 . 4868 . 1 1 2 ASP OD1 O -13.094 -5.559 2.845 . . . 1.0 . . . . . . . . . . . . A . 1 ASP OD1 . . . . . . . . . c19602_2mgt 1 . 10 . 4869 . 1 1 2 ASP OD2 O -11.733 -5.663 1.135 . . . 1.0 . . . . . . . . . . . . A . 1 ASP OD2 . . . . . . . . . c19602_2mgt 1 . 10 . 4870 . 1 1 3 ALA C C -17.166 -0.017 0.892 . . . 1.0 . . . . . . . . . . . . A . 2 ALA C . . . . . . . . . c19602_2mgt 1 . 10 . 4871 . 1 1 3 ALA CA C -17.140 -1.181 -0.102 . . . 1.0 . . . . . . . . . . . . A . 2 ALA CA . . . . . . . . . c19602_2mgt 1 . 10 . 4872 . 1 1 3 ALA CB C -18.576 -1.546 -0.469 . . . 1.0 . . . . . . . . . . . . A . 2 ALA CB . . . . . . . . . c19602_2mgt 1 . 10 . 4873 . 1 1 3 ALA H H -16.805 -3.261 -0.083 . . . 1.0 . . . . . . . . . . . . A . 2 ALA H . . . . . . . . . c19602_2mgt 1 . 10 . 4874 . 1 1 3 ALA HA H -16.632 -0.832 -0.999 . . . 1.0 . . . . . . . . . . . . A . 2 ALA HA . . . . . . . . . c19602_2mgt 1 . 10 . 4875 . 1 1 3 ALA HB1 H -19.097 -1.910 0.415 . . . 1.0 . . . . . . . . . . . . A . 2 ALA HB1 . . . . . . . . . c19602_2mgt 1 . 10 . 4876 . 1 1 3 ALA HB2 H -19.091 -0.662 -0.838 . . . 1.0 . . . . . . . . . . . . A . 2 ALA HB2 . . . . . . . . . c19602_2mgt 1 . 10 . 4877 . 1 1 3 ALA HB3 H -18.576 -2.323 -1.231 . . . 1.0 . . . . . . . . . . . . A . 2 ALA HB3 . . . . . . . . . c19602_2mgt 1 . 10 . 4878 . 1 1 3 ALA N N -16.487 -2.410 0.352 . . . 1.0 . . . . . . . . . . . . A . 2 ALA N . . . . . . . . . c19602_2mgt 1 . 10 . 4879 . 1 1 3 ALA O O -16.822 1.100 0.523 . . . 1.0 . . . . . . . . . . . . A . 2 ALA O . . . . . . . . . c19602_2mgt 1 . 10 . 4880 . 1 1 4 GLU C C -16.346 1.411 3.544 . . . 1.0 . . . . . . . . . . . . A . 3 GLU C . . . . . . . . . c19602_2mgt 1 . 10 . 4881 . 1 1 4 GLU CA C -17.673 0.735 3.193 . . . 1.0 . . . . . . . . . . . . A . 3 GLU CA . . . . . . . . . c19602_2mgt 1 . 10 . 4882 . 1 1 4 GLU CB C -18.315 0.080 4.412 . . . 1.0 . . . . . . . . . . . . A . 3 GLU CB . . . . . . . . . c19602_2mgt 1 . 10 . 4883 . 1 1 4 GLU CD C -18.183 -1.937 5.862 . . . 1.0 . . . . . . . . . . . . A . 3 GLU CD . . . . . . . . . c19602_2mgt 1 . 10 . 4884 . 1 1 4 GLU CG C -17.378 -0.935 5.070 . . . 1.0 . . . . . . . . . . . . A . 3 GLU CG . . . . . . . . . c19602_2mgt 1 . 10 . 4885 . 1 1 4 GLU H H -17.822 -1.216 2.376 . . . 1.0 . . . . . . . . . . . . A . 3 GLU H . . . . . . . . . c19602_2mgt 1 . 10 . 4886 . 1 1 4 GLU HA H -18.348 1.512 2.851 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HA . . . . . . . . . c19602_2mgt 1 . 10 . 4887 . 1 1 4 GLU HB2 H -18.577 0.841 5.145 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HB2 . . . . . . . . . c19602_2mgt 1 . 10 . 4888 . 1 1 4 GLU HB3 H -19.232 -0.417 4.094 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HB3 . . . . . . . . . c19602_2mgt 1 . 10 . 4889 . 1 1 4 GLU HG2 H -16.804 -1.468 4.310 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HG2 . . . . . . . . . c19602_2mgt 1 . 10 . 4890 . 1 1 4 GLU HG3 H -16.693 -0.414 5.737 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HG3 . . . . . . . . . c19602_2mgt 1 . 10 . 4891 . 1 1 4 GLU N N -17.561 -0.269 2.140 . . . 1.0 . . . . . . . . . . . . A . 3 GLU N . . . . . . . . . c19602_2mgt 1 . 10 . 4892 . 1 1 4 GLU O O -16.368 2.508 4.079 . . . 1.0 . . . . . . . . . . . . A . 3 GLU O . . . . . . . . . c19602_2mgt 1 . 10 . 4893 . 1 1 4 GLU OE1 O -18.889 -1.496 6.787 . . . 1.0 . . . . . . . . . . . . A . 3 GLU OE1 . . . . . . . . . c19602_2mgt 1 . 10 . 4894 . 1 1 4 GLU OE2 O -18.144 -3.122 5.514 . . . 1.0 . . . . . . . . . . . . A . 3 GLU OE2 . . . . . . . . . c19602_2mgt 1 . 10 . 4895 . 1 1 5 PHE C C -13.270 1.864 2.081 . . . 1.0 . . . . . . . . . . . . A . 4 PHE C . . . . . . . . . c19602_2mgt 1 . 10 . 4896 . 1 1 5 PHE CA C -13.871 1.362 3.383 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CA . . . . . . . . . c19602_2mgt 1 . 10 . 4897 . 1 1 5 PHE CB C -12.951 0.319 4.012 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CB . . . . . . . . . c19602_2mgt 1 . 10 . 4898 . 1 1 5 PHE CD1 C -13.491 0.748 6.432 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CD1 . . . . . . . . . c19602_2mgt 1 . 10 . 4899 . 1 1 5 PHE CD2 C -13.991 -1.440 5.491 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CD2 . . . . . . . . . c19602_2mgt 1 . 10 . 4900 . 1 1 5 PHE CE1 C -14.007 0.340 7.671 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CE1 . . . . . . . . . c19602_2mgt 1 . 10 . 4901 . 1 1 5 PHE CE2 C -14.518 -1.843 6.728 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CE2 . . . . . . . . . c19602_2mgt 1 . 10 . 4902 . 1 1 5 PHE CG C -13.465 -0.147 5.350 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CG . . . . . . . . . c19602_2mgt 1 . 10 . 4903 . 1 1 5 PHE CZ C -14.523 -0.958 7.819 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CZ . . . . . . . . . c19602_2mgt 1 . 10 . 4904 . 1 1 5 PHE H H -15.266 -0.132 2.837 . . . 1.0 . . . . . . . . . . . . A . 4 PHE H . . . . . . . . . c19602_2mgt 1 . 10 . 4905 . 1 1 5 PHE HA H -13.922 2.215 4.051 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HA . . . . . . . . . c19602_2mgt 1 . 10 . 4906 . 1 1 5 PHE HB2 H -12.852 -0.529 3.333 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HB2 . . . . . . . . . c19602_2mgt 1 . 10 . 4907 . 1 1 5 PHE HB3 H -11.964 0.755 4.156 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HB3 . . . . . . . . . c19602_2mgt 1 . 10 . 4908 . 1 1 5 PHE HD1 H -13.132 1.757 6.300 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HD1 . . . . . . . . . c19602_2mgt 1 . 10 . 4909 . 1 1 5 PHE HD2 H -14.012 -2.108 4.643 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HD2 . . . . . . . . . c19602_2mgt 1 . 10 . 4910 . 1 1 5 PHE HE1 H -14.007 1.025 8.504 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HE1 . . . . . . . . . c19602_2mgt 1 . 10 . 4911 . 1 1 5 PHE HE2 H -14.924 -2.831 6.839 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HE2 . . . . . . . . . c19602_2mgt 1 . 10 . 4912 . 1 1 5 PHE HZ H -14.919 -1.281 8.771 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HZ . . . . . . . . . c19602_2mgt 1 . 10 . 4913 . 1 1 5 PHE N N -15.206 0.796 3.227 . . . 1.0 . . . . . . . . . . . . A . 4 PHE N . . . . . . . . . c19602_2mgt 1 . 10 . 4914 . 1 1 5 PHE O O -12.273 2.575 2.149 . . . 1.0 . . . . . . . . . . . . A . 4 PHE O . . . . . . . . . c19602_2mgt 1 . 10 . 4915 . 1 1 6 ARG C C -13.757 3.531 -0.594 . . . 1.0 . . . . . . . . . . . . A . 5 ARG C . . . . . . . . . c19602_2mgt 1 . 10 . 4916 . 1 1 6 ARG CA C -13.453 2.033 -0.396 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CA . . . . . . . . . c19602_2mgt 1 . 10 . 4917 . 1 1 6 ARG CB C -14.098 1.163 -1.484 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CB . . . . . . . . . c19602_2mgt 1 . 10 . 4918 . 1 1 6 ARG CD C -12.274 -0.689 -1.283 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CD . . . . . . . . . c19602_2mgt 1 . 10 . 4919 . 1 1 6 ARG CG C -13.766 -0.332 -1.356 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CG . . . . . . . . . c19602_2mgt 1 . 10 . 4920 . 1 1 6 ARG CZ C -11.594 -0.438 -3.686 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CZ . . . . . . . . . c19602_2mgt 1 . 10 . 4921 . 1 1 6 ARG H H -14.693 0.970 0.949 . . . 1.0 . . . . . . . . . . . . A . 5 ARG H . . . . . . . . . c19602_2mgt 1 . 10 . 4922 . 1 1 6 ARG HA H -12.376 1.905 -0.475 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HA . . . . . . . . . c19602_2mgt 1 . 10 . 4923 . 1 1 6 ARG HB2 H -15.178 1.286 -1.442 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HB2 . . . . . . . . . c19602_2mgt 1 . 10 . 4924 . 1 1 6 ARG HB3 H -13.764 1.506 -2.464 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HB3 . . . . . . . . . c19602_2mgt 1 . 10 . 4925 . 1 1 6 ARG HD2 H -11.864 -0.312 -0.348 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HD2 . . . . . . . . . c19602_2mgt 1 . 10 . 4926 . 1 1 6 ARG HD3 H -12.160 -1.773 -1.285 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HD3 . . . . . . . . . c19602_2mgt 1 . 10 . 4927 . 1 1 6 ARG HE H -10.877 0.638 -2.146 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HE . . . . . . . . . c19602_2mgt 1 . 10 . 4928 . 1 1 6 ARG HG2 H -14.243 -0.721 -0.465 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HG2 . . . . . . . . . c19602_2mgt 1 . 10 . 4929 . 1 1 6 ARG HG3 H -14.202 -0.841 -2.206 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HG3 . . . . . . . . . c19602_2mgt 1 . 10 . 4930 . 1 1 6 ARG HH11 H -12.984 -1.895 -3.449 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH11 . . . . . . . . . c19602_2mgt 1 . 10 . 4931 . 1 1 6 ARG HH12 H -12.481 -1.602 -5.099 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH12 . . . . . . . . . c19602_2mgt 1 . 10 . 4932 . 1 1 6 ARG HH21 H -10.162 0.880 -4.263 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH21 . . . . . . . . . c19602_2mgt 1 . 10 . 4933 . 1 1 6 ARG HH22 H -10.888 -0.057 -5.550 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH22 . . . . . . . . . c19602_2mgt 1 . 10 . 4934 . 1 1 6 ARG N N -13.871 1.555 0.923 . . . 1.0 . . . . . . . . . . . . A . 5 ARG N . . . . . . . . . c19602_2mgt 1 . 10 . 4935 . 1 1 6 ARG NE N -11.502 -0.115 -2.389 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NE . . . . . . . . . c19602_2mgt 1 . 10 . 4936 . 1 1 6 ARG NH1 N -12.416 -1.391 -4.113 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NH1 . . . . . . . . . c19602_2mgt 1 . 10 . 4937 . 1 1 6 ARG NH2 N -10.847 0.207 -4.577 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NH2 . . . . . . . . . c19602_2mgt 1 . 10 . 4938 . 1 1 6 ARG O O -13.965 3.980 -1.715 . . . 1.0 . . . . . . . . . . . . A . 5 ARG O . . . . . . . . . c19602_2mgt 1 . 10 . 4939 . 1 1 7 ARG C C -12.933 6.591 0.201 . . . 1.0 . . . . . . . . . . . . A . 6 ARG C . . . . . . . . . c19602_2mgt 1 . 10 . 4940 . 1 1 7 ARG CA C -14.134 5.712 0.552 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CA . . . . . . . . . c19602_2mgt 1 . 10 . 4941 . 1 1 7 ARG CB C -14.584 6.065 1.976 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CB . . . . . . . . . c19602_2mgt 1 . 10 . 4942 . 1 1 7 ARG CD C -16.992 5.180 1.769 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CD . . . . . . . . . c19602_2mgt 1 . 10 . 4943 . 1 1 7 ARG CG C -15.683 5.172 2.558 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CG . . . . . . . . . c19602_2mgt 1 . 10 . 4944 . 1 1 7 ARG CZ C -17.422 4.290 -0.536 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CZ . . . . . . . . . c19602_2mgt 1 . 10 . 4945 . 1 1 7 ARG H H -13.633 3.867 1.387 . . . 1.0 . . . . . . . . . . . . A . 6 ARG H . . . . . . . . . c19602_2mgt 1 . 10 . 4946 . 1 1 7 ARG HA H -14.948 5.886 -0.141 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HA . . . . . . . . . c19602_2mgt 1 . 10 . 4947 . 1 1 7 ARG HB2 H -13.717 5.987 2.633 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HB2 . . . . . . . . . c19602_2mgt 1 . 10 . 4948 . 1 1 7 ARG HB3 H -14.928 7.101 1.996 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HB3 . . . . . . . . . c19602_2mgt 1 . 10 . 4949 . 1 1 7 ARG HD2 H -17.814 4.996 2.462 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HD2 . . . . . . . . . c19602_2mgt 1 . 10 . 4950 . 1 1 7 ARG HD3 H -17.124 6.162 1.330 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HD3 . . . . . . . . . c19602_2mgt 1 . 10 . 4951 . 1 1 7 ARG HE H -16.899 3.185 1.066 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HE . . . . . . . . . c19602_2mgt 1 . 10 . 4952 . 1 1 7 ARG HG2 H -15.303 4.158 2.621 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HG2 . . . . . . . . . c19602_2mgt 1 . 10 . 4953 . 1 1 7 ARG HG3 H -15.893 5.525 3.566 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HG3 . . . . . . . . . c19602_2mgt 1 . 10 . 4954 . 1 1 7 ARG HH11 H -17.518 6.327 -0.521 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH11 . . . . . . . . . c19602_2mgt 1 . 10 . 4955 . 1 1 7 ARG HH12 H -17.961 5.561 -2.028 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH12 . . . . . . . . . c19602_2mgt 1 . 10 . 4956 . 1 1 7 ARG HH21 H -17.462 2.291 -0.904 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH21 . . . . . . . . . c19602_2mgt 1 . 10 . 4957 . 1 1 7 ARG HH22 H -17.953 3.306 -2.238 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH22 . . . . . . . . . c19602_2mgt 1 . 10 . 4958 . 1 1 7 ARG N N -13.807 4.303 0.497 . . . 1.0 . . . . . . . . . . . . A . 6 ARG N . . . . . . . . . c19602_2mgt 1 . 10 . 4959 . 1 1 7 ARG NE N -17.040 4.132 0.740 . . . 1.0 . . . . . . . . . . . . A . 6 ARG NE . . . . . . . . . c19602_2mgt 1 . 10 . 4960 . 1 1 7 ARG NH1 N -17.659 5.490 -1.067 . . . 1.0 . . . . . . . . . . . . A . 6 ARG NH1 . . . . . . . . . c19602_2mgt 1 . 10 . 4961 . 1 1 7 ARG NH2 N -17.591 3.211 -1.301 . . . 1.0 . . . . . . . . . . . . A . 6 ARG NH2 . . . . . . . . . c19602_2mgt 1 . 10 . 4962 . 1 1 7 ARG O O -11.793 6.142 0.250 . . . 1.0 . . . . . . . . . . . . A . 6 ARG O . . . . . . . . . c19602_2mgt 1 . 10 . 4963 . 1 1 8 ASP C C -11.312 9.105 1.077 . . . 1.0 . . . . . . . . . . . . A . 7 ASP C . . . . . . . . . c19602_2mgt 1 . 10 . 4964 . 1 1 8 ASP CA C -12.164 8.907 -0.192 . . . 1.0 . . . . . . . . . . . . A . 7 ASP CA . . . . . . . . . c19602_2mgt 1 . 10 . 4965 . 1 1 8 ASP CB C -12.894 10.202 -0.575 . . . 1.0 . . . . . . . . . . . . A . 7 ASP CB . . . . . . . . . c19602_2mgt 1 . 10 . 4966 . 1 1 8 ASP CG C -11.925 11.322 -0.915 . . . 1.0 . . . . . . . . . . . . A . 7 ASP CG . . . . . . . . . c19602_2mgt 1 . 10 . 4967 . 1 1 8 ASP H H -14.144 8.194 -0.027 . . . 1.0 . . . . . . . . . . . . A . 7 ASP H . . . . . . . . . c19602_2mgt 1 . 10 . 4968 . 1 1 8 ASP HA H -11.504 8.621 -1.010 . . . 1.0 . . . . . . . . . . . . A . 7 ASP HA . . . . . . . . . c19602_2mgt 1 . 10 . 4969 . 1 1 8 ASP HB2 H -13.512 10.017 -1.455 . . . 1.0 . . . . . . . . . . . . A . 7 ASP HB2 . . . . . . . . . c19602_2mgt 1 . 10 . 4970 . 1 1 8 ASP HB3 H -13.544 10.510 0.246 . . . 1.0 . . . . . . . . . . . . A . 7 ASP HB3 . . . . . . . . . c19602_2mgt 1 . 10 . 4971 . 1 1 8 ASP N N -13.184 7.880 -0.036 . . . 1.0 . . . . . . . . . . . . A . 7 ASP N . . . . . . . . . c19602_2mgt 1 . 10 . 4972 . 1 1 8 ASP O O -10.202 9.623 0.983 . . . 1.0 . . . . . . . . . . . . A . 7 ASP O . . . . . . . . . c19602_2mgt 1 . 10 . 4973 . 1 1 8 ASP OD1 O -10.924 11.048 -1.578 . . . 1.0 . . . . . . . . . . . . A . 7 ASP OD1 . . . . . . . . . c19602_2mgt 1 . 10 . 4974 . 1 1 8 ASP OD2 O -12.199 12.475 -0.513 . . . 1.0 . . . . . . . . . . . . A . 7 ASP OD2 . . . . . . . . . c19602_2mgt 1 . 10 . 4975 . 1 1 9 SER C C -9.916 8.659 3.900 . . . 1.0 . . . . . . . . . . . . A . 8 SER C . . . . . . . . . c19602_2mgt 1 . 10 . 4976 . 1 1 9 SER CA C -11.374 8.990 3.589 . . . 1.0 . . . . . . . . . . . . A . 8 SER CA . . . . . . . . . c19602_2mgt 1 . 10 . 4977 . 1 1 9 SER CB C -12.237 8.196 4.572 . . . 1.0 . . . . . . . . . . . . A . 8 SER CB . . . . . . . . . c19602_2mgt 1 . 10 . 4978 . 1 1 9 SER H H -12.731 8.232 2.205 . . . 1.0 . . . . . . . . . . . . A . 8 SER H . . . . . . . . . c19602_2mgt 1 . 10 . 4979 . 1 1 9 SER HA H -11.537 10.051 3.770 . . . 1.0 . . . . . . . . . . . . A . 8 SER HA . . . . . . . . . c19602_2mgt 1 . 10 . 4980 . 1 1 9 SER HB2 H -11.952 7.144 4.524 . . . 1.0 . . . . . . . . . . . . A . 8 SER HB2 . . . . . . . . . c19602_2mgt 1 . 10 . 4981 . 1 1 9 SER HB3 H -12.070 8.564 5.585 . . . 1.0 . . . . . . . . . . . . A . 8 SER HB3 . . . . . . . . . c19602_2mgt 1 . 10 . 4982 . 1 1 9 SER HG H -14.099 7.770 4.881 . . . 1.0 . . . . . . . . . . . . A . 8 SER HG . . . . . . . . . c19602_2mgt 1 . 10 . 4983 . 1 1 9 SER N N -11.828 8.679 2.238 . . . 1.0 . . . . . . . . . . . . A . 8 SER N . . . . . . . . . c19602_2mgt 1 . 10 . 4984 . 1 1 9 SER O O -9.351 9.300 4.776 . . . 1.0 . . . . . . . . . . . . A . 8 SER O . . . . . . . . . c19602_2mgt 1 . 10 . 4985 . 1 1 9 SER OG O -13.605 8.312 4.256 . . . 1.0 . . . . . . . . . . . . A . 8 SER OG . . . . . . . . . c19602_2mgt 1 . 10 . 4986 . 1 1 10 GLY C C -7.182 7.390 2.216 . . . 1.0 . . . . . . . . . . . . A . 9 GLY C . . . . . . . . . c19602_2mgt 1 . 10 . 4987 . 1 1 10 GLY CA C -7.956 7.224 3.510 . . . 1.0 . . . . . . . . . . . . A . 9 GLY CA . . . . . . . . . c19602_2mgt 1 . 10 . 4988 . 1 1 10 GLY H H -9.772 7.229 2.456 . . . 1.0 . . . . . . . . . . . . A . 9 GLY H . . . . . . . . . c19602_2mgt 1 . 10 . 4989 . 1 1 10 GLY HA2 H -7.477 7.802 4.300 . . . 1.0 . . . . . . . . . . . . A . 9 GLY HA2 . . . . . . . . . c19602_2mgt 1 . 10 . 4990 . 1 1 10 GLY HA3 H -7.995 6.186 3.816 . . . 1.0 . . . . . . . . . . . . A . 9 GLY HA3 . . . . . . . . . c19602_2mgt 1 . 10 . 4991 . 1 1 10 GLY N N -9.311 7.668 3.240 . . . 1.0 . . . . . . . . . . . . A . 9 GLY N . . . . . . . . . c19602_2mgt 1 . 10 . 4992 . 1 1 10 GLY O O -7.017 8.521 1.784 . . . 1.0 . . . . . . . . . . . . A . 9 GLY O . . . . . . . . . c19602_2mgt 1 . 10 . 4993 . 1 1 11 TYR C C -5.950 4.055 1.083 . . . 1.0 . . . . . . . . . . . . A . 10 TYR C . . . . . . . . . c19602_2mgt 1 . 10 . 4994 . 1 1 11 TYR CA C -6.809 4.937 1.974 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CA . . . . . . . . . c19602_2mgt 1 . 10 . 4995 . 1 1 11 TYR CB C -8.246 4.424 1.852 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CB . . . . . . . . . c19602_2mgt 1 . 10 . 4996 . 1 1 11 TYR CD1 C -8.107 2.909 3.883 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CD1 . . . . . . . . . c19602_2mgt 1 . 10 . 4997 . 1 1 11 TYR CD2 C -10.131 4.204 3.489 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CD2 . . . . . . . . . c19602_2mgt 1 . 10 . 4998 . 1 1 11 TYR CE1 C -8.689 2.333 5.016 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CE1 . . . . . . . . . c19602_2mgt 1 . 10 . 4999 . 1 1 11 TYR CE2 C -10.725 3.624 4.616 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CE2 . . . . . . . . . c19602_2mgt 1 . 10 . 5000 . 1 1 11 TYR CG C -8.831 3.836 3.110 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CG . . . . . . . . . c19602_2mgt 1 . 10 . 5001 . 1 1 11 TYR CZ C -10.008 2.675 5.375 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CZ . . . . . . . . . c19602_2mgt 1 . 10 . 5002 . 1 1 11 TYR H H -6.474 6.443 0.589 . . . 1.0 . . . . . . . . . . . . A . 10 TYR H . . . . . . . . . c19602_2mgt 1 . 10 . 5003 . 1 1 11 TYR HA H -6.453 4.864 3.002 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HA . . . . . . . . . c19602_2mgt 1 . 10 . 5004 . 1 1 11 TYR HB2 H -8.897 5.224 1.506 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HB2 . . . . . . . . . c19602_2mgt 1 . 10 . 5005 . 1 1 11 TYR HB3 H -8.278 3.660 1.078 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HB3 . . . . . . . . . c19602_2mgt 1 . 10 . 5006 . 1 1 11 TYR HD1 H -7.109 2.620 3.609 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HD1 . . . . . . . . . c19602_2mgt 1 . 10 . 5007 . 1 1 11 TYR HD2 H -10.683 4.919 2.899 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HD2 . . . . . . . . . c19602_2mgt 1 . 10 . 5008 . 1 1 11 TYR HE1 H -8.127 1.626 5.600 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HE1 . . . . . . . . . c19602_2mgt 1 . 10 . 5009 . 1 1 11 TYR HE2 H -11.724 3.910 4.901 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HE2 . . . . . . . . . c19602_2mgt 1 . 10 . 5010 . 1 1 11 TYR HH H -9.990 1.520 6.943 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HH . . . . . . . . . c19602_2mgt 1 . 10 . 5011 . 1 1 11 TYR N N -6.740 6.319 1.549 . . . 1.0 . . . . . . . . . . . . A . 10 TYR N . . . . . . . . . c19602_2mgt 1 . 10 . 5012 . 1 1 11 TYR O O -5.773 4.335 -0.099 . . . 1.0 . . . . . . . . . . . . A . 10 TYR O . . . . . . . . . c19602_2mgt 1 . 10 . 5013 . 1 1 11 TYR OH O -10.584 2.102 6.461 . . . 1.0 . . . . . . . . . . . . A . 10 TYR OH . . . . . . . . . c19602_2mgt 1 . 10 . 5014 . 1 1 12 GLU C C -5.634 0.528 1.670 . . . 1.0 . . . . . . . . . . . . A . 11 GLU C . . . . . . . . . c19602_2mgt 1 . 10 . 5015 . 1 1 12 GLU CA C -5.075 1.758 0.939 . . . 1.0 . . . . . . . . . . . . A . 11 GLU CA . . . . . . . . . c19602_2mgt 1 . 10 . 5016 . 1 1 12 GLU CB C -3.559 1.813 0.909 . . . 1.0 . . . . . . . . . . . . A . 11 GLU CB . . . . . . . . . c19602_2mgt 1 . 10 . 5017 . 1 1 12 GLU CD C -1.516 0.542 0.231 . . . 1.0 . . . . . . . . . . . . A . 11 GLU CD . . . . . . . . . c19602_2mgt 1 . 10 . 5018 . 1 1 12 GLU CG C -2.979 0.802 -0.080 . . . 1.0 . . . . . . . . . . . . A . 11 GLU CG . . . . . . . . . c19602_2mgt 1 . 10 . 5019 . 1 1 12 GLU H H -5.639 2.822 2.649 . . . 1.0 . . . . . . . . . . . . A . 11 GLU H . . . . . . . . . c19602_2mgt 1 . 10 . 5020 . 1 1 12 GLU HA H -5.447 1.795 -0.081 . . . 1.0 . . . . . . . . . . . . A . 11 GLU HA . . . . . . . . . c19602_2mgt 1 . 10 . 5021 . 1 1 12 GLU HB2 H -3.235 2.809 0.604 . . . 1.0 . . . . . . . . . . . . A . 11 GLU HB2 . . . . . . . . . c19602_2mgt 1 . 10 . 5022 . 1 1 12 GLU HB3 H -3.188 1.627 1.918 . . . 1.0 . . . . . . . . . . . . A . 11 GLU HB3 . . . . . . . . . c19602_2mgt 1 . 10 . 5023 . 1 1 12 GLU HG2 H -3.528 -0.139 -0.018 . . . 1.0 . . . . . . . . . . . . A . 11 GLU HG2 . . . . . . . . . c19602_2mgt 1 . 10 . 5024 . 1 1 12 GLU HG3 H -3.069 1.200 -1.090 . . . 1.0 . . . . . . . . . . . . A . 11 GLU HG3 . . . . . . . . . c19602_2mgt 1 . 10 . 5025 . 1 1 12 GLU N N -5.541 2.922 1.651 . . . 1.0 . . . . . . . . . . . . A . 11 GLU N . . . . . . . . . c19602_2mgt 1 . 10 . 5026 . 1 1 12 GLU O O -4.943 -0.111 2.467 . . . 1.0 . . . . . . . . . . . . A . 11 GLU O . . . . . . . . . c19602_2mgt 1 . 10 . 5027 . 1 1 12 GLU OE1 O -0.919 1.346 0.965 . . . 1.0 . . . . . . . . . . . . A . 11 GLU OE1 . . . . . . . . . c19602_2mgt 1 . 10 . 5028 . 1 1 12 GLU OE2 O -0.984 -0.489 -0.206 . . . 1.0 . . . . . . . . . . . . A . 11 GLU OE2 . . . . . . . . . c19602_2mgt 1 . 10 . 5029 . 1 1 13 VAL C C -7.211 -2.020 2.392 . . . 1.0 . . . . . . . . . . . . A . 12 VAL C . . . . . . . . . c19602_2mgt 1 . 10 . 5030 . 1 1 13 VAL CA C -7.781 -0.613 2.246 . . . 1.0 . . . . . . . . . . . . A . 12 VAL CA . . . . . . . . . c19602_2mgt 1 . 10 . 5031 . 1 1 13 VAL CB C -9.205 -0.659 1.650 . . . 1.0 . . . . . . . . . . . . A . 12 VAL CB . . . . . . . . . c19602_2mgt 1 . 10 . 5032 . 1 1 13 VAL CG1 C -10.123 -1.701 2.320 . . . 1.0 . . . . . . . . . . . . A . 12 VAL CG1 . . . . . . . . . c19602_2mgt 1 . 10 . 5033 . 1 1 13 VAL CG2 C -9.878 0.702 1.815 . . . 1.0 . . . . . . . . . . . . A . 12 VAL CG2 . . . . . . . . . c19602_2mgt 1 . 10 . 5034 . 1 1 13 VAL H H -7.390 0.776 0.714 . . . 1.0 . . . . . . . . . . . . A . 12 VAL H . . . . . . . . . c19602_2mgt 1 . 10 . 5035 . 1 1 13 VAL HA H -7.858 -0.169 3.237 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HA . . . . . . . . . c19602_2mgt 1 . 10 . 5036 . 1 1 13 VAL HB H -9.141 -0.885 0.585 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HB . . . . . . . . . c19602_2mgt 1 . 10 . 5037 . 1 1 13 VAL HG11 H -11.136 -1.609 1.931 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HG11 . . . . . . . . . c19602_2mgt 1 . 10 . 5038 . 1 1 13 VAL HG12 H -9.775 -2.710 2.104 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HG12 . . . . . . . . . c19602_2mgt 1 . 10 . 5039 . 1 1 13 VAL HG13 H -10.136 -1.547 3.400 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HG13 . . . . . . . . . c19602_2mgt 1 . 10 . 5040 . 1 1 13 VAL HG21 H -9.983 0.934 2.872 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HG21 . . . . . . . . . c19602_2mgt 1 . 10 . 5041 . 1 1 13 VAL HG22 H -9.290 1.475 1.327 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HG22 . . . . . . . . . c19602_2mgt 1 . 10 . 5042 . 1 1 13 VAL HG23 H -10.856 0.662 1.347 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HG23 . . . . . . . . . c19602_2mgt 1 . 10 . 5043 . 1 1 13 VAL N N -6.924 0.255 1.440 . . . 1.0 . . . . . . . . . . . . A . 12 VAL N . . . . . . . . . c19602_2mgt 1 . 10 . 5044 . 1 1 13 VAL O O -7.478 -2.657 3.405 . . . 1.0 . . . . . . . . . . . . A . 12 VAL O . . . . . . . . . c19602_2mgt 1 . 10 . 5045 . 1 1 14 HIS C C -4.883 -4.118 2.537 . . . 1.0 . . . . . . . . . . . . A . 13 HIS C . . . . . . . . . c19602_2mgt 1 . 10 . 5046 . 1 1 14 HIS CA C -5.920 -3.855 1.431 . . . 1.0 . . . . . . . . . . . . A . 13 HIS CA . . . . . . . . . c19602_2mgt 1 . 10 . 5047 . 1 1 14 HIS CB C -5.453 -4.251 0.024 . . . 1.0 . . . . . . . . . . . . A . 13 HIS CB . . . . . . . . . c19602_2mgt 1 . 10 . 5048 . 1 1 14 HIS CD2 C -5.970 -6.765 -0.007 . . . 1.0 . . . . . . . . . . . . A . 13 HIS CD2 . . . . . . . . . c19602_2mgt 1 . 10 . 5049 . 1 1 14 HIS CE1 C -3.988 -7.570 -0.473 . . . 1.0 . . . . . . . . . . . . A . 13 HIS CE1 . . . . . . . . . c19602_2mgt 1 . 10 . 5050 . 1 1 14 HIS CG C -5.110 -5.710 -0.131 . . . 1.0 . . . . . . . . . . . . A . 13 HIS CG . . . . . . . . . c19602_2mgt 1 . 10 . 5051 . 1 1 14 HIS H H -6.262 -1.939 0.595 . . . 1.0 . . . . . . . . . . . . A . 13 HIS H . . . . . . . . . c19602_2mgt 1 . 10 . 5052 . 1 1 14 HIS HA H -6.779 -4.468 1.663 . . . 1.0 . . . . . . . . . . . . A . 13 HIS HA . . . . . . . . . c19602_2mgt 1 . 10 . 5053 . 1 1 14 HIS HB2 H -6.253 -4.035 -0.684 . . . 1.0 . . . . . . . . . . . . A . 13 HIS HB2 . . . . . . . . . c19602_2mgt 1 . 10 . 5054 . 1 1 14 HIS HB3 H -4.593 -3.649 -0.248 . . . 1.0 . . . . . . . . . . . . A . 13 HIS HB3 . . . . . . . . . c19602_2mgt 1 . 10 . 5055 . 1 1 14 HIS HD1 H -3.022 -5.710 -0.558 . . . 1.0 . . . . . . . . . . . . A . 13 HIS HD1 . . . . . . . . . c19602_2mgt 1 . 10 . 5056 . 1 1 14 HIS HD2 H -7.024 -6.702 0.222 . . . 1.0 . . . . . . . . . . . . A . 13 HIS HD2 . . . . . . . . . c19602_2mgt 1 . 10 . 5057 . 1 1 14 HIS HE1 H -3.175 -8.253 -0.671 . . . 1.0 . . . . . . . . . . . . A . 13 HIS HE1 . . . . . . . . . c19602_2mgt 1 . 10 . 5058 . 1 1 14 HIS N N -6.426 -2.498 1.421 . . . 1.0 . . . . . . . . . . . . A . 13 HIS N . . . . . . . . . c19602_2mgt 1 . 10 . 5059 . 1 1 14 HIS ND1 N -3.874 -6.235 -0.429 . . . 1.0 . . . . . . . . . . . . A . 13 HIS ND1 . . . . . . . . . c19602_2mgt 1 . 10 . 5060 . 1 1 14 HIS NE2 N -5.249 -7.945 -0.223 . . . 1.0 . . . . . . . . . . . . A . 13 HIS NE2 . . . . . . . . . c19602_2mgt 1 . 10 . 5061 . 1 1 14 HIS O O -4.610 -5.279 2.801 . . . 1.0 . . . . . . . . . . . . A . 13 HIS O . . . . . . . . . c19602_2mgt 1 . 10 . 5062 . 1 1 15 HIS C C -4.549 -3.466 5.717 . . . 1.0 . . . . . . . . . . . . A . 14 HIS C . . . . . . . . . c19602_2mgt 1 . 10 . 5063 . 1 1 15 HIS CA C -3.626 -3.359 4.502 . . . 1.0 . . . . . . . . . . . . A . 14 HIS CA . . . . . . . . . c19602_2mgt 1 . 10 . 5064 . 1 1 15 HIS CB C -2.613 -2.253 4.756 . . . 1.0 . . . . . . . . . . . . A . 14 HIS CB . . . . . . . . . c19602_2mgt 1 . 10 . 5065 . 1 1 15 HIS CD2 C -1.046 -1.191 3.059 . . . 1.0 . . . . . . . . . . . . A . 14 HIS CD2 . . . . . . . . . c19602_2mgt 1 . 10 . 5066 . 1 1 15 HIS CE1 C 0.242 -2.894 2.567 . . . 1.0 . . . . . . . . . . . . A . 14 HIS CE1 . . . . . . . . . c19602_2mgt 1 . 10 . 5067 . 1 1 15 HIS CG C -1.474 -2.264 3.781 . . . 1.0 . . . . . . . . . . . . A . 14 HIS CG . . . . . . . . . c19602_2mgt 1 . 10 . 5068 . 1 1 15 HIS H H -4.591 -2.155 3.013 . . . 1.0 . . . . . . . . . . . . A . 14 HIS H . . . . . . . . . c19602_2mgt 1 . 10 . 5069 . 1 1 15 HIS HA H -3.080 -4.297 4.423 . . . 1.0 . . . . . . . . . . . . A . 14 HIS HA . . . . . . . . . c19602_2mgt 1 . 10 . 5070 . 1 1 15 HIS HB2 H -3.122 -1.290 4.717 . . . 1.0 . . . . . . . . . . . . A . 14 HIS HB2 . . . . . . . . . c19602_2mgt 1 . 10 . 5071 . 1 1 15 HIS HB3 H -2.193 -2.375 5.755 . . . 1.0 . . . . . . . . . . . . A . 14 HIS HB3 . . . . . . . . . c19602_2mgt 1 . 10 . 5072 . 1 1 15 HIS HD1 H -0.711 -4.261 3.842 . . . 1.0 . . . . . . . . . . . . A . 14 HIS HD1 . . . . . . . . . c19602_2mgt 1 . 10 . 5073 . 1 1 15 HIS HD2 H -1.482 -0.203 3.093 . . . 1.0 . . . . . . . . . . . . A . 14 HIS HD2 . . . . . . . . . c19602_2mgt 1 . 10 . 5074 . 1 1 15 HIS HE1 H 1.017 -3.495 2.122 . . . 1.0 . . . . . . . . . . . . A . 14 HIS HE1 . . . . . . . . . c19602_2mgt 1 . 10 . 5075 . 1 1 15 HIS N N -4.360 -3.110 3.254 . . . 1.0 . . . . . . . . . . . . A . 14 HIS N . . . . . . . . . c19602_2mgt 1 . 10 . 5076 . 1 1 15 HIS ND1 N -0.653 -3.324 3.468 . . . 1.0 . . . . . . . . . . . . A . 14 HIS ND1 . . . . . . . . . c19602_2mgt 1 . 10 . 5077 . 1 1 15 HIS NE2 N 0.049 -1.599 2.294 . . . 1.0 . . . . . . . . . . . . A . 14 HIS NE2 . . . . . . . . . c19602_2mgt 1 . 10 . 5078 . 1 1 15 HIS O O -4.229 -4.180 6.662 . . . 1.0 . . . . . . . . . . . . A . 14 HIS O . . . . . . . . . c19602_2mgt 1 . 10 . 5079 . 1 1 16 GLN C C -7.511 -4.107 6.707 . . . 1.0 . . . . . . . . . . . . A . 15 GLN C . . . . . . . . . c19602_2mgt 1 . 10 . 5080 . 1 1 16 GLN CA C -6.653 -2.843 6.795 . . . 1.0 . . . . . . . . . . . . A . 15 GLN CA . . . . . . . . . c19602_2mgt 1 . 10 . 5081 . 1 1 16 GLN CB C -7.498 -1.561 6.795 . . . 1.0 . . . . . . . . . . . . A . 15 GLN CB . . . . . . . . . c19602_2mgt 1 . 10 . 5082 . 1 1 16 GLN CD C -6.376 -0.605 8.871 . . . 1.0 . . . . . . . . . . . . A . 15 GLN CD . . . . . . . . . c19602_2mgt 1 . 10 . 5083 . 1 1 16 GLN CG C -6.727 -0.377 7.400 . . . 1.0 . . . . . . . . . . . . A . 15 GLN CG . . . . . . . . . c19602_2mgt 1 . 10 . 5084 . 1 1 16 GLN H H -5.927 -2.210 4.914 . . . 1.0 . . . . . . . . . . . . A . 15 GLN H . . . . . . . . . c19602_2mgt 1 . 10 . 5085 . 1 1 16 GLN HA H -6.108 -2.908 7.730 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HA . . . . . . . . . c19602_2mgt 1 . 10 . 5086 . 1 1 16 GLN HB2 H -7.799 -1.314 5.777 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HB2 . . . . . . . . . c19602_2mgt 1 . 10 . 5087 . 1 1 16 GLN HB3 H -8.401 -1.727 7.376 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HB3 . . . . . . . . . c19602_2mgt 1 . 10 . 5088 . 1 1 16 GLN HE21 H -8.167 0.085 9.512 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HE21 . . . . . . . . . c19602_2mgt 1 . 10 . 5089 . 1 1 16 GLN HE22 H -7.067 -0.432 10.771 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HE22 . . . . . . . . . c19602_2mgt 1 . 10 . 5090 . 1 1 16 GLN HG2 H -5.816 -0.206 6.827 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HG2 . . . . . . . . . c19602_2mgt 1 . 10 . 5091 . 1 1 16 GLN HG3 H -7.337 0.520 7.328 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HG3 . . . . . . . . . c19602_2mgt 1 . 10 . 5092 . 1 1 16 GLN N N -5.687 -2.773 5.713 . . . 1.0 . . . . . . . . . . . . A . 15 GLN N . . . . . . . . . c19602_2mgt 1 . 10 . 5093 . 1 1 16 GLN NE2 N -7.278 -0.298 9.793 . . . 1.0 . . . . . . . . . . . . A . 15 GLN NE2 . . . . . . . . . c19602_2mgt 1 . 10 . 5094 . 1 1 16 GLN O O -7.903 -4.638 7.738 . . . 1.0 . . . . . . . . . . . . A . 15 GLN O . . . . . . . . . c19602_2mgt 1 . 10 . 5095 . 1 1 16 GLN OE1 O -5.301 -1.091 9.186 . . . 1.0 . . . . . . . . . . . . A . 15 GLN OE1 . . . . . . . . . c19602_2mgt 1 . 10 . 5096 . 1 1 17 LYS C C -7.981 -6.677 4.182 . . . 1.0 . . . . . . . . . . . . A . 16 LYS C . . . . . . . . . c19602_2mgt 1 . 10 . 5097 . 1 1 17 LYS CA C -8.591 -5.795 5.273 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CA . . . . . . . . . c19602_2mgt 1 . 10 . 5098 . 1 1 17 LYS CB C -10.016 -5.353 4.904 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CB . . . . . . . . . c19602_2mgt 1 . 10 . 5099 . 1 1 17 LYS CD C -12.271 -4.633 5.932 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CD . . . . . . . . . c19602_2mgt 1 . 10 . 5100 . 1 1 17 LYS CE C -13.052 -5.910 6.258 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CE . . . . . . . . . c19602_2mgt 1 . 10 . 5101 . 1 1 17 LYS CG C -10.756 -4.771 6.122 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CG . . . . . . . . . c19602_2mgt 1 . 10 . 5102 . 1 1 17 LYS H H -7.428 -4.128 4.689 . . . 1.0 . . . . . . . . . . . . A . 16 LYS H . . . . . . . . . c19602_2mgt 1 . 10 . 5103 . 1 1 17 LYS HA H -8.637 -6.393 6.185 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HA . . . . . . . . . c19602_2mgt 1 . 10 . 5104 . 1 1 17 LYS HB2 H -9.983 -4.610 4.106 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HB2 . . . . . . . . . c19602_2mgt 1 . 10 . 5105 . 1 1 17 LYS HB3 H -10.546 -6.217 4.526 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HB3 . . . . . . . . . c19602_2mgt 1 . 10 . 5106 . 1 1 17 LYS HD2 H -12.623 -3.874 6.627 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HD2 . . . . . . . . . c19602_2mgt 1 . 10 . 5107 . 1 1 17 LYS HD3 H -12.495 -4.284 4.925 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HD3 . . . . . . . . . c19602_2mgt 1 . 10 . 5108 . 1 1 17 LYS HE2 H -12.791 -6.251 7.259 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HE2 . . . . . . . . . c19602_2mgt 1 . 10 . 5109 . 1 1 17 LYS HE3 H -14.112 -5.680 6.241 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HE3 . . . . . . . . . c19602_2mgt 1 . 10 . 5110 . 1 1 17 LYS HG2 H -10.574 -5.391 7.002 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HG2 . . . . . . . . . c19602_2mgt 1 . 10 . 5111 . 1 1 17 LYS HG3 H -10.351 -3.779 6.320 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HG3 . . . . . . . . . c19602_2mgt 1 . 10 . 5112 . 1 1 17 LYS HZ1 H -12.987 -6.667 4.360 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HZ1 . . . . . . . . . c19602_2mgt 1 . 10 . 5113 . 1 1 17 LYS HZ2 H -11.863 -7.309 5.363 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HZ2 . . . . . . . . . c19602_2mgt 1 . 10 . 5114 . 1 1 17 LYS HZ3 H -13.440 -7.766 5.492 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HZ3 . . . . . . . . . c19602_2mgt 1 . 10 . 5115 . 1 1 17 LYS N N -7.766 -4.620 5.502 . . . 1.0 . . . . . . . . . . . . A . 16 LYS N . . . . . . . . . c19602_2mgt 1 . 10 . 5116 . 1 1 17 LYS NZ N -12.820 -6.994 5.301 . . . 1.0 . . . . . . . . . . . . A . 16 LYS NZ . . . . . . . . . c19602_2mgt 1 . 10 . 5117 . 1 1 17 LYS O O -7.371 -6.194 3.236 . . . 1.0 . . . . . . . . . . . . A . 16 LYS O . . . . . . . . . c19602_2mgt 1 . 10 . 5118 . 1 1 18 NH2 HN1 H -7.788 -8.609 3.590 . . . 1.0 . . . . . . . . . . . . A . 17 NH2 HN1 . . . . . . . . . c19602_2mgt 1 . 10 . 5119 . 1 1 18 NH2 HN2 H -8.656 -8.364 5.088 . . . 1.0 . . . . . . . . . . . . A . 17 NH2 HN2 . . . . . . . . . c19602_2mgt 1 . 10 . 5120 . 1 1 18 NH2 N N -8.155 -7.990 4.297 . . . 1.0 . . . . . . . . . . . . A . 17 NH2 N . . . . . . . . . c19602_2mgt 1 . 10 . 5121 . 2 1 1 ACE C C 12.639 5.696 -3.687 . . . 1.0 . . . . . . . . . . . . B . 0 ACE C . . . . . . . . . c19602_2mgt 1 . 10 . 5122 . 2 1 1 ACE CH3 C 11.419 5.959 -2.829 . . . 1.0 . . . . . . . . . . . . B . 0 ACE CH3 . . . . . . . . . c19602_2mgt 1 . 10 . 5123 . 2 1 1 ACE H1 H 10.557 5.456 -3.268 . . . 1.0 . . . . . . . . . . . . B . 0 ACE H1 . . . . . . . . . c19602_2mgt 1 . 10 . 5124 . 2 1 1 ACE H2 H 11.584 5.575 -1.824 . . . 1.0 . . . . . . . . . . . . B . 0 ACE H2 . . . . . . . . . c19602_2mgt 1 . 10 . 5125 . 2 1 1 ACE H3 H 11.238 7.032 -2.777 . . . 1.0 . . . . . . . . . . . . B . 0 ACE H3 . . . . . . . . . c19602_2mgt 1 . 10 . 5126 . 2 1 1 ACE O O 12.501 5.448 -4.873 . . . 1.0 . . . . . . . . . . . . B . 0 ACE O . . . . . . . . . c19602_2mgt 1 . 10 . 5127 . 2 1 2 ASP C C 15.276 4.238 -4.406 . . . 1.0 . . . . . . . . . . . . B . 1 ASP C . . . . . . . . . c19602_2mgt 1 . 10 . 5128 . 2 1 2 ASP CA C 15.115 5.620 -3.764 . . . 1.0 . . . . . . . . . . . . B . 1 ASP CA . . . . . . . . . c19602_2mgt 1 . 10 . 5129 . 2 1 2 ASP CB C 16.205 5.916 -2.733 . . . 1.0 . . . . . . . . . . . . B . 1 ASP CB . . . . . . . . . c19602_2mgt 1 . 10 . 5130 . 2 1 2 ASP CG C 17.504 6.408 -3.342 . . . 1.0 . . . . . . . . . . . . B . 1 ASP CG . . . . . . . . . c19602_2mgt 1 . 10 . 5131 . 2 1 2 ASP H H 13.862 5.933 -2.107 . . . 1.0 . . . . . . . . . . . . B . 1 ASP H . . . . . . . . . c19602_2mgt 1 . 10 . 5132 . 2 1 2 ASP HA H 15.179 6.374 -4.545 . . . 1.0 . . . . . . . . . . . . B . 1 ASP HA . . . . . . . . . c19602_2mgt 1 . 10 . 5133 . 2 1 2 ASP HB2 H 15.856 6.704 -2.062 . . . 1.0 . . . . . . . . . . . . B . 1 ASP HB2 . . . . . . . . . c19602_2mgt 1 . 10 . 5134 . 2 1 2 ASP HB3 H 16.401 5.026 -2.139 . . . 1.0 . . . . . . . . . . . . B . 1 ASP HB3 . . . . . . . . . c19602_2mgt 1 . 10 . 5135 . 2 1 2 ASP N N 13.830 5.752 -3.097 . . . 1.0 . . . . . . . . . . . . B . 1 ASP N . . . . . . . . . c19602_2mgt 1 . 10 . 5136 . 2 1 2 ASP O O 14.691 3.268 -3.931 . . . 1.0 . . . . . . . . . . . . B . 1 ASP O . . . . . . . . . c19602_2mgt 1 . 10 . 5137 . 2 1 2 ASP OD1 O 17.727 6.219 -4.560 . . . 1.0 . . . . . . . . . . . . B . 1 ASP OD1 . . . . . . . . . c19602_2mgt 1 . 10 . 5138 . 2 1 2 ASP OD2 O 18.281 6.989 -2.583 . . . 1.0 . . . . . . . . . . . . B . 1 ASP OD2 . . . . . . . . . c19602_2mgt 1 . 10 . 5139 . 2 1 3 ALA C C 16.722 1.768 -5.528 . . . 1.0 . . . . . . . . . . . . B . 2 ALA C . . . . . . . . . c19602_2mgt 1 . 10 . 5140 . 2 1 3 ALA CA C 16.245 2.985 -6.321 . . . 1.0 . . . . . . . . . . . . B . 2 ALA CA . . . . . . . . . c19602_2mgt 1 . 10 . 5141 . 2 1 3 ALA CB C 17.225 3.318 -7.449 . . . 1.0 . . . . . . . . . . . . B . 2 ALA CB . . . . . . . . . c19602_2mgt 1 . 10 . 5142 . 2 1 3 ALA H H 16.566 4.998 -5.762 . . . 1.0 . . . . . . . . . . . . B . 2 ALA H . . . . . . . . . c19602_2mgt 1 . 10 . 5143 . 2 1 3 ALA HA H 15.284 2.746 -6.768 . . . 1.0 . . . . . . . . . . . . B . 2 ALA HA . . . . . . . . . c19602_2mgt 1 . 10 . 5144 . 2 1 3 ALA HB1 H 18.195 3.602 -7.042 . . . 1.0 . . . . . . . . . . . . B . 2 ALA HB1 . . . . . . . . . c19602_2mgt 1 . 10 . 5145 . 2 1 3 ALA HB2 H 17.352 2.448 -8.090 . . . 1.0 . . . . . . . . . . . . B . 2 ALA HB2 . . . . . . . . . c19602_2mgt 1 . 10 . 5146 . 2 1 3 ALA HB3 H 16.830 4.141 -8.042 . . . 1.0 . . . . . . . . . . . . B . 2 ALA HB3 . . . . . . . . . c19602_2mgt 1 . 10 . 5147 . 2 1 3 ALA N N 16.068 4.165 -5.483 . . . 1.0 . . . . . . . . . . . . B . 2 ALA N . . . . . . . . . c19602_2mgt 1 . 10 . 5148 . 2 1 3 ALA O O 16.208 0.677 -5.741 . . . 1.0 . . . . . . . . . . . . B . 2 ALA O . . . . . . . . . c19602_2mgt 1 . 10 . 5149 . 2 1 4 GLU C C 17.096 0.378 -2.701 . . . 1.0 . . . . . . . . . . . . B . 3 GLU C . . . . . . . . . c19602_2mgt 1 . 10 . 5150 . 2 1 4 GLU CA C 18.148 0.984 -3.628 . . . 1.0 . . . . . . . . . . . . B . 3 GLU CA . . . . . . . . . c19602_2mgt 1 . 10 . 5151 . 2 1 4 GLU CB C 19.252 1.643 -2.802 . . . 1.0 . . . . . . . . . . . . B . 3 GLU CB . . . . . . . . . c19602_2mgt 1 . 10 . 5152 . 2 1 4 GLU CD C 19.954 3.683 -1.535 . . . 1.0 . . . . . . . . . . . . B . 3 GLU CD . . . . . . . . . c19602_2mgt 1 . 10 . 5153 . 2 1 4 GLU CG C 18.771 2.869 -2.016 . . . 1.0 . . . . . . . . . . . . B . 3 GLU CG . . . . . . . . . c19602_2mgt 1 . 10 . 5154 . 2 1 4 GLU H H 18.019 2.903 -4.490 . . . 1.0 . . . . . . . . . . . . B . 3 GLU H . . . . . . . . . c19602_2mgt 1 . 10 . 5155 . 2 1 4 GLU HA H 18.589 0.167 -4.192 . . . 1.0 . . . . . . . . . . . . B . 3 GLU HA . . . . . . . . . c19602_2mgt 1 . 10 . 5156 . 2 1 4 GLU HB2 H 19.682 0.921 -2.110 . . . 1.0 . . . . . . . . . . . . B . 3 GLU HB2 . . . . . . . . . c19602_2mgt 1 . 10 . 5157 . 2 1 4 GLU HB3 H 20.031 1.950 -3.493 . . . 1.0 . . . . . . . . . . . . B . 3 GLU HB3 . . . . . . . . . c19602_2mgt 1 . 10 . 5158 . 2 1 4 GLU HG2 H 18.160 3.512 -2.645 . . . 1.0 . . . . . . . . . . . . B . 3 GLU HG2 . . . . . . . . . c19602_2mgt 1 . 10 . 5159 . 2 1 4 GLU HG3 H 18.171 2.548 -1.162 . . . 1.0 . . . . . . . . . . . . B . 3 GLU HG3 . . . . . . . . . c19602_2mgt 1 . 10 . 5160 . 2 1 4 GLU N N 17.639 1.971 -4.578 . . . 1.0 . . . . . . . . . . . . B . 3 GLU N . . . . . . . . . c19602_2mgt 1 . 10 . 5161 . 2 1 4 GLU O O 17.377 -0.654 -2.099 . . . 1.0 . . . . . . . . . . . . B . 3 GLU O . . . . . . . . . c19602_2mgt 1 . 10 . 5162 . 2 1 4 GLU OE1 O 20.749 4.124 -2.395 . . . 1.0 . . . . . . . . . . . . B . 3 GLU OE1 . . . . . . . . . c19602_2mgt 1 . 10 . 5163 . 2 1 4 GLU OE2 O 20.083 3.878 -0.327 . . . 1.0 . . . . . . . . . . . . B . 3 GLU OE2 . . . . . . . . . c19602_2mgt 1 . 10 . 5164 . 2 1 5 PHE C C 13.728 -0.137 -2.919 . . . 1.0 . . . . . . . . . . . . B . 4 PHE C . . . . . . . . . c19602_2mgt 1 . 10 . 5165 . 2 1 5 PHE CA C 14.752 0.387 -1.930 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CA . . . . . . . . . c19602_2mgt 1 . 10 . 5166 . 2 1 5 PHE CB C 14.089 1.409 -1.010 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CB . . . . . . . . . c19602_2mgt 1 . 10 . 5167 . 2 1 5 PHE CD1 C 15.819 1.237 0.810 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CD1 . . . . . . . . . c19602_2mgt 1 . 10 . 5168 . 2 1 5 PHE CD2 C 15.279 3.431 -0.100 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CD2 . . . . . . . . . c19602_2mgt 1 . 10 . 5169 . 2 1 5 PHE CE1 C 16.785 1.822 1.645 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CE1 . . . . . . . . . c19602_2mgt 1 . 10 . 5170 . 2 1 5 PHE CE2 C 16.244 4.017 0.736 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CE2 . . . . . . . . . c19602_2mgt 1 . 10 . 5171 . 2 1 5 PHE CG C 15.067 2.045 -0.058 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CG . . . . . . . . . c19602_2mgt 1 . 10 . 5172 . 2 1 5 PHE CZ C 16.996 3.213 1.611 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CZ . . . . . . . . . c19602_2mgt 1 . 10 . 5173 . 2 1 5 PHE H H 15.775 1.869 -3.052 . . . 1.0 . . . . . . . . . . . . B . 4 PHE H . . . . . . . . . c19602_2mgt 1 . 10 . 5174 . 2 1 5 PHE HA H 15.078 -0.458 -1.329 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HA . . . . . . . . . c19602_2mgt 1 . 10 . 5175 . 2 1 5 PHE HB2 H 13.619 2.181 -1.621 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HB2 . . . . . . . . . c19602_2mgt 1 . 10 . 5176 . 2 1 5 PHE HB3 H 13.312 0.912 -0.430 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HB3 . . . . . . . . . c19602_2mgt 1 . 10 . 5177 . 2 1 5 PHE HD1 H 15.671 0.165 0.807 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HD1 . . . . . . . . . c19602_2mgt 1 . 10 . 5178 . 2 1 5 PHE HD2 H 14.708 4.032 -0.791 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HD2 . . . . . . . . . c19602_2mgt 1 . 10 . 5179 . 2 1 5 PHE HE1 H 17.378 1.200 2.293 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HE1 . . . . . . . . . c19602_2mgt 1 . 10 . 5180 . 2 1 5 PHE HE2 H 16.411 5.083 0.697 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HE2 . . . . . . . . . c19602_2mgt 1 . 10 . 5181 . 2 1 5 PHE HZ H 17.744 3.660 2.248 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HZ . . . . . . . . . c19602_2mgt 1 . 10 . 5182 . 2 1 5 PHE N N 15.908 0.981 -2.593 . . . 1.0 . . . . . . . . . . . . B . 4 PHE N . . . . . . . . . c19602_2mgt 1 . 10 . 5183 . 2 1 5 PHE O O 12.981 -1.037 -2.546 . . . 1.0 . . . . . . . . . . . . B . 4 PHE O . . . . . . . . . c19602_2mgt 1 . 10 . 5184 . 2 1 6 ARG C C 13.452 -1.448 -5.789 . . . 1.0 . . . . . . . . . . . . B . 5 ARG C . . . . . . . . . c19602_2mgt 1 . 10 . 5185 . 2 1 6 ARG CA C 12.879 -0.126 -5.251 . . . 1.0 . . . . . . . . . . . . B . 5 ARG CA . . . . . . . . . c19602_2mgt 1 . 10 . 5186 . 2 1 6 ARG CB C 12.738 0.939 -6.355 . . . 1.0 . . . . . . . . . . . . B . 5 ARG CB . . . . . . . . . c19602_2mgt 1 . 10 . 5187 . 2 1 6 ARG CD C 10.689 2.060 -5.233 . . . 1.0 . . . . . . . . . . . . B . 5 ARG CD . . . . . . . . . c19602_2mgt 1 . 10 . 5188 . 2 1 6 ARG CG C 12.030 2.242 -5.948 . . . 1.0 . . . . . . . . . . . . B . 5 ARG CG . . . . . . . . . c19602_2mgt 1 . 10 . 5189 . 2 1 6 ARG CZ C 8.577 1.844 -6.568 . . . 1.0 . . . . . . . . . . . . B . 5 ARG CZ . . . . . . . . . c19602_2mgt 1 . 10 . 5190 . 2 1 6 ARG H H 14.331 1.136 -4.380 . . . 1.0 . . . . . . . . . . . . B . 5 ARG H . . . . . . . . . c19602_2mgt 1 . 10 . 5191 . 2 1 6 ARG HA H 11.891 -0.346 -4.851 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HA . . . . . . . . . c19602_2mgt 1 . 10 . 5192 . 2 1 6 ARG HB2 H 13.734 1.182 -6.717 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HB2 . . . . . . . . . c19602_2mgt 1 . 10 . 5193 . 2 1 6 ARG HB3 H 12.180 0.512 -7.186 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HB3 . . . . . . . . . c19602_2mgt 1 . 10 . 5194 . 2 1 6 ARG HD2 H 10.850 1.488 -4.326 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HD2 . . . . . . . . . c19602_2mgt 1 . 10 . 5195 . 2 1 6 ARG HD3 H 10.304 3.034 -4.934 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HD3 . . . . . . . . . c19602_2mgt 1 . 10 . 5196 . 2 1 6 ARG HE H 9.816 0.338 -6.089 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HE . . . . . . . . . c19602_2mgt 1 . 10 . 5197 . 2 1 6 ARG HG2 H 12.683 2.800 -5.288 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HG2 . . . . . . . . . c19602_2mgt 1 . 10 . 5198 . 2 1 6 ARG HG3 H 11.868 2.844 -6.841 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HG3 . . . . . . . . . c19602_2mgt 1 . 10 . 5199 . 2 1 6 ARG HH11 H 9.060 3.801 -6.322 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HH11 . . . . . . . . . c19602_2mgt 1 . 10 . 5200 . 2 1 6 ARG HH12 H 7.482 3.502 -7.011 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HH12 . . . . . . . . . c19602_2mgt 1 . 10 . 5201 . 2 1 6 ARG HH21 H 7.758 0.017 -6.930 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HH21 . . . . . . . . . c19602_2mgt 1 . 10 . 5202 . 2 1 6 ARG HH22 H 6.754 1.390 -7.334 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HH22 . . . . . . . . . c19602_2mgt 1 . 10 . 5203 . 2 1 6 ARG N N 13.699 0.380 -4.157 . . . 1.0 . . . . . . . . . . . . B . 5 ARG N . . . . . . . . . c19602_2mgt 1 . 10 . 5204 . 2 1 6 ARG NE N 9.701 1.340 -6.047 . . . 1.0 . . . . . . . . . . . . B . 5 ARG NE . . . . . . . . . c19602_2mgt 1 . 10 . 5205 . 2 1 6 ARG NH1 N 8.352 3.153 -6.634 . . . 1.0 . . . . . . . . . . . . B . 5 ARG NH1 . . . . . . . . . c19602_2mgt 1 . 10 . 5206 . 2 1 6 ARG NH2 N 7.637 1.015 -7.019 . . . 1.0 . . . . . . . . . . . . B . 5 ARG NH2 . . . . . . . . . c19602_2mgt 1 . 10 . 5207 . 2 1 6 ARG O O 13.632 -1.610 -6.992 . . . 1.0 . . . . . . . . . . . . B . 5 ARG O . . . . . . . . . c19602_2mgt 1 . 10 . 5208 . 2 1 7 ARG C C 13.173 -4.719 -5.149 . . . 1.0 . . . . . . . . . . . . B . 6 ARG C . . . . . . . . . c19602_2mgt 1 . 10 . 5209 . 2 1 7 ARG CA C 14.303 -3.698 -5.055 . . . 1.0 . . . . . . . . . . . . B . 6 ARG CA . . . . . . . . . c19602_2mgt 1 . 10 . 5210 . 2 1 7 ARG CB C 15.183 -4.040 -3.843 . . . 1.0 . . . . . . . . . . . . B . 6 ARG CB . . . . . . . . . c19602_2mgt 1 . 10 . 5211 . 2 1 7 ARG CD C 17.400 -3.027 -4.714 . . . 1.0 . . . . . . . . . . . . B . 6 ARG CD . . . . . . . . . c19602_2mgt 1 . 10 . 5212 . 2 1 7 ARG CG C 16.347 -3.076 -3.601 . . . 1.0 . . . . . . . . . . . . B . 6 ARG CG . . . . . . . . . c19602_2mgt 1 . 10 . 5213 . 2 1 7 ARG CZ C 17.238 -2.177 -7.083 . . . 1.0 . . . . . . . . . . . . B . 6 ARG CZ . . . . . . . . . c19602_2mgt 1 . 10 . 5214 . 2 1 7 ARG H H 13.611 -2.116 -3.909 . . . 1.0 . . . . . . . . . . . . B . 6 ARG H . . . . . . . . . c19602_2mgt 1 . 10 . 5215 . 2 1 7 ARG HA H 14.902 -3.719 -5.959 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HA . . . . . . . . . c19602_2mgt 1 . 10 . 5216 . 2 1 7 ARG HB2 H 14.557 -4.035 -2.948 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HB2 . . . . . . . . . c19602_2mgt 1 . 10 . 5217 . 2 1 7 ARG HB3 H 15.591 -5.042 -3.959 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HB3 . . . . . . . . . c19602_2mgt 1 . 10 . 5218 . 2 1 7 ARG HD2 H 18.342 -2.701 -4.275 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HD2 . . . . . . . . . c19602_2mgt 1 . 10 . 5219 . 2 1 7 ARG HD3 H 17.538 -4.025 -5.122 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HD3 . . . . . . . . . c19602_2mgt 1 . 10 . 5220 . 2 1 7 ARG HE H 16.622 -1.204 -5.437 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HE . . . . . . . . . c19602_2mgt 1 . 10 . 5221 . 2 1 7 ARG HG2 H 15.935 -2.082 -3.452 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HG2 . . . . . . . . . c19602_2mgt 1 . 10 . 5222 . 2 1 7 ARG HG3 H 16.844 -3.381 -2.680 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HG3 . . . . . . . . . c19602_2mgt 1 . 10 . 5223 . 2 1 7 ARG HH11 H 18.198 -3.967 -7.049 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HH11 . . . . . . . . . c19602_2mgt 1 . 10 . 5224 . 2 1 7 ARG HH12 H 17.998 -3.251 -8.632 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HH12 . . . . . . . . . c19602_2mgt 1 . 10 . 5225 . 2 1 7 ARG HH21 H 16.350 -0.397 -7.515 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HH21 . . . . . . . . . c19602_2mgt 1 . 10 . 5226 . 2 1 7 ARG HH22 H 16.990 -1.274 -8.885 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HH22 . . . . . . . . . c19602_2mgt 1 . 10 . 5227 . 2 1 7 ARG N N 13.760 -2.369 -4.871 . . . 1.0 . . . . . . . . . . . . B . 6 ARG N . . . . . . . . . c19602_2mgt 1 . 10 . 5228 . 2 1 7 ARG NE N 17.038 -2.065 -5.762 . . . 1.0 . . . . . . . . . . . . B . 6 ARG NE . . . . . . . . . c19602_2mgt 1 . 10 . 5229 . 2 1 7 ARG NH1 N 17.850 -3.224 -7.633 . . . 1.0 . . . . . . . . . . . . B . 6 ARG NH1 . . . . . . . . . c19602_2mgt 1 . 10 . 5230 . 2 1 7 ARG NH2 N 16.824 -1.205 -7.892 . . . 1.0 . . . . . . . . . . . . B . 6 ARG NH2 . . . . . . . . . c19602_2mgt 1 . 10 . 5231 . 2 1 7 ARG O O 12.059 -4.480 -4.682 . . . 1.0 . . . . . . . . . . . . B . 6 ARG O . . . . . . . . . c19602_2mgt 1 . 10 . 5232 . 2 1 8 ASP C C 12.206 -7.663 -4.501 . . . 1.0 . . . . . . . . . . . . B . 7 ASP C . . . . . . . . . c19602_2mgt 1 . 10 . 5233 . 2 1 8 ASP CA C 12.563 -6.993 -5.840 . . . 1.0 . . . . . . . . . . . . B . 7 ASP CA . . . . . . . . . c19602_2mgt 1 . 10 . 5234 . 2 1 8 ASP CB C 13.165 -8.001 -6.817 . . . 1.0 . . . . . . . . . . . . B . 7 ASP CB . . . . . . . . . c19602_2mgt 1 . 10 . 5235 . 2 1 8 ASP CG C 12.122 -9.040 -7.173 . . . 1.0 . . . . . . . . . . . . B . 7 ASP CG . . . . . . . . . c19602_2mgt 1 . 10 . 5236 . 2 1 8 ASP H H 14.435 -6.036 -6.031 . . . 1.0 . . . . . . . . . . . . B . 7 ASP H . . . . . . . . . c19602_2mgt 1 . 10 . 5237 . 2 1 8 ASP HA H 11.646 -6.598 -6.277 . . . 1.0 . . . . . . . . . . . . B . 7 ASP HA . . . . . . . . . c19602_2mgt 1 . 10 . 5238 . 2 1 8 ASP HB2 H 13.485 -7.498 -7.730 . . . 1.0 . . . . . . . . . . . . B . 7 ASP HB2 . . . . . . . . . c19602_2mgt 1 . 10 . 5239 . 2 1 8 ASP HB3 H 14.031 -8.489 -6.366 . . . 1.0 . . . . . . . . . . . . B . 7 ASP HB3 . . . . . . . . . c19602_2mgt 1 . 10 . 5240 . 2 1 8 ASP N N 13.493 -5.890 -5.698 . . . 1.0 . . . . . . . . . . . . B . 7 ASP N . . . . . . . . . c19602_2mgt 1 . 10 . 5241 . 2 1 8 ASP O O 11.142 -8.257 -4.403 . . . 1.0 . . . . . . . . . . . . B . 7 ASP O . . . . . . . . . c19602_2mgt 1 . 10 . 5242 . 2 1 8 ASP OD1 O 11.116 -8.665 -7.814 . . . 1.0 . . . . . . . . . . . . B . 7 ASP OD1 . . . . . . . . . c19602_2mgt 1 . 10 . 5243 . 2 1 8 ASP OD2 O 12.303 -10.194 -6.775 . . . 1.0 . . . . . . . . . . . . B . 7 ASP OD2 . . . . . . . . . c19602_2mgt 1 . 10 . 5244 . 2 1 9 SER C C 11.613 -7.719 -1.390 . . . 1.0 . . . . . . . . . . . . B . 8 SER C . . . . . . . . . c19602_2mgt 1 . 10 . 5245 . 2 1 9 SER CA C 12.876 -8.148 -2.144 . . . 1.0 . . . . . . . . . . . . B . 8 SER CA . . . . . . . . . c19602_2mgt 1 . 10 . 5246 . 2 1 9 SER CB C 14.065 -7.749 -1.272 . . . 1.0 . . . . . . . . . . . . B . 8 SER CB . . . . . . . . . c19602_2mgt 1 . 10 . 5247 . 2 1 9 SER H H 13.958 -7.145 -3.646 . . . 1.0 . . . . . . . . . . . . B . 8 SER H . . . . . . . . . c19602_2mgt 1 . 10 . 5248 . 2 1 9 SER HA H 12.861 -9.232 -2.254 . . . 1.0 . . . . . . . . . . . . B . 8 SER HA . . . . . . . . . c19602_2mgt 1 . 10 . 5249 . 2 1 9 SER HB2 H 14.172 -6.663 -1.289 . . . 1.0 . . . . . . . . . . . . B . 8 SER HB2 . . . . . . . . . c19602_2mgt 1 . 10 . 5250 . 2 1 9 SER HB3 H 13.885 -8.068 -0.249 . . . 1.0 . . . . . . . . . . . . B . 8 SER HB3 . . . . . . . . . c19602_2mgt 1 . 10 . 5251 . 2 1 9 SER HG H 15.173 -9.308 -1.557 . . . 1.0 . . . . . . . . . . . . B . 8 SER HG . . . . . . . . . c19602_2mgt 1 . 10 . 5252 . 2 1 9 SER N N 13.054 -7.556 -3.470 . . . 1.0 . . . . . . . . . . . . B . 8 SER N . . . . . . . . . c19602_2mgt 1 . 10 . 5253 . 2 1 9 SER O O 11.303 -8.329 -0.370 . . . 1.0 . . . . . . . . . . . . B . 8 SER O . . . . . . . . . c19602_2mgt 1 . 10 . 5254 . 2 1 9 SER OG O 15.252 -8.361 -1.715 . . . 1.0 . . . . . . . . . . . . B . 8 SER OG . . . . . . . . . c19602_2mgt 1 . 10 . 5255 . 2 1 10 GLY C C 8.692 -6.193 -2.555 . . . 1.0 . . . . . . . . . . . . B . 9 GLY C . . . . . . . . . c19602_2mgt 1 . 10 . 5256 . 2 1 10 GLY CA C 9.606 -6.300 -1.336 . . . 1.0 . . . . . . . . . . . . B . 9 GLY CA . . . . . . . . . c19602_2mgt 1 . 10 . 5257 . 2 1 10 GLY H H 11.187 -6.216 -2.697 . . . 1.0 . . . . . . . . . . . . B . 9 GLY H . . . . . . . . . c19602_2mgt 1 . 10 . 5258 . 2 1 10 GLY HA2 H 9.211 -7.025 -0.626 . . . 1.0 . . . . . . . . . . . . B . 9 GLY HA2 . . . . . . . . . c19602_2mgt 1 . 10 . 5259 . 2 1 10 GLY HA3 H 9.718 -5.348 -0.825 . . . 1.0 . . . . . . . . . . . . B . 9 GLY HA3 . . . . . . . . . c19602_2mgt 1 . 10 . 5260 . 2 1 10 GLY N N 10.904 -6.683 -1.846 . . . 1.0 . . . . . . . . . . . . B . 9 GLY N . . . . . . . . . c19602_2mgt 1 . 10 . 5261 . 2 1 10 GLY O O 8.587 -7.145 -3.323 . . . 1.0 . . . . . . . . . . . . B . 9 GLY O . . . . . . . . . c19602_2mgt 1 . 10 . 5262 . 2 1 11 TYR C C 6.844 -2.977 -2.329 . . . 1.0 . . . . . . . . . . . . B . 10 TYR C . . . . . . . . . c19602_2mgt 1 . 10 . 5263 . 2 1 11 TYR CA C 8.027 -3.869 -1.972 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CA . . . . . . . . . c19602_2mgt 1 . 10 . 5264 . 2 1 11 TYR CB C 9.327 -3.085 -2.194 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CB . . . . . . . . . c19602_2mgt 1 . 10 . 5265 . 2 1 11 TYR CD1 C 9.474 -2.182 0.186 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CD1 . . . . . . . . . c19602_2mgt 1 . 10 . 5266 . 2 1 11 TYR CD2 C 11.490 -2.952 -0.933 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CD2 . . . . . . . . . c19602_2mgt 1 . 10 . 5267 . 2 1 11 TYR CE1 C 10.226 -1.793 1.298 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CE1 . . . . . . . . . c19602_2mgt 1 . 10 . 5268 . 2 1 11 TYR CE2 C 12.260 -2.532 0.164 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CE2 . . . . . . . . . c19602_2mgt 1 . 10 . 5269 . 2 1 11 TYR CG C 10.103 -2.745 -0.941 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CG . . . . . . . . . c19602_2mgt 1 . 10 . 5270 . 2 1 11 TYR CZ C 11.626 -1.940 1.282 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CZ . . . . . . . . . c19602_2mgt 1 . 10 . 5271 . 2 1 11 TYR H H 7.646 -4.938 -3.712 . . . 1.0 . . . . . . . . . . . . B . 10 TYR H . . . . . . . . . c19602_2mgt 1 . 10 . 5272 . 2 1 11 TYR HA H 7.944 -4.168 -0.928 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HA . . . . . . . . . c19602_2mgt 1 . 10 . 5273 . 2 1 11 TYR HB2 H 9.985 -3.642 -2.857 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HB2 . . . . . . . . . c19602_2mgt 1 . 10 . 5274 . 2 1 11 TYR HB3 H 9.096 -2.164 -2.726 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HB3 . . . . . . . . . c19602_2mgt 1 . 10 . 5275 . 2 1 11 TYR HD1 H 8.414 -2.024 0.210 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HD1 . . . . . . . . . c19602_2mgt 1 . 10 . 5276 . 2 1 11 TYR HD2 H 11.972 -3.402 -1.789 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HD2 . . . . . . . . . c19602_2mgt 1 . 10 . 5277 . 2 1 11 TYR HE1 H 9.731 -1.372 2.157 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HE1 . . . . . . . . . c19602_2mgt 1 . 10 . 5278 . 2 1 11 TYR HE2 H 13.327 -2.682 0.146 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HE2 . . . . . . . . . c19602_2mgt 1 . 10 . 5279 . 2 1 11 TYR HH H 13.290 -1.673 2.250 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HH . . . . . . . . . c19602_2mgt 1 . 10 . 5280 . 2 1 11 TYR N N 8.037 -5.057 -2.797 . . . 1.0 . . . . . . . . . . . . B . 10 TYR N . . . . . . . . . c19602_2mgt 1 . 10 . 5281 . 2 1 11 TYR O O 6.288 -3.054 -3.419 . . . 1.0 . . . . . . . . . . . . B . 10 TYR O . . . . . . . . . c19602_2mgt 1 . 10 . 5282 . 2 1 11 TYR OH O 12.345 -1.525 2.358 . . . 1.0 . . . . . . . . . . . . B . 10 TYR OH . . . . . . . . . c19602_2mgt 1 . 10 . 5283 . 2 1 12 GLU C C 6.378 0.254 -0.815 . . . 1.0 . . . . . . . . . . . . B . 11 GLU C . . . . . . . . . c19602_2mgt 1 . 10 . 5284 . 2 1 12 GLU CA C 5.732 -0.887 -1.624 . . . 1.0 . . . . . . . . . . . . B . 11 GLU CA . . . . . . . . . c19602_2mgt 1 . 10 . 5285 . 2 1 12 GLU CB C 4.324 -1.252 -1.183 . . . 1.0 . . . . . . . . . . . . B . 11 GLU CB . . . . . . . . . c19602_2mgt 1 . 10 . 5286 . 2 1 12 GLU CD C 2.144 -0.141 -0.556 . . . 1.0 . . . . . . . . . . . . B . 11 GLU CD . . . . . . . . . c19602_2mgt 1 . 10 . 5287 . 2 1 12 GLU CG C 3.285 -0.199 -1.558 . . . 1.0 . . . . . . . . . . . . B . 11 GLU CG . . . . . . . . . c19602_2mgt 1 . 10 . 5288 . 2 1 12 GLU H H 6.958 -2.143 -0.501 . . . 1.0 . . . . . . . . . . . . B . 11 GLU H . . . . . . . . . c19602_2mgt 1 . 10 . 5289 . 2 1 12 GLU HA H 5.726 -0.642 -2.685 . . . 1.0 . . . . . . . . . . . . B . 11 GLU HA . . . . . . . . . c19602_2mgt 1 . 10 . 5290 . 2 1 12 GLU HB2 H 4.034 -2.195 -1.647 . . . 1.0 . . . . . . . . . . . . B . 11 GLU HB2 . . . . . . . . . c19602_2mgt 1 . 10 . 5291 . 2 1 12 GLU HB3 H 4.357 -1.396 -0.105 . . . 1.0 . . . . . . . . . . . . B . 11 GLU HB3 . . . . . . . . . c19602_2mgt 1 . 10 . 5292 . 2 1 12 GLU HG2 H 3.751 0.787 -1.594 . . . 1.0 . . . . . . . . . . . . B . 11 GLU HG2 . . . . . . . . . c19602_2mgt 1 . 10 . 5293 . 2 1 12 GLU HG3 H 2.886 -0.425 -2.545 . . . 1.0 . . . . . . . . . . . . B . 11 GLU HG3 . . . . . . . . . c19602_2mgt 1 . 10 . 5294 . 2 1 12 GLU N N 6.548 -2.056 -1.417 . . . 1.0 . . . . . . . . . . . . B . 11 GLU N . . . . . . . . . c19602_2mgt 1 . 10 . 5295 . 2 1 12 GLU O O 5.816 0.744 0.165 . . . 1.0 . . . . . . . . . . . . B . 11 GLU O . . . . . . . . . c19602_2mgt 1 . 10 . 5296 . 2 1 12 GLU OE1 O 1.950 -1.096 0.229 . . . 1.0 . . . . . . . . . . . . B . 11 GLU OE1 . . . . . . . . . c19602_2mgt 1 . 10 . 5297 . 2 1 12 GLU OE2 O 1.475 0.893 -0.518 . . . 1.0 . . . . . . . . . . . . B . 11 GLU OE2 . . . . . . . . . c19602_2mgt 1 . 10 . 5298 . 2 1 13 VAL C C 7.976 2.797 -0.064 . . . 1.0 . . . . . . . . . . . . B . 12 VAL C . . . . . . . . . c19602_2mgt 1 . 10 . 5299 . 2 1 13 VAL CA C 8.571 1.497 -0.570 . . . 1.0 . . . . . . . . . . . . B . 12 VAL CA . . . . . . . . . c19602_2mgt 1 . 10 . 5300 . 2 1 13 VAL CB C 9.717 1.826 -1.551 . . . 1.0 . . . . . . . . . . . . B . 12 VAL CB . . . . . . . . . c19602_2mgt 1 . 10 . 5301 . 2 1 13 VAL CG1 C 10.647 2.962 -1.088 . . . 1.0 . . . . . . . . . . . . B . 12 VAL CG1 . . . . . . . . . c19602_2mgt 1 . 10 . 5302 . 2 1 13 VAL CG2 C 10.600 0.597 -1.724 . . . 1.0 . . . . . . . . . . . . B . 12 VAL CG2 . . . . . . . . . c19602_2mgt 1 . 10 . 5303 . 2 1 13 VAL H H 7.942 0.173 -2.063 . . . 1.0 . . . . . . . . . . . . B . 12 VAL H . . . . . . . . . c19602_2mgt 1 . 10 . 5304 . 2 1 13 VAL HA H 9.010 0.968 0.271 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HA . . . . . . . . . c19602_2mgt 1 . 10 . 5305 . 2 1 13 VAL HB H 9.297 2.107 -2.518 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HB . . . . . . . . . c19602_2mgt 1 . 10 . 5306 . 2 1 13 VAL HG11 H 11.060 2.730 -0.104 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HG11 . . . . . . . . . c19602_2mgt 1 . 10 . 5307 . 2 1 13 VAL HG12 H 11.461 3.089 -1.800 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HG12 . . . . . . . . . c19602_2mgt 1 . 10 . 5308 . 2 1 13 VAL HG13 H 10.101 3.903 -1.041 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HG13 . . . . . . . . . c19602_2mgt 1 . 10 . 5309 . 2 1 13 VAL HG21 H 10.041 -0.207 -2.190 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HG21 . . . . . . . . . c19602_2mgt 1 . 10 . 5310 . 2 1 13 VAL HG22 H 11.421 0.870 -2.375 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HG22 . . . . . . . . . c19602_2mgt 1 . 10 . 5311 . 2 1 13 VAL HG23 H 10.993 0.272 -0.761 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HG23 . . . . . . . . . c19602_2mgt 1 . 10 . 5312 . 2 1 13 VAL N N 7.604 0.614 -1.222 . . . 1.0 . . . . . . . . . . . . B . 12 VAL N . . . . . . . . . c19602_2mgt 1 . 10 . 5313 . 2 1 13 VAL O O 8.460 3.299 0.946 . . . 1.0 . . . . . . . . . . . . B . 12 VAL O . . . . . . . . . c19602_2mgt 1 . 10 . 5314 . 2 1 14 HIS C C 5.882 4.828 0.945 . . . 1.0 . . . . . . . . . . . . B . 13 HIS C . . . . . . . . . c19602_2mgt 1 . 10 . 5315 . 2 1 14 HIS CA C 6.540 4.715 -0.436 . . . 1.0 . . . . . . . . . . . . B . 13 HIS CA . . . . . . . . . c19602_2mgt 1 . 10 . 5316 . 2 1 14 HIS CB C 5.649 5.278 -1.545 . . . 1.0 . . . . . . . . . . . . B . 13 HIS CB . . . . . . . . . c19602_2mgt 1 . 10 . 5317 . 2 1 14 HIS CD2 C 3.378 4.098 -1.848 . . . 1.0 . . . . . . . . . . . . B . 13 HIS CD2 . . . . . . . . . c19602_2mgt 1 . 10 . 5318 . 2 1 14 HIS CE1 C 2.127 5.379 -0.579 . . . 1.0 . . . . . . . . . . . . B . 13 HIS CE1 . . . . . . . . . c19602_2mgt 1 . 10 . 5319 . 2 1 14 HIS CG C 4.171 5.083 -1.329 . . . 1.0 . . . . . . . . . . . . B . 13 HIS CG . . . . . . . . . c19602_2mgt 1 . 10 . 5320 . 2 1 14 HIS H H 6.624 2.924 -1.587 . . . 1.0 . . . . . . . . . . . . B . 13 HIS H . . . . . . . . . c19602_2mgt 1 . 10 . 5321 . 2 1 14 HIS HA H 7.449 5.314 -0.411 . . . 1.0 . . . . . . . . . . . . B . 13 HIS HA . . . . . . . . . c19602_2mgt 1 . 10 . 5322 . 2 1 14 HIS HB2 H 5.836 6.347 -1.572 . . . 1.0 . . . . . . . . . . . . B . 13 HIS HB2 . . . . . . . . . c19602_2mgt 1 . 10 . 5323 . 2 1 14 HIS HB3 H 5.948 4.873 -2.510 . . . 1.0 . . . . . . . . . . . . B . 13 HIS HB3 . . . . . . . . . c19602_2mgt 1 . 10 . 5324 . 2 1 14 HIS HD1 H 3.671 6.673 -0.001 . . . 1.0 . . . . . . . . . . . . B . 13 HIS HD1 . . . . . . . . . c19602_2mgt 1 . 10 . 5325 . 2 1 14 HIS HD2 H 3.697 3.304 -2.506 . . . 1.0 . . . . . . . . . . . . B . 13 HIS HD2 . . . . . . . . . c19602_2mgt 1 . 10 . 5326 . 2 1 14 HIS HE1 H 1.283 5.795 -0.050 . . . 1.0 . . . . . . . . . . . . B . 13 HIS HE1 . . . . . . . . . c19602_2mgt 1 . 10 . 5327 . 2 1 14 HIS N N 6.982 3.369 -0.753 . . . 1.0 . . . . . . . . . . . . B . 13 HIS N . . . . . . . . . c19602_2mgt 1 . 10 . 5328 . 2 1 14 HIS ND1 N 3.368 5.873 -0.540 . . . 1.0 . . . . . . . . . . . . B . 13 HIS ND1 . . . . . . . . . c19602_2mgt 1 . 10 . 5329 . 2 1 14 HIS NE2 N 2.079 4.299 -1.371 . . . 1.0 . . . . . . . . . . . . B . 13 HIS NE2 . . . . . . . . . c19602_2mgt 1 . 10 . 5330 . 2 1 14 HIS O O 5.715 5.943 1.428 . . . 1.0 . . . . . . . . . . . . B . 13 HIS O . . . . . . . . . c19602_2mgt 1 . 10 . 5331 . 2 1 15 HIS C C 5.459 2.418 3.757 . . . 1.0 . . . . . . . . . . . . B . 14 HIS C . . . . . . . . . c19602_2mgt 1 . 10 . 5332 . 2 1 15 HIS CA C 5.168 3.729 3.008 . . . 1.0 . . . . . . . . . . . . B . 14 HIS CA . . . . . . . . . c19602_2mgt 1 . 10 . 5333 . 2 1 15 HIS CB C 3.709 4.174 3.175 . . . 1.0 . . . . . . . . . . . . B . 14 HIS CB . . . . . . . . . c19602_2mgt 1 . 10 . 5334 . 2 1 15 HIS CD2 C 2.308 2.415 1.968 . . . 1.0 . . . . . . . . . . . . B . 14 HIS CD2 . . . . . . . . . c19602_2mgt 1 . 10 . 5335 . 2 1 15 HIS CE1 C 1.397 1.410 3.698 . . . 1.0 . . . . . . . . . . . . B . 14 HIS CE1 . . . . . . . . . c19602_2mgt 1 . 10 . 5336 . 2 1 15 HIS CG C 2.732 3.044 3.096 . . . 1.0 . . . . . . . . . . . . B . 14 HIS CG . . . . . . . . . c19602_2mgt 1 . 10 . 5337 . 2 1 15 HIS H H 5.658 2.814 1.138 . . . 1.0 . . . . . . . . . . . . B . 14 HIS H . . . . . . . . . c19602_2mgt 1 . 10 . 5338 . 2 1 15 HIS HA H 5.786 4.492 3.477 . . . 1.0 . . . . . . . . . . . . B . 14 HIS HA . . . . . . . . . c19602_2mgt 1 . 10 . 5339 . 2 1 15 HIS HB2 H 3.605 4.630 4.155 . . . 1.0 . . . . . . . . . . . . B . 14 HIS HB2 . . . . . . . . . c19602_2mgt 1 . 10 . 5340 . 2 1 15 HIS HB3 H 3.444 4.921 2.429 . . . 1.0 . . . . . . . . . . . . B . 14 HIS HB3 . . . . . . . . . c19602_2mgt 1 . 10 . 5341 . 2 1 15 HIS HD1 H 2.323 2.608 5.135 . . . 1.0 . . . . . . . . . . . . B . 14 HIS HD1 . . . . . . . . . c19602_2mgt 1 . 10 . 5342 . 2 1 15 HIS HD2 H 2.594 2.662 0.956 . . . 1.0 . . . . . . . . . . . . B . 14 HIS HD2 . . . . . . . . . c19602_2mgt 1 . 10 . 5343 . 2 1 15 HIS HE1 H 0.841 0.713 4.307 . . . 1.0 . . . . . . . . . . . . B . 14 HIS HE1 . . . . . . . . . c19602_2mgt 1 . 10 . 5344 . 2 1 15 HIS N N 5.537 3.708 1.597 . . . 1.0 . . . . . . . . . . . . B . 14 HIS N . . . . . . . . . c19602_2mgt 1 . 10 . 5345 . 2 1 15 HIS ND1 N 2.163 2.397 4.165 . . . 1.0 . . . . . . . . . . . . B . 14 HIS ND1 . . . . . . . . . c19602_2mgt 1 . 10 . 5346 . 2 1 15 HIS NE2 N 1.468 1.378 2.365 . . . 1.0 . . . . . . . . . . . . B . 14 HIS NE2 . . . . . . . . . c19602_2mgt 1 . 10 . 5347 . 2 1 15 HIS O O 5.304 2.393 4.975 . . . 1.0 . . . . . . . . . . . . B . 14 HIS O . . . . . . . . . c19602_2mgt 1 . 10 . 5348 . 2 1 16 GLN C C 7.871 0.138 3.871 . . . 1.0 . . . . . . . . . . . . B . 15 GLN C . . . . . . . . . c19602_2mgt 1 . 10 . 5349 . 2 1 16 GLN CA C 6.345 0.120 3.715 . . . 1.0 . . . . . . . . . . . . B . 15 GLN CA . . . . . . . . . c19602_2mgt 1 . 10 . 5350 . 2 1 16 GLN CB C 5.902 -1.113 2.927 . . . 1.0 . . . . . . . . . . . . B . 15 GLN CB . . . . . . . . . c19602_2mgt 1 . 10 . 5351 . 2 1 16 GLN CD C 3.593 -1.465 3.968 . . . 1.0 . . . . . . . . . . . . B . 15 GLN CD . . . . . . . . . c19602_2mgt 1 . 10 . 5352 . 2 1 16 GLN CG C 4.392 -1.249 2.685 . . . 1.0 . . . . . . . . . . . . B . 15 GLN CG . . . . . . . . . c19602_2mgt 1 . 10 . 5353 . 2 1 16 GLN H H 5.931 1.369 2.071 . . . 1.0 . . . . . . . . . . . . B . 15 GLN H . . . . . . . . . c19602_2mgt 1 . 10 . 5354 . 2 1 16 GLN HA H 5.904 0.056 4.706 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HA . . . . . . . . . c19602_2mgt 1 . 10 . 5355 . 2 1 16 GLN HB2 H 6.421 -1.115 1.970 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HB2 . . . . . . . . . c19602_2mgt 1 . 10 . 5356 . 2 1 16 GLN HB3 H 6.217 -1.986 3.486 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HB3 . . . . . . . . . c19602_2mgt 1 . 10 . 5357 . 2 1 16 GLN HE21 H 3.270 -3.420 3.544 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HE21 . . . . . . . . . c19602_2mgt 1 . 10 . 5358 . 2 1 16 GLN HE22 H 2.550 -2.851 5.032 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HE22 . . . . . . . . . c19602_2mgt 1 . 10 . 5359 . 2 1 16 GLN HG2 H 4.013 -0.366 2.172 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HG2 . . . . . . . . . c19602_2mgt 1 . 10 . 5360 . 2 1 16 GLN HG3 H 4.237 -2.105 2.032 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HG3 . . . . . . . . . c19602_2mgt 1 . 10 . 5361 . 2 1 16 GLN N N 5.880 1.343 3.076 . . . 1.0 . . . . . . . . . . . . B . 15 GLN N . . . . . . . . . c19602_2mgt 1 . 10 . 5362 . 2 1 16 GLN NE2 N 3.099 -2.676 4.203 . . . 1.0 . . . . . . . . . . . . B . 15 GLN NE2 . . . . . . . . . c19602_2mgt 1 . 10 . 5363 . 2 1 16 GLN O O 8.571 0.872 3.176 . . . 1.0 . . . . . . . . . . . . B . 15 GLN O . . . . . . . . . c19602_2mgt 1 . 10 . 5364 . 2 1 16 GLN OE1 O 3.410 -0.544 4.750 . . . 1.0 . . . . . . . . . . . . B . 15 GLN OE1 . . . . . . . . . c19602_2mgt 1 . 10 . 5365 . 2 1 17 LYS C C 10.439 -1.978 5.369 . . . 1.0 . . . . . . . . . . . . B . 16 LYS C . . . . . . . . . c19602_2mgt 1 . 10 . 5366 . 2 1 17 LYS CA C 9.742 -0.605 5.321 . . . 1.0 . . . . . . . . . . . . B . 16 LYS CA . . . . . . . . . c19602_2mgt 1 . 10 . 5367 . 2 1 17 LYS CB C 9.684 0.074 6.703 . . . 1.0 . . . . . . . . . . . . B . 16 LYS CB . . . . . . . . . c19602_2mgt 1 . 10 . 5368 . 2 1 17 LYS CD C 9.495 2.322 7.892 . . . 1.0 . . . . . . . . . . . . B . 16 LYS CD . . . . . . . . . c19602_2mgt 1 . 10 . 5369 . 2 1 17 LYS CE C 8.793 1.792 9.145 . . . 1.0 . . . . . . . . . . . . B . 16 LYS CE . . . . . . . . . c19602_2mgt 1 . 10 . 5370 . 2 1 17 LYS CG C 9.195 1.529 6.616 . . . 1.0 . . . . . . . . . . . . B . 16 LYS CG . . . . . . . . . c19602_2mgt 1 . 10 . 5371 . 2 1 17 LYS H H 7.751 -1.308 5.273 . . . 1.0 . . . . . . . . . . . . B . 16 LYS H . . . . . . . . . c19602_2mgt 1 . 10 . 5372 . 2 1 17 LYS HA H 10.339 0.021 4.663 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HA . . . . . . . . . c19602_2mgt 1 . 10 . 5373 . 2 1 17 LYS HB2 H 9.026 -0.492 7.363 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HB2 . . . . . . . . . c19602_2mgt 1 . 10 . 5374 . 2 1 17 LYS HB3 H 10.682 0.083 7.132 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HB3 . . . . . . . . . c19602_2mgt 1 . 10 . 5375 . 2 1 17 LYS HD2 H 10.568 2.300 8.063 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HD2 . . . . . . . . . c19602_2mgt 1 . 10 . 5376 . 2 1 17 LYS HD3 H 9.210 3.362 7.736 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HD3 . . . . . . . . . c19602_2mgt 1 . 10 . 5377 . 2 1 17 LYS HE2 H 8.922 0.712 9.224 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HE2 . . . . . . . . . c19602_2mgt 1 . 10 . 5378 . 2 1 17 LYS HE3 H 9.240 2.264 10.015 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HE3 . . . . . . . . . c19602_2mgt 1 . 10 . 5379 . 2 1 17 LYS HG2 H 9.707 2.025 5.791 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HG2 . . . . . . . . . c19602_2mgt 1 . 10 . 5380 . 2 1 17 LYS HG3 H 8.125 1.548 6.413 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HG3 . . . . . . . . . c19602_2mgt 1 . 10 . 5381 . 2 1 17 LYS HZ1 H 6.890 1.619 8.415 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HZ1 . . . . . . . . . c19602_2mgt 1 . 10 . 5382 . 2 1 17 LYS HZ2 H 6.954 1.887 10.036 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HZ2 . . . . . . . . . c19602_2mgt 1 . 10 . 5383 . 2 1 17 LYS HZ3 H 7.245 3.115 8.985 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HZ3 . . . . . . . . . c19602_2mgt 1 . 10 . 5384 . 2 1 17 LYS N N 8.382 -0.685 4.793 . . . 1.0 . . . . . . . . . . . . B . 16 LYS N . . . . . . . . . c19602_2mgt 1 . 10 . 5385 . 2 1 17 LYS NZ N 7.366 2.124 9.146 . . . 1.0 . . . . . . . . . . . . B . 16 LYS NZ . . . . . . . . . c19602_2mgt 1 . 10 . 5386 . 2 1 17 LYS O O 9.905 -2.984 4.918 . . . 1.0 . . . . . . . . . . . . B . 16 LYS O . . . . . . . . . c19602_2mgt 1 . 10 . 5387 . 2 1 18 NH2 HN1 H 12.090 -1.222 6.290 . . . 1.0 . . . . . . . . . . . . B . 17 NH2 HN1 . . . . . . . . . c19602_2mgt 1 . 10 . 5388 . 2 1 18 NH2 HN2 H 12.142 -2.932 5.920 . . . 1.0 . . . . . . . . . . . . B . 17 NH2 HN2 . . . . . . . . . c19602_2mgt 1 . 10 . 5389 . 2 1 18 NH2 N N 11.661 -2.045 5.896 . . . 1.0 . . . . . . . . . . . . B . 17 NH2 N . . . . . . . . . c19602_2mgt 1 . 10 . 5390 . 3 2 1 ZN ZN Zn 0.570 0.016 1.114 . . . 1.0 . . . . . . . . . . . . A . 101 ZN ZN . . . . . . . . . c19602_2mgt 1 . 11 . 5391 . 1 1 1 ACE C C -12.451 -4.136 -2.132 . . . 1.0 . . . . . . . . . . . . A . 0 ACE C . . . . . . . . . c19602_2mgt 1 . 11 . 5392 . 1 1 1 ACE CH3 C -10.934 -4.160 -2.134 . . . 1.0 . . . . . . . . . . . . A . 0 ACE CH3 . . . . . . . . . c19602_2mgt 1 . 11 . 5393 . 1 1 1 ACE H1 H -10.580 -5.187 -2.235 . . . 1.0 . . . . . . . . . . . . A . 0 ACE H1 . . . . . . . . . c19602_2mgt 1 . 11 . 5394 . 1 1 1 ACE H2 H -10.570 -3.572 -2.974 . . . 1.0 . . . . . . . . . . . . A . 0 ACE H2 . . . . . . . . . c19602_2mgt 1 . 11 . 5395 . 1 1 1 ACE H3 H -10.563 -3.740 -1.202 . . . 1.0 . . . . . . . . . . . . A . 0 ACE H3 . . . . . . . . . c19602_2mgt 1 . 11 . 5396 . 1 1 1 ACE O O -13.066 -5.172 -2.360 . . . 1.0 . . . . . . . . . . . . A . 0 ACE O . . . . . . . . . c19602_2mgt 1 . 11 . 5397 . 1 1 2 ASP C C -14.801 -1.276 -2.059 . . . 1.0 . . . . . . . . . . . . A . 1 ASP C . . . . . . . . . c19602_2mgt 1 . 11 . 5398 . 1 1 2 ASP CA C -14.494 -2.759 -1.870 . . . 1.0 . . . . . . . . . . . . A . 1 ASP CA . . . . . . . . . c19602_2mgt 1 . 11 . 5399 . 1 1 2 ASP CB C -15.105 -3.240 -0.546 . . . 1.0 . . . . . . . . . . . . A . 1 ASP CB . . . . . . . . . c19602_2mgt 1 . 11 . 5400 . 1 1 2 ASP CG C -16.572 -3.611 -0.688 . . . 1.0 . . . . . . . . . . . . A . 1 ASP CG . . . . . . . . . c19602_2mgt 1 . 11 . 5401 . 1 1 2 ASP H H -12.473 -2.152 -1.712 . . . 1.0 . . . . . . . . . . . . A . 1 ASP H . . . . . . . . . c19602_2mgt 1 . 11 . 5402 . 1 1 2 ASP HA H -14.935 -3.324 -2.693 . . . 1.0 . . . . . . . . . . . . A . 1 ASP HA . . . . . . . . . c19602_2mgt 1 . 11 . 5403 . 1 1 2 ASP HB2 H -14.571 -4.111 -0.180 . . . 1.0 . . . . . . . . . . . . A . 1 ASP HB2 . . . . . . . . . c19602_2mgt 1 . 11 . 5404 . 1 1 2 ASP HB3 H -15.025 -2.445 0.192 . . . 1.0 . . . . . . . . . . . . A . 1 ASP HB3 . . . . . . . . . c19602_2mgt 1 . 11 . 5405 . 1 1 2 ASP N N -13.047 -2.966 -1.878 . . . 1.0 . . . . . . . . . . . . A . 1 ASP N . . . . . . . . . c19602_2mgt 1 . 11 . 5406 . 1 1 2 ASP O O -14.032 -0.425 -1.615 . . . 1.0 . . . . . . . . . . . . A . 1 ASP O . . . . . . . . . c19602_2mgt 1 . 11 . 5407 . 1 1 2 ASP OD1 O -17.377 -2.697 -0.954 . . . 1.0 . . . . . . . . . . . . A . 1 ASP OD1 . . . . . . . . . c19602_2mgt 1 . 11 . 5408 . 1 1 2 ASP OD2 O -16.876 -4.806 -0.517 . . . 1.0 . . . . . . . . . . . . A . 1 ASP OD2 . . . . . . . . . c19602_2mgt 1 . 11 . 5409 . 1 1 3 ALA C C -16.585 1.092 -1.521 . . . 1.0 . . . . . . . . . . . . A . 2 ALA C . . . . . . . . . c19602_2mgt 1 . 11 . 5410 . 1 1 3 ALA CA C -16.455 0.367 -2.856 . . . 1.0 . . . . . . . . . . . . A . 2 ALA CA . . . . . . . . . c19602_2mgt 1 . 11 . 5411 . 1 1 3 ALA CB C -17.816 0.322 -3.559 . . . 1.0 . . . . . . . . . . . . A . 2 ALA CB . . . . . . . . . c19602_2mgt 1 . 11 . 5412 . 1 1 3 ALA H H -16.536 -1.737 -3.003 . . . 1.0 . . . . . . . . . . . . A . 2 ALA H . . . . . . . . . c19602_2mgt 1 . 11 . 5413 . 1 1 3 ALA HA H -15.741 0.895 -3.476 . . . 1.0 . . . . . . . . . . . . A . 2 ALA HA . . . . . . . . . c19602_2mgt 1 . 11 . 5414 . 1 1 3 ALA HB1 H -18.208 1.336 -3.658 . . . 1.0 . . . . . . . . . . . . A . 2 ALA HB1 . . . . . . . . . c19602_2mgt 1 . 11 . 5415 . 1 1 3 ALA HB2 H -17.713 -0.116 -4.548 . . . 1.0 . . . . . . . . . . . . A . 2 ALA HB2 . . . . . . . . . c19602_2mgt 1 . 11 . 5416 . 1 1 3 ALA HB3 H -18.518 -0.272 -2.973 . . . 1.0 . . . . . . . . . . . . A . 2 ALA HB3 . . . . . . . . . c19602_2mgt 1 . 11 . 5417 . 1 1 3 ALA N N -15.950 -0.981 -2.681 . . . 1.0 . . . . . . . . . . . . A . 2 ALA N . . . . . . . . . c19602_2mgt 1 . 11 . 5418 . 1 1 3 ALA O O -16.146 2.232 -1.408 . . . 1.0 . . . . . . . . . . . . A . 2 ALA O . . . . . . . . . c19602_2mgt 1 . 11 . 5419 . 1 1 4 GLU C C -16.118 1.297 1.599 . . . 1.0 . . . . . . . . . . . . A . 3 GLU C . . . . . . . . . c19602_2mgt 1 . 11 . 5420 . 1 1 4 GLU CA C -17.384 1.007 0.800 . . . 1.0 . . . . . . . . . . . . A . 3 GLU CA . . . . . . . . . c19602_2mgt 1 . 11 . 5421 . 1 1 4 GLU CB C -18.331 0.122 1.605 . . . 1.0 . . . . . . . . . . . . A . 3 GLU CB . . . . . . . . . c19602_2mgt 1 . 11 . 5422 . 1 1 4 GLU CD C -18.542 -1.887 3.065 . . . 1.0 . . . . . . . . . . . . A . 3 GLU CD . . . . . . . . . c19602_2mgt 1 . 11 . 5423 . 1 1 4 GLU CG C -17.641 -1.146 2.108 . . . 1.0 . . . . . . . . . . . . A . 3 GLU CG . . . . . . . . . c19602_2mgt 1 . 11 . 5424 . 1 1 4 GLU H H -17.441 -0.534 -0.657 . . . 1.0 . . . . . . . . . . . . A . 3 GLU H . . . . . . . . . c19602_2mgt 1 . 11 . 5425 . 1 1 4 GLU HA H -17.870 1.961 0.635 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HA . . . . . . . . . c19602_2mgt 1 . 11 . 5426 . 1 1 4 GLU HB2 H -18.695 0.697 2.455 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HB2 . . . . . . . . . c19602_2mgt 1 . 11 . 5427 . 1 1 4 GLU HB3 H -19.187 -0.151 0.992 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HB3 . . . . . . . . . c19602_2mgt 1 . 11 . 5428 . 1 1 4 GLU HG2 H -17.393 -1.771 1.258 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HG2 . . . . . . . . . c19602_2mgt 1 . 11 . 5429 . 1 1 4 GLU HG3 H -16.721 -0.915 2.637 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HG3 . . . . . . . . . c19602_2mgt 1 . 11 . 5430 . 1 1 4 GLU N N -17.135 0.417 -0.505 . . . 1.0 . . . . . . . . . . . . A . 3 GLU N . . . . . . . . . c19602_2mgt 1 . 11 . 5431 . 1 1 4 GLU O O -16.223 1.942 2.633 . . . 1.0 . . . . . . . . . . . . A . 3 GLU O . . . . . . . . . c19602_2mgt 1 . 11 . 5432 . 1 1 4 GLU OE1 O -18.635 -1.418 4.220 . . . 1.0 . . . . . . . . . . . . A . 3 GLU OE1 . . . . . . . . . c19602_2mgt 1 . 11 . 5433 . 1 1 4 GLU OE2 O -19.142 -2.887 2.662 . . . 1.0 . . . . . . . . . . . . A . 3 GLU OE2 . . . . . . . . . c19602_2mgt 1 . 11 . 5434 . 1 1 5 PHE C C -12.913 2.146 0.786 . . . 1.0 . . . . . . . . . . . . A . 4 PHE C . . . . . . . . . c19602_2mgt 1 . 11 . 5435 . 1 1 5 PHE CA C -13.660 1.190 1.706 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CA . . . . . . . . . c19602_2mgt 1 . 11 . 5436 . 1 1 5 PHE CB C -12.841 -0.071 1.968 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CB . . . . . . . . . c19602_2mgt 1 . 11 . 5437 . 1 1 5 PHE CD1 C -14.208 -0.705 4.014 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CD1 . . . . . . . . . c19602_2mgt 1 . 11 . 5438 . 1 1 5 PHE CD2 C -13.614 -2.434 2.410 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CD2 . . . . . . . . . c19602_2mgt 1 . 11 . 5439 . 1 1 5 PHE CE1 C -14.933 -1.649 4.759 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CE1 . . . . . . . . . c19602_2mgt 1 . 11 . 5440 . 1 1 5 PHE CE2 C -14.349 -3.375 3.150 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CE2 . . . . . . . . . c19602_2mgt 1 . 11 . 5441 . 1 1 5 PHE CG C -13.560 -1.093 2.827 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CG . . . . . . . . . c19602_2mgt 1 . 11 . 5442 . 1 1 5 PHE CZ C -15.009 -2.984 4.327 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CZ . . . . . . . . . c19602_2mgt 1 . 11 . 5443 . 1 1 5 PHE H H -14.964 0.202 0.354 . . . 1.0 . . . . . . . . . . . . A . 4 PHE H . . . . . . . . . c19602_2mgt 1 . 11 . 5444 . 1 1 5 PHE HA H -13.804 1.712 2.648 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HA . . . . . . . . . c19602_2mgt 1 . 11 . 5445 . 1 1 5 PHE HB2 H -12.590 -0.522 1.007 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HB2 . . . . . . . . . c19602_2mgt 1 . 11 . 5446 . 1 1 5 PHE HB3 H -11.914 0.217 2.462 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HB3 . . . . . . . . . c19602_2mgt 1 . 11 . 5447 . 1 1 5 PHE HD1 H -14.170 0.324 4.344 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HD1 . . . . . . . . . c19602_2mgt 1 . 11 . 5448 . 1 1 5 PHE HD2 H -13.113 -2.734 1.502 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HD2 . . . . . . . . . c19602_2mgt 1 . 11 . 5449 . 1 1 5 PHE HE1 H -15.435 -1.344 5.663 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HE1 . . . . . . . . . c19602_2mgt 1 . 11 . 5450 . 1 1 5 PHE HE2 H -14.416 -4.393 2.801 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HE2 . . . . . . . . . c19602_2mgt 1 . 11 . 5451 . 1 1 5 PHE HZ H -15.573 -3.707 4.899 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HZ . . . . . . . . . c19602_2mgt 1 . 11 . 5452 . 1 1 5 PHE N N -14.954 0.817 1.154 . . . 1.0 . . . . . . . . . . . . A . 4 PHE N . . . . . . . . . c19602_2mgt 1 . 11 . 5453 . 1 1 5 PHE O O -12.095 2.919 1.269 . . . 1.0 . . . . . . . . . . . . A . 4 PHE O . . . . . . . . . c19602_2mgt 1 . 11 . 5454 . 1 1 6 ARG C C -13.593 4.476 -1.264 . . . 1.0 . . . . . . . . . . . . A . 5 ARG C . . . . . . . . . c19602_2mgt 1 . 11 . 5455 . 1 1 6 ARG CA C -12.797 3.173 -1.462 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CA . . . . . . . . . c19602_2mgt 1 . 11 . 5456 . 1 1 6 ARG CB C -12.885 2.595 -2.884 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CB . . . . . . . . . c19602_2mgt 1 . 11 . 5457 . 1 1 6 ARG CD C -10.353 2.097 -3.071 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CD . . . . . . . . . c19602_2mgt 1 . 11 . 5458 . 1 1 6 ARG CG C -11.787 1.568 -3.214 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CG . . . . . . . . . c19602_2mgt 1 . 11 . 5459 . 1 1 6 ARG CZ C -9.096 3.824 -4.376 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CZ . . . . . . . . . c19602_2mgt 1 . 11 . 5460 . 1 1 6 ARG H H -13.913 1.493 -0.848 . . . 1.0 . . . . . . . . . . . . A . 5 ARG H . . . . . . . . . c19602_2mgt 1 . 11 . 5461 . 1 1 6 ARG HA H -11.756 3.415 -1.254 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HA . . . . . . . . . c19602_2mgt 1 . 11 . 5462 . 1 1 6 ARG HB2 H -13.859 2.125 -3.016 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HB2 . . . . . . . . . c19602_2mgt 1 . 11 . 5463 . 1 1 6 ARG HB3 H -12.808 3.402 -3.609 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HB3 . . . . . . . . . c19602_2mgt 1 . 11 . 5464 . 1 1 6 ARG HD2 H -10.103 2.198 -2.017 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HD2 . . . . . . . . . c19602_2mgt 1 . 11 . 5465 . 1 1 6 ARG HD3 H -9.673 1.371 -3.513 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HD3 . . . . . . . . . c19602_2mgt 1 . 11 . 5466 . 1 1 6 ARG HE H -10.948 4.051 -3.614 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HE . . . . . . . . . c19602_2mgt 1 . 11 . 5467 . 1 1 6 ARG HG2 H -11.893 0.694 -2.576 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HG2 . . . . . . . . . c19602_2mgt 1 . 11 . 5468 . 1 1 6 ARG HG3 H -11.932 1.249 -4.246 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HG3 . . . . . . . . . c19602_2mgt 1 . 11 . 5469 . 1 1 6 ARG HH11 H -7.989 2.133 -4.131 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH11 . . . . . . . . . c19602_2mgt 1 . 11 . 5470 . 1 1 6 ARG HH12 H -7.227 3.401 -5.058 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH12 . . . . . . . . . c19602_2mgt 1 . 11 . 5471 . 1 1 6 ARG HH21 H -9.915 5.630 -4.821 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH21 . . . . . . . . . c19602_2mgt 1 . 11 . 5472 . 1 1 6 ARG HH22 H -8.305 5.357 -5.449 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH22 . . . . . . . . . c19602_2mgt 1 . 11 . 5473 . 1 1 6 ARG N N -13.234 2.161 -0.512 . . . 1.0 . . . . . . . . . . . . A . 5 ARG N . . . . . . . . . c19602_2mgt 1 . 11 . 5474 . 1 1 6 ARG NE N -10.179 3.403 -3.713 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NE . . . . . . . . . c19602_2mgt 1 . 11 . 5475 . 1 1 6 ARG NH1 N -8.014 3.061 -4.527 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NH1 . . . . . . . . . c19602_2mgt 1 . 11 . 5476 . 1 1 6 ARG NH2 N -9.100 5.042 -4.910 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NH2 . . . . . . . . . c19602_2mgt 1 . 11 . 5477 . 1 1 6 ARG O O -14.025 5.095 -2.229 . . . 1.0 . . . . . . . . . . . . A . 5 ARG O . . . . . . . . . c19602_2mgt 1 . 11 . 5478 . 1 1 7 ARG C C -13.148 7.180 0.593 . . . 1.0 . . . . . . . . . . . . A . 6 ARG C . . . . . . . . . c19602_2mgt 1 . 11 . 5479 . 1 1 7 ARG CA C -14.282 6.156 0.485 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CA . . . . . . . . . c19602_2mgt 1 . 11 . 5480 . 1 1 7 ARG CB C -14.861 5.940 1.892 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CB . . . . . . . . . c19602_2mgt 1 . 11 . 5481 . 1 1 7 ARG CD C -17.249 5.356 1.130 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CD . . . . . . . . . c19602_2mgt 1 . 11 . 5482 . 1 1 7 ARG CG C -16.028 4.957 1.955 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CG . . . . . . . . . c19602_2mgt 1 . 11 . 5483 . 1 1 7 ARG CZ C -17.705 5.222 -1.333 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CZ . . . . . . . . . c19602_2mgt 1 . 11 . 5484 . 1 1 7 ARG H H -13.414 4.278 0.724 . . . 1.0 . . . . . . . . . . . . A . 6 ARG H . . . . . . . . . c19602_2mgt 1 . 11 . 5485 . 1 1 7 ARG HA H -15.056 6.514 -0.185 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HA . . . . . . . . . c19602_2mgt 1 . 11 . 5486 . 1 1 7 ARG HB2 H -14.066 5.563 2.536 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HB2 . . . . . . . . . c19602_2mgt 1 . 11 . 5487 . 1 1 7 ARG HB3 H -15.192 6.886 2.308 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HB3 . . . . . . . . . c19602_2mgt 1 . 11 . 5488 . 1 1 7 ARG HD2 H -18.145 5.017 1.650 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HD2 . . . . . . . . . c19602_2mgt 1 . 11 . 5489 . 1 1 7 ARG HD3 H -17.280 6.439 1.040 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HD3 . . . . . . . . . c19602_2mgt 1 . 11 . 5490 . 1 1 7 ARG HE H -16.788 3.803 -0.230 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HE . . . . . . . . . c19602_2mgt 1 . 11 . 5491 . 1 1 7 ARG HG2 H -15.661 4.000 1.603 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HG2 . . . . . . . . . c19602_2mgt 1 . 11 . 5492 . 1 1 7 ARG HG3 H -16.338 4.861 2.996 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HG3 . . . . . . . . . c19602_2mgt 1 . 11 . 5493 . 1 1 7 ARG HH11 H -18.491 6.923 -0.551 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH11 . . . . . . . . . c19602_2mgt 1 . 11 . 5494 . 1 1 7 ARG HH12 H -18.703 6.728 -2.274 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH12 . . . . . . . . . c19602_2mgt 1 . 11 . 5495 . 1 1 7 ARG HH21 H -17.049 3.658 -2.450 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH21 . . . . . . . . . c19602_2mgt 1 . 11 . 5496 . 1 1 7 ARG HH22 H -17.916 4.898 -3.323 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH22 . . . . . . . . . c19602_2mgt 1 . 11 . 5497 . 1 1 7 ARG N N -13.770 4.882 0.001 . . . 1.0 . . . . . . . . . . . . A . 6 ARG N . . . . . . . . . c19602_2mgt 1 . 11 . 5498 . 1 1 7 ARG NE N -17.213 4.721 -0.192 . . . 1.0 . . . . . . . . . . . . A . 6 ARG NE . . . . . . . . . c19602_2mgt 1 . 11 . 5499 . 1 1 7 ARG NH1 N -18.348 6.387 -1.393 . . . 1.0 . . . . . . . . . . . . A . 6 ARG NH1 . . . . . . . . . c19602_2mgt 1 . 11 . 5500 . 1 1 7 ARG NH2 N -17.548 4.535 -2.457 . . . 1.0 . . . . . . . . . . . . A . 6 ARG NH2 . . . . . . . . . c19602_2mgt 1 . 11 . 5501 . 1 1 7 ARG O O -11.979 6.819 0.473 . . . 1.0 . . . . . . . . . . . . A . 6 ARG O . . . . . . . . . c19602_2mgt 1 . 11 . 5502 . 1 1 8 ASP C C -11.781 9.152 2.622 . . . 1.0 . . . . . . . . . . . . A . 7 ASP C . . . . . . . . . c19602_2mgt 1 . 11 . 5503 . 1 1 8 ASP CA C -12.476 9.451 1.292 . . . 1.0 . . . . . . . . . . . . A . 7 ASP CA . . . . . . . . . c19602_2mgt 1 . 11 . 5504 . 1 1 8 ASP CB C -13.151 10.815 1.416 . . . 1.0 . . . . . . . . . . . . A . 7 ASP CB . . . . . . . . . c19602_2mgt 1 . 11 . 5505 . 1 1 8 ASP CG C -13.753 11.289 0.108 . . . 1.0 . . . . . . . . . . . . A . 7 ASP CG . . . . . . . . . c19602_2mgt 1 . 11 . 5506 . 1 1 8 ASP H H -14.447 8.681 1.030 . . . 1.0 . . . . . . . . . . . . A . 7 ASP H . . . . . . . . . c19602_2mgt 1 . 11 . 5507 . 1 1 8 ASP HA H -11.718 9.502 0.510 . . . 1.0 . . . . . . . . . . . . A . 7 ASP HA . . . . . . . . . c19602_2mgt 1 . 11 . 5508 . 1 1 8 ASP HB2 H -13.936 10.761 2.175 . . . 1.0 . . . . . . . . . . . . A . 7 ASP HB2 . . . . . . . . . c19602_2mgt 1 . 11 . 5509 . 1 1 8 ASP HB3 H -12.416 11.552 1.737 . . . 1.0 . . . . . . . . . . . . A . 7 ASP HB3 . . . . . . . . . c19602_2mgt 1 . 11 . 5510 . 1 1 8 ASP N N -13.472 8.437 0.925 . . . 1.0 . . . . . . . . . . . . A . 7 ASP N . . . . . . . . . c19602_2mgt 1 . 11 . 5511 . 1 1 8 ASP O O -10.784 9.796 2.942 . . . 1.0 . . . . . . . . . . . . A . 7 ASP O . . . . . . . . . c19602_2mgt 1 . 11 . 5512 . 1 1 8 ASP OD1 O -13.157 11.003 -0.957 . . . 1.0 . . . . . . . . . . . . A . 7 ASP OD1 . . . . . . . . . c19602_2mgt 1 . 11 . 5513 . 1 1 8 ASP OD2 O -14.795 11.947 0.169 . . . 1.0 . . . . . . . . . . . . A . 7 ASP OD2 . . . . . . . . . c19602_2mgt 1 . 11 . 5514 . 1 1 9 SER C C -10.600 7.527 5.101 . . . 1.0 . . . . . . . . . . . . A . 8 SER C . . . . . . . . . c19602_2mgt 1 . 11 . 5515 . 1 1 9 SER CA C -12.042 7.913 4.773 . . . 1.0 . . . . . . . . . . . . A . 8 SER CA . . . . . . . . . c19602_2mgt 1 . 11 . 5516 . 1 1 9 SER CB C -12.972 6.781 5.219 . . . 1.0 . . . . . . . . . . . . A . 8 SER CB . . . . . . . . . c19602_2mgt 1 . 11 . 5517 . 1 1 9 SER H H -13.150 7.743 3.020 . . . 1.0 . . . . . . . . . . . . A . 8 SER H . . . . . . . . . c19602_2mgt 1 . 11 . 5518 . 1 1 9 SER HA H -12.287 8.804 5.348 . . . 1.0 . . . . . . . . . . . . A . 8 SER HA . . . . . . . . . c19602_2mgt 1 . 11 . 5519 . 1 1 9 SER HB2 H -12.747 5.879 4.649 . . . 1.0 . . . . . . . . . . . . A . 8 SER HB2 . . . . . . . . . c19602_2mgt 1 . 11 . 5520 . 1 1 9 SER HB3 H -12.818 6.580 6.278 . . . 1.0 . . . . . . . . . . . . A . 8 SER HB3 . . . . . . . . . c19602_2mgt 1 . 11 . 5521 . 1 1 9 SER HG H -14.877 6.419 5.312 . . . 1.0 . . . . . . . . . . . . A . 8 SER HG . . . . . . . . . c19602_2mgt 1 . 11 . 5522 . 1 1 9 SER N N -12.324 8.195 3.380 . . . 1.0 . . . . . . . . . . . . A . 8 SER N . . . . . . . . . c19602_2mgt 1 . 11 . 5523 . 1 1 9 SER O O -10.304 7.444 6.286 . . . 1.0 . . . . . . . . . . . . A . 8 SER O . . . . . . . . . c19602_2mgt 1 . 11 . 5524 . 1 1 9 SER OG O -14.319 7.141 5.010 . . . 1.0 . . . . . . . . . . . . A . 8 SER OG . . . . . . . . . c19602_2mgt 1 . 11 . 5525 . 1 1 10 GLY C C -7.507 7.506 3.196 . . . 1.0 . . . . . . . . . . . . A . 9 GLY C . . . . . . . . . c19602_2mgt 1 . 11 . 5526 . 1 1 10 GLY CA C -8.325 6.940 4.355 . . . 1.0 . . . . . . . . . . . . A . 9 GLY CA . . . . . . . . . c19602_2mgt 1 . 11 . 5527 . 1 1 10 GLY H H -9.973 7.410 3.154 . . . 1.0 . . . . . . . . . . . . A . 9 GLY H . . . . . . . . . c19602_2mgt 1 . 11 . 5528 . 1 1 10 GLY HA2 H -7.970 7.360 5.295 . . . 1.0 . . . . . . . . . . . . A . 9 GLY HA2 . . . . . . . . . c19602_2mgt 1 . 11 . 5529 . 1 1 10 GLY HA3 H -8.244 5.859 4.428 . . . 1.0 . . . . . . . . . . . . A . 9 GLY HA3 . . . . . . . . . c19602_2mgt 1 . 11 . 5530 . 1 1 10 GLY N N -9.714 7.285 4.124 . . . 1.0 . . . . . . . . . . . . A . 9 GLY N . . . . . . . . . c19602_2mgt 1 . 11 . 5531 . 1 1 10 GLY O O -7.548 8.711 2.989 . . . 1.0 . . . . . . . . . . . . A . 9 GLY O . . . . . . . . . c19602_2mgt 1 . 11 . 5532 . 1 1 11 TYR C C -5.596 4.722 1.590 . . . 1.0 . . . . . . . . . . . . A . 10 TYR C . . . . . . . . . c19602_2mgt 1 . 11 . 5533 . 1 1 11 TYR CA C -6.743 5.265 2.429 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CA . . . . . . . . . c19602_2mgt 1 . 11 . 5534 . 1 1 11 TYR CB C -8.058 4.700 1.880 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CB . . . . . . . . . c19602_2mgt 1 . 11 . 5535 . 1 1 11 TYR CD1 C -8.229 2.804 3.550 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CD1 . . . . . . . . . c19602_2mgt 1 . 11 . 5536 . 1 1 11 TYR CD2 C -10.199 4.154 3.081 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CD2 . . . . . . . . . c19602_2mgt 1 . 11 . 5537 . 1 1 11 TYR CE1 C -8.984 1.998 4.412 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CE1 . . . . . . . . . c19602_2mgt 1 . 11 . 5538 . 1 1 11 TYR CE2 C -10.963 3.333 3.924 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CE2 . . . . . . . . . c19602_2mgt 1 . 11 . 5539 . 1 1 11 TYR CG C -8.841 3.871 2.869 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CG . . . . . . . . . c19602_2mgt 1 . 11 . 5540 . 1 1 11 TYR CZ C -10.363 2.236 4.577 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CZ . . . . . . . . . c19602_2mgt 1 . 11 . 5541 . 1 1 11 TYR H H -6.399 7.108 1.568 . . . 1.0 . . . . . . . . . . . . A . 10 TYR H . . . . . . . . . c19602_2mgt 1 . 11 . 5542 . 1 1 11 TYR HA H -6.598 4.928 3.451 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HA . . . . . . . . . c19602_2mgt 1 . 11 . 5543 . 1 1 11 TYR HB2 H -8.693 5.504 1.511 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HB2 . . . . . . . . . c19602_2mgt 1 . 11 . 5544 . 1 1 11 TYR HB3 H -7.840 4.081 1.014 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HB3 . . . . . . . . . c19602_2mgt 1 . 11 . 5545 . 1 1 11 TYR HD1 H -7.184 2.590 3.406 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HD1 . . . . . . . . . c19602_2mgt 1 . 11 . 5546 . 1 1 11 TYR HD2 H -10.667 4.979 2.563 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HD2 . . . . . . . . . c19602_2mgt 1 . 11 . 5547 . 1 1 11 TYR HE1 H -8.508 1.197 4.946 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HE1 . . . . . . . . . c19602_2mgt 1 . 11 . 5548 . 1 1 11 TYR HE2 H -12.009 3.543 4.058 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HE2 . . . . . . . . . c19602_2mgt 1 . 11 . 5549 . 1 1 11 TYR HH H -10.572 0.746 5.813 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HH . . . . . . . . . c19602_2mgt 1 . 11 . 5550 . 1 1 11 TYR N N -6.784 6.708 2.402 . . . 1.0 . . . . . . . . . . . . A . 10 TYR N . . . . . . . . . c19602_2mgt 1 . 11 . 5551 . 1 1 11 TYR O O -5.220 5.293 0.566 . . . 1.0 . . . . . . . . . . . . A . 10 TYR O . . . . . . . . . c19602_2mgt 1 . 11 . 5552 . 1 1 11 TYR OH O -11.102 1.421 5.383 . . . 1.0 . . . . . . . . . . . . A . 10 TYR OH . . . . . . . . . c19602_2mgt 1 . 11 . 5553 . 1 1 12 GLU C C -5.447 1.224 1.451 . . . 1.0 . . . . . . . . . . . . A . 11 GLU C . . . . . . . . . c19602_2mgt 1 . 11 . 5554 . 1 1 12 GLU CA C -4.654 2.502 1.116 . . . 1.0 . . . . . . . . . . . . A . 11 GLU CA . . . . . . . . . c19602_2mgt 1 . 11 . 5555 . 1 1 12 GLU CB C -3.145 2.356 1.354 . . . 1.0 . . . . . . . . . . . . A . 11 GLU CB . . . . . . . . . c19602_2mgt 1 . 11 . 5556 . 1 1 12 GLU CD C -1.216 0.773 0.795 . . . 1.0 . . . . . . . . . . . . A . 11 GLU CD . . . . . . . . . c19602_2mgt 1 . 11 . 5557 . 1 1 12 GLU CG C -2.536 1.378 0.345 . . . 1.0 . . . . . . . . . . . . A . 11 GLU CG . . . . . . . . . c19602_2mgt 1 . 11 . 5558 . 1 1 12 GLU H H -5.466 3.202 2.898 . . . 1.0 . . . . . . . . . . . . A . 11 GLU H . . . . . . . . . c19602_2mgt 1 . 11 . 5559 . 1 1 12 GLU HA H -4.832 2.792 0.079 . . . 1.0 . . . . . . . . . . . . A . 11 GLU HA . . . . . . . . . c19602_2mgt 1 . 11 . 5560 . 1 1 12 GLU HB2 H -2.666 3.329 1.245 . . . 1.0 . . . . . . . . . . . . A . 11 GLU HB2 . . . . . . . . . c19602_2mgt 1 . 11 . 5561 . 1 1 12 GLU HB3 H -2.976 2.007 2.370 . . . 1.0 . . . . . . . . . . . . A . 11 GLU HB3 . . . . . . . . . c19602_2mgt 1 . 11 . 5562 . 1 1 12 GLU HG2 H -3.226 0.551 0.200 . . . 1.0 . . . . . . . . . . . . A . 11 GLU HG2 . . . . . . . . . c19602_2mgt 1 . 11 . 5563 . 1 1 12 GLU HG3 H -2.404 1.888 -0.605 . . . 1.0 . . . . . . . . . . . . A . 11 GLU HG3 . . . . . . . . . c19602_2mgt 1 . 11 . 5564 . 1 1 12 GLU N N -5.166 3.528 1.993 . . . 1.0 . . . . . . . . . . . . A . 11 GLU N . . . . . . . . . c19602_2mgt 1 . 11 . 5565 . 1 1 12 GLU O O -5.043 0.443 2.314 . . . 1.0 . . . . . . . . . . . . A . 11 GLU O . . . . . . . . . c19602_2mgt 1 . 11 . 5566 . 1 1 12 GLU OE1 O -0.425 1.453 1.467 . . . 1.0 . . . . . . . . . . . . A . 11 GLU OE1 . . . . . . . . . c19602_2mgt 1 . 11 . 5567 . 1 1 12 GLU OE2 O -1.004 -0.409 0.490 . . . 1.0 . . . . . . . . . . . . A . 11 GLU OE2 . . . . . . . . . c19602_2mgt 1 . 11 . 5568 . 1 1 13 VAL C C -6.897 -1.447 0.747 . . . 1.0 . . . . . . . . . . . . A . 12 VAL C . . . . . . . . . c19602_2mgt 1 . 11 . 5569 . 1 1 13 VAL CA C -7.534 -0.079 0.993 . . . 1.0 . . . . . . . . . . . . A . 12 VAL CA . . . . . . . . . c19602_2mgt 1 . 11 . 5570 . 1 1 13 VAL CB C -8.791 0.119 0.114 . . . 1.0 . . . . . . . . . . . . A . 12 VAL CB . . . . . . . . . c19602_2mgt 1 . 11 . 5571 . 1 1 13 VAL CG1 C -9.792 -1.053 0.105 . . . 1.0 . . . . . . . . . . . . A . 12 VAL CG1 . . . . . . . . . c19602_2mgt 1 . 11 . 5572 . 1 1 13 VAL CG2 C -9.571 1.325 0.627 . . . 1.0 . . . . . . . . . . . . A . 12 VAL CG2 . . . . . . . . . c19602_2mgt 1 . 11 . 5573 . 1 1 13 VAL H H -6.869 1.715 0.100 . . . 1.0 . . . . . . . . . . . . A . 12 VAL H . . . . . . . . . c19602_2mgt 1 . 11 . 5574 . 1 1 13 VAL HA H -7.844 -0.048 2.033 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HA . . . . . . . . . c19602_2mgt 1 . 11 . 5575 . 1 1 13 VAL HB H -8.479 0.308 -0.912 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HB . . . . . . . . . c19602_2mgt 1 . 11 . 5576 . 1 1 13 VAL HG11 H -9.342 -1.930 -0.353 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HG11 . . . . . . . . . c19602_2mgt 1 . 11 . 5577 . 1 1 13 VAL HG12 H -10.107 -1.294 1.118 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HG12 . . . . . . . . . c19602_2mgt 1 . 11 . 5578 . 1 1 13 VAL HG13 H -10.670 -0.790 -0.483 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HG13 . . . . . . . . . c19602_2mgt 1 . 11 . 5579 . 1 1 13 VAL HG21 H -10.453 1.450 0.008 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HG21 . . . . . . . . . c19602_2mgt 1 . 11 . 5580 . 1 1 13 VAL HG22 H -9.860 1.166 1.664 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HG22 . . . . . . . . . c19602_2mgt 1 . 11 . 5581 . 1 1 13 VAL HG23 H -8.967 2.222 0.542 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HG23 . . . . . . . . . c19602_2mgt 1 . 11 . 5582 . 1 1 13 VAL N N -6.594 1.028 0.784 . . . 1.0 . . . . . . . . . . . . A . 12 VAL N . . . . . . . . . c19602_2mgt 1 . 11 . 5583 . 1 1 13 VAL O O -7.453 -2.447 1.178 . . . 1.0 . . . . . . . . . . . . A . 12 VAL O . . . . . . . . . c19602_2mgt 1 . 11 . 5584 . 1 1 14 HIS C C -4.573 -3.325 1.390 . . . 1.0 . . . . . . . . . . . . A . 13 HIS C . . . . . . . . . c19602_2mgt 1 . 11 . 5585 . 1 1 14 HIS CA C -4.960 -2.747 0.017 . . . 1.0 . . . . . . . . . . . . A . 13 HIS CA . . . . . . . . . c19602_2mgt 1 . 11 . 5586 . 1 1 14 HIS CB C -3.765 -2.496 -0.913 . . . 1.0 . . . . . . . . . . . . A . 13 HIS CB . . . . . . . . . c19602_2mgt 1 . 11 . 5587 . 1 1 14 HIS CD2 C -2.458 -4.706 -1.202 . . . 1.0 . . . . . . . . . . . . A . 13 HIS CD2 . . . . . . . . . c19602_2mgt 1 . 11 . 5588 . 1 1 14 HIS CE1 C -0.557 -4.108 -0.287 . . . 1.0 . . . . . . . . . . . . A . 13 HIS CE1 . . . . . . . . . c19602_2mgt 1 . 11 . 5589 . 1 1 14 HIS CG C -2.587 -3.419 -0.760 . . . 1.0 . . . . . . . . . . . . A . 13 HIS CG . . . . . . . . . c19602_2mgt 1 . 11 . 5590 . 1 1 14 HIS H H -5.295 -0.670 -0.229 . . . 1.0 . . . . . . . . . . . . A . 13 HIS H . . . . . . . . . c19602_2mgt 1 . 11 . 5591 . 1 1 14 HIS HA H -5.625 -3.467 -0.453 . . . 1.0 . . . . . . . . . . . . A . 13 HIS HA . . . . . . . . . c19602_2mgt 1 . 11 . 5592 . 1 1 14 HIS HB2 H -4.119 -2.544 -1.943 . . . 1.0 . . . . . . . . . . . . A . 13 HIS HB2 . . . . . . . . . c19602_2mgt 1 . 11 . 5593 . 1 1 14 HIS HB3 H -3.389 -1.490 -0.742 . . . 1.0 . . . . . . . . . . . . A . 13 HIS HB3 . . . . . . . . . c19602_2mgt 1 . 11 . 5594 . 1 1 14 HIS HD1 H -1.178 -2.185 0.237 . . . 1.0 . . . . . . . . . . . . A . 13 HIS HD1 . . . . . . . . . c19602_2mgt 1 . 11 . 5595 . 1 1 14 HIS HD2 H -3.207 -5.281 -1.725 . . . 1.0 . . . . . . . . . . . . A . 13 HIS HD2 . . . . . . . . . c19602_2mgt 1 . 11 . 5596 . 1 1 14 HIS HE1 H 0.464 -4.100 0.057 . . . 1.0 . . . . . . . . . . . . A . 13 HIS HE1 . . . . . . . . . c19602_2mgt 1 . 11 . 5597 . 1 1 14 HIS N N -5.717 -1.516 0.128 . . . 1.0 . . . . . . . . . . . . A . 13 HIS N . . . . . . . . . c19602_2mgt 1 . 11 . 5598 . 1 1 14 HIS ND1 N -1.395 -3.077 -0.178 . . . 1.0 . . . . . . . . . . . . A . 13 HIS ND1 . . . . . . . . . c19602_2mgt 1 . 11 . 5599 . 1 1 14 HIS NE2 N -1.163 -5.139 -0.888 . . . 1.0 . . . . . . . . . . . . A . 13 HIS NE2 . . . . . . . . . c19602_2mgt 1 . 11 . 5600 . 1 1 14 HIS O O -4.324 -4.522 1.454 . . . 1.0 . . . . . . . . . . . . A . 13 HIS O . . . . . . . . . c19602_2mgt 1 . 11 . 5601 . 1 1 15 HIS C C -5.856 -3.415 4.457 . . . 1.0 . . . . . . . . . . . . A . 14 HIS C . . . . . . . . . c19602_2mgt 1 . 11 . 5602 . 1 1 15 HIS CA C -4.498 -3.086 3.847 . . . 1.0 . . . . . . . . . . . . A . 14 HIS CA . . . . . . . . . c19602_2mgt 1 . 11 . 5603 . 1 1 15 HIS CB C -3.763 -2.092 4.743 . . . 1.0 . . . . . . . . . . . . A . 14 HIS CB . . . . . . . . . c19602_2mgt 1 . 11 . 5604 . 1 1 15 HIS CD2 C -1.765 -0.997 3.632 . . . 1.0 . . . . . . . . . . . . A . 14 HIS CD2 . . . . . . . . . c19602_2mgt 1 . 11 . 5605 . 1 1 15 HIS CE1 C -0.291 -2.603 3.836 . . . 1.0 . . . . . . . . . . . . A . 14 HIS CE1 . . . . . . . . . c19602_2mgt 1 . 11 . 5606 . 1 1 15 HIS CG C -2.329 -2.005 4.352 . . . 1.0 . . . . . . . . . . . . A . 14 HIS CG . . . . . . . . . c19602_2mgt 1 . 11 . 5607 . 1 1 15 HIS H H -4.815 -1.569 2.387 . . . 1.0 . . . . . . . . . . . . A . 14 HIS H . . . . . . . . . c19602_2mgt 1 . 11 . 5608 . 1 1 15 HIS HA H -3.919 -4.009 3.829 . . . 1.0 . . . . . . . . . . . . A . 14 HIS HA . . . . . . . . . c19602_2mgt 1 . 11 . 5609 . 1 1 15 HIS HB2 H -4.219 -1.107 4.663 . . . 1.0 . . . . . . . . . . . . A . 14 HIS HB2 . . . . . . . . . c19602_2mgt 1 . 11 . 5610 . 1 1 15 HIS HB3 H -3.815 -2.419 5.782 . . . 1.0 . . . . . . . . . . . . A . 14 HIS HB3 . . . . . . . . . c19602_2mgt 1 . 11 . 5611 . 1 1 15 HIS HD1 H -1.536 -3.902 4.915 . . . 1.0 . . . . . . . . . . . . A . 14 HIS HD1 . . . . . . . . . c19602_2mgt 1 . 11 . 5612 . 1 1 15 HIS HD2 H -2.264 -0.093 3.323 . . . 1.0 . . . . . . . . . . . . A . 14 HIS HD2 . . . . . . . . . c19602_2mgt 1 . 11 . 5613 . 1 1 15 HIS HE1 H 0.613 -3.181 3.758 . . . 1.0 . . . . . . . . . . . . A . 14 HIS HE1 . . . . . . . . . c19602_2mgt 1 . 11 . 5614 . 1 1 15 HIS N N -4.599 -2.551 2.486 . . . 1.0 . . . . . . . . . . . . A . 14 HIS N . . . . . . . . . c19602_2mgt 1 . 11 . 5615 . 1 1 15 HIS ND1 N -1.395 -3.002 4.477 . . . 1.0 . . . . . . . . . . . . A . 14 HIS ND1 . . . . . . . . . c19602_2mgt 1 . 11 . 5616 . 1 1 15 HIS NE2 N -0.467 -1.384 3.311 . . . 1.0 . . . . . . . . . . . . A . 14 HIS NE2 . . . . . . . . . c19602_2mgt 1 . 11 . 5617 . 1 1 15 HIS O O -5.923 -4.289 5.313 . . . 1.0 . . . . . . . . . . . . A . 14 HIS O . . . . . . . . . c19602_2mgt 1 . 11 . 5618 . 1 1 16 GLN C C -8.753 -4.385 3.977 . . . 1.0 . . . . . . . . . . . . A . 15 GLN C . . . . . . . . . c19602_2mgt 1 . 11 . 5619 . 1 1 16 GLN CA C -8.269 -3.045 4.517 . . . 1.0 . . . . . . . . . . . . A . 15 GLN CA . . . . . . . . . c19602_2mgt 1 . 11 . 5620 . 1 1 16 GLN CB C -9.195 -1.907 4.097 . . . 1.0 . . . . . . . . . . . . A . 15 GLN CB . . . . . . . . . c19602_2mgt 1 . 11 . 5621 . 1 1 16 GLN CD C -11.013 -2.279 5.886 . . . 1.0 . . . . . . . . . . . . A . 15 GLN CD . . . . . . . . . c19602_2mgt 1 . 11 . 5622 . 1 1 16 GLN CG C -10.678 -2.129 4.407 . . . 1.0 . . . . . . . . . . . . A . 15 GLN CG . . . . . . . . . c19602_2mgt 1 . 11 . 5623 . 1 1 16 GLN H H -6.853 -2.023 3.351 . . . 1.0 . . . . . . . . . . . . A . 15 GLN H . . . . . . . . . c19602_2mgt 1 . 11 . 5624 . 1 1 16 GLN HA H -8.233 -3.086 5.599 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HA . . . . . . . . . c19602_2mgt 1 . 11 . 5625 . 1 1 16 GLN HB2 H -8.864 -0.991 4.574 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HB2 . . . . . . . . . c19602_2mgt 1 . 11 . 5626 . 1 1 16 GLN HB3 H -9.099 -1.775 3.029 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HB3 . . . . . . . . . c19602_2mgt 1 . 11 . 5627 . 1 1 16 GLN HE21 H -12.968 -2.663 5.472 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HE21 . . . . . . . . . c19602_2mgt 1 . 11 . 5628 . 1 1 16 GLN HE22 H -12.535 -2.628 7.170 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HE22 . . . . . . . . . c19602_2mgt 1 . 11 . 5629 . 1 1 16 GLN HG2 H -11.209 -1.260 4.036 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HG2 . . . . . . . . . c19602_2mgt 1 . 11 . 5630 . 1 1 16 GLN HG3 H -11.035 -3.004 3.866 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HG3 . . . . . . . . . c19602_2mgt 1 . 11 . 5631 . 1 1 16 GLN N N -6.936 -2.756 4.035 . . . 1.0 . . . . . . . . . . . . A . 15 GLN N . . . . . . . . . c19602_2mgt 1 . 11 . 5632 . 1 1 16 GLN NE2 N -12.275 -2.548 6.196 . . . 1.0 . . . . . . . . . . . . A . 15 GLN NE2 . . . . . . . . . c19602_2mgt 1 . 11 . 5633 . 1 1 16 GLN O O -9.252 -5.193 4.745 . . . 1.0 . . . . . . . . . . . . A . 15 GLN O . . . . . . . . . c19602_2mgt 1 . 11 . 5634 . 1 1 16 GLN OE1 O -10.164 -2.145 6.755 . . . 1.0 . . . . . . . . . . . . A . 15 GLN OE1 . . . . . . . . . c19602_2mgt 1 . 11 . 5635 . 1 1 17 LYS C C -8.402 -5.908 0.618 . . . 1.0 . . . . . . . . . . . . A . 16 LYS C . . . . . . . . . c19602_2mgt 1 . 11 . 5636 . 1 1 17 LYS CA C -9.152 -5.743 1.944 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CA . . . . . . . . . c19602_2mgt 1 . 11 . 5637 . 1 1 17 LYS CB C -10.654 -5.491 1.722 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CB . . . . . . . . . c19602_2mgt 1 . 11 . 5638 . 1 1 17 LYS CD C -12.772 -6.397 0.681 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CD . . . . . . . . . c19602_2mgt 1 . 11 . 5639 . 1 1 17 LYS CE C -13.285 -7.460 -0.289 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CE . . . . . . . . . c19602_2mgt 1 . 11 . 5640 . 1 1 17 LYS CG C -11.295 -6.643 0.951 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CG . . . . . . . . . c19602_2mgt 1 . 11 . 5641 . 1 1 17 LYS H H -8.177 -3.883 2.121 . . . 1.0 . . . . . . . . . . . . A . 16 LYS H . . . . . . . . . c19602_2mgt 1 . 11 . 5642 . 1 1 17 LYS HA H -9.027 -6.649 2.537 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HA . . . . . . . . . c19602_2mgt 1 . 11 . 5643 . 1 1 17 LYS HB2 H -11.157 -5.384 2.682 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HB2 . . . . . . . . . c19602_2mgt 1 . 11 . 5644 . 1 1 17 LYS HB3 H -10.783 -4.564 1.160 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HB3 . . . . . . . . . c19602_2mgt 1 . 11 . 5645 . 1 1 17 LYS HD2 H -13.340 -6.432 1.605 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HD2 . . . . . . . . . c19602_2mgt 1 . 11 . 5646 . 1 1 17 LYS HD3 H -12.877 -5.411 0.240 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HD3 . . . . . . . . . c19602_2mgt 1 . 11 . 5647 . 1 1 17 LYS HE2 H -12.577 -7.563 -1.113 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HE2 . . . . . . . . . c19602_2mgt 1 . 11 . 5648 . 1 1 17 LYS HE3 H -13.362 -8.415 0.229 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HE3 . . . . . . . . . c19602_2mgt 1 . 11 . 5649 . 1 1 17 LYS HG2 H -10.805 -6.726 -0.016 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HG2 . . . . . . . . . c19602_2mgt 1 . 11 . 5650 . 1 1 17 LYS HG3 H -11.171 -7.568 1.512 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HG3 . . . . . . . . . c19602_2mgt 1 . 11 . 5651 . 1 1 17 LYS HZ1 H -14.926 -7.807 -1.459 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HZ1 . . . . . . . . . c19602_2mgt 1 . 11 . 5652 . 1 1 17 LYS HZ2 H -15.255 -6.958 -0.091 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HZ2 . . . . . . . . . c19602_2mgt 1 . 11 . 5653 . 1 1 17 LYS HZ3 H -14.504 -6.218 -1.354 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HZ3 . . . . . . . . . c19602_2mgt 1 . 11 . 5654 . 1 1 17 LYS N N -8.599 -4.614 2.673 . . . 1.0 . . . . . . . . . . . . A . 16 LYS N . . . . . . . . . c19602_2mgt 1 . 11 . 5655 . 1 1 17 LYS NZ N -14.592 -7.083 -0.840 . . . 1.0 . . . . . . . . . . . . A . 16 LYS NZ . . . . . . . . . c19602_2mgt 1 . 11 . 5656 . 1 1 17 LYS O O -8.077 -4.935 -0.052 . . . 1.0 . . . . . . . . . . . . A . 16 LYS O . . . . . . . . . c19602_2mgt 1 . 11 . 5657 . 1 1 18 NH2 HN1 H -7.666 -7.296 -0.667 . . . 1.0 . . . . . . . . . . . . A . 17 NH2 HN1 . . . . . . . . . c19602_2mgt 1 . 11 . 5658 . 1 1 18 NH2 HN2 H -8.441 -7.934 0.765 . . . 1.0 . . . . . . . . . . . . A . 17 NH2 HN2 . . . . . . . . . c19602_2mgt 1 . 11 . 5659 . 1 1 18 NH2 N N -8.152 -7.147 0.205 . . . 1.0 . . . . . . . . . . . . A . 17 NH2 N . . . . . . . . . c19602_2mgt 1 . 11 . 5660 . 2 1 1 ACE C C 8.260 4.988 -8.822 . . . 1.0 . . . . . . . . . . . . B . 0 ACE C . . . . . . . . . c19602_2mgt 1 . 11 . 5661 . 2 1 1 ACE CH3 C 7.731 5.550 -7.520 . . . 1.0 . . . . . . . . . . . . B . 0 ACE CH3 . . . . . . . . . c19602_2mgt 1 . 11 . 5662 . 2 1 1 ACE H1 H 8.110 4.955 -6.691 . . . 1.0 . . . . . . . . . . . . B . 0 ACE H1 . . . . . . . . . c19602_2mgt 1 . 11 . 5663 . 2 1 1 ACE H2 H 8.063 6.581 -7.408 . . . 1.0 . . . . . . . . . . . . B . 0 ACE H2 . . . . . . . . . c19602_2mgt 1 . 11 . 5664 . 2 1 1 ACE H3 H 6.643 5.531 -7.536 . . . 1.0 . . . . . . . . . . . . B . 0 ACE H3 . . . . . . . . . c19602_2mgt 1 . 11 . 5665 . 2 1 1 ACE O O 7.514 4.365 -9.572 . . . 1.0 . . . . . . . . . . . . B . 0 ACE O . . . . . . . . . c19602_2mgt 1 . 11 . 5666 . 2 1 2 ASP C C 10.987 3.647 -10.308 . . . 1.0 . . . . . . . . . . . . B . 1 ASP C . . . . . . . . . c19602_2mgt 1 . 11 . 5667 . 2 1 2 ASP CA C 10.184 4.946 -10.358 . . . 1.0 . . . . . . . . . . . . B . 1 ASP CA . . . . . . . . . c19602_2mgt 1 . 11 . 5668 . 2 1 2 ASP CB C 11.072 6.131 -10.723 . . . 1.0 . . . . . . . . . . . . B . 1 ASP CB . . . . . . . . . c19602_2mgt 1 . 11 . 5669 . 2 1 2 ASP CG C 11.232 6.198 -12.224 . . . 1.0 . . . . . . . . . . . . B . 1 ASP CG . . . . . . . . . c19602_2mgt 1 . 11 . 5670 . 2 1 2 ASP H H 10.099 5.723 -8.403 . . . 1.0 . . . . . . . . . . . . B . 1 ASP H . . . . . . . . . c19602_2mgt 1 . 11 . 5671 . 2 1 2 ASP HA H 9.412 4.850 -11.123 . . . 1.0 . . . . . . . . . . . . B . 1 ASP HA . . . . . . . . . c19602_2mgt 1 . 11 . 5672 . 2 1 2 ASP HB2 H 10.605 7.058 -10.388 . . . 1.0 . . . . . . . . . . . . B . 1 ASP HB2 . . . . . . . . . c19602_2mgt 1 . 11 . 5673 . 2 1 2 ASP HB3 H 12.049 6.032 -10.248 . . . 1.0 . . . . . . . . . . . . B . 1 ASP HB3 . . . . . . . . . c19602_2mgt 1 . 11 . 5674 . 2 1 2 ASP N N 9.542 5.235 -9.088 . . . 1.0 . . . . . . . . . . . . B . 1 ASP N . . . . . . . . . c19602_2mgt 1 . 11 . 5675 . 2 1 2 ASP O O 11.445 3.245 -9.241 . . . 1.0 . . . . . . . . . . . . B . 1 ASP O . . . . . . . . . c19602_2mgt 1 . 11 . 5676 . 2 1 2 ASP OD1 O 10.299 6.737 -12.861 . . . 1.0 . . . . . . . . . . . . B . 1 ASP OD1 . . . . . . . . . c19602_2mgt 1 . 11 . 5677 . 2 1 2 ASP OD2 O 12.238 5.692 -12.732 . . . 1.0 . . . . . . . . . . . . B . 1 ASP OD2 . . . . . . . . . c19602_2mgt 1 . 11 . 5678 . 2 1 3 ALA C C 12.673 1.161 -10.743 . . . 1.0 . . . . . . . . . . . . B . 2 ALA C . . . . . . . . . c19602_2mgt 1 . 11 . 5679 . 2 1 3 ALA CA C 11.567 1.636 -11.679 . . . 1.0 . . . . . . . . . . . . B . 2 ALA CA . . . . . . . . . c19602_2mgt 1 . 11 . 5680 . 2 1 3 ALA CB C 11.992 1.455 -13.137 . . . 1.0 . . . . . . . . . . . . B . 2 ALA CB . . . . . . . . . c19602_2mgt 1 . 11 . 5681 . 2 1 3 ALA H H 10.798 3.486 -12.307 . . . 1.0 . . . . . . . . . . . . B . 2 ALA H . . . . . . . . . c19602_2mgt 1 . 11 . 5682 . 2 1 3 ALA HA H 10.704 0.999 -11.505 . . . 1.0 . . . . . . . . . . . . B . 2 ALA HA . . . . . . . . . c19602_2mgt 1 . 11 . 5683 . 2 1 3 ALA HB1 H 12.410 0.460 -13.265 . . . 1.0 . . . . . . . . . . . . B . 2 ALA HB1 . . . . . . . . . c19602_2mgt 1 . 11 . 5684 . 2 1 3 ALA HB2 H 11.131 1.577 -13.791 . . . 1.0 . . . . . . . . . . . . B . 2 ALA HB2 . . . . . . . . . c19602_2mgt 1 . 11 . 5685 . 2 1 3 ALA HB3 H 12.756 2.186 -13.398 . . . 1.0 . . . . . . . . . . . . B . 2 ALA HB3 . . . . . . . . . c19602_2mgt 1 . 11 . 5686 . 2 1 3 ALA N N 11.153 3.022 -11.483 . . . 1.0 . . . . . . . . . . . . B . 2 ALA N . . . . . . . . . c19602_2mgt 1 . 11 . 5687 . 2 1 3 ALA O O 12.459 0.204 -10.010 . . . 1.0 . . . . . . . . . . . . B . 2 ALA O . . . . . . . . . c19602_2mgt 1 . 11 . 5688 . 2 1 4 GLU C C 14.867 1.103 -8.600 . . . 1.0 . . . . . . . . . . . . B . 3 GLU C . . . . . . . . . c19602_2mgt 1 . 11 . 5689 . 2 1 4 GLU CA C 15.051 1.411 -10.085 . . . 1.0 . . . . . . . . . . . . B . 3 GLU CA . . . . . . . . . c19602_2mgt 1 . 11 . 5690 . 2 1 4 GLU CB C 16.141 2.466 -10.289 . . . 1.0 . . . . . . . . . . . . B . 3 GLU CB . . . . . . . . . c19602_2mgt 1 . 11 . 5691 . 2 1 4 GLU CD C 16.674 4.913 -10.167 . . . 1.0 . . . . . . . . . . . . B . 3 GLU CD . . . . . . . . . c19602_2mgt 1 . 11 . 5692 . 2 1 4 GLU CG C 15.779 3.812 -9.644 . . . 1.0 . . . . . . . . . . . . B . 3 GLU CG . . . . . . . . . c19602_2mgt 1 . 11 . 5693 . 2 1 4 GLU H H 13.904 2.629 -11.377 . . . 1.0 . . . . . . . . . . . . B . 3 GLU H . . . . . . . . . c19602_2mgt 1 . 11 . 5694 . 2 1 4 GLU HA H 15.388 0.502 -10.567 . . . 1.0 . . . . . . . . . . . . B . 3 GLU HA . . . . . . . . . c19602_2mgt 1 . 11 . 5695 . 2 1 4 GLU HB2 H 17.076 2.105 -9.860 . . . 1.0 . . . . . . . . . . . . B . 3 GLU HB2 . . . . . . . . . c19602_2mgt 1 . 11 . 5696 . 2 1 4 GLU HB3 H 16.296 2.600 -11.359 . . . 1.0 . . . . . . . . . . . . B . 3 GLU HB3 . . . . . . . . . c19602_2mgt 1 . 11 . 5697 . 2 1 4 GLU HG2 H 14.741 4.071 -9.862 . . . 1.0 . . . . . . . . . . . . B . 3 GLU HG2 . . . . . . . . . c19602_2mgt 1 . 11 . 5698 . 2 1 4 GLU HG3 H 15.901 3.741 -8.563 . . . 1.0 . . . . . . . . . . . . B . 3 GLU HG3 . . . . . . . . . c19602_2mgt 1 . 11 . 5699 . 2 1 4 GLU N N 13.831 1.830 -10.764 . . . 1.0 . . . . . . . . . . . . B . 3 GLU N . . . . . . . . . c19602_2mgt 1 . 11 . 5700 . 2 1 4 GLU O O 15.478 0.151 -8.130 . . . 1.0 . . . . . . . . . . . . B . 3 GLU O . . . . . . . . . c19602_2mgt 1 . 11 . 5701 . 2 1 4 GLU OE1 O 17.767 5.069 -9.598 . . . 1.0 . . . . . . . . . . . . B . 3 GLU OE1 . . . . . . . . . c19602_2mgt 1 . 11 . 5702 . 2 1 4 GLU OE2 O 16.285 5.581 -11.142 . . . 1.0 . . . . . . . . . . . . B . 3 GLU OE2 . . . . . . . . . c19602_2mgt 1 . 11 . 5703 . 2 1 5 PHE C C 12.353 1.179 -6.180 . . . 1.0 . . . . . . . . . . . . B . 4 PHE C . . . . . . . . . c19602_2mgt 1 . 11 . 5704 . 2 1 5 PHE CA C 13.757 1.714 -6.466 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CA . . . . . . . . . c19602_2mgt 1 . 11 . 5705 . 2 1 5 PHE CB C 13.959 3.059 -5.778 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CB . . . . . . . . . c19602_2mgt 1 . 11 . 5706 . 2 1 5 PHE CD1 C 11.705 4.106 -5.316 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CD1 . . . . . . . . . c19602_2mgt 1 . 11 . 5707 . 2 1 5 PHE CD2 C 13.079 5.025 -7.100 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CD2 . . . . . . . . . c19602_2mgt 1 . 11 . 5708 . 2 1 5 PHE CE1 C 10.753 5.117 -5.520 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CE1 . . . . . . . . . c19602_2mgt 1 . 11 . 5709 . 2 1 5 PHE CE2 C 12.136 6.052 -7.290 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CE2 . . . . . . . . . c19602_2mgt 1 . 11 . 5710 . 2 1 5 PHE CG C 12.886 4.081 -6.079 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CG . . . . . . . . . c19602_2mgt 1 . 11 . 5711 . 2 1 5 PHE CZ C 10.990 6.111 -6.483 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CZ . . . . . . . . . c19602_2mgt 1 . 11 . 5712 . 2 1 5 PHE H H 13.559 2.631 -8.358 . . . 1.0 . . . . . . . . . . . . B . 4 PHE H . . . . . . . . . c19602_2mgt 1 . 11 . 5713 . 2 1 5 PHE HA H 14.470 1.015 -6.041 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HA . . . . . . . . . c19602_2mgt 1 . 11 . 5714 . 2 1 5 PHE HB2 H 13.977 2.888 -4.702 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HB2 . . . . . . . . . c19602_2mgt 1 . 11 . 5715 . 2 1 5 PHE HB3 H 14.934 3.458 -6.059 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HB3 . . . . . . . . . c19602_2mgt 1 . 11 . 5716 . 2 1 5 PHE HD1 H 11.546 3.354 -4.559 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HD1 . . . . . . . . . c19602_2mgt 1 . 11 . 5717 . 2 1 5 PHE HD2 H 13.965 4.970 -7.711 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HD2 . . . . . . . . . c19602_2mgt 1 . 11 . 5718 . 2 1 5 PHE HE1 H 9.855 5.144 -4.926 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HE1 . . . . . . . . . c19602_2mgt 1 . 11 . 5719 . 2 1 5 PHE HE2 H 12.295 6.802 -8.049 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HE2 . . . . . . . . . c19602_2mgt 1 . 11 . 5720 . 2 1 5 PHE HZ H 10.276 6.907 -6.620 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HZ . . . . . . . . . c19602_2mgt 1 . 11 . 5721 . 2 1 5 PHE N N 14.028 1.870 -7.891 . . . 1.0 . . . . . . . . . . . . B . 4 PHE N . . . . . . . . . c19602_2mgt 1 . 11 . 5722 . 2 1 5 PHE O O 12.082 0.793 -5.043 . . . 1.0 . . . . . . . . . . . . B . 4 PHE O . . . . . . . . . c19602_2mgt 1 . 11 . 5723 . 2 1 6 ARG C C 10.422 -1.010 -7.358 . . . 1.0 . . . . . . . . . . . . B . 5 ARG C . . . . . . . . . c19602_2mgt 1 . 11 . 5724 . 2 1 6 ARG CA C 10.185 0.491 -7.160 . . . 1.0 . . . . . . . . . . . . B . 5 ARG CA . . . . . . . . . c19602_2mgt 1 . 11 . 5725 . 2 1 6 ARG CB C 9.260 1.156 -8.191 . . . 1.0 . . . . . . . . . . . . B . 5 ARG CB . . . . . . . . . c19602_2mgt 1 . 11 . 5726 . 2 1 6 ARG CD C 7.172 0.510 -6.822 . . . 1.0 . . . . . . . . . . . . B . 5 ARG CD . . . . . . . . . c19602_2mgt 1 . 11 . 5727 . 2 1 6 ARG CG C 7.832 0.590 -8.203 . . . 1.0 . . . . . . . . . . . . B . 5 ARG CG . . . . . . . . . c19602_2mgt 1 . 11 . 5728 . 2 1 6 ARG CZ C 5.882 2.593 -6.423 . . . 1.0 . . . . . . . . . . . . B . 5 ARG CZ . . . . . . . . . c19602_2mgt 1 . 11 . 5729 . 2 1 6 ARG H H 11.755 1.501 -8.099 . . . 1.0 . . . . . . . . . . . . B . 5 ARG H . . . . . . . . . c19602_2mgt 1 . 11 . 5730 . 2 1 6 ARG HA H 9.759 0.655 -6.176 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HA . . . . . . . . . c19602_2mgt 1 . 11 . 5731 . 2 1 6 ARG HB2 H 9.212 2.220 -7.963 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HB2 . . . . . . . . . c19602_2mgt 1 . 11 . 5732 . 2 1 6 ARG HB3 H 9.687 1.047 -9.188 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HB3 . . . . . . . . . c19602_2mgt 1 . 11 . 5733 . 2 1 6 ARG HD2 H 6.212 0.005 -6.905 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HD2 . . . . . . . . . c19602_2mgt 1 . 11 . 5734 . 2 1 6 ARG HD3 H 7.781 -0.087 -6.144 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HD3 . . . . . . . . . c19602_2mgt 1 . 11 . 5735 . 2 1 6 ARG HE H 7.696 2.182 -5.629 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HE . . . . . . . . . c19602_2mgt 1 . 11 . 5736 . 2 1 6 ARG HG2 H 7.221 1.206 -8.863 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HG2 . . . . . . . . . c19602_2mgt 1 . 11 . 5737 . 2 1 6 ARG HG3 H 7.863 -0.410 -8.620 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HG3 . . . . . . . . . c19602_2mgt 1 . 11 . 5738 . 2 1 6 ARG HH11 H 4.969 1.376 -7.777 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HH11 . . . . . . . . . c19602_2mgt 1 . 11 . 5739 . 2 1 6 ARG HH12 H 4.104 2.840 -7.381 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HH12 . . . . . . . . . c19602_2mgt 1 . 11 . 5740 . 2 1 6 ARG HH21 H 6.487 4.024 -5.119 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HH21 . . . . . . . . . c19602_2mgt 1 . 11 . 5741 . 2 1 6 ARG HH22 H 4.940 4.306 -5.882 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HH22 . . . . . . . . . c19602_2mgt 1 . 11 . 5742 . 2 1 6 ARG N N 11.477 1.142 -7.197 . . . 1.0 . . . . . . . . . . . . B . 5 ARG N . . . . . . . . . c19602_2mgt 1 . 11 . 5743 . 2 1 6 ARG NE N 6.972 1.840 -6.243 . . . 1.0 . . . . . . . . . . . . B . 5 ARG NE . . . . . . . . . c19602_2mgt 1 . 11 . 5744 . 2 1 6 ARG NH1 N 4.906 2.237 -7.255 . . . 1.0 . . . . . . . . . . . . B . 5 ARG NH1 . . . . . . . . . c19602_2mgt 1 . 11 . 5745 . 2 1 6 ARG NH2 N 5.761 3.730 -5.754 . . . 1.0 . . . . . . . . . . . . B . 5 ARG NH2 . . . . . . . . . c19602_2mgt 1 . 11 . 5746 . 2 1 6 ARG O O 10.089 -1.587 -8.387 . . . 1.0 . . . . . . . . . . . . B . 5 ARG O . . . . . . . . . c19602_2mgt 1 . 11 . 5747 . 2 1 7 ARG C C 10.727 -3.929 -5.698 . . . 1.0 . . . . . . . . . . . . B . 6 ARG C . . . . . . . . . c19602_2mgt 1 . 11 . 5748 . 2 1 7 ARG CA C 11.642 -2.948 -6.402 . . . 1.0 . . . . . . . . . . . . B . 6 ARG CA . . . . . . . . . c19602_2mgt 1 . 11 . 5749 . 2 1 7 ARG CB C 13.030 -2.929 -5.745 . . . 1.0 . . . . . . . . . . . . B . 6 ARG CB . . . . . . . . . c19602_2mgt 1 . 11 . 5750 . 2 1 7 ARG CD C 14.424 -2.780 -7.914 . . . 1.0 . . . . . . . . . . . . B . 6 ARG CD . . . . . . . . . c19602_2mgt 1 . 11 . 5751 . 2 1 7 ARG CG C 14.085 -2.160 -6.552 . . . 1.0 . . . . . . . . . . . . B . 6 ARG CG . . . . . . . . . c19602_2mgt 1 . 11 . 5752 . 2 1 7 ARG CZ C 12.778 -3.120 -9.797 . . . 1.0 . . . . . . . . . . . . B . 6 ARG CZ . . . . . . . . . c19602_2mgt 1 . 11 . 5753 . 2 1 7 ARG H H 11.363 -1.051 -5.578 . . . 1.0 . . . . . . . . . . . . B . 6 ARG H . . . . . . . . . c19602_2mgt 1 . 11 . 5754 . 2 1 7 ARG HA H 11.733 -3.267 -7.430 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HA . . . . . . . . . c19602_2mgt 1 . 11 . 5755 . 2 1 7 ARG HB2 H 12.942 -2.449 -4.770 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HB2 . . . . . . . . . c19602_2mgt 1 . 11 . 5756 . 2 1 7 ARG HB3 H 13.382 -3.949 -5.595 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HB3 . . . . . . . . . c19602_2mgt 1 . 11 . 5757 . 2 1 7 ARG HD2 H 15.428 -2.461 -8.192 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HD2 . . . . . . . . . c19602_2mgt 1 . 11 . 5758 . 2 1 7 ARG HD3 H 14.436 -3.860 -7.828 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HD3 . . . . . . . . . c19602_2mgt 1 . 11 . 5759 . 2 1 7 ARG HE H 13.468 -1.344 -9.133 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HE . . . . . . . . . c19602_2mgt 1 . 11 . 5760 . 2 1 7 ARG HG2 H 13.747 -1.135 -6.678 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HG2 . . . . . . . . . c19602_2mgt 1 . 11 . 5761 . 2 1 7 ARG HG3 H 15.002 -2.131 -5.968 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HG3 . . . . . . . . . c19602_2mgt 1 . 11 . 5762 . 2 1 7 ARG HH11 H 13.298 -4.907 -8.971 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HH11 . . . . . . . . . c19602_2mgt 1 . 11 . 5763 . 2 1 7 ARG HH12 H 12.186 -4.998 -10.317 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HH12 . . . . . . . . . c19602_2mgt 1 . 11 . 5764 . 2 1 7 ARG HH21 H 12.034 -1.541 -10.839 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HH21 . . . . . . . . . c19602_2mgt 1 . 11 . 5765 . 2 1 7 ARG HH22 H 11.484 -3.113 -11.371 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HH22 . . . . . . . . . c19602_2mgt 1 . 11 . 5766 . 2 1 7 ARG N N 11.091 -1.610 -6.370 . . . 1.0 . . . . . . . . . . . . B . 6 ARG N . . . . . . . . . c19602_2mgt 1 . 11 . 5767 . 2 1 7 ARG NE N 13.506 -2.342 -8.978 . . . 1.0 . . . . . . . . . . . . B . 6 ARG NE . . . . . . . . . c19602_2mgt 1 . 11 . 5768 . 2 1 7 ARG NH1 N 12.754 -4.451 -9.688 . . . 1.0 . . . . . . . . . . . . B . 6 ARG NH1 . . . . . . . . . c19602_2mgt 1 . 11 . 5769 . 2 1 7 ARG NH2 N 12.044 -2.546 -10.751 . . . 1.0 . . . . . . . . . . . . B . 6 ARG NH2 . . . . . . . . . c19602_2mgt 1 . 11 . 5770 . 2 1 7 ARG O O 10.030 -3.579 -4.750 . . . 1.0 . . . . . . . . . . . . B . 6 ARG O . . . . . . . . . c19602_2mgt 1 . 11 . 5771 . 2 1 8 ASP C C 10.859 -6.924 -4.440 . . . 1.0 . . . . . . . . . . . . B . 7 ASP C . . . . . . . . . c19602_2mgt 1 . 11 . 5772 . 2 1 8 ASP CA C 10.067 -6.312 -5.588 . . . 1.0 . . . . . . . . . . . . B . 7 ASP CA . . . . . . . . . c19602_2mgt 1 . 11 . 5773 . 2 1 8 ASP CB C 9.884 -7.384 -6.664 . . . 1.0 . . . . . . . . . . . . B . 7 ASP CB . . . . . . . . . c19602_2mgt 1 . 11 . 5774 . 2 1 8 ASP CG C 8.943 -6.917 -7.757 . . . 1.0 . . . . . . . . . . . . B . 7 ASP CG . . . . . . . . . c19602_2mgt 1 . 11 . 5775 . 2 1 8 ASP H H 11.365 -5.367 -6.957 . . . 1.0 . . . . . . . . . . . . B . 7 ASP H . . . . . . . . . c19602_2mgt 1 . 11 . 5776 . 2 1 8 ASP HA H 9.089 -5.998 -5.220 . . . 1.0 . . . . . . . . . . . . B . 7 ASP HA . . . . . . . . . c19602_2mgt 1 . 11 . 5777 . 2 1 8 ASP HB2 H 10.850 -7.637 -7.100 . . . 1.0 . . . . . . . . . . . . B . 7 ASP HB2 . . . . . . . . . c19602_2mgt 1 . 11 . 5778 . 2 1 8 ASP HB3 H 9.468 -8.282 -6.208 . . . 1.0 . . . . . . . . . . . . B . 7 ASP HB3 . . . . . . . . . c19602_2mgt 1 . 11 . 5779 . 2 1 8 ASP N N 10.763 -5.173 -6.169 . . . 1.0 . . . . . . . . . . . . B . 7 ASP N . . . . . . . . . c19602_2mgt 1 . 11 . 5780 . 2 1 8 ASP O O 10.317 -7.749 -3.713 . . . 1.0 . . . . . . . . . . . . B . 7 ASP O . . . . . . . . . c19602_2mgt 1 . 11 . 5781 . 2 1 8 ASP OD1 O 9.313 -5.994 -8.501 . . . 1.0 . . . . . . . . . . . . B . 7 ASP OD1 . . . . . . . . . c19602_2mgt 1 . 11 . 5782 . 2 1 8 ASP OD2 O 7.840 -7.502 -7.820 . . . 1.0 . . . . . . . . . . . . B . 7 ASP OD2 . . . . . . . . . c19602_2mgt 1 . 11 . 5783 . 2 1 9 SER C C 12.577 -7.065 -1.872 . . . 1.0 . . . . . . . . . . . . B . 8 SER C . . . . . . . . . c19602_2mgt 1 . 11 . 5784 . 2 1 9 SER CA C 13.058 -7.126 -3.327 . . . 1.0 . . . . . . . . . . . . B . 8 SER CA . . . . . . . . . c19602_2mgt 1 . 11 . 5785 . 2 1 9 SER CB C 14.423 -6.446 -3.481 . . . 1.0 . . . . . . . . . . . . B . 8 SER CB . . . . . . . . . c19602_2mgt 1 . 11 . 5786 . 2 1 9 SER H H 12.526 -5.901 -4.950 . . . 1.0 . . . . . . . . . . . . B . 8 SER H . . . . . . . . . c19602_2mgt 1 . 11 . 5787 . 2 1 9 SER HA H 13.170 -8.176 -3.592 . . . 1.0 . . . . . . . . . . . . B . 8 SER HA . . . . . . . . . c19602_2mgt 1 . 11 . 5788 . 2 1 9 SER HB2 H 14.320 -5.372 -3.328 . . . 1.0 . . . . . . . . . . . . B . 8 SER HB2 . . . . . . . . . c19602_2mgt 1 . 11 . 5789 . 2 1 9 SER HB3 H 15.117 -6.846 -2.744 . . . 1.0 . . . . . . . . . . . . B . 8 SER HB3 . . . . . . . . . c19602_2mgt 1 . 11 . 5790 . 2 1 9 SER HG H 15.872 -6.463 -4.780 . . . 1.0 . . . . . . . . . . . . B . 8 SER HG . . . . . . . . . c19602_2mgt 1 . 11 . 5791 . 2 1 9 SER N N 12.132 -6.543 -4.280 . . . 1.0 . . . . . . . . . . . . B . 8 SER N . . . . . . . . . c19602_2mgt 1 . 11 . 5792 . 2 1 9 SER O O 13.159 -7.752 -1.043 . . . 1.0 . . . . . . . . . . . . B . 8 SER O . . . . . . . . . c19602_2mgt 1 . 11 . 5793 . 2 1 9 SER OG O 14.939 -6.697 -4.769 . . . 1.0 . . . . . . . . . . . . B . 8 SER OG . . . . . . . . . c19602_2mgt 1 . 11 . 5794 . 2 1 10 GLY C C 9.415 -6.904 -0.619 . . . 1.0 . . . . . . . . . . . . B . 9 GLY C . . . . . . . . . c19602_2mgt 1 . 11 . 5795 . 2 1 10 GLY CA C 10.781 -6.284 -0.320 . . . 1.0 . . . . . . . . . . . . B . 9 GLY CA . . . . . . . . . c19602_2mgt 1 . 11 . 5796 . 2 1 10 GLY H H 11.052 -5.819 -2.326 . . . 1.0 . . . . . . . . . . . . B . 9 GLY H . . . . . . . . . c19602_2mgt 1 . 11 . 5797 . 2 1 10 GLY HA2 H 11.290 -6.866 0.447 . . . 1.0 . . . . . . . . . . . . B . 9 GLY HA2 . . . . . . . . . c19602_2mgt 1 . 11 . 5798 . 2 1 10 GLY HA3 H 10.669 -5.258 0.022 . . . 1.0 . . . . . . . . . . . . B . 9 GLY HA3 . . . . . . . . . c19602_2mgt 1 . 11 . 5799 . 2 1 10 GLY N N 11.521 -6.294 -1.567 . . . 1.0 . . . . . . . . . . . . B . 9 GLY N . . . . . . . . . c19602_2mgt 1 . 11 . 5800 . 2 1 10 GLY O O 9.340 -8.115 -0.752 . . . 1.0 . . . . . . . . . . . . B . 9 GLY O . . . . . . . . . c19602_2mgt 1 . 11 . 5801 . 2 1 11 TYR C C 6.747 -4.270 -0.746 . . . 1.0 . . . . . . . . . . . . B . 10 TYR C . . . . . . . . . c19602_2mgt 1 . 11 . 5802 . 2 1 11 TYR CA C 8.210 -4.713 -0.704 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CA . . . . . . . . . c19602_2mgt 1 . 11 . 5803 . 2 1 11 TYR CB C 8.950 -4.072 -1.888 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CB . . . . . . . . . c19602_2mgt 1 . 11 . 5804 . 2 1 11 TYR CD1 C 9.834 -2.182 -0.466 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CD1 . . . . . . . . . c19602_2mgt 1 . 11 . 5805 . 2 1 11 TYR CD2 C 11.323 -3.230 -2.077 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CD2 . . . . . . . . . c19602_2mgt 1 . 11 . 5806 . 2 1 11 TYR CE1 C 10.865 -1.335 -0.048 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CE1 . . . . . . . . . c19602_2mgt 1 . 11 . 5807 . 2 1 11 TYR CE2 C 12.359 -2.387 -1.669 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CE2 . . . . . . . . . c19602_2mgt 1 . 11 . 5808 . 2 1 11 TYR CG C 10.059 -3.138 -1.472 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CG . . . . . . . . . c19602_2mgt 1 . 11 . 5809 . 2 1 11 TYR CZ C 12.141 -1.455 -0.636 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CZ . . . . . . . . . c19602_2mgt 1 . 11 . 5810 . 2 1 11 TYR H H 7.496 -6.600 -1.129 . . . 1.0 . . . . . . . . . . . . B . 10 TYR H . . . . . . . . . c19602_2mgt 1 . 11 . 5811 . 2 1 11 TYR HA H 8.649 -4.386 0.238 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HA . . . . . . . . . c19602_2mgt 1 . 11 . 5812 . 2 1 11 TYR HB2 H 9.359 -4.843 -2.537 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HB2 . . . . . . . . . c19602_2mgt 1 . 11 . 5813 . 2 1 11 TYR HB3 H 8.241 -3.525 -2.504 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HB3 . . . . . . . . . c19602_2mgt 1 . 11 . 5814 . 2 1 11 TYR HD1 H 8.871 -2.100 -0.004 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HD1 . . . . . . . . . c19602_2mgt 1 . 11 . 5815 . 2 1 11 TYR HD2 H 11.511 -3.966 -2.840 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HD2 . . . . . . . . . c19602_2mgt 1 . 11 . 5816 . 2 1 11 TYR HE1 H 10.679 -0.617 0.733 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HE1 . . . . . . . . . c19602_2mgt 1 . 11 . 5817 . 2 1 11 TYR HE2 H 13.328 -2.479 -2.120 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HE2 . . . . . . . . . c19602_2mgt 1 . 11 . 5818 . 2 1 11 TYR HH H 12.915 -0.105 0.522 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HH . . . . . . . . . c19602_2mgt 1 . 11 . 5819 . 2 1 11 TYR N N 8.320 -6.152 -0.776 . . . 1.0 . . . . . . . . . . . . B . 10 TYR N . . . . . . . . . c19602_2mgt 1 . 11 . 5820 . 2 1 11 TYR O O 5.882 -4.989 -1.239 . . . 1.0 . . . . . . . . . . . . B . 10 TYR O . . . . . . . . . c19602_2mgt 1 . 11 . 5821 . 2 1 11 TYR OH O 13.177 -0.712 -0.176 . . . 1.0 . . . . . . . . . . . . B . 10 TYR OH . . . . . . . . . c19602_2mgt 1 . 11 . 5822 . 2 1 12 GLU C C 5.894 -0.740 -0.710 . . . 1.0 . . . . . . . . . . . . B . 11 GLU C . . . . . . . . . c19602_2mgt 1 . 11 . 5823 . 2 1 12 GLU CA C 5.408 -2.199 -0.734 . . . 1.0 . . . . . . . . . . . . B . 11 GLU CA . . . . . . . . . c19602_2mgt 1 . 11 . 5824 . 2 1 12 GLU CB C 4.206 -2.450 0.178 . . . 1.0 . . . . . . . . . . . . B . 11 GLU CB . . . . . . . . . c19602_2mgt 1 . 11 . 5825 . 2 1 12 GLU CD C 1.949 -1.312 0.407 . . . 1.0 . . . . . . . . . . . . B . 11 GLU CD . . . . . . . . . c19602_2mgt 1 . 11 . 5826 . 2 1 12 GLU CG C 2.937 -1.968 -0.532 . . . 1.0 . . . . . . . . . . . . B . 11 GLU CG . . . . . . . . . c19602_2mgt 1 . 11 . 5827 . 2 1 12 GLU H H 7.245 -2.554 0.191 . . . 1.0 . . . . . . . . . . . . B . 11 GLU H . . . . . . . . . c19602_2mgt 1 . 11 . 5828 . 2 1 12 GLU HA H 5.138 -2.485 -1.749 . . . 1.0 . . . . . . . . . . . . B . 11 GLU HA . . . . . . . . . c19602_2mgt 1 . 11 . 5829 . 2 1 12 GLU HB2 H 4.113 -3.516 0.388 . . . 1.0 . . . . . . . . . . . . B . 11 GLU HB2 . . . . . . . . . c19602_2mgt 1 . 11 . 5830 . 2 1 12 GLU HB3 H 4.365 -1.933 1.124 . . . 1.0 . . . . . . . . . . . . B . 11 GLU HB3 . . . . . . . . . c19602_2mgt 1 . 11 . 5831 . 2 1 12 GLU HG2 H 3.197 -1.248 -1.307 . . . 1.0 . . . . . . . . . . . . B . 11 GLU HG2 . . . . . . . . . c19602_2mgt 1 . 11 . 5832 . 2 1 12 GLU HG3 H 2.450 -2.815 -1.006 . . . 1.0 . . . . . . . . . . . . B . 11 GLU HG3 . . . . . . . . . c19602_2mgt 1 . 11 . 5833 . 2 1 12 GLU N N 6.521 -3.024 -0.326 . . . 1.0 . . . . . . . . . . . . B . 11 GLU N . . . . . . . . . c19602_2mgt 1 . 11 . 5834 . 2 1 12 GLU O O 5.655 -0.007 0.247 . . . 1.0 . . . . . . . . . . . . B . 11 GLU O . . . . . . . . . c19602_2mgt 1 . 11 . 5835 . 2 1 12 GLU OE1 O 1.357 -2.029 1.232 . . . 1.0 . . . . . . . . . . . . B . 11 GLU OE1 . . . . . . . . . c19602_2mgt 1 . 11 . 5836 . 2 1 12 GLU OE2 O 1.803 -0.080 0.305 . . . 1.0 . . . . . . . . . . . . B . 11 GLU OE2 . . . . . . . . . c19602_2mgt 1 . 11 . 5837 . 2 1 13 VAL C C 6.820 2.161 -1.528 . . . 1.0 . . . . . . . . . . . . B . 12 VAL C . . . . . . . . . c19602_2mgt 1 . 11 . 5838 . 2 1 13 VAL CA C 7.517 0.820 -1.832 . . . 1.0 . . . . . . . . . . . . B . 12 VAL CA . . . . . . . . . c19602_2mgt 1 . 11 . 5839 . 2 1 13 VAL CB C 8.212 0.814 -3.212 . . . 1.0 . . . . . . . . . . . . B . 12 VAL CB . . . . . . . . . c19602_2mgt 1 . 11 . 5840 . 2 1 13 VAL CG1 C 8.990 2.096 -3.540 . . . 1.0 . . . . . . . . . . . . B . 12 VAL CG1 . . . . . . . . . c19602_2mgt 1 . 11 . 5841 . 2 1 13 VAL CG2 C 9.209 -0.346 -3.308 . . . 1.0 . . . . . . . . . . . . B . 12 VAL CG2 . . . . . . . . . c19602_2mgt 1 . 11 . 5842 . 2 1 13 VAL H H 6.757 -1.022 -2.499 . . . 1.0 . . . . . . . . . . . . B . 12 VAL H . . . . . . . . . c19602_2mgt 1 . 11 . 5843 . 2 1 13 VAL HA H 8.297 0.682 -1.091 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HA . . . . . . . . . c19602_2mgt 1 . 11 . 5844 . 2 1 13 VAL HB H 7.444 0.672 -3.969 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HB . . . . . . . . . c19602_2mgt 1 . 11 . 5845 . 2 1 13 VAL HG11 H 9.704 2.318 -2.746 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HG11 . . . . . . . . . c19602_2mgt 1 . 11 . 5846 . 2 1 13 VAL HG12 H 9.525 1.986 -4.481 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HG12 . . . . . . . . . c19602_2mgt 1 . 11 . 5847 . 2 1 13 VAL HG13 H 8.299 2.923 -3.656 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HG13 . . . . . . . . . c19602_2mgt 1 . 11 . 5848 . 2 1 13 VAL HG21 H 8.701 -1.289 -3.122 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HG21 . . . . . . . . . c19602_2mgt 1 . 11 . 5849 . 2 1 13 VAL HG22 H 9.634 -0.388 -4.305 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HG22 . . . . . . . . . c19602_2mgt 1 . 11 . 5850 . 2 1 13 VAL HG23 H 10.007 -0.205 -2.582 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HG23 . . . . . . . . . c19602_2mgt 1 . 11 . 5851 . 2 1 13 VAL N N 6.647 -0.357 -1.748 . . . 1.0 . . . . . . . . . . . . B . 12 VAL N . . . . . . . . . c19602_2mgt 1 . 11 . 5852 . 2 1 13 VAL O O 7.503 3.125 -1.185 . . . 1.0 . . . . . . . . . . . . B . 12 VAL O . . . . . . . . . c19602_2mgt 1 . 11 . 5853 . 2 1 14 HIS C C 4.869 3.775 0.298 . . . 1.0 . . . . . . . . . . . . B . 13 HIS C . . . . . . . . . c19602_2mgt 1 . 11 . 5854 . 2 1 14 HIS CA C 4.754 3.437 -1.199 . . . 1.0 . . . . . . . . . . . . B . 13 HIS CA . . . . . . . . . c19602_2mgt 1 . 11 . 5855 . 2 1 14 HIS CB C 3.272 3.346 -1.593 . . . 1.0 . . . . . . . . . . . . B . 13 HIS CB . . . . . . . . . c19602_2mgt 1 . 11 . 5856 . 2 1 14 HIS CD2 C 3.442 4.610 -3.818 . . . 1.0 . . . . . . . . . . . . B . 13 HIS CD2 . . . . . . . . . c19602_2mgt 1 . 11 . 5857 . 2 1 14 HIS CE1 C 2.079 3.415 -5.044 . . . 1.0 . . . . . . . . . . . . B . 13 HIS CE1 . . . . . . . . . c19602_2mgt 1 . 11 . 5858 . 2 1 14 HIS CG C 2.988 3.572 -3.052 . . . 1.0 . . . . . . . . . . . . B . 13 HIS CG . . . . . . . . . c19602_2mgt 1 . 11 . 5859 . 2 1 14 HIS H H 4.951 1.429 -1.872 . . . 1.0 . . . . . . . . . . . . B . 13 HIS H . . . . . . . . . c19602_2mgt 1 . 11 . 5860 . 2 1 14 HIS HA H 5.218 4.244 -1.759 . . . 1.0 . . . . . . . . . . . . B . 13 HIS HA . . . . . . . . . c19602_2mgt 1 . 11 . 5861 . 2 1 14 HIS HB2 H 2.869 2.386 -1.272 . . . 1.0 . . . . . . . . . . . . B . 13 HIS HB2 . . . . . . . . . c19602_2mgt 1 . 11 . 5862 . 2 1 14 HIS HB3 H 2.725 4.123 -1.063 . . . 1.0 . . . . . . . . . . . . B . 13 HIS HB3 . . . . . . . . . c19602_2mgt 1 . 11 . 5863 . 2 1 14 HIS HD1 H 1.604 2.029 -3.545 . . . 1.0 . . . . . . . . . . . . B . 13 HIS HD1 . . . . . . . . . c19602_2mgt 1 . 11 . 5864 . 2 1 14 HIS HD2 H 4.112 5.393 -3.496 . . . 1.0 . . . . . . . . . . . . B . 13 HIS HD2 . . . . . . . . . c19602_2mgt 1 . 11 . 5865 . 2 1 14 HIS HE1 H 1.487 3.052 -5.869 . . . 1.0 . . . . . . . . . . . . B . 13 HIS HE1 . . . . . . . . . c19602_2mgt 1 . 11 . 5866 . 2 1 14 HIS N N 5.484 2.238 -1.587 . . . 1.0 . . . . . . . . . . . . B . 13 HIS N . . . . . . . . . c19602_2mgt 1 . 11 . 5867 . 2 1 14 HIS ND1 N 2.120 2.846 -3.833 . . . 1.0 . . . . . . . . . . . . B . 13 HIS ND1 . . . . . . . . . c19602_2mgt 1 . 11 . 5868 . 2 1 14 HIS NE2 N 2.870 4.496 -5.086 . . . 1.0 . . . . . . . . . . . . B . 13 HIS NE2 . . . . . . . . . c19602_2mgt 1 . 11 . 5869 . 2 1 14 HIS O O 4.493 4.880 0.675 . . . 1.0 . . . . . . . . . . . . B . 13 HIS O . . . . . . . . . c19602_2mgt 1 . 11 . 5870 . 2 1 15 HIS C C 7.042 3.742 2.809 . . . 1.0 . . . . . . . . . . . . B . 14 HIS C . . . . . . . . . c19602_2mgt 1 . 11 . 5871 . 2 1 15 HIS CA C 5.652 3.157 2.555 . . . 1.0 . . . . . . . . . . . . B . 14 HIS CA . . . . . . . . . c19602_2mgt 1 . 11 . 5872 . 2 1 15 HIS CB C 5.452 1.905 3.418 . . . 1.0 . . . . . . . . . . . . B . 14 HIS CB . . . . . . . . . c19602_2mgt 1 . 11 . 5873 . 2 1 15 HIS CD2 C 3.290 0.817 2.668 . . . 1.0 . . . . . . . . . . . . B . 14 HIS CD2 . . . . . . . . . c19602_2mgt 1 . 11 . 5874 . 2 1 15 HIS CE1 C 1.908 1.520 4.209 . . . 1.0 . . . . . . . . . . . . B . 14 HIS CE1 . . . . . . . . . c19602_2mgt 1 . 11 . 5875 . 2 1 15 HIS CG C 4.004 1.552 3.558 . . . 1.0 . . . . . . . . . . . . B . 14 HIS CG . . . . . . . . . c19602_2mgt 1 . 11 . 5876 . 2 1 15 HIS H H 5.643 1.960 0.793 . . . 1.0 . . . . . . . . . . . . B . 14 HIS H . . . . . . . . . c19602_2mgt 1 . 11 . 5877 . 2 1 15 HIS HA H 4.932 3.902 2.898 . . . 1.0 . . . . . . . . . . . . B . 14 HIS HA . . . . . . . . . c19602_2mgt 1 . 11 . 5878 . 2 1 15 HIS HB2 H 6.001 1.067 2.991 . . . 1.0 . . . . . . . . . . . . B . 14 HIS HB2 . . . . . . . . . c19602_2mgt 1 . 11 . 5879 . 2 1 15 HIS HB3 H 5.834 2.079 4.422 . . . 1.0 . . . . . . . . . . . . B . 14 HIS HB3 . . . . . . . . . c19602_2mgt 1 . 11 . 5880 . 2 1 15 HIS HD1 H 3.350 2.574 5.307 . . . 1.0 . . . . . . . . . . . . B . 14 HIS HD1 . . . . . . . . . c19602_2mgt 1 . 11 . 5881 . 2 1 15 HIS HD2 H 3.702 0.372 1.781 . . . 1.0 . . . . . . . . . . . . B . 14 HIS HD2 . . . . . . . . . c19602_2mgt 1 . 11 . 5882 . 2 1 15 HIS HE1 H 1.010 1.707 4.775 . . . 1.0 . . . . . . . . . . . . B . 14 HIS HE1 . . . . . . . . . c19602_2mgt 1 . 11 . 5883 . 2 1 15 HIS N N 5.387 2.871 1.146 . . . 1.0 . . . . . . . . . . . . B . 14 HIS N . . . . . . . . . c19602_2mgt 1 . 11 . 5884 . 2 1 15 HIS ND1 N 3.126 1.986 4.519 . . . 1.0 . . . . . . . . . . . . B . 14 HIS ND1 . . . . . . . . . c19602_2mgt 1 . 11 . 5885 . 2 1 15 HIS NE2 N 1.957 0.808 3.076 . . . 1.0 . . . . . . . . . . . . B . 14 HIS NE2 . . . . . . . . . c19602_2mgt 1 . 11 . 5886 . 2 1 15 HIS O O 7.282 4.117 3.952 . . . 1.0 . . . . . . . . . . . . B . 14 HIS O . . . . . . . . . c19602_2mgt 1 . 11 . 5887 . 2 1 16 GLN C C 9.242 5.892 1.261 . . . 1.0 . . . . . . . . . . . . B . 15 GLN C . . . . . . . . . c19602_2mgt 1 . 11 . 5888 . 2 1 16 GLN CA C 9.215 4.546 1.980 . . . 1.0 . . . . . . . . . . . . B . 15 GLN CA . . . . . . . . . c19602_2mgt 1 . 11 . 5889 . 2 1 16 GLN CB C 10.408 3.663 1.608 . . . 1.0 . . . . . . . . . . . . B . 15 GLN CB . . . . . . . . . c19602_2mgt 1 . 11 . 5890 . 2 1 16 GLN CD C 11.780 2.390 -0.084 . . . 1.0 . . . . . . . . . . . . B . 15 GLN CD . . . . . . . . . c19602_2mgt 1 . 11 . 5891 . 2 1 16 GLN CG C 10.500 3.187 0.156 . . . 1.0 . . . . . . . . . . . . B . 15 GLN CG . . . . . . . . . c19602_2mgt 1 . 11 . 5892 . 2 1 16 GLN H H 7.726 3.509 0.897 . . . 1.0 . . . . . . . . . . . . B . 15 GLN H . . . . . . . . . c19602_2mgt 1 . 11 . 5893 . 2 1 16 GLN HA H 9.339 4.762 3.034 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HA . . . . . . . . . c19602_2mgt 1 . 11 . 5894 . 2 1 16 GLN HB2 H 11.317 4.210 1.848 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HB2 . . . . . . . . . c19602_2mgt 1 . 11 . 5895 . 2 1 16 GLN HB3 H 10.378 2.791 2.245 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HB3 . . . . . . . . . c19602_2mgt 1 . 11 . 5896 . 2 1 16 GLN HE21 H 11.902 3.014 -2.017 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HE21 . . . . . . . . . c19602_2mgt 1 . 11 . 5897 . 2 1 16 GLN HE22 H 13.179 1.944 -1.481 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HE22 . . . . . . . . . c19602_2mgt 1 . 11 . 5898 . 2 1 16 GLN HG2 H 9.655 2.541 -0.071 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HG2 . . . . . . . . . c19602_2mgt 1 . 11 . 5899 . 2 1 16 GLN HG3 H 10.480 4.051 -0.507 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HG3 . . . . . . . . . c19602_2mgt 1 . 11 . 5900 . 2 1 16 GLN N N 7.943 3.849 1.818 . . . 1.0 . . . . . . . . . . . . B . 15 GLN N . . . . . . . . . c19602_2mgt 1 . 11 . 5901 . 2 1 16 GLN NE2 N 12.314 2.433 -1.300 . . . 1.0 . . . . . . . . . . . . B . 15 GLN NE2 . . . . . . . . . c19602_2mgt 1 . 11 . 5902 . 2 1 16 GLN O O 8.482 6.122 0.328 . . . 1.0 . . . . . . . . . . . . B . 15 GLN O . . . . . . . . . c19602_2mgt 1 . 11 . 5903 . 2 1 16 GLN OE1 O 12.297 1.740 0.819 . . . 1.0 . . . . . . . . . . . . B . 15 GLN OE1 . . . . . . . . . c19602_2mgt 1 . 11 . 5904 . 2 1 17 LYS C C 9.297 9.116 1.891 . . . 1.0 . . . . . . . . . . . . B . 16 LYS C . . . . . . . . . c19602_2mgt 1 . 11 . 5905 . 2 1 17 LYS CA C 10.365 8.160 1.341 . . . 1.0 . . . . . . . . . . . . B . 16 LYS CA . . . . . . . . . c19602_2mgt 1 . 11 . 5906 . 2 1 17 LYS CB C 10.490 8.319 -0.184 . . . 1.0 . . . . . . . . . . . . B . 16 LYS CB . . . . . . . . . c19602_2mgt 1 . 11 . 5907 . 2 1 17 LYS CD C 12.861 9.163 -0.574 . . . 1.0 . . . . . . . . . . . . B . 16 LYS CD . . . . . . . . . c19602_2mgt 1 . 11 . 5908 . 2 1 17 LYS CE C 13.132 8.361 -1.846 . . . 1.0 . . . . . . . . . . . . B . 16 LYS CE . . . . . . . . . c19602_2mgt 1 . 11 . 5909 . 2 1 17 LYS CG C 11.376 9.529 -0.526 . . . 1.0 . . . . . . . . . . . . B . 16 LYS CG . . . . . . . . . c19602_2mgt 1 . 11 . 5910 . 2 1 17 LYS H H 10.701 6.447 2.509 . . . 1.0 . . . . . . . . . . . . B . 16 LYS H . . . . . . . . . c19602_2mgt 1 . 11 . 5911 . 2 1 17 LYS HA H 11.320 8.436 1.788 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HA . . . . . . . . . c19602_2mgt 1 . 11 . 5912 . 2 1 17 LYS HB2 H 10.917 7.414 -0.616 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HB2 . . . . . . . . . c19602_2mgt 1 . 11 . 5913 . 2 1 17 LYS HB3 H 9.501 8.466 -0.620 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HB3 . . . . . . . . . c19602_2mgt 1 . 11 . 5914 . 2 1 17 LYS HD2 H 13.459 10.074 -0.586 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HD2 . . . . . . . . . c19602_2mgt 1 . 11 . 5915 . 2 1 17 LYS HD3 H 13.124 8.568 0.301 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HD3 . . . . . . . . . c19602_2mgt 1 . 11 . 5916 . 2 1 17 LYS HE2 H 12.500 7.476 -1.861 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HE2 . . . . . . . . . c19602_2mgt 1 . 11 . 5917 . 2 1 17 LYS HE3 H 12.885 8.969 -2.713 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HE3 . . . . . . . . . c19602_2mgt 1 . 11 . 5918 . 2 1 17 LYS HG2 H 11.092 9.931 -1.496 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HG2 . . . . . . . . . c19602_2mgt 1 . 11 . 5919 . 2 1 17 LYS HG3 H 11.228 10.315 0.213 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HG3 . . . . . . . . . c19602_2mgt 1 . 11 . 5920 . 2 1 17 LYS HZ1 H 15.135 8.756 -1.927 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HZ1 . . . . . . . . . c19602_2mgt 1 . 11 . 5921 . 2 1 17 LYS HZ2 H 14.761 7.353 -1.154 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HZ2 . . . . . . . . . c19602_2mgt 1 . 11 . 5922 . 2 1 17 LYS HZ3 H 14.682 7.432 -2.798 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HZ3 . . . . . . . . . c19602_2mgt 1 . 11 . 5923 . 2 1 17 LYS N N 10.126 6.773 1.744 . . . 1.0 . . . . . . . . . . . . B . 16 LYS N . . . . . . . . . c19602_2mgt 1 . 11 . 5924 . 2 1 17 LYS NZ N 14.533 7.947 -1.941 . . . 1.0 . . . . . . . . . . . . B . 16 LYS NZ . . . . . . . . . c19602_2mgt 1 . 11 . 5925 . 2 1 17 LYS O O 9.628 10.136 2.484 . . . 1.0 . . . . . . . . . . . . B . 16 LYS O . . . . . . . . . c19602_2mgt 1 . 11 . 5926 . 2 1 18 NH2 HN1 H 7.755 7.990 1.193 . . . 1.0 . . . . . . . . . . . . B . 17 NH2 HN1 . . . . . . . . . c19602_2mgt 1 . 11 . 5927 . 2 1 18 NH2 HN2 H 7.302 9.439 2.068 . . . 1.0 . . . . . . . . . . . . B . 17 NH2 HN2 . . . . . . . . . c19602_2mgt 1 . 11 . 5928 . 2 1 18 NH2 N N 8.012 8.819 1.709 . . . 1.0 . . . . . . . . . . . . B . 17 NH2 N . . . . . . . . . c19602_2mgt 1 . 11 . 5929 . 3 2 1 ZN ZN Zn 0.583 -0.246 1.945 . . . 1.0 . . . . . . . . . . . . A . 101 ZN ZN . . . . . . . . . c19602_2mgt 1 . 12 . 5930 . 1 1 1 ACE C C -11.609 -4.804 -2.168 . . . 1.0 . . . . . . . . . . . . A . 0 ACE C . . . . . . . . . c19602_2mgt 1 . 12 . 5931 . 1 1 1 ACE CH3 C -10.179 -5.052 -1.733 . . . 1.0 . . . . . . . . . . . . A . 0 ACE CH3 . . . . . . . . . c19602_2mgt 1 . 12 . 5932 . 1 1 1 ACE H1 H -9.913 -6.066 -2.024 . . . 1.0 . . . . . . . . . . . . A . 0 ACE H1 . . . . . . . . . c19602_2mgt 1 . 12 . 5933 . 1 1 1 ACE H2 H -9.509 -4.342 -2.217 . . . 1.0 . . . . . . . . . . . . A . 0 ACE H2 . . . . . . . . . c19602_2mgt 1 . 12 . 5934 . 1 1 1 ACE H3 H -10.095 -4.956 -0.651 . . . 1.0 . . . . . . . . . . . . A . 0 ACE H3 . . . . . . . . . c19602_2mgt 1 . 12 . 5935 . 1 1 1 ACE O O -11.837 -4.227 -3.224 . . . 1.0 . . . . . . . . . . . . A . 0 ACE O . . . . . . . . . c19602_2mgt 1 . 12 . 5936 . 1 1 2 ASP C C -14.612 -3.938 -1.807 . . . 1.0 . . . . . . . . . . . . A . 1 ASP C . . . . . . . . . c19602_2mgt 1 . 12 . 5937 . 1 1 2 ASP CA C -13.985 -5.328 -1.634 . . . 1.0 . . . . . . . . . . . . A . 1 ASP CA . . . . . . . . . c19602_2mgt 1 . 12 . 5938 . 1 1 2 ASP CB C -14.633 -6.115 -0.485 . . . 1.0 . . . . . . . . . . . . A . 1 ASP CB . . . . . . . . . c19602_2mgt 1 . 12 . 5939 . 1 1 2 ASP CG C -15.888 -6.892 -0.860 . . . 1.0 . . . . . . . . . . . . A . 1 ASP CG . . . . . . . . . c19602_2mgt 1 . 12 . 5940 . 1 1 2 ASP H H -12.256 -5.715 -0.494 . . . 1.0 . . . . . . . . . . . . A . 1 ASP H . . . . . . . . . c19602_2mgt 1 . 12 . 5941 . 1 1 2 ASP HA H -14.124 -5.888 -2.556 . . . 1.0 . . . . . . . . . . . . A . 1 ASP HA . . . . . . . . . c19602_2mgt 1 . 12 . 5942 . 1 1 2 ASP HB2 H -13.913 -6.858 -0.150 . . . 1.0 . . . . . . . . . . . . A . 1 ASP HB2 . . . . . . . . . c19602_2mgt 1 . 12 . 5943 . 1 1 2 ASP HB3 H -14.842 -5.450 0.352 . . . 1.0 . . . . . . . . . . . . A . 1 ASP HB3 . . . . . . . . . c19602_2mgt 1 . 12 . 5944 . 1 1 2 ASP N N -12.555 -5.272 -1.352 . . . 1.0 . . . . . . . . . . . . A . 1 ASP N . . . . . . . . . c19602_2mgt 1 . 12 . 5945 . 1 1 2 ASP O O -14.039 -2.946 -1.370 . . . 1.0 . . . . . . . . . . . . A . 1 ASP O . . . . . . . . . c19602_2mgt 1 . 12 . 5946 . 1 1 2 ASP OD1 O -16.716 -6.384 -1.633 . . . 1.0 . . . . . . . . . . . . A . 1 ASP OD1 . . . . . . . . . c19602_2mgt 1 . 12 . 5947 . 1 1 2 ASP OD2 O -16.014 -8.022 -0.350 . . . 1.0 . . . . . . . . . . . . A . 1 ASP OD2 . . . . . . . . . c19602_2mgt 1 . 12 . 5948 . 1 1 3 ALA C C -16.732 -1.789 -1.469 . . . 1.0 . . . . . . . . . . . . A . 2 ALA C . . . . . . . . . c19602_2mgt 1 . 12 . 5949 . 1 1 3 ALA CA C -16.598 -2.698 -2.695 . . . 1.0 . . . . . . . . . . . . A . 2 ALA CA . . . . . . . . . c19602_2mgt 1 . 12 . 5950 . 1 1 3 ALA CB C -17.978 -3.147 -3.191 . . . 1.0 . . . . . . . . . . . . A . 2 ALA CB . . . . . . . . . c19602_2mgt 1 . 12 . 5951 . 1 1 3 ALA H H -16.196 -4.763 -2.743 . . . 1.0 . . . . . . . . . . . . A . 2 ALA H . . . . . . . . . c19602_2mgt 1 . 12 . 5952 . 1 1 3 ALA HA H -16.117 -2.132 -3.490 . . . 1.0 . . . . . . . . . . . . A . 2 ALA HA . . . . . . . . . c19602_2mgt 1 . 12 . 5953 . 1 1 3 ALA HB1 H -18.463 -3.779 -2.447 . . . 1.0 . . . . . . . . . . . . A . 2 ALA HB1 . . . . . . . . . c19602_2mgt 1 . 12 . 5954 . 1 1 3 ALA HB2 H -18.606 -2.276 -3.371 . . . 1.0 . . . . . . . . . . . . A . 2 ALA HB2 . . . . . . . . . c19602_2mgt 1 . 12 . 5955 . 1 1 3 ALA HB3 H -17.873 -3.705 -4.120 . . . 1.0 . . . . . . . . . . . . A . 2 ALA HB3 . . . . . . . . . c19602_2mgt 1 . 12 . 5956 . 1 1 3 ALA N N -15.799 -3.889 -2.430 . . . 1.0 . . . . . . . . . . . . A . 2 ALA N . . . . . . . . . c19602_2mgt 1 . 12 . 5957 . 1 1 3 ALA O O -16.437 -0.604 -1.575 . . . 1.0 . . . . . . . . . . . . A . 2 ALA O . . . . . . . . . c19602_2mgt 1 . 12 . 5958 . 1 1 4 GLU C C -16.011 -0.990 1.521 . . . 1.0 . . . . . . . . . . . . A . 3 GLU C . . . . . . . . . c19602_2mgt 1 . 12 . 5959 . 1 1 4 GLU CA C -17.289 -1.624 0.956 . . . 1.0 . . . . . . . . . . . . A . 3 GLU CA . . . . . . . . . c19602_2mgt 1 . 12 . 5960 . 1 1 4 GLU CB C -17.839 -2.602 1.997 . . . 1.0 . . . . . . . . . . . . A . 3 GLU CB . . . . . . . . . c19602_2mgt 1 . 12 . 5961 . 1 1 4 GLU CD C -17.369 -4.698 3.274 . . . 1.0 . . . . . . . . . . . . A . 3 GLU CD . . . . . . . . . c19602_2mgt 1 . 12 . 5962 . 1 1 4 GLU CG C -16.803 -3.689 2.309 . . . 1.0 . . . . . . . . . . . . A . 3 GLU CG . . . . . . . . . c19602_2mgt 1 . 12 . 5963 . 1 1 4 GLU H H -17.317 -3.331 -0.304 . . . 1.0 . . . . . . . . . . . . A . 3 GLU H . . . . . . . . . c19602_2mgt 1 . 12 . 5964 . 1 1 4 GLU HA H -18.021 -0.833 0.805 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HA . . . . . . . . . c19602_2mgt 1 . 12 . 5965 . 1 1 4 GLU HB2 H -18.080 -2.057 2.910 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HB2 . . . . . . . . . c19602_2mgt 1 . 12 . 5966 . 1 1 4 GLU HB3 H -18.751 -3.062 1.622 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HB3 . . . . . . . . . c19602_2mgt 1 . 12 . 5967 . 1 1 4 GLU HG2 H -16.488 -4.180 1.393 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HG2 . . . . . . . . . c19602_2mgt 1 . 12 . 5968 . 1 1 4 GLU HG3 H -15.932 -3.244 2.785 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HG3 . . . . . . . . . c19602_2mgt 1 . 12 . 5969 . 1 1 4 GLU N N -17.114 -2.342 -0.312 . . . 1.0 . . . . . . . . . . . . A . 3 GLU N . . . . . . . . . c19602_2mgt 1 . 12 . 5970 . 1 1 4 GLU O O -16.098 -0.226 2.480 . . . 1.0 . . . . . . . . . . . . A . 3 GLU O . . . . . . . . . c19602_2mgt 1 . 12 . 5971 . 1 1 4 GLU OE1 O -17.563 -4.363 4.428 . . . 1.0 . . . . . . . . . . . . A . 3 GLU OE1 . . . . . . . . . c19602_2mgt 1 . 12 . 5972 . 1 1 4 GLU OE2 O -17.606 -5.850 2.790 . . . 1.0 . . . . . . . . . . . . A . 3 GLU OE2 . . . . . . . . . c19602_2mgt 1 . 12 . 5973 . 1 1 5 PHE C C -13.009 0.089 0.131 . . . 1.0 . . . . . . . . . . . . A . 4 PHE C . . . . . . . . . c19602_2mgt 1 . 12 . 5974 . 1 1 5 PHE CA C -13.549 -0.738 1.289 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CA . . . . . . . . . c19602_2mgt 1 . 12 . 5975 . 1 1 5 PHE CB C -12.555 -1.840 1.644 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CB . . . . . . . . . c19602_2mgt 1 . 12 . 5976 . 1 1 5 PHE CD1 C -13.584 -2.293 3.915 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CD1 . . . . . . . . . c19602_2mgt 1 . 12 . 5977 . 1 1 5 PHE CD2 C -13.037 -4.168 2.472 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CD2 . . . . . . . . . c19602_2mgt 1 . 12 . 5978 . 1 1 5 PHE CE1 C -14.044 -3.178 4.901 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CE1 . . . . . . . . . c19602_2mgt 1 . 12 . 5979 . 1 1 5 PHE CE2 C -13.496 -5.055 3.456 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CE2 . . . . . . . . . c19602_2mgt 1 . 12 . 5980 . 1 1 5 PHE CG C -13.063 -2.786 2.706 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CG . . . . . . . . . c19602_2mgt 1 . 12 . 5981 . 1 1 5 PHE CZ C -13.993 -4.561 4.674 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CZ . . . . . . . . . c19602_2mgt 1 . 12 . 5982 . 1 1 5 PHE H H -14.846 -2.065 0.275 . . . 1.0 . . . . . . . . . . . . A . 4 PHE H . . . . . . . . . c19602_2mgt 1 . 12 . 5983 . 1 1 5 PHE HA H -13.658 -0.072 2.142 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HA . . . . . . . . . c19602_2mgt 1 . 12 . 5984 . 1 1 5 PHE HB2 H -12.318 -2.403 0.740 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HB2 . . . . . . . . . c19602_2mgt 1 . 12 . 5985 . 1 1 5 PHE HB3 H -11.632 -1.382 1.999 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HB3 . . . . . . . . . c19602_2mgt 1 . 12 . 5986 . 1 1 5 PHE HD1 H -13.659 -1.232 4.076 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HD1 . . . . . . . . . c19602_2mgt 1 . 12 . 5987 . 1 1 5 PHE HD2 H -12.670 -4.536 1.529 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HD2 . . . . . . . . . c19602_2mgt 1 . 12 . 5988 . 1 1 5 PHE HE1 H -14.451 -2.794 5.821 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HE1 . . . . . . . . . c19602_2mgt 1 . 12 . 5989 . 1 1 5 PHE HE2 H -13.471 -6.116 3.273 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HE2 . . . . . . . . . c19602_2mgt 1 . 12 . 5990 . 1 1 5 PHE HZ H -14.345 -5.242 5.432 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HZ . . . . . . . . . c19602_2mgt 1 . 12 . 5991 . 1 1 5 PHE N N -14.841 -1.336 0.973 . . . 1.0 . . . . . . . . . . . . A . 4 PHE N . . . . . . . . . c19602_2mgt 1 . 12 . 5992 . 1 1 5 PHE O O -12.169 0.953 0.357 . . . 1.0 . . . . . . . . . . . . A . 4 PHE O . . . . . . . . . c19602_2mgt 1 . 12 . 5993 . 1 1 6 ARG C C -14.236 2.053 -2.026 . . . 1.0 . . . . . . . . . . . . A . 5 ARG C . . . . . . . . . c19602_2mgt 1 . 12 . 5994 . 1 1 6 ARG CA C -13.345 0.816 -2.194 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CA . . . . . . . . . c19602_2mgt 1 . 12 . 5995 . 1 1 6 ARG CB C -13.569 0.074 -3.519 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CB . . . . . . . . . c19602_2mgt 1 . 12 . 5996 . 1 1 6 ARG CD C -11.090 -0.734 -3.465 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CD . . . . . . . . . c19602_2mgt 1 . 12 . 5997 . 1 1 6 ARG CG C -12.544 -1.021 -3.869 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CG . . . . . . . . . c19602_2mgt 1 . 12 . 5998 . 1 1 6 ARG CZ C -9.484 1.168 -3.570 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CZ . . . . . . . . . c19602_2mgt 1 . 12 . 5999 . 1 1 6 ARG H H -14.200 -0.844 -1.220 . . . 1.0 . . . . . . . . . . . . A . 5 ARG H . . . . . . . . . c19602_2mgt 1 . 12 . 6000 . 1 1 6 ARG HA H -12.325 1.188 -2.155 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HA . . . . . . . . . c19602_2mgt 1 . 12 . 6001 . 1 1 6 ARG HB2 H -14.556 -0.380 -3.486 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HB2 . . . . . . . . . c19602_2mgt 1 . 12 . 6002 . 1 1 6 ARG HB3 H -13.563 0.803 -4.325 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HB3 . . . . . . . . . c19602_2mgt 1 . 12 . 6003 . 1 1 6 ARG HD2 H -11.007 -0.824 -2.383 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HD2 . . . . . . . . . c19602_2mgt 1 . 12 . 6004 . 1 1 6 ARG HD3 H -10.430 -1.472 -3.912 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HD3 . . . . . . . . . c19602_2mgt 1 . 12 . 6005 . 1 1 6 ARG HE H -11.386 1.216 -4.225 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HE . . . . . . . . . c19602_2mgt 1 . 12 . 6006 . 1 1 6 ARG HG2 H -12.853 -1.939 -3.382 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HG2 . . . . . . . . . c19602_2mgt 1 . 12 . 6007 . 1 1 6 ARG HG3 H -12.586 -1.195 -4.944 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HG3 . . . . . . . . . c19602_2mgt 1 . 12 . 6008 . 1 1 6 ARG HH11 H -8.537 -0.570 -3.097 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH11 . . . . . . . . . c19602_2mgt 1 . 12 . 6009 . 1 1 6 ARG HH12 H -7.583 0.882 -2.914 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH12 . . . . . . . . . c19602_2mgt 1 . 12 . 6010 . 1 1 6 ARG HH21 H -10.138 3.060 -3.917 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH21 . . . . . . . . . c19602_2mgt 1 . 12 . 6011 . 1 1 6 ARG HH22 H -8.476 2.930 -3.389 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH22 . . . . . . . . . c19602_2mgt 1 . 12 . 6012 . 1 1 6 ARG N N -13.531 -0.099 -1.084 . . . 1.0 . . . . . . . . . . . . A . 5 ARG N . . . . . . . . . c19602_2mgt 1 . 12 . 6013 . 1 1 6 ARG NE N -10.662 0.610 -3.865 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NE . . . . . . . . . c19602_2mgt 1 . 12 . 6014 . 1 1 6 ARG NH1 N -8.447 0.431 -3.179 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NH1 . . . . . . . . . c19602_2mgt 1 . 12 . 6015 . 1 1 6 ARG NH2 N -9.347 2.490 -3.650 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NH2 . . . . . . . . . c19602_2mgt 1 . 12 . 6016 . 1 1 6 ARG O O -14.907 2.486 -2.957 . . . 1.0 . . . . . . . . . . . . A . 5 ARG O . . . . . . . . . c19602_2mgt 1 . 12 . 6017 . 1 1 7 ARG C C -13.806 4.992 -0.699 . . . 1.0 . . . . . . . . . . . . A . 6 ARG C . . . . . . . . . c19602_2mgt 1 . 12 . 6018 . 1 1 7 ARG CA C -14.813 3.880 -0.435 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CA . . . . . . . . . c19602_2mgt 1 . 12 . 6019 . 1 1 7 ARG CB C -15.135 3.873 1.066 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CB . . . . . . . . . c19602_2mgt 1 . 12 . 6020 . 1 1 7 ARG CD C -17.380 2.605 0.929 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CD . . . . . . . . . c19602_2mgt 1 . 12 . 6021 . 1 1 7 ARG CG C -15.973 2.680 1.525 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CG . . . . . . . . . c19602_2mgt 1 . 12 . 6022 . 1 1 7 ARG CZ C -18.213 2.190 -1.397 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CZ . . . . . . . . . c19602_2mgt 1 . 12 . 6023 . 1 1 7 ARG H H -13.669 2.170 -0.102 . . . 1.0 . . . . . . . . . . . . A . 6 ARG H . . . . . . . . . c19602_2mgt 1 . 12 . 6024 . 1 1 7 ARG HA H -15.725 4.041 -1.001 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HA . . . . . . . . . c19602_2mgt 1 . 12 . 6025 . 1 1 7 ARG HB2 H -14.195 3.848 1.621 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HB2 . . . . . . . . . c19602_2mgt 1 . 12 . 6026 . 1 1 7 ARG HB3 H -15.652 4.794 1.333 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HB3 . . . . . . . . . c19602_2mgt 1 . 12 . 6027 . 1 1 7 ARG HD2 H -18.010 2.039 1.613 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HD2 . . . . . . . . . c19602_2mgt 1 . 12 . 6028 . 1 1 7 ARG HD3 H -17.778 3.616 0.842 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HD3 . . . . . . . . . c19602_2mgt 1 . 12 . 6029 . 1 1 7 ARG HE H -16.750 1.146 -0.477 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HE . . . . . . . . . c19602_2mgt 1 . 12 . 6030 . 1 1 7 ARG HG2 H -15.425 1.773 1.292 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HG2 . . . . . . . . . c19602_2mgt 1 . 12 . 6031 . 1 1 7 ARG HG3 H -16.079 2.742 2.602 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HG3 . . . . . . . . . c19602_2mgt 1 . 12 . 6032 . 1 1 7 ARG HH11 H -19.244 3.675 -0.472 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH11 . . . . . . . . . c19602_2mgt 1 . 12 . 6033 . 1 1 7 ARG HH12 H -19.751 3.315 -2.106 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH12 . . . . . . . . . c19602_2mgt 1 . 12 . 6034 . 1 1 7 ARG HH21 H -17.457 0.732 -2.593 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH21 . . . . . . . . . c19602_2mgt 1 . 12 . 6035 . 1 1 7 ARG HH22 H -18.760 1.666 -3.286 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH22 . . . . . . . . . c19602_2mgt 1 . 12 . 6036 . 1 1 7 ARG N N -14.226 2.615 -0.816 . . . 1.0 . . . . . . . . . . . . A . 6 ARG N . . . . . . . . . c19602_2mgt 1 . 12 . 6037 . 1 1 7 ARG NE N -17.393 1.920 -0.371 . . . 1.0 . . . . . . . . . . . . A . 6 ARG NE . . . . . . . . . c19602_2mgt 1 . 12 . 6038 . 1 1 7 ARG NH1 N -19.132 3.150 -1.327 . . . 1.0 . . . . . . . . . . . . A . 6 ARG NH1 . . . . . . . . . c19602_2mgt 1 . 12 . 6039 . 1 1 7 ARG NH2 N -18.128 1.482 -2.521 . . . 1.0 . . . . . . . . . . . . A . 6 ARG NH2 . . . . . . . . . c19602_2mgt 1 . 12 . 6040 . 1 1 7 ARG O O -12.598 4.763 -0.697 . . . 1.0 . . . . . . . . . . . . A . 6 ARG O . . . . . . . . . c19602_2mgt 1 . 12 . 6041 . 1 1 8 ASP C C -12.977 7.727 0.653 . . . 1.0 . . . . . . . . . . . . A . 7 ASP C . . . . . . . . . c19602_2mgt 1 . 12 . 6042 . 1 1 8 ASP CA C -13.527 7.434 -0.756 . . . 1.0 . . . . . . . . . . . . A . 7 ASP CA . . . . . . . . . c19602_2mgt 1 . 12 . 6043 . 1 1 8 ASP CB C -14.451 8.569 -1.199 . . . 1.0 . . . . . . . . . . . . A . 7 ASP CB . . . . . . . . . c19602_2mgt 1 . 12 . 6044 . 1 1 8 ASP CG C -13.682 9.870 -1.278 . . . 1.0 . . . . . . . . . . . . A . 7 ASP CG . . . . . . . . . c19602_2mgt 1 . 12 . 6045 . 1 1 8 ASP H H -15.320 6.324 -0.790 . . . 1.0 . . . . . . . . . . . . A . 7 ASP H . . . . . . . . . c19602_2mgt 1 . 12 . 6046 . 1 1 8 ASP HA H -12.696 7.353 -1.457 . . . 1.0 . . . . . . . . . . . . A . 7 ASP HA . . . . . . . . . c19602_2mgt 1 . 12 . 6047 . 1 1 8 ASP HB2 H -14.874 8.335 -2.173 . . . 1.0 . . . . . . . . . . . . A . 7 ASP HB2 . . . . . . . . . c19602_2mgt 1 . 12 . 6048 . 1 1 8 ASP HB3 H -15.266 8.682 -0.482 . . . 1.0 . . . . . . . . . . . . A . 7 ASP HB3 . . . . . . . . . c19602_2mgt 1 . 12 . 6049 . 1 1 8 ASP N N -14.316 6.216 -0.809 . . . 1.0 . . . . . . . . . . . . A . 7 ASP N . . . . . . . . . c19602_2mgt 1 . 12 . 6050 . 1 1 8 ASP O O -12.051 8.524 0.802 . . . 1.0 . . . . . . . . . . . . A . 7 ASP O . . . . . . . . . c19602_2mgt 1 . 12 . 6051 . 1 1 8 ASP OD1 O -12.815 9.962 -2.174 . . . 1.0 . . . . . . . . . . . . A . 7 ASP OD1 . . . . . . . . . c19602_2mgt 1 . 12 . 6052 . 1 1 8 ASP OD2 O -13.912 10.732 -0.421 . . . 1.0 . . . . . . . . . . . . A . 7 ASP OD2 . . . . . . . . . c19602_2mgt 1 . 12 . 6053 . 1 1 9 SER C C -12.114 6.968 3.746 . . . 1.0 . . . . . . . . . . . . A . 8 SER C . . . . . . . . . c19602_2mgt 1 . 12 . 6054 . 1 1 9 SER CA C -13.408 7.474 3.085 . . . 1.0 . . . . . . . . . . . . A . 8 SER CA . . . . . . . . . c19602_2mgt 1 . 12 . 6055 . 1 1 9 SER CB C -14.647 6.989 3.859 . . . 1.0 . . . . . . . . . . . . A . 8 SER CB . . . . . . . . . c19602_2mgt 1 . 12 . 6056 . 1 1 9 SER H H -14.332 6.487 1.484 . . . 1.0 . . . . . . . . . . . . A . 8 SER H . . . . . . . . . c19602_2mgt 1 . 12 . 6057 . 1 1 9 SER HA H -13.385 8.560 3.130 . . . 1.0 . . . . . . . . . . . . A . 8 SER HA . . . . . . . . . c19602_2mgt 1 . 12 . 6058 . 1 1 9 SER HB2 H -14.677 5.899 3.850 . . . 1.0 . . . . . . . . . . . . A . 8 SER HB2 . . . . . . . . . c19602_2mgt 1 . 12 . 6059 . 1 1 9 SER HB3 H -14.591 7.334 4.891 . . . 1.0 . . . . . . . . . . . . A . 8 SER HB3 . . . . . . . . . c19602_2mgt 1 . 12 . 6060 . 1 1 9 SER HG H -15.827 8.448 3.355 . . . 1.0 . . . . . . . . . . . . A . 8 SER HG . . . . . . . . . c19602_2mgt 1 . 12 . 6061 . 1 1 9 SER N N -13.565 7.108 1.685 . . . 1.0 . . . . . . . . . . . . A . 8 SER N . . . . . . . . . c19602_2mgt 1 . 12 . 6062 . 1 1 9 SER O O -12.099 6.844 4.966 . . . 1.0 . . . . . . . . . . . . A . 8 SER O . . . . . . . . . c19602_2mgt 1 . 12 . 6063 . 1 1 9 SER OG O -15.838 7.490 3.288 . . . 1.0 . . . . . . . . . . . . A . 8 SER OG . . . . . . . . . c19602_2mgt 1 . 12 . 6064 . 1 1 10 GLY C C -8.655 6.919 2.725 . . . 1.0 . . . . . . . . . . . . A . 9 GLY C . . . . . . . . . c19602_2mgt 1 . 12 . 6065 . 1 1 10 GLY CA C -9.756 6.272 3.560 . . . 1.0 . . . . . . . . . . . . A . 9 GLY CA . . . . . . . . . c19602_2mgt 1 . 12 . 6066 . 1 1 10 GLY H H -11.047 6.822 2.002 . . . 1.0 . . . . . . . . . . . . A . 9 GLY H . . . . . . . . . c19602_2mgt 1 . 12 . 6067 . 1 1 10 GLY HA2 H -9.659 6.592 4.597 . . . 1.0 . . . . . . . . . . . . A . 9 GLY HA2 . . . . . . . . . c19602_2mgt 1 . 12 . 6068 . 1 1 10 GLY HA3 H -9.688 5.191 3.541 . . . 1.0 . . . . . . . . . . . . A . 9 GLY HA3 . . . . . . . . . c19602_2mgt 1 . 12 . 6069 . 1 1 10 GLY N N -11.041 6.665 3.001 . . . 1.0 . . . . . . . . . . . . A . 9 GLY N . . . . . . . . . c19602_2mgt 1 . 12 . 6070 . 1 1 10 GLY O O -8.674 8.133 2.575 . . . 1.0 . . . . . . . . . . . . A . 9 GLY O . . . . . . . . . c19602_2mgt 1 . 12 . 6071 . 1 1 11 TYR C C -6.136 4.360 1.683 . . . 1.0 . . . . . . . . . . . . A . 10 TYR C . . . . . . . . . c19602_2mgt 1 . 12 . 6072 . 1 1 11 TYR CA C -7.493 4.757 2.242 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CA . . . . . . . . . c19602_2mgt 1 . 12 . 6073 . 1 1 11 TYR CB C -8.557 4.026 1.411 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CB . . . . . . . . . c19602_2mgt 1 . 12 . 6074 . 1 1 11 TYR CD1 C -8.777 2.088 3.010 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CD1 . . . . . . . . . c19602_2mgt 1 . 12 . 6075 . 1 1 11 TYR CD2 C -10.792 3.146 2.137 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CD2 . . . . . . . . . c19602_2mgt 1 . 12 . 6076 . 1 1 11 TYR CE1 C -9.552 1.174 3.731 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CE1 . . . . . . . . . c19602_2mgt 1 . 12 . 6077 . 1 1 11 TYR CE2 C -11.576 2.239 2.859 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CE2 . . . . . . . . . c19602_2mgt 1 . 12 . 6078 . 1 1 11 TYR CG C -9.393 3.060 2.204 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CG . . . . . . . . . c19602_2mgt 1 . 12 . 6079 . 1 1 11 TYR CZ C -10.958 1.231 3.628 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CZ . . . . . . . . . c19602_2mgt 1 . 12 . 6080 . 1 1 11 TYR H H -7.113 6.637 1.480 . . . 1.0 . . . . . . . . . . . . A . 10 TYR H . . . . . . . . . c19602_2mgt 1 . 12 . 6081 . 1 1 11 TYR HA H -7.546 4.456 3.288 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HA . . . . . . . . . c19602_2mgt 1 . 12 . 6082 . 1 1 11 TYR HB2 H -9.212 4.740 0.915 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HB2 . . . . . . . . . c19602_2mgt 1 . 12 . 6083 . 1 1 11 TYR HB3 H -8.073 3.466 0.615 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HB3 . . . . . . . . . c19602_2mgt 1 . 12 . 6084 . 1 1 11 TYR HD1 H -7.706 2.029 3.076 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HD1 . . . . . . . . . c19602_2mgt 1 . 12 . 6085 . 1 1 11 TYR HD2 H -11.260 3.904 1.527 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HD2 . . . . . . . . . c19602_2mgt 1 . 12 . 6086 . 1 1 11 TYR HE1 H -9.065 0.438 4.349 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HE1 . . . . . . . . . c19602_2mgt 1 . 12 . 6087 . 1 1 11 TYR HE2 H -12.650 2.298 2.800 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HE2 . . . . . . . . . c19602_2mgt 1 . 12 . 6088 . 1 1 11 TYR HH H -11.200 -0.310 4.781 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HH . . . . . . . . . c19602_2mgt 1 . 12 . 6089 . 1 1 11 TYR N N -7.690 6.185 2.163 . . . 1.0 . . . . . . . . . . . . A . 10 TYR N . . . . . . . . . c19602_2mgt 1 . 12 . 6090 . 1 1 11 TYR O O -5.664 4.917 0.692 . . . 1.0 . . . . . . . . . . . . A . 10 TYR O . . . . . . . . . c19602_2mgt 1 . 12 . 6091 . 1 1 11 TYR OH O -11.724 0.319 4.276 . . . 1.0 . . . . . . . . . . . . A . 10 TYR OH . . . . . . . . . c19602_2mgt 1 . 12 . 6092 . 1 1 12 GLU C C -5.549 0.901 1.800 . . . 1.0 . . . . . . . . . . . . A . 11 GLU C . . . . . . . . . c19602_2mgt 1 . 12 . 6093 . 1 1 12 GLU CA C -4.948 2.264 1.422 . . . 1.0 . . . . . . . . . . . . A . 11 GLU CA . . . . . . . . . c19602_2mgt 1 . 12 . 6094 . 1 1 12 GLU CB C -3.445 2.362 1.659 . . . 1.0 . . . . . . . . . . . . A . 11 GLU CB . . . . . . . . . c19602_2mgt 1 . 12 . 6095 . 1 1 12 GLU CD C -1.274 1.305 0.914 . . . 1.0 . . . . . . . . . . . . A . 11 GLU CD . . . . . . . . . c19602_2mgt 1 . 12 . 6096 . 1 1 12 GLU CG C -2.688 1.695 0.509 . . . 1.0 . . . . . . . . . . . . A . 11 GLU CG . . . . . . . . . c19602_2mgt 1 . 12 . 6097 . 1 1 12 GLU H H -6.009 2.915 3.088 . . . 1.0 . . . . . . . . . . . . A . 11 GLU H . . . . . . . . . c19602_2mgt 1 . 12 . 6098 . 1 1 12 GLU HA H -5.140 2.475 0.373 . . . 1.0 . . . . . . . . . . . . A . 11 GLU HA . . . . . . . . . c19602_2mgt 1 . 12 . 6099 . 1 1 12 GLU HB2 H -3.147 3.410 1.710 . . . 1.0 . . . . . . . . . . . . A . 11 GLU HB2 . . . . . . . . . c19602_2mgt 1 . 12 . 6100 . 1 1 12 GLU HB3 H -3.212 1.892 2.610 . . . 1.0 . . . . . . . . . . . . A . 11 GLU HB3 . . . . . . . . . c19602_2mgt 1 . 12 . 6101 . 1 1 12 GLU HG2 H -3.224 0.795 0.202 . . . 1.0 . . . . . . . . . . . . A . 11 GLU HG2 . . . . . . . . . c19602_2mgt 1 . 12 . 6102 . 1 1 12 GLU HG3 H -2.650 2.376 -0.341 . . . 1.0 . . . . . . . . . . . . A . 11 GLU HG3 . . . . . . . . . c19602_2mgt 1 . 12 . 6103 . 1 1 12 GLU N N -5.622 3.255 2.222 . . . 1.0 . . . . . . . . . . . . A . 11 GLU N . . . . . . . . . c19602_2mgt 1 . 12 . 6104 . 1 1 12 GLU O O -5.224 0.331 2.842 . . . 1.0 . . . . . . . . . . . . A . 11 GLU O . . . . . . . . . c19602_2mgt 1 . 12 . 6105 . 1 1 12 GLU OE1 O -0.593 2.151 1.548 . . . 1.0 . . . . . . . . . . . . A . 11 GLU OE1 . . . . . . . . . c19602_2mgt 1 . 12 . 6106 . 1 1 12 GLU OE2 O -0.878 0.176 0.637 . . . 1.0 . . . . . . . . . . . . A . 11 GLU OE2 . . . . . . . . . c19602_2mgt 1 . 12 . 6107 . 1 1 13 VAL C C -6.305 -2.072 1.088 . . . 1.0 . . . . . . . . . . . . A . 12 VAL C . . . . . . . . . c19602_2mgt 1 . 12 . 6108 . 1 1 13 VAL CA C -7.218 -0.842 1.115 . . . 1.0 . . . . . . . . . . . . A . 12 VAL CA . . . . . . . . . c19602_2mgt 1 . 12 . 6109 . 1 1 13 VAL CB C -8.285 -0.941 0.006 . . . 1.0 . . . . . . . . . . . . A . 12 VAL CB . . . . . . . . . c19602_2mgt 1 . 12 . 6110 . 1 1 13 VAL CG1 C -9.069 -2.263 -0.003 . . . 1.0 . . . . . . . . . . . . A . 12 VAL CG1 . . . . . . . . . c19602_2mgt 1 . 12 . 6111 . 1 1 13 VAL CG2 C -9.303 0.187 0.151 . . . 1.0 . . . . . . . . . . . . A . 12 VAL CG2 . . . . . . . . . c19602_2mgt 1 . 12 . 6112 . 1 1 13 VAL H H -6.685 0.945 0.130 . . . 1.0 . . . . . . . . . . . . A . 12 VAL H . . . . . . . . . c19602_2mgt 1 . 12 . 6113 . 1 1 13 VAL HA H -7.729 -0.796 2.069 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HA . . . . . . . . . c19602_2mgt 1 . 12 . 6114 . 1 1 13 VAL HB H -7.787 -0.832 -0.952 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HB . . . . . . . . . c19602_2mgt 1 . 12 . 6115 . 1 1 13 VAL HG11 H -9.885 -2.211 -0.724 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HG11 . . . . . . . . . c19602_2mgt 1 . 12 . 6116 . 1 1 13 VAL HG12 H -8.416 -3.083 -0.301 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HG12 . . . . . . . . . c19602_2mgt 1 . 12 . 6117 . 1 1 13 VAL HG13 H -9.479 -2.465 0.986 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HG13 . . . . . . . . . c19602_2mgt 1 . 12 . 6118 . 1 1 13 VAL HG21 H -10.013 0.129 -0.669 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HG21 . . . . . . . . . c19602_2mgt 1 . 12 . 6119 . 1 1 13 VAL HG22 H -9.818 0.082 1.103 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HG22 . . . . . . . . . c19602_2mgt 1 . 12 . 6120 . 1 1 13 VAL HG23 H -8.813 1.155 0.105 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HG23 . . . . . . . . . c19602_2mgt 1 . 12 . 6121 . 1 1 13 VAL N N -6.460 0.404 0.951 . . . 1.0 . . . . . . . . . . . . A . 12 VAL N . . . . . . . . . c19602_2mgt 1 . 12 . 6122 . 1 1 13 VAL O O -6.683 -3.145 1.549 . . . 1.0 . . . . . . . . . . . . A . 12 VAL O . . . . . . . . . c19602_2mgt 1 . 12 . 6123 . 1 1 14 HIS C C -3.714 -3.300 2.087 . . . 1.0 . . . . . . . . . . . . A . 13 HIS C . . . . . . . . . c19602_2mgt 1 . 12 . 6124 . 1 1 14 HIS CA C -4.073 -2.945 0.632 . . . 1.0 . . . . . . . . . . . . A . 13 HIS CA . . . . . . . . . c19602_2mgt 1 . 12 . 6125 . 1 1 14 HIS CB C -2.892 -2.444 -0.207 . . . 1.0 . . . . . . . . . . . . A . 13 HIS CB . . . . . . . . . c19602_2mgt 1 . 12 . 6126 . 1 1 14 HIS CD2 C -1.121 -4.257 -0.557 . . . 1.0 . . . . . . . . . . . . A . 13 HIS CD2 . . . . . . . . . c19602_2mgt 1 . 12 . 6127 . 1 1 14 HIS CE1 C 0.457 -3.516 0.764 . . . 1.0 . . . . . . . . . . . . A . 13 HIS CE1 . . . . . . . . . c19602_2mgt 1 . 12 . 6128 . 1 1 14 HIS CG C -1.579 -3.125 0.047 . . . 1.0 . . . . . . . . . . . . A . 13 HIS CG . . . . . . . . . c19602_2mgt 1 . 12 . 6129 . 1 1 14 HIS H H -4.825 -1.027 0.182 . . . 1.0 . . . . . . . . . . . . A . 13 HIS H . . . . . . . . . c19602_2mgt 1 . 12 . 6130 . 1 1 14 HIS HA H -4.504 -3.827 0.161 . . . 1.0 . . . . . . . . . . . . A . 13 HIS HA . . . . . . . . . c19602_2mgt 1 . 12 . 6131 . 1 1 14 HIS HB2 H -3.144 -2.552 -1.263 . . . 1.0 . . . . . . . . . . . . A . 13 HIS HB2 . . . . . . . . . c19602_2mgt 1 . 12 . 6132 . 1 1 14 HIS HB3 H -2.749 -1.385 -0.017 . . . 1.0 . . . . . . . . . . . . A . 13 HIS HB3 . . . . . . . . . c19602_2mgt 1 . 12 . 6133 . 1 1 14 HIS HD1 H -0.595 -1.821 1.412 . . . 1.0 . . . . . . . . . . . . A . 13 HIS HD1 . . . . . . . . . c19602_2mgt 1 . 12 . 6134 . 1 1 14 HIS HD2 H -1.658 -4.849 -1.273 . . . 1.0 . . . . . . . . . . . . A . 13 HIS HD2 . . . . . . . . . c19602_2mgt 1 . 12 . 6135 . 1 1 14 HIS HE1 H 1.402 -3.404 1.275 . . . 1.0 . . . . . . . . . . . . A . 13 HIS HE1 . . . . . . . . . c19602_2mgt 1 . 12 . 6136 . 1 1 14 HIS N N -5.083 -1.917 0.584 . . . 1.0 . . . . . . . . . . . . A . 13 HIS N . . . . . . . . . c19602_2mgt 1 . 12 . 6137 . 1 1 14 HIS ND1 N -0.580 -2.678 0.876 . . . 1.0 . . . . . . . . . . . . A . 13 HIS ND1 . . . . . . . . . c19602_2mgt 1 . 12 . 6138 . 1 1 14 HIS NE2 N 0.171 -4.502 -0.096 . . . 1.0 . . . . . . . . . . . . A . 13 HIS NE2 . . . . . . . . . c19602_2mgt 1 . 12 . 6139 . 1 1 14 HIS O O -3.361 -4.447 2.343 . . . 1.0 . . . . . . . . . . . . A . 13 HIS O . . . . . . . . . c19602_2mgt 1 . 12 . 6140 . 1 1 15 HIS C C -5.055 -2.975 5.178 . . . 1.0 . . . . . . . . . . . . A . 14 HIS C . . . . . . . . . c19602_2mgt 1 . 12 . 6141 . 1 1 15 HIS CA C -3.731 -2.660 4.476 . . . 1.0 . . . . . . . . . . . . A . 14 HIS CA . . . . . . . . . c19602_2mgt 1 . 12 . 6142 . 1 1 15 HIS CB C -2.983 -1.518 5.163 . . . 1.0 . . . . . . . . . . . . A . 14 HIS CB . . . . . . . . . c19602_2mgt 1 . 12 . 6143 . 1 1 15 HIS CD2 C -1.189 -0.332 3.818 . . . 1.0 . . . . . . . . . . . . A . 14 HIS CD2 . . . . . . . . . c19602_2mgt 1 . 12 . 6144 . 1 1 15 HIS CE1 C 0.416 -1.816 3.882 . . . 1.0 . . . . . . . . . . . . A . 14 HIS CE1 . . . . . . . . . c19602_2mgt 1 . 12 . 6145 . 1 1 15 HIS CG C -1.604 -1.364 4.601 . . . 1.0 . . . . . . . . . . . . A . 14 HIS CG . . . . . . . . . c19602_2mgt 1 . 12 . 6146 . 1 1 15 HIS H H -4.185 -1.448 2.792 . . . 1.0 . . . . . . . . . . . . A . 14 HIS H . . . . . . . . . c19602_2mgt 1 . 12 . 6147 . 1 1 15 HIS HA H -3.112 -3.548 4.582 . . . 1.0 . . . . . . . . . . . . A . 14 HIS HA . . . . . . . . . c19602_2mgt 1 . 12 . 6148 . 1 1 15 HIS HB2 H -3.529 -0.587 5.017 . . . 1.0 . . . . . . . . . . . . A . 14 HIS HB2 . . . . . . . . . c19602_2mgt 1 . 12 . 6149 . 1 1 15 HIS HB3 H -2.905 -1.715 6.231 . . . 1.0 . . . . . . . . . . . . A . 14 HIS HB3 . . . . . . . . . c19602_2mgt 1 . 12 . 6150 . 1 1 15 HIS HD1 H -0.604 -3.176 5.116 . . . 1.0 . . . . . . . . . . . . A . 14 HIS HD1 . . . . . . . . . c19602_2mgt 1 . 12 . 6151 . 1 1 15 HIS HD2 H -1.774 0.540 3.576 . . . 1.0 . . . . . . . . . . . . A . 14 HIS HD2 . . . . . . . . . c19602_2mgt 1 . 12 . 6152 . 1 1 15 HIS HE1 H 1.347 -2.327 3.692 . . . 1.0 . . . . . . . . . . . . A . 14 HIS HE1 . . . . . . . . . c19602_2mgt 1 . 12 . 6153 . 1 1 15 HIS N N -3.878 -2.376 3.048 . . . 1.0 . . . . . . . . . . . . A . 14 HIS N . . . . . . . . . c19602_2mgt 1 . 12 . 6154 . 1 1 15 HIS ND1 N -0.588 -2.290 4.632 . . . 1.0 . . . . . . . . . . . . A . 14 HIS ND1 . . . . . . . . . c19602_2mgt 1 . 12 . 6155 . 1 1 15 HIS NE2 N 0.090 -0.629 3.359 . . . 1.0 . . . . . . . . . . . . A . 14 HIS NE2 . . . . . . . . . c19602_2mgt 1 . 12 . 6156 . 1 1 15 HIS O O -5.011 -3.552 6.261 . . . 1.0 . . . . . . . . . . . . A . 14 HIS O . . . . . . . . . c19602_2mgt 1 . 12 . 6157 . 1 1 16 GLN C C -7.321 -4.887 4.759 . . . 1.0 . . . . . . . . . . . . A . 15 GLN C . . . . . . . . . c19602_2mgt 1 . 12 . 6158 . 1 1 16 GLN CA C -7.459 -3.375 4.943 . . . 1.0 . . . . . . . . . . . . A . 15 GLN CA . . . . . . . . . c19602_2mgt 1 . 12 . 6159 . 1 1 16 GLN CB C -8.612 -2.856 4.084 . . . 1.0 . . . . . . . . . . . . A . 15 GLN CB . . . . . . . . . c19602_2mgt 1 . 12 . 6160 . 1 1 16 GLN CD C -10.368 -2.520 5.893 . . . 1.0 . . . . . . . . . . . . A . 15 GLN CD . . . . . . . . . c19602_2mgt 1 . 12 . 6161 . 1 1 16 GLN CG C -9.979 -3.267 4.625 . . . 1.0 . . . . . . . . . . . . A . 15 GLN CG . . . . . . . . . c19602_2mgt 1 . 12 . 6162 . 1 1 16 GLN H H -6.235 -2.211 3.688 . . . 1.0 . . . . . . . . . . . . A . 15 GLN H . . . . . . . . . c19602_2mgt 1 . 12 . 6163 . 1 1 16 GLN HA H -7.664 -3.150 5.981 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HA . . . . . . . . . c19602_2mgt 1 . 12 . 6164 . 1 1 16 GLN HB2 H -8.553 -1.774 3.997 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HB2 . . . . . . . . . c19602_2mgt 1 . 12 . 6165 . 1 1 16 GLN HB3 H -8.525 -3.286 3.096 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HB3 . . . . . . . . . c19602_2mgt 1 . 12 . 6166 . 1 1 16 GLN HE21 H -10.899 -4.232 6.847 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HE21 . . . . . . . . . c19602_2mgt 1 . 12 . 6167 . 1 1 16 GLN HE22 H -11.107 -2.756 7.765 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HE22 . . . . . . . . . c19602_2mgt 1 . 12 . 6168 . 1 1 16 GLN HG2 H -10.715 -3.056 3.857 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HG2 . . . . . . . . . c19602_2mgt 1 . 12 . 6169 . 1 1 16 GLN HG3 H -9.984 -4.337 4.808 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HG3 . . . . . . . . . c19602_2mgt 1 . 12 . 6170 . 1 1 16 GLN N N -6.219 -2.714 4.559 . . . 1.0 . . . . . . . . . . . . A . 15 GLN N . . . . . . . . . c19602_2mgt 1 . 12 . 6171 . 1 1 16 GLN NE2 N -10.824 -3.228 6.920 . . . 1.0 . . . . . . . . . . . . A . 15 GLN NE2 . . . . . . . . . c19602_2mgt 1 . 12 . 6172 . 1 1 16 GLN O O -7.813 -5.641 5.588 . . . 1.0 . . . . . . . . . . . . A . 15 GLN O . . . . . . . . . c19602_2mgt 1 . 12 . 6173 . 1 1 16 GLN OE1 O -10.259 -1.303 5.957 . . . 1.0 . . . . . . . . . . . . A . 15 GLN OE1 . . . . . . . . . c19602_2mgt 1 . 12 . 6174 . 1 1 17 LYS C C -4.956 -7.102 4.083 . . . 1.0 . . . . . . . . . . . . A . 16 LYS C . . . . . . . . . c19602_2mgt 1 . 12 . 6175 . 1 1 17 LYS CA C -6.246 -6.672 3.377 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CA . . . . . . . . . c19602_2mgt 1 . 12 . 6176 . 1 1 17 LYS CB C -6.044 -6.781 1.863 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CB . . . . . . . . . c19602_2mgt 1 . 12 . 6177 . 1 1 17 LYS CD C -7.108 -6.591 -0.416 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CD . . . . . . . . . c19602_2mgt 1 . 12 . 6178 . 1 1 17 LYS CE C -6.436 -7.828 -1.013 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CE . . . . . . . . . c19602_2mgt 1 . 12 . 6179 . 1 1 17 LYS CG C -7.361 -6.641 1.094 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CG . . . . . . . . . c19602_2mgt 1 . 12 . 6180 . 1 1 17 LYS H H -6.293 -4.588 3.055 . . . 1.0 . . . . . . . . . . . . A . 16 LYS H . . . . . . . . . c19602_2mgt 1 . 12 . 6181 . 1 1 17 LYS HA H -7.045 -7.348 3.677 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HA . . . . . . . . . c19602_2mgt 1 . 12 . 6182 . 1 1 17 LYS HB2 H -5.350 -6.006 1.538 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HB2 . . . . . . . . . c19602_2mgt 1 . 12 . 6183 . 1 1 17 LYS HB3 H -5.606 -7.752 1.630 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HB3 . . . . . . . . . c19602_2mgt 1 . 12 . 6184 . 1 1 17 LYS HD2 H -8.057 -6.449 -0.918 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HD2 . . . . . . . . . c19602_2mgt 1 . 12 . 6185 . 1 1 17 LYS HD3 H -6.480 -5.726 -0.621 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HD3 . . . . . . . . . c19602_2mgt 1 . 12 . 6186 . 1 1 17 LYS HE2 H -6.307 -7.673 -2.084 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HE2 . . . . . . . . . c19602_2mgt 1 . 12 . 6187 . 1 1 17 LYS HE3 H -5.459 -7.965 -0.555 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HE3 . . . . . . . . . c19602_2mgt 1 . 12 . 6188 . 1 1 17 LYS HG2 H -8.015 -7.476 1.342 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HG2 . . . . . . . . . c19602_2mgt 1 . 12 . 6189 . 1 1 17 LYS HG3 H -7.861 -5.716 1.380 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HG3 . . . . . . . . . c19602_2mgt 1 . 12 . 6190 . 1 1 17 LYS HZ1 H -7.327 -9.222 0.182 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HZ1 . . . . . . . . . c19602_2mgt 1 . 12 . 6191 . 1 1 17 LYS HZ2 H -8.150 -8.926 -1.207 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HZ2 . . . . . . . . . c19602_2mgt 1 . 12 . 6192 . 1 1 17 LYS HZ3 H -6.775 -9.835 -1.243 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HZ3 . . . . . . . . . c19602_2mgt 1 . 12 . 6193 . 1 1 17 LYS N N -6.622 -5.299 3.693 . . . 1.0 . . . . . . . . . . . . A . 16 LYS N . . . . . . . . . c19602_2mgt 1 . 12 . 6194 . 1 1 17 LYS NZ N -7.229 -9.046 -0.808 . . . 1.0 . . . . . . . . . . . . A . 16 LYS NZ . . . . . . . . . c19602_2mgt 1 . 12 . 6195 . 1 1 17 LYS O O -4.593 -8.269 4.002 . . . 1.0 . . . . . . . . . . . . A . 16 LYS O . . . . . . . . . c19602_2mgt 1 . 12 . 6196 . 1 1 18 NH2 HN1 H -3.399 -6.485 5.235 . . . 1.0 . . . . . . . . . . . . A . 17 NH2 HN1 . . . . . . . . . c19602_2mgt 1 . 12 . 6197 . 1 1 18 NH2 HN2 H -4.561 -5.247 4.818 . . . 1.0 . . . . . . . . . . . . A . 17 NH2 HN2 . . . . . . . . . c19602_2mgt 1 . 12 . 6198 . 1 1 18 NH2 N N -4.241 -6.203 4.757 . . . 1.0 . . . . . . . . . . . . A . 17 NH2 N . . . . . . . . . c19602_2mgt 1 . 12 . 6199 . 2 1 1 ACE C C 18.613 5.788 -7.852 . . . 1.0 . . . . . . . . . . . . B . 0 ACE C . . . . . . . . . c19602_2mgt 1 . 12 . 6200 . 2 1 1 ACE CH3 C 18.326 6.189 -9.288 . . . 1.0 . . . . . . . . . . . . B . 0 ACE CH3 . . . . . . . . . c19602_2mgt 1 . 12 . 6201 . 2 1 1 ACE H1 H 19.005 6.984 -9.585 . . . 1.0 . . . . . . . . . . . . B . 0 ACE H1 . . . . . . . . . c19602_2mgt 1 . 12 . 6202 . 2 1 1 ACE H2 H 18.467 5.328 -9.938 . . . 1.0 . . . . . . . . . . . . B . 0 ACE H2 . . . . . . . . . c19602_2mgt 1 . 12 . 6203 . 2 1 1 ACE H3 H 17.301 6.542 -9.376 . . . 1.0 . . . . . . . . . . . . B . 0 ACE H3 . . . . . . . . . c19602_2mgt 1 . 12 . 6204 . 2 1 1 ACE O O 19.602 6.236 -7.284 . . . 1.0 . . . . . . . . . . . . B . 0 ACE O . . . . . . . . . c19602_2mgt 1 . 12 . 6205 . 2 1 2 ASP C C 18.494 2.963 -6.058 . . . 1.0 . . . . . . . . . . . . B . 1 ASP C . . . . . . . . . c19602_2mgt 1 . 12 . 6206 . 2 1 2 ASP CA C 17.921 4.369 -5.948 . . . 1.0 . . . . . . . . . . . . B . 1 ASP CA . . . . . . . . . c19602_2mgt 1 . 12 . 6207 . 2 1 2 ASP CB C 16.573 4.330 -5.234 . . . 1.0 . . . . . . . . . . . . B . 1 ASP CB . . . . . . . . . c19602_2mgt 1 . 12 . 6208 . 2 1 2 ASP CG C 16.159 5.725 -4.800 . . . 1.0 . . . . . . . . . . . . B . 1 ASP CG . . . . . . . . . c19602_2mgt 1 . 12 . 6209 . 2 1 2 ASP H H 16.956 4.630 -7.804 . . . 1.0 . . . . . . . . . . . . B . 1 ASP H . . . . . . . . . c19602_2mgt 1 . 12 . 6210 . 2 1 2 ASP HA H 18.605 4.982 -5.360 . . . 1.0 . . . . . . . . . . . . B . 1 ASP HA . . . . . . . . . c19602_2mgt 1 . 12 . 6211 . 2 1 2 ASP HB2 H 15.810 3.913 -5.896 . . . 1.0 . . . . . . . . . . . . B . 1 ASP HB2 . . . . . . . . . c19602_2mgt 1 . 12 . 6212 . 2 1 2 ASP HB3 H 16.657 3.690 -4.360 . . . 1.0 . . . . . . . . . . . . B . 1 ASP HB3 . . . . . . . . . c19602_2mgt 1 . 12 . 6213 . 2 1 2 ASP N N 17.754 4.946 -7.273 . . . 1.0 . . . . . . . . . . . . B . 1 ASP N . . . . . . . . . c19602_2mgt 1 . 12 . 6214 . 2 1 2 ASP O O 17.929 2.103 -6.733 . . . 1.0 . . . . . . . . . . . . B . 1 ASP O . . . . . . . . . c19602_2mgt 1 . 12 . 6215 . 2 1 2 ASP OD1 O 16.826 6.226 -3.845 . . . 1.0 . . . . . . . . . . . . B . 1 ASP OD1 . . . . . . . . . c19602_2mgt 1 . 12 . 6216 . 2 1 2 ASP OD2 O 15.250 6.293 -5.382 . . . 1.0 . . . . . . . . . . . . B . 1 ASP OD2 . . . . . . . . . c19602_2mgt 1 . 12 . 6217 . 2 1 3 ALA C C 19.895 0.633 -4.190 . . . 1.0 . . . . . . . . . . . . B . 2 ALA C . . . . . . . . . c19602_2mgt 1 . 12 . 6218 . 2 1 3 ALA CA C 20.338 1.488 -5.376 . . . 1.0 . . . . . . . . . . . . B . 2 ALA CA . . . . . . . . . c19602_2mgt 1 . 12 . 6219 . 2 1 3 ALA CB C 21.844 1.774 -5.423 . . . 1.0 . . . . . . . . . . . . B . 2 ALA CB . . . . . . . . . c19602_2mgt 1 . 12 . 6220 . 2 1 3 ALA H H 20.014 3.498 -4.834 . . . 1.0 . . . . . . . . . . . . B . 2 ALA H . . . . . . . . . c19602_2mgt 1 . 12 . 6221 . 2 1 3 ALA HA H 20.085 0.938 -6.283 . . . 1.0 . . . . . . . . . . . . B . 2 ALA HA . . . . . . . . . c19602_2mgt 1 . 12 . 6222 . 2 1 3 ALA HB1 H 22.076 2.331 -6.329 . . . 1.0 . . . . . . . . . . . . B . 2 ALA HB1 . . . . . . . . . c19602_2mgt 1 . 12 . 6223 . 2 1 3 ALA HB2 H 22.155 2.362 -4.563 . . . 1.0 . . . . . . . . . . . . B . 2 ALA HB2 . . . . . . . . . c19602_2mgt 1 . 12 . 6224 . 2 1 3 ALA HB3 H 22.393 0.835 -5.437 . . . 1.0 . . . . . . . . . . . . B . 2 ALA HB3 . . . . . . . . . c19602_2mgt 1 . 12 . 6225 . 2 1 3 ALA N N 19.613 2.741 -5.366 . . . 1.0 . . . . . . . . . . . . B . 2 ALA N . . . . . . . . . c19602_2mgt 1 . 12 . 6226 . 2 1 3 ALA O O 18.893 -0.067 -4.309 . . . 1.0 . . . . . . . . . . . . B . 2 ALA O . . . . . . . . . c19602_2mgt 1 . 12 . 6227 . 2 1 4 GLU C C 19.407 -0.997 -1.662 . . . 1.0 . . . . . . . . . . . . B . 3 GLU C . . . . . . . . . c19602_2mgt 1 . 12 . 6228 . 2 1 4 GLU CA C 20.746 -0.418 -2.109 . . . 1.0 . . . . . . . . . . . . B . 3 GLU CA . . . . . . . . . c19602_2mgt 1 . 12 . 6229 . 2 1 4 GLU CB C 21.576 0.044 -0.901 . . . 1.0 . . . . . . . . . . . . B . 3 GLU CB . . . . . . . . . c19602_2mgt 1 . 12 . 6230 . 2 1 4 GLU CD C 21.765 1.628 1.049 . . . 1.0 . . . . . . . . . . . . B . 3 GLU CD . . . . . . . . . c19602_2mgt 1 . 12 . 6231 . 2 1 4 GLU CG C 20.827 1.045 0.008 . . . 1.0 . . . . . . . . . . . . B . 3 GLU CG . . . . . . . . . c19602_2mgt 1 . 12 . 6232 . 2 1 4 GLU H H 21.399 1.343 -3.053 . . . 1.0 . . . . . . . . . . . . B . 3 GLU H . . . . . . . . . c19602_2mgt 1 . 12 . 6233 . 2 1 4 GLU HA H 21.301 -1.221 -2.588 . . . 1.0 . . . . . . . . . . . . B . 3 GLU HA . . . . . . . . . c19602_2mgt 1 . 12 . 6234 . 2 1 4 GLU HB2 H 21.845 -0.824 -0.305 . . . 1.0 . . . . . . . . . . . . B . 3 GLU HB2 . . . . . . . . . c19602_2mgt 1 . 12 . 6235 . 2 1 4 GLU HB3 H 22.493 0.501 -1.259 . . . 1.0 . . . . . . . . . . . . B . 3 GLU HB3 . . . . . . . . . c19602_2mgt 1 . 12 . 6236 . 2 1 4 GLU HG2 H 20.385 1.819 -0.605 . . . 1.0 . . . . . . . . . . . . B . 3 GLU HG2 . . . . . . . . . c19602_2mgt 1 . 12 . 6237 . 2 1 4 GLU HG3 H 20.043 0.518 0.548 . . . 1.0 . . . . . . . . . . . . B . 3 GLU HG3 . . . . . . . . . c19602_2mgt 1 . 12 . 6238 . 2 1 4 GLU N N 20.654 0.663 -3.086 . . . 1.0 . . . . . . . . . . . . B . 3 GLU N . . . . . . . . . c19602_2mgt 1 . 12 . 6239 . 2 1 4 GLU O O 19.276 -2.214 -1.628 . . . 1.0 . . . . . . . . . . . . B . 3 GLU O . . . . . . . . . c19602_2mgt 1 . 12 . 6240 . 2 1 4 GLU OE1 O 22.717 1.069 1.414 . . . 1.0 . . . . . . . . . . . . B . 3 GLU OE1 . . . . . . . . . c19602_2mgt 1 . 12 . 6241 . 2 1 4 GLU OE2 O 21.362 2.807 1.507 . . . 1.0 . . . . . . . . . . . . B . 3 GLU OE2 . . . . . . . . . c19602_2mgt 1 . 12 . 6242 . 2 1 5 PHE C C 16.089 -0.823 -1.751 . . . 1.0 . . . . . . . . . . . . B . 4 PHE C . . . . . . . . . c19602_2mgt 1 . 12 . 6243 . 2 1 5 PHE CA C 17.181 -0.570 -0.719 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CA . . . . . . . . . c19602_2mgt 1 . 12 . 6244 . 2 1 5 PHE CB C 16.706 0.495 0.271 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CB . . . . . . . . . c19602_2mgt 1 . 12 . 6245 . 2 1 5 PHE CD1 C 17.011 2.699 -0.917 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CD1 . . . . . . . . . c19602_2mgt 1 . 12 . 6246 . 2 1 5 PHE CD2 C 14.769 1.781 -0.713 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CD2 . . . . . . . . . c19602_2mgt 1 . 12 . 6247 . 2 1 5 PHE CE1 C 16.496 3.799 -1.621 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CE1 . . . . . . . . . c19602_2mgt 1 . 12 . 6248 . 2 1 5 PHE CE2 C 14.260 2.857 -1.457 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CE2 . . . . . . . . . c19602_2mgt 1 . 12 . 6249 . 2 1 5 PHE CG C 16.143 1.714 -0.424 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CG . . . . . . . . . c19602_2mgt 1 . 12 . 6250 . 2 1 5 PHE CZ C 15.118 3.884 -1.884 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CZ . . . . . . . . . c19602_2mgt 1 . 12 . 6251 . 2 1 5 PHE H H 18.591 0.844 -1.424 . . . 1.0 . . . . . . . . . . . . B . 4 PHE H . . . . . . . . . c19602_2mgt 1 . 12 . 6252 . 2 1 5 PHE HA H 17.361 -1.483 -0.162 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HA . . . . . . . . . c19602_2mgt 1 . 12 . 6253 . 2 1 5 PHE HB2 H 15.924 0.061 0.895 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HB2 . . . . . . . . . c19602_2mgt 1 . 12 . 6254 . 2 1 5 PHE HB3 H 17.528 0.782 0.927 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HB3 . . . . . . . . . c19602_2mgt 1 . 12 . 6255 . 2 1 5 PHE HD1 H 18.074 2.592 -0.773 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HD1 . . . . . . . . . c19602_2mgt 1 . 12 . 6256 . 2 1 5 PHE HD2 H 14.121 0.968 -0.413 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HD2 . . . . . . . . . c19602_2mgt 1 . 12 . 6257 . 2 1 5 PHE HE1 H 17.165 4.567 -1.972 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HE1 . . . . . . . . . c19602_2mgt 1 . 12 . 6258 . 2 1 5 PHE HE2 H 13.213 2.888 -1.711 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HE2 . . . . . . . . . c19602_2mgt 1 . 12 . 6259 . 2 1 5 PHE HZ H 14.723 4.721 -2.440 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HZ . . . . . . . . . c19602_2mgt 1 . 12 . 6260 . 2 1 5 PHE N N 18.426 -0.148 -1.337 . . . 1.0 . . . . . . . . . . . . B . 4 PHE N . . . . . . . . . c19602_2mgt 1 . 12 . 6261 . 2 1 5 PHE O O 15.157 -1.555 -1.447 . . . 1.0 . . . . . . . . . . . . B . 4 PHE O . . . . . . . . . c19602_2mgt 1 . 12 . 6262 . 2 1 6 ARG C C 15.303 -1.553 -4.764 . . . 1.0 . . . . . . . . . . . . B . 5 ARG C . . . . . . . . . c19602_2mgt 1 . 12 . 6263 . 2 1 6 ARG CA C 15.130 -0.265 -3.955 . . . 1.0 . . . . . . . . . . . . B . 5 ARG CA . . . . . . . . . c19602_2mgt 1 . 12 . 6264 . 2 1 6 ARG CB C 15.175 1.047 -4.748 . . . 1.0 . . . . . . . . . . . . B . 5 ARG CB . . . . . . . . . c19602_2mgt 1 . 12 . 6265 . 2 1 6 ARG CD C 12.679 0.819 -5.371 . . . 1.0 . . . . . . . . . . . . B . 5 ARG CD . . . . . . . . . c19602_2mgt 1 . 12 . 6266 . 2 1 6 ARG CG C 14.089 1.234 -5.814 . . . 1.0 . . . . . . . . . . . . B . 5 ARG CG . . . . . . . . . c19602_2mgt 1 . 12 . 6267 . 2 1 6 ARG CZ C 12.020 -1.098 -6.842 . . . 1.0 . . . . . . . . . . . . B . 5 ARG CZ . . . . . . . . . c19602_2mgt 1 . 12 . 6268 . 2 1 6 ARG H H 16.958 0.386 -3.143 . . . 1.0 . . . . . . . . . . . . B . 5 ARG H . . . . . . . . . c19602_2mgt 1 . 12 . 6269 . 2 1 6 ARG HA H 14.169 -0.316 -3.444 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HA . . . . . . . . . c19602_2mgt 1 . 12 . 6270 . 2 1 6 ARG HB2 H 15.074 1.864 -4.034 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HB2 . . . . . . . . . c19602_2mgt 1 . 12 . 6271 . 2 1 6 ARG HB3 H 16.148 1.140 -5.222 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HB3 . . . . . . . . . c19602_2mgt 1 . 12 . 6272 . 2 1 6 ARG HD2 H 12.559 1.008 -4.304 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HD2 . . . . . . . . . c19602_2mgt 1 . 12 . 6273 . 2 1 6 ARG HD3 H 11.947 1.432 -5.894 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HD3 . . . . . . . . . c19602_2mgt 1 . 12 . 6274 . 2 1 6 ARG HE H 12.510 -1.246 -4.886 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HE . . . . . . . . . c19602_2mgt 1 . 12 . 6275 . 2 1 6 ARG HG2 H 14.065 2.290 -6.081 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HG2 . . . . . . . . . c19602_2mgt 1 . 12 . 6276 . 2 1 6 ARG HG3 H 14.378 0.676 -6.702 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HG3 . . . . . . . . . c19602_2mgt 1 . 12 . 6277 . 2 1 6 ARG HH11 H 11.981 0.682 -7.832 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HH11 . . . . . . . . . c19602_2mgt 1 . 12 . 6278 . 2 1 6 ARG HH12 H 11.543 -0.716 -8.786 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HH12 . . . . . . . . . c19602_2mgt 1 . 12 . 6279 . 2 1 6 ARG HH21 H 11.936 -3.024 -6.179 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HH21 . . . . . . . . . c19602_2mgt 1 . 12 . 6280 . 2 1 6 ARG HH22 H 11.502 -2.784 -7.856 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HH22 . . . . . . . . . c19602_2mgt 1 . 12 . 6281 . 2 1 6 ARG N N 16.166 -0.205 -2.939 . . . 1.0 . . . . . . . . . . . . B . 5 ARG N . . . . . . . . . c19602_2mgt 1 . 12 . 6282 . 2 1 6 ARG NE N 12.404 -0.601 -5.655 . . . 1.0 . . . . . . . . . . . . B . 5 ARG NE . . . . . . . . . c19602_2mgt 1 . 12 . 6283 . 2 1 6 ARG NH1 N 11.848 -0.315 -7.911 . . . 1.0 . . . . . . . . . . . . B . 5 ARG NH1 . . . . . . . . . c19602_2mgt 1 . 12 . 6284 . 2 1 6 ARG NH2 N 11.804 -2.409 -6.968 . . . 1.0 . . . . . . . . . . . . B . 5 ARG NH2 . . . . . . . . . c19602_2mgt 1 . 12 . 6285 . 2 1 6 ARG O O 15.540 -1.549 -5.967 . . . 1.0 . . . . . . . . . . . . B . 5 ARG O . . . . . . . . . c19602_2mgt 1 . 12 . 6286 . 2 1 7 ARG C C 14.108 -4.576 -5.062 . . . 1.0 . . . . . . . . . . . . B . 6 ARG C . . . . . . . . . c19602_2mgt 1 . 12 . 6287 . 2 1 7 ARG CA C 15.403 -4.028 -4.470 . . . 1.0 . . . . . . . . . . . . B . 6 ARG CA . . . . . . . . . c19602_2mgt 1 . 12 . 6288 . 2 1 7 ARG CB C 15.867 -4.850 -3.258 . . . 1.0 . . . . . . . . . . . . B . 6 ARG CB . . . . . . . . . c19602_2mgt 1 . 12 . 6289 . 2 1 7 ARG CD C 18.428 -4.487 -3.569 . . . 1.0 . . . . . . . . . . . . B . 6 ARG CD . . . . . . . . . c19602_2mgt 1 . 12 . 6290 . 2 1 7 ARG CG C 17.208 -4.411 -2.643 . . . 1.0 . . . . . . . . . . . . B . 6 ARG CG . . . . . . . . . c19602_2mgt 1 . 12 . 6291 . 2 1 7 ARG CZ C 18.626 -3.249 -5.748 . . . 1.0 . . . . . . . . . . . . B . 6 ARG CZ . . . . . . . . . c19602_2mgt 1 . 12 . 6292 . 2 1 7 ARG H H 15.027 -2.562 -3.054 . . . 1.0 . . . . . . . . . . . . B . 6 ARG H . . . . . . . . . c19602_2mgt 1 . 12 . 6293 . 2 1 7 ARG HA H 16.170 -4.052 -5.232 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HA . . . . . . . . . c19602_2mgt 1 . 12 . 6294 . 2 1 7 ARG HB2 H 15.107 -4.754 -2.480 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HB2 . . . . . . . . . c19602_2mgt 1 . 12 . 6295 . 2 1 7 ARG HB3 H 15.946 -5.897 -3.541 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HB3 . . . . . . . . . c19602_2mgt 1 . 12 . 6296 . 2 1 7 ARG HD2 H 19.317 -4.552 -2.944 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HD2 . . . . . . . . . c19602_2mgt 1 . 12 . 6297 . 2 1 7 ARG HD3 H 18.379 -5.393 -4.170 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HD3 . . . . . . . . . c19602_2mgt 1 . 12 . 6298 . 2 1 7 ARG HE H 18.613 -2.404 -3.917 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HE . . . . . . . . . c19602_2mgt 1 . 12 . 6299 . 2 1 7 ARG HG2 H 17.105 -3.398 -2.260 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HG2 . . . . . . . . . c19602_2mgt 1 . 12 . 6300 . 2 1 7 ARG HG3 H 17.412 -5.062 -1.795 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HG3 . . . . . . . . . c19602_2mgt 1 . 12 . 6301 . 2 1 7 ARG HH11 H 18.542 -5.257 -6.074 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HH11 . . . . . . . . . c19602_2mgt 1 . 12 . 6302 . 2 1 7 ARG HH12 H 18.639 -4.264 -7.510 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HH12 . . . . . . . . . c19602_2mgt 1 . 12 . 6303 . 2 1 7 ARG HH21 H 18.691 -1.221 -5.824 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HH21 . . . . . . . . . c19602_2mgt 1 . 12 . 6304 . 2 1 7 ARG HH22 H 18.715 -2.032 -7.371 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HH22 . . . . . . . . . c19602_2mgt 1 . 12 . 6305 . 2 1 7 ARG N N 15.212 -2.667 -4.037 . . . 1.0 . . . . . . . . . . . . B . 6 ARG N . . . . . . . . . c19602_2mgt 1 . 12 . 6306 . 2 1 7 ARG NE N 18.564 -3.287 -4.410 . . . 1.0 . . . . . . . . . . . . B . 6 ARG NE . . . . . . . . . c19602_2mgt 1 . 12 . 6307 . 2 1 7 ARG NH1 N 18.624 -4.348 -6.503 . . . 1.0 . . . . . . . . . . . . B . 6 ARG NH1 . . . . . . . . . c19602_2mgt 1 . 12 . 6308 . 2 1 7 ARG NH2 N 18.676 -2.074 -6.362 . . . 1.0 . . . . . . . . . . . . B . 6 ARG NH2 . . . . . . . . . c19602_2mgt 1 . 12 . 6309 . 2 1 7 ARG O O 13.019 -4.056 -4.819 . . . 1.0 . . . . . . . . . . . . B . 6 ARG O . . . . . . . . . c19602_2mgt 1 . 12 . 6310 . 2 1 8 ASP C C 12.180 -7.008 -5.753 . . . 1.0 . . . . . . . . . . . . B . 7 ASP C . . . . . . . . . c19602_2mgt 1 . 12 . 6311 . 2 1 8 ASP CA C 13.189 -6.251 -6.626 . . . 1.0 . . . . . . . . . . . . B . 7 ASP CA . . . . . . . . . c19602_2mgt 1 . 12 . 6312 . 2 1 8 ASP CB C 13.868 -7.188 -7.627 . . . 1.0 . . . . . . . . . . . . B . 7 ASP CB . . . . . . . . . c19602_2mgt 1 . 12 . 6313 . 2 1 8 ASP CG C 12.841 -7.985 -8.405 . . . 1.0 . . . . . . . . . . . . B . 7 ASP CG . . . . . . . . . c19602_2mgt 1 . 12 . 6314 . 2 1 8 ASP H H 15.181 -6.003 -5.996 . . . 1.0 . . . . . . . . . . . . B . 7 ASP H . . . . . . . . . c19602_2mgt 1 . 12 . 6315 . 2 1 8 ASP HA H 12.656 -5.476 -7.178 . . . 1.0 . . . . . . . . . . . . B . 7 ASP HA . . . . . . . . . c19602_2mgt 1 . 12 . 6316 . 2 1 8 ASP HB2 H 14.501 -6.612 -8.295 . . . 1.0 . . . . . . . . . . . . B . 7 ASP HB2 . . . . . . . . . c19602_2mgt 1 . 12 . 6317 . 2 1 8 ASP HB3 H 14.496 -7.907 -7.088 . . . 1.0 . . . . . . . . . . . . B . 7 ASP HB3 . . . . . . . . . c19602_2mgt 1 . 12 . 6318 . 2 1 8 ASP N N 14.253 -5.632 -5.858 . . . 1.0 . . . . . . . . . . . . B . 7 ASP N . . . . . . . . . c19602_2mgt 1 . 12 . 6319 . 2 1 8 ASP O O 10.986 -6.972 -6.032 . . . 1.0 . . . . . . . . . . . . B . 7 ASP O . . . . . . . . . c19602_2mgt 1 . 12 . 6320 . 2 1 8 ASP OD1 O 12.420 -9.008 -7.965 . . . 1.0 . . . . . . . . . . . . B . 7 ASP OD1 . . . . . . . . . c19602_2mgt 1 . 12 . 6321 . 2 1 8 ASP OD2 O 12.471 -7.448 -9.528 . . . 1.0 . . . . . . . . . . . . B . 7 ASP OD2 . . . . . . . . . c19602_2mgt 1 . 12 . 6322 . 2 1 9 SER C C 11.261 -7.569 -2.718 . . . 1.0 . . . . . . . . . . . . B . 8 SER C . . . . . . . . . c19602_2mgt 1 . 12 . 6323 . 2 1 9 SER CA C 11.815 -8.473 -3.811 . . . 1.0 . . . . . . . . . . . . B . 8 SER CA . . . . . . . . . c19602_2mgt 1 . 12 . 6324 . 2 1 9 SER CB C 12.602 -9.637 -3.207 . . . 1.0 . . . . . . . . . . . . B . 8 SER CB . . . . . . . . . c19602_2mgt 1 . 12 . 6325 . 2 1 9 SER H H 13.641 -7.723 -4.545 . . . 1.0 . . . . . . . . . . . . B . 8 SER H . . . . . . . . . c19602_2mgt 1 . 12 . 6326 . 2 1 9 SER HA H 10.989 -8.889 -4.378 . . . 1.0 . . . . . . . . . . . . B . 8 SER HA . . . . . . . . . c19602_2mgt 1 . 12 . 6327 . 2 1 9 SER HB2 H 13.486 -9.263 -2.693 . . . 1.0 . . . . . . . . . . . . B . 8 SER HB2 . . . . . . . . . c19602_2mgt 1 . 12 . 6328 . 2 1 9 SER HB3 H 11.970 -10.173 -2.501 . . . 1.0 . . . . . . . . . . . . B . 8 SER HB3 . . . . . . . . . c19602_2mgt 1 . 12 . 6329 . 2 1 9 SER HG H 12.266 -10.719 -4.787 . . . 1.0 . . . . . . . . . . . . B . 8 SER HG . . . . . . . . . c19602_2mgt 1 . 12 . 6330 . 2 1 9 SER N N 12.649 -7.703 -4.714 . . . 1.0 . . . . . . . . . . . . B . 8 SER N . . . . . . . . . c19602_2mgt 1 . 12 . 6331 . 2 1 9 SER O O 11.969 -6.717 -2.183 . . . 1.0 . . . . . . . . . . . . B . 8 SER O . . . . . . . . . c19602_2mgt 1 . 12 . 6332 . 2 1 9 SER OG O 13.016 -10.525 -4.213 . . . 1.0 . . . . . . . . . . . . B . 8 SER OG . . . . . . . . . c19602_2mgt 1 . 12 . 6333 . 2 1 10 GLY C C 7.782 -7.118 -1.862 . . . 1.0 . . . . . . . . . . . . B . 9 GLY C . . . . . . . . . c19602_2mgt 1 . 12 . 6334 . 2 1 10 GLY CA C 9.235 -7.061 -1.391 . . . 1.0 . . . . . . . . . . . . B . 9 GLY CA . . . . . . . . . c19602_2mgt 1 . 12 . 6335 . 2 1 10 GLY H H 9.432 -8.429 -2.932 . . . 1.0 . . . . . . . . . . . . B . 9 GLY H . . . . . . . . . c19602_2mgt 1 . 12 . 6336 . 2 1 10 GLY HA2 H 9.332 -7.555 -0.427 . . . 1.0 . . . . . . . . . . . . B . 9 GLY HA2 . . . . . . . . . c19602_2mgt 1 . 12 . 6337 . 2 1 10 GLY HA3 H 9.620 -6.048 -1.287 . . . 1.0 . . . . . . . . . . . . B . 9 GLY HA3 . . . . . . . . . c19602_2mgt 1 . 12 . 6338 . 2 1 10 GLY N N 9.987 -7.787 -2.384 . . . 1.0 . . . . . . . . . . . . B . 9 GLY N . . . . . . . . . c19602_2mgt 1 . 12 . 6339 . 2 1 10 GLY O O 7.283 -8.201 -2.165 . . . 1.0 . . . . . . . . . . . . B . 9 GLY O . . . . . . . . . c19602_2mgt 1 . 12 . 6340 . 2 1 11 TYR C C 6.177 -3.747 -1.690 . . . 1.0 . . . . . . . . . . . . B . 10 TYR C . . . . . . . . . c19602_2mgt 1 . 12 . 6341 . 2 1 11 TYR CA C 7.412 -4.645 -1.610 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CA . . . . . . . . . c19602_2mgt 1 . 12 . 6342 . 2 1 11 TYR CB C 8.514 -4.078 -2.525 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CB . . . . . . . . . c19602_2mgt 1 . 12 . 6343 . 2 1 11 TYR CD1 C 9.505 -2.621 -0.676 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CD1 . . . . . . . . . c19602_2mgt 1 . 12 . 6344 . 2 1 11 TYR CD2 C 10.983 -3.644 -2.306 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CD2 . . . . . . . . . c19602_2mgt 1 . 12 . 6345 . 2 1 11 TYR CE1 C 10.596 -2.020 -0.043 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CE1 . . . . . . . . . c19602_2mgt 1 . 12 . 6346 . 2 1 11 TYR CE2 C 12.090 -3.050 -1.678 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CE2 . . . . . . . . . c19602_2mgt 1 . 12 . 6347 . 2 1 11 TYR CG C 9.687 -3.434 -1.810 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CG . . . . . . . . . c19602_2mgt 1 . 12 . 6348 . 2 1 11 TYR CZ C 11.896 -2.232 -0.539 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CZ . . . . . . . . . c19602_2mgt 1 . 12 . 6349 . 2 1 11 TYR H H 6.203 -6.083 -2.484 . . . 1.0 . . . . . . . . . . . . B . 10 TYR H . . . . . . . . . c19602_2mgt 1 . 12 . 6350 . 2 1 11 TYR HA H 7.758 -4.659 -0.583 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HA . . . . . . . . . c19602_2mgt 1 . 12 . 6351 . 2 1 11 TYR HB2 H 8.899 -4.864 -3.172 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HB2 . . . . . . . . . c19602_2mgt 1 . 12 . 6352 . 2 1 11 TYR HB3 H 8.077 -3.346 -3.193 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HB3 . . . . . . . . . c19602_2mgt 1 . 12 . 6353 . 2 1 11 TYR HD1 H 8.533 -2.445 -0.267 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HD1 . . . . . . . . . c19602_2mgt 1 . 12 . 6354 . 2 1 11 TYR HD2 H 11.124 -4.280 -3.165 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HD2 . . . . . . . . . c19602_2mgt 1 . 12 . 6355 . 2 1 11 TYR HE1 H 10.435 -1.410 0.831 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HE1 . . . . . . . . . c19602_2mgt 1 . 12 . 6356 . 2 1 11 TYR HE2 H 13.081 -3.250 -2.048 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HE2 . . . . . . . . . c19602_2mgt 1 . 12 . 6357 . 2 1 11 TYR HH H 13.793 -1.873 -0.304 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HH . . . . . . . . . c19602_2mgt 1 . 12 . 6358 . 2 1 11 TYR N N 7.064 -6.000 -1.980 . . . 1.0 . . . . . . . . . . . . B . 10 TYR N . . . . . . . . . c19602_2mgt 1 . 12 . 6359 . 2 1 11 TYR O O 5.284 -3.951 -2.508 . . . 1.0 . . . . . . . . . . . . B . 10 TYR O . . . . . . . . . c19602_2mgt 1 . 12 . 6360 . 2 1 11 TYR OH O 12.949 -1.669 0.108 . . . 1.0 . . . . . . . . . . . . B . 10 TYR OH . . . . . . . . . c19602_2mgt 1 . 12 . 6361 . 2 1 12 GLU C C 6.349 -0.289 -0.718 . . . 1.0 . . . . . . . . . . . . B . 11 GLU C . . . . . . . . . c19602_2mgt 1 . 12 . 6362 . 2 1 12 GLU CA C 5.443 -1.479 -1.088 . . . 1.0 . . . . . . . . . . . . B . 11 GLU CA . . . . . . . . . c19602_2mgt 1 . 12 . 6363 . 2 1 12 GLU CB C 4.158 -1.558 -0.272 . . . 1.0 . . . . . . . . . . . . B . 11 GLU CB . . . . . . . . . c19602_2mgt 1 . 12 . 6364 . 2 1 12 GLU CD C 2.183 -0.025 0.222 . . . 1.0 . . . . . . . . . . . . B . 11 GLU CD . . . . . . . . . c19602_2mgt 1 . 12 . 6365 . 2 1 12 GLU CG C 3.192 -0.507 -0.798 . . . 1.0 . . . . . . . . . . . . B . 11 GLU CG . . . . . . . . . c19602_2mgt 1 . 12 . 6366 . 2 1 12 GLU H H 6.900 -2.648 -0.164 . . . 1.0 . . . . . . . . . . . . B . 11 GLU H . . . . . . . . . c19602_2mgt 1 . 12 . 6367 . 2 1 12 GLU HA H 5.175 -1.416 -2.142 . . . 1.0 . . . . . . . . . . . . B . 11 GLU HA . . . . . . . . . c19602_2mgt 1 . 12 . 6368 . 2 1 12 GLU HB2 H 3.704 -2.544 -0.382 . . . 1.0 . . . . . . . . . . . . B . 11 GLU HB2 . . . . . . . . . c19602_2mgt 1 . 12 . 6369 . 2 1 12 GLU HB3 H 4.382 -1.398 0.783 . . . 1.0 . . . . . . . . . . . . B . 11 GLU HB3 . . . . . . . . . c19602_2mgt 1 . 12 . 6370 . 2 1 12 GLU HG2 H 3.745 0.386 -1.112 . . . 1.0 . . . . . . . . . . . . B . 11 GLU HG2 . . . . . . . . . c19602_2mgt 1 . 12 . 6371 . 2 1 12 GLU HG3 H 2.671 -0.900 -1.669 . . . 1.0 . . . . . . . . . . . . B . 11 GLU HG3 . . . . . . . . . c19602_2mgt 1 . 12 . 6372 . 2 1 12 GLU N N 6.201 -2.686 -0.888 . . . 1.0 . . . . . . . . . . . . B . 11 GLU N . . . . . . . . . c19602_2mgt 1 . 12 . 6373 . 2 1 12 GLU O O 6.141 0.372 0.296 . . . 1.0 . . . . . . . . . . . . B . 11 GLU O . . . . . . . . . c19602_2mgt 1 . 12 . 6374 . 2 1 12 GLU OE1 O 1.895 -0.854 1.189 . . . 1.0 . . . . . . . . . . . . B . 11 GLU OE1 . . . . . . . . . c19602_2mgt 1 . 12 . 6375 . 2 1 12 GLU OE2 O 1.753 1.075 0.135 . . . 1.0 . . . . . . . . . . . . B . 11 GLU OE2 . . . . . . . . . c19602_2mgt 1 . 12 . 6376 . 2 1 13 VAL C C 8.104 2.230 -0.865 . . . 1.0 . . . . . . . . . . . . B . 12 VAL C . . . . . . . . . c19602_2mgt 1 . 12 . 6377 . 2 1 13 VAL CA C 8.496 0.866 -1.434 . . . 1.0 . . . . . . . . . . . . B . 12 VAL CA . . . . . . . . . c19602_2mgt 1 . 12 . 6378 . 2 1 13 VAL CB C 9.136 1.050 -2.834 . . . 1.0 . . . . . . . . . . . . B . 12 VAL CB . . . . . . . . . c19602_2mgt 1 . 12 . 6379 . 2 1 13 VAL CG1 C 10.146 2.206 -2.898 . . . 1.0 . . . . . . . . . . . . B . 12 VAL CG1 . . . . . . . . . c19602_2mgt 1 . 12 . 6380 . 2 1 13 VAL CG2 C 9.873 -0.216 -3.287 . . . 1.0 . . . . . . . . . . . . B . 12 VAL CG2 . . . . . . . . . c19602_2mgt 1 . 12 . 6381 . 2 1 13 VAL H H 7.415 -0.659 -2.367 . . . 1.0 . . . . . . . . . . . . B . 12 VAL H . . . . . . . . . c19602_2mgt 1 . 12 . 6382 . 2 1 13 VAL HA H 9.241 0.412 -0.784 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HA . . . . . . . . . c19602_2mgt 1 . 12 . 6383 . 2 1 13 VAL HB H 8.343 1.264 -3.553 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HB . . . . . . . . . c19602_2mgt 1 . 12 . 6384 . 2 1 13 VAL HG11 H 10.918 2.070 -2.139 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HG11 . . . . . . . . . c19602_2mgt 1 . 12 . 6385 . 2 1 13 VAL HG12 H 10.608 2.243 -3.883 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HG12 . . . . . . . . . c19602_2mgt 1 . 12 . 6386 . 2 1 13 VAL HG13 H 9.637 3.152 -2.735 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HG13 . . . . . . . . . c19602_2mgt 1 . 12 . 6387 . 2 1 13 VAL HG21 H 10.773 -0.363 -2.689 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HG21 . . . . . . . . . c19602_2mgt 1 . 12 . 6388 . 2 1 13 VAL HG22 H 9.233 -1.087 -3.188 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HG22 . . . . . . . . . c19602_2mgt 1 . 12 . 6389 . 2 1 13 VAL HG23 H 10.138 -0.113 -4.336 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HG23 . . . . . . . . . c19602_2mgt 1 . 12 . 6390 . 2 1 13 VAL N N 7.374 -0.066 -1.554 . . . 1.0 . . . . . . . . . . . . B . 12 VAL N . . . . . . . . . c19602_2mgt 1 . 12 . 6391 . 2 1 13 VAL O O 8.861 2.800 -0.086 . . . 1.0 . . . . . . . . . . . . B . 12 VAL O . . . . . . . . . c19602_2mgt 1 . 12 . 6392 . 2 1 14 HIS C C 6.062 4.456 0.349 . . . 1.0 . . . . . . . . . . . . B . 13 HIS C . . . . . . . . . c19602_2mgt 1 . 12 . 6393 . 2 1 14 HIS CA C 6.603 4.162 -1.056 . . . 1.0 . . . . . . . . . . . . B . 13 HIS CA . . . . . . . . . c19602_2mgt 1 . 12 . 6394 . 2 1 14 HIS CB C 5.713 4.653 -2.200 . . . 1.0 . . . . . . . . . . . . B . 13 HIS CB . . . . . . . . . c19602_2mgt 1 . 12 . 6395 . 2 1 14 HIS CD2 C 7.622 5.404 -3.707 . . . 1.0 . . . . . . . . . . . . B . 13 HIS CD2 . . . . . . . . . c19602_2mgt 1 . 12 . 6396 . 2 1 14 HIS CE1 C 7.336 4.074 -5.420 . . . 1.0 . . . . . . . . . . . . B . 13 HIS CE1 . . . . . . . . . c19602_2mgt 1 . 12 . 6397 . 2 1 14 HIS CG C 6.492 4.668 -3.485 . . . 1.0 . . . . . . . . . . . . B . 13 HIS CG . . . . . . . . . c19602_2mgt 1 . 12 . 6398 . 2 1 14 HIS H H 6.373 2.240 -1.918 . . . 1.0 . . . . . . . . . . . . B . 13 HIS H . . . . . . . . . c19602_2mgt 1 . 12 . 6399 . 2 1 14 HIS HA H 7.536 4.718 -1.127 . . . 1.0 . . . . . . . . . . . . B . 13 HIS HA . . . . . . . . . c19602_2mgt 1 . 12 . 6400 . 2 1 14 HIS HB2 H 4.832 4.019 -2.293 . . . 1.0 . . . . . . . . . . . . B . 13 HIS HB2 . . . . . . . . . c19602_2mgt 1 . 12 . 6401 . 2 1 14 HIS HB3 H 5.390 5.670 -2.000 . . . 1.0 . . . . . . . . . . . . B . 13 HIS HB3 . . . . . . . . . c19602_2mgt 1 . 12 . 6402 . 2 1 14 HIS HD1 H 5.591 3.157 -4.693 . . . 1.0 . . . . . . . . . . . . B . 13 HIS HD1 . . . . . . . . . c19602_2mgt 1 . 12 . 6403 . 2 1 14 HIS HD2 H 8.057 6.119 -3.023 . . . 1.0 . . . . . . . . . . . . B . 13 HIS HD2 . . . . . . . . . c19602_2mgt 1 . 12 . 6404 . 2 1 14 HIS HE1 H 7.478 3.565 -6.362 . . . 1.0 . . . . . . . . . . . . B . 13 HIS HE1 . . . . . . . . . c19602_2mgt 1 . 12 . 6405 . 2 1 14 HIS N N 6.957 2.770 -1.287 . . . 1.0 . . . . . . . . . . . . B . 13 HIS N . . . . . . . . . c19602_2mgt 1 . 12 . 6406 . 2 1 14 HIS ND1 N 6.324 3.842 -4.571 . . . 1.0 . . . . . . . . . . . . B . 13 HIS ND1 . . . . . . . . . c19602_2mgt 1 . 12 . 6407 . 2 1 14 HIS NE2 N 8.156 5.019 -4.934 . . . 1.0 . . . . . . . . . . . . B . 13 HIS NE2 . . . . . . . . . c19602_2mgt 1 . 12 . 6408 . 2 1 14 HIS O O 5.767 5.612 0.640 . . . 1.0 . . . . . . . . . . . . B . 13 HIS O . . . . . . . . . c19602_2mgt 1 . 12 . 6409 . 2 1 15 HIS C C 6.766 2.544 3.467 . . . 1.0 . . . . . . . . . . . . B . 14 HIS C . . . . . . . . . c19602_2mgt 1 . 12 . 6410 . 2 1 15 HIS CA C 6.165 3.724 2.683 . . . 1.0 . . . . . . . . . . . . B . 14 HIS CA . . . . . . . . . c19602_2mgt 1 . 12 . 6411 . 2 1 15 HIS CB C 4.873 4.275 3.310 . . . 1.0 . . . . . . . . . . . . B . 14 HIS CB . . . . . . . . . c19602_2mgt 1 . 12 . 6412 . 2 1 15 HIS CD2 C 2.927 2.894 2.396 . . . 1.0 . . . . . . . . . . . . B . 14 HIS CD2 . . . . . . . . . c19602_2mgt 1 . 12 . 6413 . 2 1 15 HIS CE1 C 2.308 1.858 4.224 . . . 1.0 . . . . . . . . . . . . B . 14 HIS CE1 . . . . . . . . . c19602_2mgt 1 . 12 . 6414 . 2 1 15 HIS CG C 3.754 3.287 3.408 . . . 1.0 . . . . . . . . . . . . B . 14 HIS CG . . . . . . . . . c19602_2mgt 1 . 12 . 6415 . 2 1 15 HIS H H 6.244 2.524 0.929 . . . 1.0 . . . . . . . . . . . . B . 14 HIS H . . . . . . . . . c19602_2mgt 1 . 12 . 6416 . 2 1 15 HIS HA H 6.892 4.529 2.771 . . . 1.0 . . . . . . . . . . . . B . 14 HIS HA . . . . . . . . . c19602_2mgt 1 . 12 . 6417 . 2 1 15 HIS HB2 H 5.102 4.631 4.315 . . . 1.0 . . . . . . . . . . . . B . 14 HIS HB2 . . . . . . . . . c19602_2mgt 1 . 12 . 6418 . 2 1 15 HIS HB3 H 4.520 5.138 2.748 . . . 1.0 . . . . . . . . . . . . B . 14 HIS HB3 . . . . . . . . . c19602_2mgt 1 . 12 . 6419 . 2 1 15 HIS HD1 H 3.777 2.709 5.460 . . . 1.0 . . . . . . . . . . . . B . 14 HIS HD1 . . . . . . . . . c19602_2mgt 1 . 12 . 6420 . 2 1 15 HIS HD2 H 2.961 3.237 1.372 . . . 1.0 . . . . . . . . . . . . B . 14 HIS HD2 . . . . . . . . . c19602_2mgt 1 . 12 . 6421 . 2 1 15 HIS HE1 H 1.787 1.210 4.913 . . . 1.0 . . . . . . . . . . . . B . 14 HIS HE1 . . . . . . . . . c19602_2mgt 1 . 12 . 6422 . 2 1 15 HIS N N 6.038 3.462 1.249 . . . 1.0 . . . . . . . . . . . . B . 14 HIS N . . . . . . . . . c19602_2mgt 1 . 12 . 6423 . 2 1 15 HIS ND1 N 3.351 2.634 4.547 . . . 1.0 . . . . . . . . . . . . B . 14 HIS ND1 . . . . . . . . . c19602_2mgt 1 . 12 . 6424 . 2 1 15 HIS NE2 N 2.011 1.989 2.924 . . . 1.0 . . . . . . . . . . . . B . 14 HIS NE2 . . . . . . . . . c19602_2mgt 1 . 12 . 6425 . 2 1 15 HIS O O 7.003 2.689 4.661 . . . 1.0 . . . . . . . . . . . . B . 14 HIS O . . . . . . . . . c19602_2mgt 1 . 12 . 6426 . 2 1 16 GLN C C 9.429 0.824 3.208 . . . 1.0 . . . . . . . . . . . . B . 15 GLN C . . . . . . . . . c19602_2mgt 1 . 12 . 6427 . 2 1 16 GLN CA C 7.981 0.415 3.427 . . . 1.0 . . . . . . . . . . . . B . 15 GLN CA . . . . . . . . . c19602_2mgt 1 . 12 . 6428 . 2 1 16 GLN CB C 7.794 -0.971 2.823 . . . 1.0 . . . . . . . . . . . . B . 15 GLN CB . . . . . . . . . c19602_2mgt 1 . 12 . 6429 . 2 1 16 GLN CD C 6.261 -2.980 2.625 . . . 1.0 . . . . . . . . . . . . B . 15 GLN CD . . . . . . . . . c19602_2mgt 1 . 12 . 6430 . 2 1 16 GLN CG C 6.414 -1.550 3.127 . . . 1.0 . . . . . . . . . . . . B . 15 GLN CG . . . . . . . . . c19602_2mgt 1 . 12 . 6431 . 2 1 16 GLN H H 6.859 1.281 1.865 . . . 1.0 . . . . . . . . . . . . B . 15 GLN H . . . . . . . . . c19602_2mgt 1 . 12 . 6432 . 2 1 16 GLN HA H 7.776 0.355 4.494 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HA . . . . . . . . . c19602_2mgt 1 . 12 . 6433 . 2 1 16 GLN HB2 H 7.965 -0.919 1.751 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HB2 . . . . . . . . . c19602_2mgt 1 . 12 . 6434 . 2 1 16 GLN HB3 H 8.544 -1.634 3.254 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HB3 . . . . . . . . . c19602_2mgt 1 . 12 . 6435 . 2 1 16 GLN HE21 H 4.675 -3.296 3.859 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HE21 . . . . . . . . . c19602_2mgt 1 . 12 . 6436 . 2 1 16 GLN HE22 H 5.151 -4.652 2.859 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HE22 . . . . . . . . . c19602_2mgt 1 . 12 . 6437 . 2 1 16 GLN HG2 H 6.283 -1.556 4.204 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HG2 . . . . . . . . . c19602_2mgt 1 . 12 . 6438 . 2 1 16 GLN HG3 H 5.635 -0.927 2.690 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HG3 . . . . . . . . . c19602_2mgt 1 . 12 . 6439 . 2 1 16 GLN N N 7.093 1.407 2.835 . . . 1.0 . . . . . . . . . . . . B . 15 GLN N . . . . . . . . . c19602_2mgt 1 . 12 . 6440 . 2 1 16 GLN NE2 N 5.274 -3.694 3.152 . . . 1.0 . . . . . . . . . . . . B . 15 GLN NE2 . . . . . . . . . c19602_2mgt 1 . 12 . 6441 . 2 1 16 GLN O O 9.800 1.268 2.126 . . . 1.0 . . . . . . . . . . . . B . 15 GLN O . . . . . . . . . c19602_2mgt 1 . 12 . 6442 . 2 1 16 GLN OE1 O 7.021 -3.451 1.788 . . . 1.0 . . . . . . . . . . . . B . 15 GLN OE1 . . . . . . . . . c19602_2mgt 1 . 12 . 6443 . 2 1 17 LYS C C 12.496 0.268 3.235 . . . 1.0 . . . . . . . . . . . . B . 16 LYS C . . . . . . . . . c19602_2mgt 1 . 12 . 6444 . 2 1 17 LYS CA C 11.653 0.978 4.305 . . . 1.0 . . . . . . . . . . . . B . 16 LYS CA . . . . . . . . . c19602_2mgt 1 . 12 . 6445 . 2 1 17 LYS CB C 12.140 0.617 5.716 . . . 1.0 . . . . . . . . . . . . B . 16 LYS CB . . . . . . . . . c19602_2mgt 1 . 12 . 6446 . 2 1 17 LYS CD C 11.859 1.077 8.217 . . . 1.0 . . . . . . . . . . . . B . 16 LYS CD . . . . . . . . . c19602_2mgt 1 . 12 . 6447 . 2 1 17 LYS CE C 13.371 0.979 8.423 . . . 1.0 . . . . . . . . . . . . B . 16 LYS CE . . . . . . . . . c19602_2mgt 1 . 12 . 6448 . 2 1 17 LYS CG C 11.535 1.533 6.792 . . . 1.0 . . . . . . . . . . . . B . 16 LYS CG . . . . . . . . . c19602_2mgt 1 . 12 . 6449 . 2 1 17 LYS H H 9.856 0.152 5.046 . . . 1.0 . . . . . . . . . . . . B . 16 LYS H . . . . . . . . . c19602_2mgt 1 . 12 . 6450 . 2 1 17 LYS HA H 11.744 2.055 4.159 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HA . . . . . . . . . c19602_2mgt 1 . 12 . 6451 . 2 1 17 LYS HB2 H 11.896 -0.422 5.934 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HB2 . . . . . . . . . c19602_2mgt 1 . 12 . 6452 . 2 1 17 LYS HB3 H 13.218 0.724 5.750 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HB3 . . . . . . . . . c19602_2mgt 1 . 12 . 6453 . 2 1 17 LYS HD2 H 11.446 1.807 8.913 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HD2 . . . . . . . . . c19602_2mgt 1 . 12 . 6454 . 2 1 17 LYS HD3 H 11.400 0.107 8.408 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HD3 . . . . . . . . . c19602_2mgt 1 . 12 . 6455 . 2 1 17 LYS HE2 H 13.756 0.157 7.822 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HE2 . . . . . . . . . c19602_2mgt 1 . 12 . 6456 . 2 1 17 LYS HE3 H 13.834 1.906 8.089 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HE3 . . . . . . . . . c19602_2mgt 1 . 12 . 6457 . 2 1 17 LYS HG2 H 11.940 2.531 6.653 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HG2 . . . . . . . . . c19602_2mgt 1 . 12 . 6458 . 2 1 17 LYS HG3 H 10.452 1.582 6.687 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HG3 . . . . . . . . . c19602_2mgt 1 . 12 . 6459 . 2 1 17 LYS HZ1 H 14.710 0.648 9.934 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HZ1 . . . . . . . . . c19602_2mgt 1 . 12 . 6460 . 2 1 17 LYS HZ2 H 13.394 1.530 10.387 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HZ2 . . . . . . . . . c19602_2mgt 1 . 12 . 6461 . 2 1 17 LYS HZ3 H 13.252 -0.092 10.160 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HZ3 . . . . . . . . . c19602_2mgt 1 . 12 . 6462 . 2 1 17 LYS N N 10.247 0.604 4.233 . . . 1.0 . . . . . . . . . . . . B . 16 LYS N . . . . . . . . . c19602_2mgt 1 . 12 . 6463 . 2 1 17 LYS NZ N 13.710 0.746 9.832 . . . 1.0 . . . . . . . . . . . . B . 16 LYS NZ . . . . . . . . . c19602_2mgt 1 . 12 . 6464 . 2 1 17 LYS O O 13.419 0.851 2.675 . . . 1.0 . . . . . . . . . . . . B . 16 LYS O . . . . . . . . . c19602_2mgt 1 . 12 . 6465 . 2 1 18 NH2 HN1 H 12.697 -1.459 2.188 . . . 1.0 . . . . . . . . . . . . B . 17 NH2 HN1 . . . . . . . . . c19602_2mgt 1 . 12 . 6466 . 2 1 18 NH2 HN2 H 11.392 -1.431 3.358 . . . 1.0 . . . . . . . . . . . . B . 17 NH2 HN2 . . . . . . . . . c19602_2mgt 1 . 12 . 6467 . 2 1 18 NH2 N N 12.169 -0.977 2.901 . . . 1.0 . . . . . . . . . . . . B . 17 NH2 N . . . . . . . . . c19602_2mgt 1 . 12 . 6468 . 3 2 1 ZN ZN Zn 0.773 0.682 1.909 . . . 1.0 . . . . . . . . . . . . A . 101 ZN ZN . . . . . . . . . c19602_2mgt 1 . 13 . 6469 . 1 1 1 ACE C C -14.041 -4.554 -5.105 . . . 1.0 . . . . . . . . . . . . A . 0 ACE C . . . . . . . . . c19602_2mgt 1 . 13 . 6470 . 1 1 1 ACE CH3 C -13.237 -4.548 -6.393 . . . 1.0 . . . . . . . . . . . . A . 0 ACE CH3 . . . . . . . . . c19602_2mgt 1 . 13 . 6471 . 1 1 1 ACE H1 H -12.382 -3.884 -6.283 . . . 1.0 . . . . . . . . . . . . A . 0 ACE H1 . . . . . . . . . c19602_2mgt 1 . 13 . 6472 . 1 1 1 ACE H2 H -12.892 -5.557 -6.614 . . . 1.0 . . . . . . . . . . . . A . 0 ACE H2 . . . . . . . . . c19602_2mgt 1 . 13 . 6473 . 1 1 1 ACE H3 H -13.861 -4.197 -7.214 . . . 1.0 . . . . . . . . . . . . A . 0 ACE H3 . . . . . . . . . c19602_2mgt 1 . 13 . 6474 . 1 1 1 ACE O O -14.096 -5.572 -4.420 . . . 1.0 . . . . . . . . . . . . A . 0 ACE O . . . . . . . . . c19602_2mgt 1 . 13 . 6475 . 1 1 2 ASP C C -16.451 -2.111 -3.714 . . . 1.0 . . . . . . . . . . . . A . 1 ASP C . . . . . . . . . c19602_2mgt 1 . 13 . 6476 . 1 1 2 ASP CA C -15.484 -3.287 -3.582 . . . 1.0 . . . . . . . . . . . . A . 1 ASP CA . . . . . . . . . c19602_2mgt 1 . 13 . 6477 . 1 1 2 ASP CB C -14.558 -3.082 -2.375 . . . 1.0 . . . . . . . . . . . . A . 1 ASP CB . . . . . . . . . c19602_2mgt 1 . 13 . 6478 . 1 1 2 ASP CG C -15.165 -3.584 -1.084 . . . 1.0 . . . . . . . . . . . . A . 1 ASP CG . . . . . . . . . c19602_2mgt 1 . 13 . 6479 . 1 1 2 ASP H H -14.616 -2.627 -5.401 . . . 1.0 . . . . . . . . . . . . A . 1 ASP H . . . . . . . . . c19602_2mgt 1 . 13 . 6480 . 1 1 2 ASP HA H -16.055 -4.207 -3.441 . . . 1.0 . . . . . . . . . . . . A . 1 ASP HA . . . . . . . . . c19602_2mgt 1 . 13 . 6481 . 1 1 2 ASP HB2 H -13.611 -3.601 -2.534 . . . 1.0 . . . . . . . . . . . . A . 1 ASP HB2 . . . . . . . . . c19602_2mgt 1 . 13 . 6482 . 1 1 2 ASP HB3 H -14.363 -2.022 -2.252 . . . 1.0 . . . . . . . . . . . . A . 1 ASP HB3 . . . . . . . . . c19602_2mgt 1 . 13 . 6483 . 1 1 2 ASP N N -14.679 -3.424 -4.785 . . . 1.0 . . . . . . . . . . . . A . 1 ASP N . . . . . . . . . c19602_2mgt 1 . 13 . 6484 . 1 1 2 ASP O O -16.065 -1.022 -4.132 . . . 1.0 . . . . . . . . . . . . A . 1 ASP O . . . . . . . . . c19602_2mgt 1 . 13 . 6485 . 1 1 2 ASP OD1 O -16.228 -3.081 -0.699 . . . 1.0 . . . . . . . . . . . . A . 1 ASP OD1 . . . . . . . . . c19602_2mgt 1 . 13 . 6486 . 1 1 2 ASP OD2 O -14.525 -4.461 -0.467 . . . 1.0 . . . . . . . . . . . . A . 1 ASP OD2 . . . . . . . . . c19602_2mgt 1 . 13 . 6487 . 1 1 3 ALA C C -18.438 -0.254 -2.126 . . . 1.0 . . . . . . . . . . . . A . 2 ALA C . . . . . . . . . c19602_2mgt 1 . 13 . 6488 . 1 1 3 ALA CA C -18.708 -1.269 -3.232 . . . 1.0 . . . . . . . . . . . . A . 2 ALA CA . . . . . . . . . c19602_2mgt 1 . 13 . 6489 . 1 1 3 ALA CB C -20.067 -1.908 -2.948 . . . 1.0 . . . . . . . . . . . . A . 2 ALA CB . . . . . . . . . c19602_2mgt 1 . 13 . 6490 . 1 1 3 ALA H H -17.941 -3.225 -2.926 . . . 1.0 . . . . . . . . . . . . A . 2 ALA H . . . . . . . . . c19602_2mgt 1 . 13 . 6491 . 1 1 3 ALA HA H -18.751 -0.742 -4.183 . . . 1.0 . . . . . . . . . . . . A . 2 ALA HA . . . . . . . . . c19602_2mgt 1 . 13 . 6492 . 1 1 3 ALA HB1 H -20.826 -1.130 -2.892 . . . 1.0 . . . . . . . . . . . . A . 2 ALA HB1 . . . . . . . . . c19602_2mgt 1 . 13 . 6493 . 1 1 3 ALA HB2 H -20.321 -2.609 -3.740 . . . 1.0 . . . . . . . . . . . . A . 2 ALA HB2 . . . . . . . . . c19602_2mgt 1 . 13 . 6494 . 1 1 3 ALA HB3 H -20.038 -2.425 -1.988 . . . 1.0 . . . . . . . . . . . . A . 2 ALA HB3 . . . . . . . . . c19602_2mgt 1 . 13 . 6495 . 1 1 3 ALA N N -17.699 -2.317 -3.294 . . . 1.0 . . . . . . . . . . . . A . 2 ALA N . . . . . . . . . c19602_2mgt 1 . 13 . 6496 . 1 1 3 ALA O O -19.007 0.828 -2.165 . . . 1.0 . . . . . . . . . . . . A . 2 ALA O . . . . . . . . . c19602_2mgt 1 . 13 . 6497 . 1 1 4 GLU C C -16.612 0.195 0.969 . . . 1.0 . . . . . . . . . . . . A . 3 GLU C . . . . . . . . . c19602_2mgt 1 . 13 . 6498 . 1 1 4 GLU CA C -17.900 -0.196 0.251 . . . 1.0 . . . . . . . . . . . . A . 3 GLU CA . . . . . . . . . c19602_2mgt 1 . 13 . 6499 . 1 1 4 GLU CB C -18.573 -1.392 0.941 . . . 1.0 . . . . . . . . . . . . A . 3 GLU CB . . . . . . . . . c19602_2mgt 1 . 13 . 6500 . 1 1 4 GLU CD C -20.162 0.008 2.273 . . . 1.0 . . . . . . . . . . . . A . 3 GLU CD . . . . . . . . . c19602_2mgt 1 . 13 . 6501 . 1 1 4 GLU CG C -19.091 -1.067 2.332 . . . 1.0 . . . . . . . . . . . . A . 3 GLU CG . . . . . . . . . c19602_2mgt 1 . 13 . 6502 . 1 1 4 GLU H H -17.159 -1.501 -1.191 . . . 1.0 . . . . . . . . . . . . A . 3 GLU H . . . . . . . . . c19602_2mgt 1 . 13 . 6503 . 1 1 4 GLU HA H -18.576 0.658 0.253 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HA . . . . . . . . . c19602_2mgt 1 . 13 . 6504 . 1 1 4 GLU HB2 H -19.413 -1.733 0.333 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HB2 . . . . . . . . . c19602_2mgt 1 . 13 . 6505 . 1 1 4 GLU HB3 H -17.869 -2.215 1.029 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HB3 . . . . . . . . . c19602_2mgt 1 . 13 . 6506 . 1 1 4 GLU HG2 H -19.518 -1.976 2.741 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HG2 . . . . . . . . . c19602_2mgt 1 . 13 . 6507 . 1 1 4 GLU HG3 H -18.264 -0.748 2.965 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HG3 . . . . . . . . . c19602_2mgt 1 . 13 . 6508 . 1 1 4 GLU N N -17.652 -0.624 -1.112 . . . 1.0 . . . . . . . . . . . . A . 3 GLU N . . . . . . . . . c19602_2mgt 1 . 13 . 6509 . 1 1 4 GLU O O -16.622 1.169 1.712 . . . 1.0 . . . . . . . . . . . . A . 3 GLU O . . . . . . . . . c19602_2mgt 1 . 13 . 6510 . 1 1 4 GLU OE1 O -21.251 -0.305 1.736 . . . 1.0 . . . . . . . . . . . . A . 3 GLU OE1 . . . . . . . . . c19602_2mgt 1 . 13 . 6511 . 1 1 4 GLU OE2 O -19.899 1.132 2.715 . . . 1.0 . . . . . . . . . . . . A . 3 GLU OE2 . . . . . . . . . c19602_2mgt 1 . 13 . 6512 . 1 1 5 PHE C C -13.249 0.395 0.396 . . . 1.0 . . . . . . . . . . . . A . 4 PHE C . . . . . . . . . c19602_2mgt 1 . 13 . 6513 . 1 1 5 PHE CA C -14.210 -0.309 1.333 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CA . . . . . . . . . c19602_2mgt 1 . 13 . 6514 . 1 1 5 PHE CB C -13.592 -1.633 1.773 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CB . . . . . . . . . c19602_2mgt 1 . 13 . 6515 . 1 1 5 PHE CD1 C -15.411 -2.792 3.073 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CD1 . . . . . . . . . c19602_2mgt 1 . 13 . 6516 . 1 1 5 PHE CD2 C -13.585 -1.727 4.279 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CD2 . . . . . . . . . c19602_2mgt 1 . 13 . 6517 . 1 1 5 PHE CE1 C -16.004 -3.159 4.291 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CE1 . . . . . . . . . c19602_2mgt 1 . 13 . 6518 . 1 1 5 PHE CE2 C -14.175 -2.093 5.499 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CE2 . . . . . . . . . c19602_2mgt 1 . 13 . 6519 . 1 1 5 PHE CG C -14.192 -2.099 3.071 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CG . . . . . . . . . c19602_2mgt 1 . 13 . 6520 . 1 1 5 PHE CZ C -15.378 -2.821 5.506 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CZ . . . . . . . . . c19602_2mgt 1 . 13 . 6521 . 1 1 5 PHE H H -15.642 -1.388 0.197 . . . 1.0 . . . . . . . . . . . . A . 4 PHE H . . . . . . . . . c19602_2mgt 1 . 13 . 6522 . 1 1 5 PHE HA H -14.317 0.328 2.209 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HA . . . . . . . . . c19602_2mgt 1 . 13 . 6523 . 1 1 5 PHE HB2 H -13.728 -2.388 1.001 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HB2 . . . . . . . . . c19602_2mgt 1 . 13 . 6524 . 1 1 5 PHE HB3 H -12.518 -1.504 1.920 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HB3 . . . . . . . . . c19602_2mgt 1 . 13 . 6525 . 1 1 5 PHE HD1 H -15.897 -3.007 2.134 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HD1 . . . . . . . . . c19602_2mgt 1 . 13 . 6526 . 1 1 5 PHE HD2 H -12.693 -1.120 4.256 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HD2 . . . . . . . . . c19602_2mgt 1 . 13 . 6527 . 1 1 5 PHE HE1 H -16.951 -3.675 4.288 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HE1 . . . . . . . . . c19602_2mgt 1 . 13 . 6528 . 1 1 5 PHE HE2 H -13.722 -1.788 6.428 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HE2 . . . . . . . . . c19602_2mgt 1 . 13 . 6529 . 1 1 5 PHE HZ H -15.841 -3.086 6.444 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HZ . . . . . . . . . c19602_2mgt 1 . 13 . 6530 . 1 1 5 PHE N N -15.525 -0.552 0.747 . . . 1.0 . . . . . . . . . . . . A . 4 PHE N . . . . . . . . . c19602_2mgt 1 . 13 . 6531 . 1 1 5 PHE O O -12.347 1.058 0.899 . . . 1.0 . . . . . . . . . . . . A . 4 PHE O . . . . . . . . . c19602_2mgt 1 . 13 . 6532 . 1 1 6 ARG C C -13.218 2.454 -2.007 . . . 1.0 . . . . . . . . . . . . A . 5 ARG C . . . . . . . . . c19602_2mgt 1 . 13 . 6533 . 1 1 6 ARG CA C -12.682 1.020 -1.922 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CA . . . . . . . . . c19602_2mgt 1 . 13 . 6534 . 1 1 6 ARG CB C -12.703 0.270 -3.261 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CB . . . . . . . . . c19602_2mgt 1 . 13 . 6535 . 1 1 6 ARG CD C -10.330 -0.749 -2.965 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CD . . . . . . . . . c19602_2mgt 1 . 13 . 6536 . 1 1 6 ARG CG C -11.808 -0.983 -3.297 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CG . . . . . . . . . c19602_2mgt 1 . 13 . 6537 . 1 1 6 ARG CZ C -8.894 0.447 -4.644 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CZ . . . . . . . . . c19602_2mgt 1 . 13 . 6538 . 1 1 6 ARG H H -14.213 -0.278 -1.259 . . . 1.0 . . . . . . . . . . . . A . 5 ARG H . . . . . . . . . c19602_2mgt 1 . 13 . 6539 . 1 1 6 ARG HA H -11.652 1.090 -1.590 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HA . . . . . . . . . c19602_2mgt 1 . 13 . 6540 . 1 1 6 ARG HB2 H -13.730 -0.017 -3.475 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HB2 . . . . . . . . . c19602_2mgt 1 . 13 . 6541 . 1 1 6 ARG HB3 H -12.373 0.940 -4.053 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HB3 . . . . . . . . . c19602_2mgt 1 . 13 . 6542 . 1 1 6 ARG HD2 H -10.237 -0.606 -1.894 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HD2 . . . . . . . . . c19602_2mgt 1 . 13 . 6543 . 1 1 6 ARG HD3 H -9.766 -1.644 -3.223 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HD3 . . . . . . . . . c19602_2mgt 1 . 13 . 6544 . 1 1 6 ARG HE H -10.038 1.329 -3.243 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HE . . . . . . . . . c19602_2mgt 1 . 13 . 6545 . 1 1 6 ARG HG2 H -12.180 -1.714 -2.584 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HG2 . . . . . . . . . c19602_2mgt 1 . 13 . 6546 . 1 1 6 ARG HG3 H -11.875 -1.427 -4.288 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HG3 . . . . . . . . . c19602_2mgt 1 . 13 . 6547 . 1 1 6 ARG HH11 H -8.843 -1.567 -4.909 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH11 . . . . . . . . . c19602_2mgt 1 . 13 . 6548 . 1 1 6 ARG HH12 H -7.839 -0.640 -5.994 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH12 . . . . . . . . . c19602_2mgt 1 . 13 . 6549 . 1 1 6 ARG HH21 H -8.696 2.472 -4.667 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH21 . . . . . . . . . c19602_2mgt 1 . 13 . 6550 . 1 1 6 ARG HH22 H -7.739 1.611 -5.848 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH22 . . . . . . . . . c19602_2mgt 1 . 13 . 6551 . 1 1 6 ARG N N -13.445 0.285 -0.925 . . . 1.0 . . . . . . . . . . . . A . 5 ARG N . . . . . . . . . c19602_2mgt 1 . 13 . 6552 . 1 1 6 ARG NE N -9.767 0.437 -3.630 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NE . . . . . . . . . c19602_2mgt 1 . 13 . 6553 . 1 1 6 ARG NH1 N -8.495 -0.676 -5.229 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NH1 . . . . . . . . . c19602_2mgt 1 . 13 . 6554 . 1 1 6 ARG NH2 N -8.401 1.602 -5.087 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NH2 . . . . . . . . . c19602_2mgt 1 . 13 . 6555 . 1 1 6 ARG O O -13.768 2.870 -3.023 . . . 1.0 . . . . . . . . . . . . A . 5 ARG O . . . . . . . . . c19602_2mgt 1 . 13 . 6556 . 1 1 7 ARG C C -12.308 5.494 -0.882 . . . 1.0 . . . . . . . . . . . . A . 6 ARG C . . . . . . . . . c19602_2mgt 1 . 13 . 6557 . 1 1 7 ARG CA C -13.492 4.554 -0.695 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CA . . . . . . . . . c19602_2mgt 1 . 13 . 6558 . 1 1 7 ARG CB C -14.037 4.725 0.723 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CB . . . . . . . . . c19602_2mgt 1 . 13 . 6559 . 1 1 7 ARG CD C -16.392 4.177 -0.077 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CD . . . . . . . . . c19602_2mgt 1 . 13 . 6560 . 1 1 7 ARG CG C -15.296 3.902 0.954 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CG . . . . . . . . . c19602_2mgt 1 . 13 . 6561 . 1 1 7 ARG CZ C -18.845 4.140 0.417 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CZ . . . . . . . . . c19602_2mgt 1 . 13 . 6562 . 1 1 7 ARG H H -12.686 2.720 -0.082 . . . 1.0 . . . . . . . . . . . . A . 6 ARG H . . . . . . . . . c19602_2mgt 1 . 13 . 6563 . 1 1 7 ARG HA H -14.288 4.782 -1.395 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HA . . . . . . . . . c19602_2mgt 1 . 13 . 6564 . 1 1 7 ARG HB2 H -13.294 4.398 1.451 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HB2 . . . . . . . . . c19602_2mgt 1 . 13 . 6565 . 1 1 7 ARG HB3 H -14.265 5.777 0.886 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HB3 . . . . . . . . . c19602_2mgt 1 . 13 . 6566 . 1 1 7 ARG HD2 H -16.508 5.249 -0.214 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HD2 . . . . . . . . . c19602_2mgt 1 . 13 . 6567 . 1 1 7 ARG HD3 H -16.132 3.717 -1.032 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HD3 . . . . . . . . . c19602_2mgt 1 . 13 . 6568 . 1 1 7 ARG HE H -17.515 2.663 0.791 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HE . . . . . . . . . c19602_2mgt 1 . 13 . 6569 . 1 1 7 ARG HG2 H -15.022 2.848 0.922 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HG2 . . . . . . . . . c19602_2mgt 1 . 13 . 6570 . 1 1 7 ARG HG3 H -15.673 4.133 1.949 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HG3 . . . . . . . . . c19602_2mgt 1 . 13 . 6571 . 1 1 7 ARG HH11 H -18.347 5.871 -0.530 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH11 . . . . . . . . . c19602_2mgt 1 . 13 . 6572 . 1 1 7 ARG HH12 H -20.028 5.718 -0.084 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH12 . . . . . . . . . c19602_2mgt 1 . 13 . 6573 . 1 1 7 ARG HH21 H -19.694 2.568 1.388 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH21 . . . . . . . . . c19602_2mgt 1 . 13 . 6574 . 1 1 7 ARG HH22 H -20.775 3.877 0.979 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH22 . . . . . . . . . c19602_2mgt 1 . 13 . 6575 . 1 1 7 ARG N N -13.076 3.180 -0.893 . . . 1.0 . . . . . . . . . . . . A . 6 ARG N . . . . . . . . . c19602_2mgt 1 . 13 . 6576 . 1 1 7 ARG NE N -17.632 3.579 0.392 . . . 1.0 . . . . . . . . . . . . A . 6 ARG NE . . . . . . . . . c19602_2mgt 1 . 13 . 6577 . 1 1 7 ARG NH1 N -19.091 5.343 -0.094 . . . 1.0 . . . . . . . . . . . . A . 6 ARG NH1 . . . . . . . . . c19602_2mgt 1 . 13 . 6578 . 1 1 7 ARG NH2 N -19.847 3.477 0.977 . . . 1.0 . . . . . . . . . . . . A . 6 ARG NH2 . . . . . . . . . c19602_2mgt 1 . 13 . 6579 . 1 1 7 ARG O O -11.209 5.194 -0.421 . . . 1.0 . . . . . . . . . . . . A . 6 ARG O . . . . . . . . . c19602_2mgt 1 . 13 . 6580 . 1 1 8 ASP C C -11.144 8.345 -0.351 . . . 1.0 . . . . . . . . . . . . A . 7 ASP C . . . . . . . . . c19602_2mgt 1 . 13 . 6581 . 1 1 8 ASP CA C -11.519 7.674 -1.678 . . . 1.0 . . . . . . . . . . . . A . 7 ASP CA . . . . . . . . . c19602_2mgt 1 . 13 . 6582 . 1 1 8 ASP CB C -11.972 8.704 -2.721 . . . 1.0 . . . . . . . . . . . . A . 7 ASP CB . . . . . . . . . c19602_2mgt 1 . 13 . 6583 . 1 1 8 ASP CG C -13.020 9.684 -2.201 . . . 1.0 . . . . . . . . . . . . A . 7 ASP CG . . . . . . . . . c19602_2mgt 1 . 13 . 6584 . 1 1 8 ASP H H -13.473 6.856 -1.840 . . . 1.0 . . . . . . . . . . . . A . 7 ASP H . . . . . . . . . c19602_2mgt 1 . 13 . 6585 . 1 1 8 ASP HA H -10.632 7.183 -2.073 . . . 1.0 . . . . . . . . . . . . A . 7 ASP HA . . . . . . . . . c19602_2mgt 1 . 13 . 6586 . 1 1 8 ASP HB2 H -11.096 9.271 -3.031 . . . 1.0 . . . . . . . . . . . . A . 7 ASP HB2 . . . . . . . . . c19602_2mgt 1 . 13 . 6587 . 1 1 8 ASP HB3 H -12.366 8.183 -3.594 . . . 1.0 . . . . . . . . . . . . A . 7 ASP HB3 . . . . . . . . . c19602_2mgt 1 . 13 . 6588 . 1 1 8 ASP N N -12.546 6.658 -1.494 . . . 1.0 . . . . . . . . . . . . A . 7 ASP N . . . . . . . . . c19602_2mgt 1 . 13 . 6589 . 1 1 8 ASP O O -9.981 8.667 -0.155 . . . 1.0 . . . . . . . . . . . . A . 7 ASP O . . . . . . . . . c19602_2mgt 1 . 13 . 6590 . 1 1 8 ASP OD1 O -14.212 9.326 -2.187 . . . 1.0 . . . . . . . . . . . . A . 7 ASP OD1 . . . . . . . . . c19602_2mgt 1 . 13 . 6591 . 1 1 8 ASP OD2 O -12.625 10.799 -1.817 . . . 1.0 . . . . . . . . . . . . A . 7 ASP OD2 . . . . . . . . . c19602_2mgt 1 . 13 . 6592 . 1 1 9 SER C C -11.067 8.608 2.868 . . . 1.0 . . . . . . . . . . . . A . 8 SER C . . . . . . . . . c19602_2mgt 1 . 13 . 6593 . 1 1 9 SER CA C -11.929 9.298 1.797 . . . 1.0 . . . . . . . . . . . . A . 8 SER CA . . . . . . . . . c19602_2mgt 1 . 13 . 6594 . 1 1 9 SER CB C -13.291 9.711 2.368 . . . 1.0 . . . . . . . . . . . . A . 8 SER CB . . . . . . . . . c19602_2mgt 1 . 13 . 6595 . 1 1 9 SER H H -13.048 8.289 0.305 . . . 1.0 . . . . . . . . . . . . A . 8 SER H . . . . . . . . . c19602_2mgt 1 . 13 . 6596 . 1 1 9 SER HA H -11.408 10.209 1.519 . . . 1.0 . . . . . . . . . . . . A . 8 SER HA . . . . . . . . . c19602_2mgt 1 . 13 . 6597 . 1 1 9 SER HB2 H -13.890 8.826 2.560 . . . 1.0 . . . . . . . . . . . . A . 8 SER HB2 . . . . . . . . . c19602_2mgt 1 . 13 . 6598 . 1 1 9 SER HB3 H -13.154 10.255 3.301 . . . 1.0 . . . . . . . . . . . . A . 8 SER HB3 . . . . . . . . . c19602_2mgt 1 . 13 . 6599 . 1 1 9 SER HG H -13.889 11.456 1.764 . . . 1.0 . . . . . . . . . . . . A . 8 SER HG . . . . . . . . . c19602_2mgt 1 . 13 . 6600 . 1 1 9 SER N N -12.106 8.535 0.561 . . . 1.0 . . . . . . . . . . . . A . 8 SER N . . . . . . . . . c19602_2mgt 1 . 13 . 6601 . 1 1 9 SER O O -10.944 9.144 3.966 . . . 1.0 . . . . . . . . . . . . A . 8 SER O . . . . . . . . . c19602_2mgt 1 . 13 . 6602 . 1 1 9 SER OG O -13.974 10.545 1.463 . . . 1.0 . . . . . . . . . . . . A . 8 SER OG . . . . . . . . . c19602_2mgt 1 . 13 . 6603 . 1 1 10 GLY C C -8.063 7.375 2.433 . . . 1.0 . . . . . . . . . . . . A . 9 GLY C . . . . . . . . . c19602_2mgt 1 . 13 . 6604 . 1 1 10 GLY CA C -9.268 7.004 3.303 . . . 1.0 . . . . . . . . . . . . A . 9 GLY CA . . . . . . . . . c19602_2mgt 1 . 13 . 6605 . 1 1 10 GLY H H -10.495 7.105 1.626 . . . 1.0 . . . . . . . . . . . . A . 9 GLY H . . . . . . . . . c19602_2mgt 1 . 13 . 6606 . 1 1 10 GLY HA2 H -9.179 7.484 4.273 . . . 1.0 . . . . . . . . . . . . A . 9 GLY HA2 . . . . . . . . . c19602_2mgt 1 . 13 . 6607 . 1 1 10 GLY HA3 H -9.344 5.932 3.460 . . . 1.0 . . . . . . . . . . . . A . 9 GLY HA3 . . . . . . . . . c19602_2mgt 1 . 13 . 6608 . 1 1 10 GLY N N -10.428 7.468 2.567 . . . 1.0 . . . . . . . . . . . . A . 9 GLY N . . . . . . . . . c19602_2mgt 1 . 13 . 6609 . 1 1 10 GLY O O -7.925 8.530 2.045 . . . 1.0 . . . . . . . . . . . . A . 9 GLY O . . . . . . . . . c19602_2mgt 1 . 13 . 6610 . 1 1 11 TYR C C -5.865 4.441 1.822 . . . 1.0 . . . . . . . . . . . . A . 10 TYR C . . . . . . . . . c19602_2mgt 1 . 13 . 6611 . 1 1 11 TYR CA C -7.146 5.047 2.386 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CA . . . . . . . . . c19602_2mgt 1 . 13 . 6612 . 1 1 11 TYR CB C -8.343 4.327 1.744 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CB . . . . . . . . . c19602_2mgt 1 . 13 . 6613 . 1 1 11 TYR CD1 C -8.533 2.615 3.594 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CD1 . . . . . . . . . c19602_2mgt 1 . 13 . 6614 . 1 1 11 TYR CD2 C -10.561 3.509 2.596 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CD2 . . . . . . . . . c19602_2mgt 1 . 13 . 6615 . 1 1 11 TYR CE1 C -9.302 1.807 4.428 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CE1 . . . . . . . . . c19602_2mgt 1 . 13 . 6616 . 1 1 11 TYR CE2 C -11.341 2.674 3.407 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CE2 . . . . . . . . . c19602_2mgt 1 . 13 . 6617 . 1 1 11 TYR CG C -9.159 3.465 2.671 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CG . . . . . . . . . c19602_2mgt 1 . 13 . 6618 . 1 1 11 TYR CZ C -10.704 1.798 4.314 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CZ . . . . . . . . . c19602_2mgt 1 . 13 . 6619 . 1 1 11 TYR H H -6.543 6.718 1.333 . . . 1.0 . . . . . . . . . . . . A . 10 TYR H . . . . . . . . . c19602_2mgt 1 . 13 . 6620 . 1 1 11 TYR HA H -7.165 4.935 3.471 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HA . . . . . . . . . c19602_2mgt 1 . 13 . 6621 . 1 1 11 TYR HB2 H -9.021 5.055 1.312 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HB2 . . . . . . . . . c19602_2mgt 1 . 13 . 6622 . 1 1 11 TYR HB3 H -7.990 3.718 0.913 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HB3 . . . . . . . . . c19602_2mgt 1 . 13 . 6623 . 1 1 11 TYR HD1 H -7.466 2.566 3.678 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HD1 . . . . . . . . . c19602_2mgt 1 . 13 . 6624 . 1 1 11 TYR HD2 H -11.039 4.177 1.901 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HD2 . . . . . . . . . c19602_2mgt 1 . 13 . 6625 . 1 1 11 TYR HE1 H -8.805 1.210 5.165 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HE1 . . . . . . . . . c19602_2mgt 1 . 13 . 6626 . 1 1 11 TYR HE2 H -12.416 2.712 3.336 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HE2 . . . . . . . . . c19602_2mgt 1 . 13 . 6627 . 1 1 11 TYR HH H -10.880 0.451 5.702 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HH . . . . . . . . . c19602_2mgt 1 . 13 . 6628 . 1 1 11 TYR N N -7.181 6.453 2.057 . . . 1.0 . . . . . . . . . . . . A . 10 TYR N . . . . . . . . . c19602_2mgt 1 . 13 . 6629 . 1 1 11 TYR O O -5.345 4.894 0.803 . . . 1.0 . . . . . . . . . . . . A . 10 TYR O . . . . . . . . . c19602_2mgt 1 . 13 . 6630 . 1 1 11 TYR OH O -11.427 0.958 5.098 . . . 1.0 . . . . . . . . . . . . A . 10 TYR OH . . . . . . . . . c19602_2mgt 1 . 13 . 6631 . 1 1 12 GLU C C -5.457 0.953 2.038 . . . 1.0 . . . . . . . . . . . . A . 11 GLU C . . . . . . . . . c19602_2mgt 1 . 13 . 6632 . 1 1 12 GLU CA C -4.784 2.278 1.673 . . . 1.0 . . . . . . . . . . . . A . 11 GLU CA . . . . . . . . . c19602_2mgt 1 . 13 . 6633 . 1 1 12 GLU CB C -3.291 2.304 1.982 . . . 1.0 . . . . . . . . . . . . A . 11 GLU CB . . . . . . . . . c19602_2mgt 1 . 13 . 6634 . 1 1 12 GLU CD C -1.202 1.032 1.354 . . . 1.0 . . . . . . . . . . . . A . 11 GLU CD . . . . . . . . . c19602_2mgt 1 . 13 . 6635 . 1 1 12 GLU CG C -2.589 1.456 0.924 . . . 1.0 . . . . . . . . . . . . A . 11 GLU CG . . . . . . . . . c19602_2mgt 1 . 13 . 6636 . 1 1 12 GLU H H -5.845 3.057 3.298 . . . 1.0 . . . . . . . . . . . . A . 11 GLU H . . . . . . . . . c19602_2mgt 1 . 13 . 6637 . 1 1 12 GLU HA H -4.919 2.457 0.605 . . . 1.0 . . . . . . . . . . . . A . 11 GLU HA . . . . . . . . . c19602_2mgt 1 . 13 . 6638 . 1 1 12 GLU HB2 H -2.921 3.329 1.931 . . . 1.0 . . . . . . . . . . . . A . 11 GLU HB2 . . . . . . . . . c19602_2mgt 1 . 13 . 6639 . 1 1 12 GLU HB3 H -3.110 1.917 2.985 . . . 1.0 . . . . . . . . . . . . A . 11 GLU HB3 . . . . . . . . . c19602_2mgt 1 . 13 . 6640 . 1 1 12 GLU HG2 H -3.170 0.552 0.734 . . . 1.0 . . . . . . . . . . . . A . 11 GLU HG2 . . . . . . . . . c19602_2mgt 1 . 13 . 6641 . 1 1 12 GLU HG3 H -2.525 2.019 -0.001 . . . 1.0 . . . . . . . . . . . . A . 11 GLU HG3 . . . . . . . . . c19602_2mgt 1 . 13 . 6642 . 1 1 12 GLU N N -5.450 3.322 2.409 . . . 1.0 . . . . . . . . . . . . A . 11 GLU N . . . . . . . . . c19602_2mgt 1 . 13 . 6643 . 1 1 12 GLU O O -5.048 0.261 2.968 . . . 1.0 . . . . . . . . . . . . A . 11 GLU O . . . . . . . . . c19602_2mgt 1 . 13 . 6644 . 1 1 12 GLU OE1 O -0.476 1.857 1.949 . . . 1.0 . . . . . . . . . . . . A . 11 GLU OE1 . . . . . . . . . c19602_2mgt 1 . 13 . 6645 . 1 1 12 GLU OE2 O -0.875 -0.137 1.107 . . . 1.0 . . . . . . . . . . . . A . 11 GLU OE2 . . . . . . . . . c19602_2mgt 1 . 13 . 6646 . 1 1 13 VAL C C -6.577 -1.860 1.398 . . . 1.0 . . . . . . . . . . . . A . 12 VAL C . . . . . . . . . c19602_2mgt 1 . 13 . 6647 . 1 1 13 VAL CA C -7.362 -0.554 1.507 . . . 1.0 . . . . . . . . . . . . A . 12 VAL CA . . . . . . . . . c19602_2mgt 1 . 13 . 6648 . 1 1 13 VAL CB C -8.535 -0.552 0.500 . . . 1.0 . . . . . . . . . . . . A . 12 VAL CB . . . . . . . . . c19602_2mgt 1 . 13 . 6649 . 1 1 13 VAL CG1 C -9.541 -1.695 0.739 . . . 1.0 . . . . . . . . . . . . A . 12 VAL CG1 . . . . . . . . . c19602_2mgt 1 . 13 . 6650 . 1 1 13 VAL CG2 C -9.318 0.757 0.596 . . . 1.0 . . . . . . . . . . . . A . 12 VAL CG2 . . . . . . . . . c19602_2mgt 1 . 13 . 6651 . 1 1 13 VAL H H -6.770 1.214 0.524 . . . 1.0 . . . . . . . . . . . . A . 12 VAL H . . . . . . . . . c19602_2mgt 1 . 13 . 6652 . 1 1 13 VAL HA H -7.766 -0.465 2.511 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HA . . . . . . . . . c19602_2mgt 1 . 13 . 6653 . 1 1 13 VAL HB H -8.138 -0.644 -0.512 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HB . . . . . . . . . c19602_2mgt 1 . 13 . 6654 . 1 1 13 VAL HG11 H -9.848 -1.714 1.785 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HG11 . . . . . . . . . c19602_2mgt 1 . 13 . 6655 . 1 1 13 VAL HG12 H -10.426 -1.568 0.115 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HG12 . . . . . . . . . c19602_2mgt 1 . 13 . 6656 . 1 1 13 VAL HG13 H -9.094 -2.652 0.476 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HG13 . . . . . . . . . c19602_2mgt 1 . 13 . 6657 . 1 1 13 VAL HG21 H -9.751 0.850 1.589 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HG21 . . . . . . . . . c19602_2mgt 1 . 13 . 6658 . 1 1 13 VAL HG22 H -8.676 1.607 0.385 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HG22 . . . . . . . . . c19602_2mgt 1 . 13 . 6659 . 1 1 13 VAL HG23 H -10.101 0.754 -0.152 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HG23 . . . . . . . . . c19602_2mgt 1 . 13 . 6660 . 1 1 13 VAL N N -6.508 0.610 1.286 . . . 1.0 . . . . . . . . . . . . A . 12 VAL N . . . . . . . . . c19602_2mgt 1 . 13 . 6661 . 1 1 13 VAL O O -7.043 -2.877 1.897 . . . 1.0 . . . . . . . . . . . . A . 12 VAL O . . . . . . . . . c19602_2mgt 1 . 13 . 6662 . 1 1 14 HIS C C -4.071 -3.719 1.745 . . . 1.0 . . . . . . . . . . . . A . 13 HIS C . . . . . . . . . c19602_2mgt 1 . 13 . 6663 . 1 1 14 HIS CA C -4.635 -3.054 0.489 . . . 1.0 . . . . . . . . . . . . A . 13 HIS CA . . . . . . . . . c19602_2mgt 1 . 13 . 6664 . 1 1 14 HIS CB C -3.526 -2.754 -0.526 . . . 1.0 . . . . . . . . . . . . A . 13 HIS CB . . . . . . . . . c19602_2mgt 1 . 13 . 6665 . 1 1 14 HIS CD2 C -3.692 -0.682 -2.016 . . . 1.0 . . . . . . . . . . . . A . 13 HIS CD2 . . . . . . . . . c19602_2mgt 1 . 13 . 6666 . 1 1 14 HIS CE1 C -5.375 -1.262 -3.291 . . . 1.0 . . . . . . . . . . . . A . 13 HIS CE1 . . . . . . . . . c19602_2mgt 1 . 13 . 6667 . 1 1 14 HIS CG C -4.038 -1.965 -1.700 . . . 1.0 . . . . . . . . . . . . A . 13 HIS CG . . . . . . . . . c19602_2mgt 1 . 13 . 6668 . 1 1 14 HIS H H -5.050 -0.980 0.385 . . . 1.0 . . . . . . . . . . . . A . 13 HIS H . . . . . . . . . c19602_2mgt 1 . 13 . 6669 . 1 1 14 HIS HA H -5.338 -3.747 0.032 . . . 1.0 . . . . . . . . . . . . A . 13 HIS HA . . . . . . . . . c19602_2mgt 1 . 13 . 6670 . 1 1 14 HIS HB2 H -2.732 -2.192 -0.034 . . . 1.0 . . . . . . . . . . . . A . 13 HIS HB2 . . . . . . . . . c19602_2mgt 1 . 13 . 6671 . 1 1 14 HIS HB3 H -3.110 -3.696 -0.887 . . . 1.0 . . . . . . . . . . . . A . 13 HIS HB3 . . . . . . . . . c19602_2mgt 1 . 13 . 6672 . 1 1 14 HIS HD1 H -5.617 -3.176 -2.472 . . . 1.0 . . . . . . . . . . . . A . 13 HIS HD1 . . . . . . . . . c19602_2mgt 1 . 13 . 6673 . 1 1 14 HIS HD2 H -2.933 -0.091 -1.524 . . . 1.0 . . . . . . . . . . . . A . 13 HIS HD2 . . . . . . . . . c19602_2mgt 1 . 13 . 6674 . 1 1 14 HIS HE1 H -6.187 -1.227 -4.000 . . . 1.0 . . . . . . . . . . . . A . 13 HIS HE1 . . . . . . . . . c19602_2mgt 1 . 13 . 6675 . 1 1 14 HIS N N -5.393 -1.847 0.772 . . . 1.0 . . . . . . . . . . . . A . 13 HIS N . . . . . . . . . c19602_2mgt 1 . 13 . 6676 . 1 1 14 HIS ND1 N -5.087 -2.317 -2.518 . . . 1.0 . . . . . . . . . . . . A . 13 HIS ND1 . . . . . . . . . c19602_2mgt 1 . 13 . 6677 . 1 1 14 HIS NE2 N -4.545 -0.242 -3.030 . . . 1.0 . . . . . . . . . . . . A . 13 HIS NE2 . . . . . . . . . c19602_2mgt 1 . 13 . 6678 . 1 1 14 HIS O O -3.721 -4.890 1.662 . . . 1.0 . . . . . . . . . . . . A . 13 HIS O . . . . . . . . . c19602_2mgt 1 . 13 . 6679 . 1 1 15 HIS C C -4.983 -4.100 4.917 . . . 1.0 . . . . . . . . . . . . A . 14 HIS C . . . . . . . . . c19602_2mgt 1 . 13 . 6680 . 1 1 15 HIS CA C -3.722 -3.625 4.193 . . . 1.0 . . . . . . . . . . . . A . 14 HIS CA . . . . . . . . . c19602_2mgt 1 . 13 . 6681 . 1 1 15 HIS CB C -3.001 -2.614 5.084 . . . 1.0 . . . . . . . . . . . . A . 14 HIS CB . . . . . . . . . c19602_2mgt 1 . 13 . 6682 . 1 1 15 HIS CD2 C -1.315 -1.076 3.948 . . . 1.0 . . . . . . . . . . . . A . 14 HIS CD2 . . . . . . . . . c19602_2mgt 1 . 13 . 6683 . 1 1 15 HIS CE1 C 0.508 -2.260 4.151 . . . 1.0 . . . . . . . . . . . . A . 14 HIS CE1 . . . . . . . . . c19602_2mgt 1 . 13 . 6684 . 1 1 15 HIS CG C -1.639 -2.234 4.589 . . . 1.0 . . . . . . . . . . . . A . 14 HIS CG . . . . . . . . . c19602_2mgt 1 . 13 . 6685 . 1 1 15 HIS H H -4.318 -2.055 2.883 . . . 1.0 . . . . . . . . . . . . A . 14 HIS H . . . . . . . . . c19602_2mgt 1 . 13 . 6686 . 1 1 15 HIS HA H -3.069 -4.485 4.061 . . . 1.0 . . . . . . . . . . . . A . 14 HIS HA . . . . . . . . . c19602_2mgt 1 . 13 . 6687 . 1 1 15 HIS HB2 H -3.611 -1.721 5.178 . . . 1.0 . . . . . . . . . . . . A . 14 HIS HB2 . . . . . . . . . c19602_2mgt 1 . 13 . 6688 . 1 1 15 HIS HB3 H -2.884 -3.039 6.077 . . . 1.0 . . . . . . . . . . . . A . 14 HIS HB3 . . . . . . . . . c19602_2mgt 1 . 13 . 6689 . 1 1 15 HIS HD1 H -0.399 -3.880 5.135 . . . 1.0 . . . . . . . . . . . . A . 14 HIS HD1 . . . . . . . . . c19602_2mgt 1 . 13 . 6690 . 1 1 15 HIS HD2 H -2.008 -0.284 3.712 . . . 1.0 . . . . . . . . . . . . A . 14 HIS HD2 . . . . . . . . . c19602_2mgt 1 . 13 . 6691 . 1 1 15 HIS HE1 H 1.536 -2.575 4.104 . . . 1.0 . . . . . . . . . . . . A . 14 HIS HE1 . . . . . . . . . c19602_2mgt 1 . 13 . 6692 . 1 1 15 HIS N N -4.020 -3.022 2.892 . . . 1.0 . . . . . . . . . . . . A . 14 HIS N . . . . . . . . . c19602_2mgt 1 . 13 . 6693 . 1 1 15 HIS ND1 N -0.486 -2.969 4.707 . . . 1.0 . . . . . . . . . . . . A . 14 HIS ND1 . . . . . . . . . c19602_2mgt 1 . 13 . 6694 . 1 1 15 HIS NE2 N 0.052 -1.099 3.666 . . . 1.0 . . . . . . . . . . . . A . 14 HIS NE2 . . . . . . . . . c19602_2mgt 1 . 13 . 6695 . 1 1 15 HIS O O -4.878 -4.948 5.796 . . . 1.0 . . . . . . . . . . . . A . 14 HIS O . . . . . . . . . c19602_2mgt 1 . 13 . 6696 . 1 1 16 GLN C C -8.079 -5.121 4.571 . . . 1.0 . . . . . . . . . . . . A . 15 GLN C . . . . . . . . . c19602_2mgt 1 . 13 . 6697 . 1 1 16 GLN CA C -7.424 -3.903 5.221 . . . 1.0 . . . . . . . . . . . . A . 15 GLN CA . . . . . . . . . c19602_2mgt 1 . 13 . 6698 . 1 1 16 GLN CB C -8.365 -2.696 5.158 . . . 1.0 . . . . . . . . . . . . A . 15 GLN CB . . . . . . . . . c19602_2mgt 1 . 13 . 6699 . 1 1 16 GLN CD C -7.102 -1.558 7.104 . . . 1.0 . . . . . . . . . . . . A . 15 GLN CD . . . . . . . . . c19602_2mgt 1 . 13 . 6700 . 1 1 16 GLN CG C -7.777 -1.407 5.739 . . . 1.0 . . . . . . . . . . . . A . 15 GLN CG . . . . . . . . . c19602_2mgt 1 . 13 . 6701 . 1 1 16 GLN H H -6.192 -2.849 3.874 . . . 1.0 . . . . . . . . . . . . A . 15 GLN H . . . . . . . . . c19602_2mgt 1 . 13 . 6702 . 1 1 16 GLN HA H -7.233 -4.140 6.264 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HA . . . . . . . . . c19602_2mgt 1 . 13 . 6703 . 1 1 16 GLN HB2 H -8.643 -2.506 4.121 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HB2 . . . . . . . . . c19602_2mgt 1 . 13 . 6704 . 1 1 16 GLN HB3 H -9.278 -2.934 5.695 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HB3 . . . . . . . . . c19602_2mgt 1 . 13 . 6705 . 1 1 16 GLN HE21 H -8.623 -0.599 8.043 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HE21 . . . . . . . . . c19602_2mgt 1 . 13 . 6706 . 1 1 16 GLN HE22 H -7.320 -1.136 9.077 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HE22 . . . . . . . . . c19602_2mgt 1 . 13 . 6707 . 1 1 16 GLN HG2 H -7.063 -0.989 5.031 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HG2 . . . . . . . . . c19602_2mgt 1 . 13 . 6708 . 1 1 16 GLN HG3 H -8.602 -0.712 5.840 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HG3 . . . . . . . . . c19602_2mgt 1 . 13 . 6709 . 1 1 16 GLN N N -6.161 -3.565 4.581 . . . 1.0 . . . . . . . . . . . . A . 15 GLN N . . . . . . . . . c19602_2mgt 1 . 13 . 6710 . 1 1 16 GLN NE2 N -7.734 -1.066 8.159 . . . 1.0 . . . . . . . . . . . . A . 15 GLN NE2 . . . . . . . . . c19602_2mgt 1 . 13 . 6711 . 1 1 16 GLN O O -8.744 -5.892 5.251 . . . 1.0 . . . . . . . . . . . . A . 15 GLN O . . . . . . . . . c19602_2mgt 1 . 13 . 6712 . 1 1 16 GLN OE1 O -6.009 -2.101 7.214 . . . 1.0 . . . . . . . . . . . . A . 15 GLN OE1 . . . . . . . . . c19602_2mgt 1 . 13 . 6713 . 1 1 17 LYS C C -7.544 -6.586 1.195 . . . 1.0 . . . . . . . . . . . . A . 16 LYS C . . . . . . . . . c19602_2mgt 1 . 13 . 6714 . 1 1 17 LYS CA C -8.321 -6.466 2.507 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CA . . . . . . . . . c19602_2mgt 1 . 13 . 6715 . 1 1 17 LYS CB C -9.840 -6.406 2.278 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CB . . . . . . . . . c19602_2mgt 1 . 13 . 6716 . 1 1 17 LYS CD C -11.796 -5.237 1.135 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CD . . . . . . . . . c19602_2mgt 1 . 13 . 6717 . 1 1 17 LYS CE C -12.651 -5.238 2.398 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CE . . . . . . . . . c19602_2mgt 1 . 13 . 6718 . 1 1 17 LYS CG C -10.311 -5.160 1.504 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CG . . . . . . . . . c19602_2mgt 1 . 13 . 6719 . 1 1 17 LYS H H -7.342 -4.611 2.770 . . . 1.0 . . . . . . . . . . . . A . 16 LYS H . . . . . . . . . c19602_2mgt 1 . 13 . 6720 . 1 1 17 LYS HA H -8.114 -7.360 3.095 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HA . . . . . . . . . c19602_2mgt 1 . 13 . 6721 . 1 1 17 LYS HB2 H -10.141 -7.299 1.735 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HB2 . . . . . . . . . c19602_2mgt 1 . 13 . 6722 . 1 1 17 LYS HB3 H -10.335 -6.438 3.246 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HB3 . . . . . . . . . c19602_2mgt 1 . 13 . 6723 . 1 1 17 LYS HD2 H -12.056 -4.374 0.523 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HD2 . . . . . . . . . c19602_2mgt 1 . 13 . 6724 . 1 1 17 LYS HD3 H -11.984 -6.148 0.564 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HD3 . . . . . . . . . c19602_2mgt 1 . 13 . 6725 . 1 1 17 LYS HE2 H -12.312 -6.041 3.049 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HE2 . . . . . . . . . c19602_2mgt 1 . 13 . 6726 . 1 1 17 LYS HE3 H -12.542 -4.284 2.915 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HE3 . . . . . . . . . c19602_2mgt 1 . 13 . 6727 . 1 1 17 LYS HG2 H -10.144 -4.270 2.113 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HG2 . . . . . . . . . c19602_2mgt 1 . 13 . 6728 . 1 1 17 LYS HG3 H -9.741 -5.064 0.581 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HG3 . . . . . . . . . c19602_2mgt 1 . 13 . 6729 . 1 1 17 LYS HZ1 H -14.606 -5.414 2.957 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HZ1 . . . . . . . . . c19602_2mgt 1 . 13 . 6730 . 1 1 17 LYS HZ2 H -14.401 -4.796 1.441 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HZ2 . . . . . . . . . c19602_2mgt 1 . 13 . 6731 . 1 1 17 LYS HZ3 H -14.174 -6.403 1.720 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HZ3 . . . . . . . . . c19602_2mgt 1 . 13 . 6732 . 1 1 17 LYS N N -7.858 -5.318 3.271 . . . 1.0 . . . . . . . . . . . . A . 16 LYS N . . . . . . . . . c19602_2mgt 1 . 13 . 6733 . 1 1 17 LYS NZ N -14.062 -5.476 2.106 . . . 1.0 . . . . . . . . . . . . A . 16 LYS NZ . . . . . . . . . c19602_2mgt 1 . 13 . 6734 . 1 1 17 LYS O O -7.029 -5.609 0.659 . . . 1.0 . . . . . . . . . . . . A . 16 LYS O . . . . . . . . . c19602_2mgt 1 . 13 . 6735 . 1 1 18 NH2 HN1 H -6.949 -7.941 -0.191 . . . 1.0 . . . . . . . . . . . . A . 17 NH2 HN1 . . . . . . . . . c19602_2mgt 1 . 13 . 6736 . 1 1 18 NH2 HN2 H -7.891 -8.587 1.137 . . . 1.0 . . . . . . . . . . . . A . 17 NH2 HN2 . . . . . . . . . c19602_2mgt 1 . 13 . 6737 . 1 1 18 NH2 N N -7.459 -7.804 0.669 . . . 1.0 . . . . . . . . . . . . A . 17 NH2 N . . . . . . . . . c19602_2mgt 1 . 13 . 6738 . 2 1 1 ACE C C 15.211 7.740 -4.377 . . . 1.0 . . . . . . . . . . . . B . 0 ACE C . . . . . . . . . c19602_2mgt 1 . 13 . 6739 . 2 1 1 ACE CH3 C 14.698 7.887 -2.956 . . . 1.0 . . . . . . . . . . . . B . 0 ACE CH3 . . . . . . . . . c19602_2mgt 1 . 13 . 6740 . 2 1 1 ACE H1 H 14.899 8.893 -2.592 . . . 1.0 . . . . . . . . . . . . B . 0 ACE H1 . . . . . . . . . c19602_2mgt 1 . 13 . 6741 . 2 1 1 ACE H2 H 13.628 7.687 -2.933 . . . 1.0 . . . . . . . . . . . . B . 0 ACE H2 . . . . . . . . . c19602_2mgt 1 . 13 . 6742 . 2 1 1 ACE H3 H 15.217 7.186 -2.309 . . . 1.0 . . . . . . . . . . . . B . 0 ACE H3 . . . . . . . . . c19602_2mgt 1 . 13 . 6743 . 2 1 1 ACE O O 15.625 8.727 -4.974 . . . 1.0 . . . . . . . . . . . . B . 0 ACE O . . . . . . . . . c19602_2mgt 1 . 13 . 6744 . 2 1 2 ASP C C 15.208 4.829 -6.716 . . . 1.0 . . . . . . . . . . . . B . 1 ASP C . . . . . . . . . c19602_2mgt 1 . 13 . 6745 . 2 1 2 ASP CA C 15.757 6.163 -6.203 . . . 1.0 . . . . . . . . . . . . B . 1 ASP CA . . . . . . . . . c19602_2mgt 1 . 13 . 6746 . 2 1 2 ASP CB C 17.292 6.119 -6.110 . . . 1.0 . . . . . . . . . . . . B . 1 ASP CB . . . . . . . . . c19602_2mgt 1 . 13 . 6747 . 2 1 2 ASP CG C 17.958 5.802 -7.448 . . . 1.0 . . . . . . . . . . . . B . 1 ASP CG . . . . . . . . . c19602_2mgt 1 . 13 . 6748 . 2 1 2 ASP H H 14.822 5.749 -4.352 . . . 1.0 . . . . . . . . . . . . B . 1 ASP H . . . . . . . . . c19602_2mgt 1 . 13 . 6749 . 2 1 2 ASP HA H 15.477 6.943 -6.911 . . . 1.0 . . . . . . . . . . . . B . 1 ASP HA . . . . . . . . . c19602_2mgt 1 . 13 . 6750 . 2 1 2 ASP HB2 H 17.663 7.082 -5.760 . . . 1.0 . . . . . . . . . . . . B . 1 ASP HB2 . . . . . . . . . c19602_2mgt 1 . 13 . 6751 . 2 1 2 ASP HB3 H 17.578 5.356 -5.388 . . . 1.0 . . . . . . . . . . . . B . 1 ASP HB3 . . . . . . . . . c19602_2mgt 1 . 13 . 6752 . 2 1 2 ASP N N 15.187 6.511 -4.907 . . . 1.0 . . . . . . . . . . . . B . 1 ASP N . . . . . . . . . c19602_2mgt 1 . 13 . 6753 . 2 1 2 ASP O O 14.884 3.927 -5.944 . . . 1.0 . . . . . . . . . . . . B . 1 ASP O . . . . . . . . . c19602_2mgt 1 . 13 . 6754 . 2 1 2 ASP OD1 O 18.251 6.758 -8.188 . . . 1.0 . . . . . . . . . . . . B . 1 ASP OD1 . . . . . . . . . c19602_2mgt 1 . 13 . 6755 . 2 1 2 ASP OD2 O 18.174 4.607 -7.730 . . . 1.0 . . . . . . . . . . . . B . 1 ASP OD2 . . . . . . . . . c19602_2mgt 1 . 13 . 6756 . 2 1 3 ALA C C 15.295 2.233 -8.348 . . . 1.0 . . . . . . . . . . . . B . 2 ALA C . . . . . . . . . c19602_2mgt 1 . 13 . 6757 . 2 1 3 ALA CA C 14.757 3.575 -8.840 . . . 1.0 . . . . . . . . . . . . B . 2 ALA CA . . . . . . . . . c19602_2mgt 1 . 13 . 6758 . 2 1 3 ALA CB C 15.264 3.802 -10.265 . . . 1.0 . . . . . . . . . . . . B . 2 ALA CB . . . . . . . . . c19602_2mgt 1 . 13 . 6759 . 2 1 3 ALA H H 15.514 5.514 -8.574 . . . 1.0 . . . . . . . . . . . . B . 2 ALA H . . . . . . . . . c19602_2mgt 1 . 13 . 6760 . 2 1 3 ALA HA H 13.670 3.536 -8.852 . . . 1.0 . . . . . . . . . . . . B . 2 ALA HA . . . . . . . . . c19602_2mgt 1 . 13 . 6761 . 2 1 3 ALA HB1 H 14.960 2.969 -10.897 . . . 1.0 . . . . . . . . . . . . B . 2 ALA HB1 . . . . . . . . . c19602_2mgt 1 . 13 . 6762 . 2 1 3 ALA HB2 H 14.853 4.727 -10.663 . . . 1.0 . . . . . . . . . . . . B . 2 ALA HB2 . . . . . . . . . c19602_2mgt 1 . 13 . 6763 . 2 1 3 ALA HB3 H 16.354 3.869 -10.257 . . . 1.0 . . . . . . . . . . . . B . 2 ALA HB3 . . . . . . . . . c19602_2mgt 1 . 13 . 6764 . 2 1 3 ALA N N 15.180 4.720 -8.048 . . . 1.0 . . . . . . . . . . . . B . 2 ALA N . . . . . . . . . c19602_2mgt 1 . 13 . 6765 . 2 1 3 ALA O O 14.594 1.238 -8.466 . . . 1.0 . . . . . . . . . . . . B . 2 ALA O . . . . . . . . . c19602_2mgt 1 . 13 . 6766 . 2 1 4 GLU C C 16.512 0.124 -6.363 . . . 1.0 . . . . . . . . . . . . B . 3 GLU C . . . . . . . . . c19602_2mgt 1 . 13 . 6767 . 2 1 4 GLU CA C 17.199 0.952 -7.447 . . . 1.0 . . . . . . . . . . . . B . 3 GLU CA . . . . . . . . . c19602_2mgt 1 . 13 . 6768 . 2 1 4 GLU CB C 18.636 1.265 -7.032 . . . 1.0 . . . . . . . . . . . . B . 3 GLU CB . . . . . . . . . c19602_2mgt 1 . 13 . 6769 . 2 1 4 GLU CD C 20.134 2.289 -5.255 . . . 1.0 . . . . . . . . . . . . B . 3 GLU CD . . . . . . . . . c19602_2mgt 1 . 13 . 6770 . 2 1 4 GLU CG C 18.702 2.058 -5.719 . . . 1.0 . . . . . . . . . . . . B . 3 GLU CG . . . . . . . . . c19602_2mgt 1 . 13 . 6771 . 2 1 4 GLU H H 17.032 3.046 -7.710 . . . 1.0 . . . . . . . . . . . . B . 3 GLU H . . . . . . . . . c19602_2mgt 1 . 13 . 6772 . 2 1 4 GLU HA H 17.236 0.336 -8.342 . . . 1.0 . . . . . . . . . . . . B . 3 GLU HA . . . . . . . . . c19602_2mgt 1 . 13 . 6773 . 2 1 4 GLU HB2 H 19.175 0.327 -6.902 . . . 1.0 . . . . . . . . . . . . B . 3 GLU HB2 . . . . . . . . . c19602_2mgt 1 . 13 . 6774 . 2 1 4 GLU HB3 H 19.115 1.834 -7.829 . . . 1.0 . . . . . . . . . . . . B . 3 GLU HB3 . . . . . . . . . c19602_2mgt 1 . 13 . 6775 . 2 1 4 GLU HG2 H 18.191 3.010 -5.852 . . . 1.0 . . . . . . . . . . . . B . 3 GLU HG2 . . . . . . . . . c19602_2mgt 1 . 13 . 6776 . 2 1 4 GLU HG3 H 18.185 1.510 -4.936 . . . 1.0 . . . . . . . . . . . . B . 3 GLU HG3 . . . . . . . . . c19602_2mgt 1 . 13 . 6777 . 2 1 4 GLU N N 16.512 2.186 -7.799 . . . 1.0 . . . . . . . . . . . . B . 3 GLU N . . . . . . . . . c19602_2mgt 1 . 13 . 6778 . 2 1 4 GLU O O 16.802 -1.062 -6.286 . . . 1.0 . . . . . . . . . . . . B . 3 GLU O . . . . . . . . . c19602_2mgt 1 . 13 . 6779 . 2 1 4 GLU OE1 O 21.030 2.337 -6.117 . . . 1.0 . . . . . . . . . . . . B . 3 GLU OE1 . . . . . . . . . c19602_2mgt 1 . 13 . 6780 . 2 1 4 GLU OE2 O 20.339 2.408 -4.035 . . . 1.0 . . . . . . . . . . . . B . 3 GLU OE2 . . . . . . . . . c19602_2mgt 1 . 13 . 6781 . 2 1 5 PHE C C 13.316 0.068 -4.905 . . . 1.0 . . . . . . . . . . . . B . 4 PHE C . . . . . . . . . c19602_2mgt 1 . 13 . 6782 . 2 1 5 PHE CA C 14.812 -0.008 -4.571 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CA . . . . . . . . . c19602_2mgt 1 . 13 . 6783 . 2 1 5 PHE CB C 15.121 0.488 -3.166 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CB . . . . . . . . . c19602_2mgt 1 . 13 . 6784 . 2 1 5 PHE CD1 C 13.388 2.168 -2.427 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CD1 . . . . . . . . . c19602_2mgt 1 . 13 . 6785 . 2 1 5 PHE CD2 C 15.615 2.952 -3.031 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CD2 . . . . . . . . . c19602_2mgt 1 . 13 . 6786 . 2 1 5 PHE CE1 C 13.017 3.474 -2.081 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CE1 . . . . . . . . . c19602_2mgt 1 . 13 . 6787 . 2 1 5 PHE CE2 C 15.249 4.257 -2.671 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CE2 . . . . . . . . . c19602_2mgt 1 . 13 . 6788 . 2 1 5 PHE CG C 14.692 1.905 -2.881 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CG . . . . . . . . . c19602_2mgt 1 . 13 . 6789 . 2 1 5 PHE CZ C 13.951 4.517 -2.193 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CZ . . . . . . . . . c19602_2mgt 1 . 13 . 6790 . 2 1 5 PHE H H 15.500 1.709 -5.607 . . . 1.0 . . . . . . . . . . . . B . 4 PHE H . . . . . . . . . c19602_2mgt 1 . 13 . 6791 . 2 1 5 PHE HA H 15.082 -1.061 -4.586 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HA . . . . . . . . . c19602_2mgt 1 . 13 . 6792 . 2 1 5 PHE HB2 H 14.637 -0.177 -2.454 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HB2 . . . . . . . . . c19602_2mgt 1 . 13 . 6793 . 2 1 5 PHE HB3 H 16.193 0.406 -3.001 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HB3 . . . . . . . . . c19602_2mgt 1 . 13 . 6794 . 2 1 5 PHE HD1 H 12.679 1.360 -2.334 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HD1 . . . . . . . . . c19602_2mgt 1 . 13 . 6795 . 2 1 5 PHE HD2 H 16.605 2.746 -3.412 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HD2 . . . . . . . . . c19602_2mgt 1 . 13 . 6796 . 2 1 5 PHE HE1 H 12.016 3.677 -1.734 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HE1 . . . . . . . . . c19602_2mgt 1 . 13 . 6797 . 2 1 5 PHE HE2 H 15.973 5.052 -2.755 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HE2 . . . . . . . . . c19602_2mgt 1 . 13 . 6798 . 2 1 5 PHE HZ H 13.661 5.517 -1.915 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HZ . . . . . . . . . c19602_2mgt 1 . 13 . 6799 . 2 1 5 PHE N N 15.635 0.712 -5.540 . . . 1.0 . . . . . . . . . . . . B . 4 PHE N . . . . . . . . . c19602_2mgt 1 . 13 . 6800 . 2 1 5 PHE O O 12.495 -0.429 -4.137 . . . 1.0 . . . . . . . . . . . . B . 4 PHE O . . . . . . . . . c19602_2mgt 1 . 13 . 6801 . 2 1 6 ARG C C 11.437 -0.783 -7.349 . . . 1.0 . . . . . . . . . . . . B . 5 ARG C . . . . . . . . . c19602_2mgt 1 . 13 . 6802 . 2 1 6 ARG CA C 11.633 0.582 -6.650 . . . 1.0 . . . . . . . . . . . . B . 5 ARG CA . . . . . . . . . c19602_2mgt 1 . 13 . 6803 . 2 1 6 ARG CB C 11.481 1.795 -7.587 . . . 1.0 . . . . . . . . . . . . B . 5 ARG CB . . . . . . . . . c19602_2mgt 1 . 13 . 6804 . 2 1 6 ARG CD C 9.110 2.380 -6.765 . . . 1.0 . . . . . . . . . . . . B . 5 ARG CD . . . . . . . . . c19602_2mgt 1 . 13 . 6805 . 2 1 6 ARG CG C 10.028 2.101 -7.961 . . . 1.0 . . . . . . . . . . . . B . 5 ARG CG . . . . . . . . . c19602_2mgt 1 . 13 . 6806 . 2 1 6 ARG CZ C 8.865 4.373 -5.282 . . . 1.0 . . . . . . . . . . . . B . 5 ARG CZ . . . . . . . . . c19602_2mgt 1 . 13 . 6807 . 2 1 6 ARG H H 13.670 1.061 -6.642 . . . 1.0 . . . . . . . . . . . . B . 5 ARG H . . . . . . . . . c19602_2mgt 1 . 13 . 6808 . 2 1 6 ARG HA H 10.919 0.679 -5.838 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HA . . . . . . . . . c19602_2mgt 1 . 13 . 6809 . 2 1 6 ARG HB2 H 11.906 2.675 -7.105 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HB2 . . . . . . . . . c19602_2mgt 1 . 13 . 6810 . 2 1 6 ARG HB3 H 12.042 1.625 -8.505 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HB3 . . . . . . . . . c19602_2mgt 1 . 13 . 6811 . 2 1 6 ARG HD2 H 8.118 2.615 -7.140 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HD2 . . . . . . . . . c19602_2mgt 1 . 13 . 6812 . 2 1 6 ARG HD3 H 9.037 1.497 -6.132 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HD3 . . . . . . . . . c19602_2mgt 1 . 13 . 6813 . 2 1 6 ARG HE H 10.609 3.495 -5.797 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HE . . . . . . . . . c19602_2mgt 1 . 13 . 6814 . 2 1 6 ARG HG2 H 10.020 2.972 -8.614 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HG2 . . . . . . . . . c19602_2mgt 1 . 13 . 6815 . 2 1 6 ARG HG3 H 9.631 1.255 -8.516 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HG3 . . . . . . . . . c19602_2mgt 1 . 13 . 6816 . 2 1 6 ARG HH11 H 7.047 3.726 -5.933 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HH11 . . . . . . . . . c19602_2mgt 1 . 13 . 6817 . 2 1 6 ARG HH12 H 7.011 5.096 -4.848 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HH12 . . . . . . . . . c19602_2mgt 1 . 13 . 6818 . 2 1 6 ARG HH21 H 10.482 5.256 -4.428 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HH21 . . . . . . . . . c19602_2mgt 1 . 13 . 6819 . 2 1 6 ARG HH22 H 8.933 5.952 -4.010 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HH22 . . . . . . . . . c19602_2mgt 1 . 13 . 6820 . 2 1 6 ARG N N 12.959 0.642 -6.062 . . . 1.0 . . . . . . . . . . . . B . 5 ARG N . . . . . . . . . c19602_2mgt 1 . 13 . 6821 . 2 1 6 ARG NE N 9.609 3.476 -5.940 . . . 1.0 . . . . . . . . . . . . B . 5 ARG NE . . . . . . . . . c19602_2mgt 1 . 13 . 6822 . 2 1 6 ARG NH1 N 7.534 4.402 -5.362 . . . 1.0 . . . . . . . . . . . . B . 5 ARG NH1 . . . . . . . . . c19602_2mgt 1 . 13 . 6823 . 2 1 6 ARG NH2 N 9.475 5.262 -4.506 . . . 1.0 . . . . . . . . . . . . B . 5 ARG NH2 . . . . . . . . . c19602_2mgt 1 . 13 . 6824 . 2 1 6 ARG O O 11.089 -0.839 -8.524 . . . 1.0 . . . . . . . . . . . . B . 5 ARG O . . . . . . . . . c19602_2mgt 1 . 13 . 6825 . 2 1 7 ARG C C 11.003 -4.231 -6.928 . . . 1.0 . . . . . . . . . . . . B . 6 ARG C . . . . . . . . . c19602_2mgt 1 . 13 . 6826 . 2 1 7 ARG CA C 12.079 -3.187 -7.206 . . . 1.0 . . . . . . . . . . . . B . 6 ARG CA . . . . . . . . . c19602_2mgt 1 . 13 . 6827 . 2 1 7 ARG CB C 13.394 -3.687 -6.585 . . . 1.0 . . . . . . . . . . . . B . 6 ARG CB . . . . . . . . . c19602_2mgt 1 . 13 . 6828 . 2 1 7 ARG CD C 14.949 -2.823 -8.449 . . . 1.0 . . . . . . . . . . . . B . 6 ARG CD . . . . . . . . . c19602_2mgt 1 . 13 . 6829 . 2 1 7 ARG CG C 14.612 -2.850 -6.956 . . . 1.0 . . . . . . . . . . . . B . 6 ARG CG . . . . . . . . . c19602_2mgt 1 . 13 . 6830 . 2 1 7 ARG CZ C 13.764 -1.443 -10.189 . . . 1.0 . . . . . . . . . . . . B . 6 ARG CZ . . . . . . . . . c19602_2mgt 1 . 13 . 6831 . 2 1 7 ARG H H 12.015 -1.757 -5.679 . . . 1.0 . . . . . . . . . . . . B . 6 ARG H . . . . . . . . . c19602_2mgt 1 . 13 . 6832 . 2 1 7 ARG HA H 12.210 -3.096 -8.280 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HA . . . . . . . . . c19602_2mgt 1 . 13 . 6833 . 2 1 7 ARG HB2 H 13.296 -3.673 -5.498 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HB2 . . . . . . . . . c19602_2mgt 1 . 13 . 6834 . 2 1 7 ARG HB3 H 13.591 -4.712 -6.900 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HB3 . . . . . . . . . c19602_2mgt 1 . 13 . 6835 . 2 1 7 ARG HD2 H 16.032 -2.882 -8.559 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HD2 . . . . . . . . . c19602_2mgt 1 . 13 . 6836 . 2 1 7 ARG HD3 H 14.508 -3.690 -8.934 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HD3 . . . . . . . . . c19602_2mgt 1 . 13 . 6837 . 2 1 7 ARG HE H 14.793 -0.723 -8.611 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HE . . . . . . . . . c19602_2mgt 1 . 13 . 6838 . 2 1 7 ARG HG2 H 14.446 -1.836 -6.605 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HG2 . . . . . . . . . c19602_2mgt 1 . 13 . 6839 . 2 1 7 ARG HG3 H 15.465 -3.266 -6.426 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HG3 . . . . . . . . . c19602_2mgt 1 . 13 . 6840 . 2 1 7 ARG HH11 H 13.617 -3.423 -10.619 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HH11 . . . . . . . . . c19602_2mgt 1 . 13 . 6841 . 2 1 7 ARG HH12 H 12.822 -2.347 -11.746 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HH12 . . . . . . . . . c19602_2mgt 1 . 13 . 6842 . 2 1 7 ARG HH21 H 13.743 0.585 -10.112 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HH21 . . . . . . . . . c19602_2mgt 1 . 13 . 6843 . 2 1 7 ARG HH22 H 12.903 -0.117 -11.471 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HH22 . . . . . . . . . c19602_2mgt 1 . 13 . 6844 . 2 1 7 ARG N N 11.764 -1.878 -6.646 . . . 1.0 . . . . . . . . . . . . B . 6 ARG N . . . . . . . . . c19602_2mgt 1 . 13 . 6845 . 2 1 7 ARG NE N 14.503 -1.573 -9.076 . . . 1.0 . . . . . . . . . . . . B . 6 ARG NE . . . . . . . . . c19602_2mgt 1 . 13 . 6846 . 2 1 7 ARG NH1 N 13.366 -2.488 -10.907 . . . 1.0 . . . . . . . . . . . . B . 6 ARG NH1 . . . . . . . . . c19602_2mgt 1 . 13 . 6847 . 2 1 7 ARG NH2 N 13.410 -0.231 -10.605 . . . 1.0 . . . . . . . . . . . . B . 6 ARG NH2 . . . . . . . . . c19602_2mgt 1 . 13 . 6848 . 2 1 7 ARG O O 10.153 -4.072 -6.061 . . . 1.0 . . . . . . . . . . . . B . 6 ARG O . . . . . . . . . c19602_2mgt 1 . 13 . 6849 . 2 1 8 ASP C C 10.759 -7.156 -5.910 . . . 1.0 . . . . . . . . . . . . B . 7 ASP C . . . . . . . . . c19602_2mgt 1 . 13 . 6850 . 2 1 8 ASP CA C 10.420 -6.603 -7.303 . . . 1.0 . . . . . . . . . . . . B . 7 ASP CA . . . . . . . . . c19602_2mgt 1 . 13 . 6851 . 2 1 8 ASP CB C 10.836 -7.634 -8.355 . . . 1.0 . . . . . . . . . . . . B . 7 ASP CB . . . . . . . . . c19602_2mgt 1 . 13 . 6852 . 2 1 8 ASP CG C 12.290 -8.061 -8.169 . . . 1.0 . . . . . . . . . . . . B . 7 ASP CG . . . . . . . . . c19602_2mgt 1 . 13 . 6853 . 2 1 8 ASP H H 11.870 -5.434 -8.291 . . . 1.0 . . . . . . . . . . . . B . 7 ASP H . . . . . . . . . c19602_2mgt 1 . 13 . 6854 . 2 1 8 ASP HA H 9.350 -6.420 -7.369 . . . 1.0 . . . . . . . . . . . . B . 7 ASP HA . . . . . . . . . c19602_2mgt 1 . 13 . 6855 . 2 1 8 ASP HB2 H 10.195 -8.508 -8.253 . . . 1.0 . . . . . . . . . . . . B . 7 ASP HB2 . . . . . . . . . c19602_2mgt 1 . 13 . 6856 . 2 1 8 ASP HB3 H 10.707 -7.221 -9.353 . . . 1.0 . . . . . . . . . . . . B . 7 ASP HB3 . . . . . . . . . c19602_2mgt 1 . 13 . 6857 . 2 1 8 ASP N N 11.132 -5.370 -7.603 . . . 1.0 . . . . . . . . . . . . B . 7 ASP N . . . . . . . . . c19602_2mgt 1 . 13 . 6858 . 2 1 8 ASP O O 10.019 -7.973 -5.380 . . . 1.0 . . . . . . . . . . . . B . 7 ASP O . . . . . . . . . c19602_2mgt 1 . 13 . 6859 . 2 1 8 ASP OD1 O 13.197 -7.249 -8.442 . . . 1.0 . . . . . . . . . . . . B . 7 ASP OD1 . . . . . . . . . c19602_2mgt 1 . 13 . 6860 . 2 1 8 ASP OD2 O 12.490 -9.198 -7.713 . . . 1.0 . . . . . . . . . . . . B . 7 ASP OD2 . . . . . . . . . c19602_2mgt 1 . 13 . 6861 . 2 1 9 SER C C 11.884 -7.222 -2.871 . . . 1.0 . . . . . . . . . . . . B . 8 SER C . . . . . . . . . c19602_2mgt 1 . 13 . 6862 . 2 1 9 SER CA C 12.600 -7.332 -4.226 . . . 1.0 . . . . . . . . . . . . B . 8 SER CA . . . . . . . . . c19602_2mgt 1 . 13 . 6863 . 2 1 9 SER CB C 14.003 -6.719 -4.166 . . . 1.0 . . . . . . . . . . . . B . 8 SER CB . . . . . . . . . c19602_2mgt 1 . 13 . 6864 . 2 1 9 SER H H 12.457 -6.117 -5.924 . . . 1.0 . . . . . . . . . . . . B . 8 SER H . . . . . . . . . c19602_2mgt 1 . 13 . 6865 . 2 1 9 SER HA H 12.715 -8.390 -4.441 . . . 1.0 . . . . . . . . . . . . B . 8 SER HA . . . . . . . . . c19602_2mgt 1 . 13 . 6866 . 2 1 9 SER HB2 H 13.930 -5.656 -3.935 . . . 1.0 . . . . . . . . . . . . B . 8 SER HB2 . . . . . . . . . c19602_2mgt 1 . 13 . 6867 . 2 1 9 SER HB3 H 14.590 -7.217 -3.393 . . . 1.0 . . . . . . . . . . . . B . 8 SER HB3 . . . . . . . . . c19602_2mgt 1 . 13 . 6868 . 2 1 9 SER HG H 15.528 -6.494 -5.354 . . . 1.0 . . . . . . . . . . . . B . 8 SER HG . . . . . . . . . c19602_2mgt 1 . 13 . 6869 . 2 1 9 SER N N 11.902 -6.738 -5.358 . . . 1.0 . . . . . . . . . . . . B . 8 SER N . . . . . . . . . c19602_2mgt 1 . 13 . 6870 . 2 1 9 SER O O 12.482 -7.577 -1.859 . . . 1.0 . . . . . . . . . . . . B . 8 SER O . . . . . . . . . c19602_2mgt 1 . 13 . 6871 . 2 1 9 SER OG O 14.649 -6.881 -5.411 . . . 1.0 . . . . . . . . . . . . B . 8 SER OG . . . . . . . . . c19602_2mgt 1 . 13 . 6872 . 2 1 10 GLY C C 8.373 -7.129 -2.115 . . . 1.0 . . . . . . . . . . . . B . 9 GLY C . . . . . . . . . c19602_2mgt 1 . 13 . 6873 . 2 1 10 GLY CA C 9.774 -6.710 -1.668 . . . 1.0 . . . . . . . . . . . . B . 9 GLY CA . . . . . . . . . c19602_2mgt 1 . 13 . 6874 . 2 1 10 GLY H H 10.181 -6.500 -3.706 . . . 1.0 . . . . . . . . . . . . B . 9 GLY H . . . . . . . . . c19602_2mgt 1 . 13 . 6875 . 2 1 10 GLY HA2 H 10.131 -7.377 -0.890 . . . 1.0 . . . . . . . . . . . . B . 9 GLY HA2 . . . . . . . . . c19602_2mgt 1 . 13 . 6876 . 2 1 10 GLY HA3 H 9.782 -5.700 -1.273 . . . 1.0 . . . . . . . . . . . . B . 9 GLY HA3 . . . . . . . . . c19602_2mgt 1 . 13 . 6877 . 2 1 10 GLY N N 10.633 -6.746 -2.836 . . . 1.0 . . . . . . . . . . . . B . 9 GLY N . . . . . . . . . c19602_2mgt 1 . 13 . 6878 . 2 1 10 GLY O O 8.177 -8.304 -2.397 . . . 1.0 . . . . . . . . . . . . B . 9 GLY O . . . . . . . . . c19602_2mgt 1 . 13 . 6879 . 2 1 11 TYR C C 6.034 -4.251 -1.716 . . . 1.0 . . . . . . . . . . . . B . 10 TYR C . . . . . . . . . c19602_2mgt 1 . 13 . 6880 . 2 1 11 TYR CA C 7.430 -4.852 -1.797 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CA . . . . . . . . . c19602_2mgt 1 . 13 . 6881 . 2 1 11 TYR CB C 8.256 -4.019 -2.789 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CB . . . . . . . . . c19602_2mgt 1 . 13 . 6882 . 2 1 11 TYR CD1 C 9.336 -2.621 -0.978 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CD1 . . . . . . . . . c19602_2mgt 1 . 13 . 6883 . 2 1 11 TYR CD2 C 10.697 -3.410 -2.833 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CD2 . . . . . . . . . c19602_2mgt 1 . 13 . 6884 . 2 1 11 TYR CE1 C 10.432 -1.931 -0.449 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CE1 . . . . . . . . . c19602_2mgt 1 . 13 . 6885 . 2 1 11 TYR CE2 C 11.802 -2.728 -2.313 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CE2 . . . . . . . . . c19602_2mgt 1 . 13 . 6886 . 2 1 11 TYR CG C 9.456 -3.335 -2.182 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CG . . . . . . . . . c19602_2mgt 1 . 13 . 6887 . 2 1 11 TYR CZ C 11.665 -1.969 -1.132 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CZ . . . . . . . . . c19602_2mgt 1 . 13 . 6888 . 2 1 11 TYR H H 6.536 -6.493 -2.680 . . . 1.0 . . . . . . . . . . . . B . 10 TYR H . . . . . . . . . c19602_2mgt 1 . 13 . 6889 . 2 1 11 TYR HA H 7.876 -4.814 -0.804 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HA . . . . . . . . . c19602_2mgt 1 . 13 . 6890 . 2 1 11 TYR HB2 H 8.583 -4.636 -3.623 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HB2 . . . . . . . . . c19602_2mgt 1 . 13 . 6891 . 2 1 11 TYR HB3 H 7.616 -3.253 -3.223 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HB3 . . . . . . . . . c19602_2mgt 1 . 13 . 6892 . 2 1 11 TYR HD1 H 8.402 -2.602 -0.451 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HD1 . . . . . . . . . c19602_2mgt 1 . 13 . 6893 . 2 1 11 TYR HD2 H 10.807 -3.999 -3.726 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HD2 . . . . . . . . . c19602_2mgt 1 . 13 . 6894 . 2 1 11 TYR HE1 H 10.325 -1.384 0.474 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HE1 . . . . . . . . . c19602_2mgt 1 . 13 . 6895 . 2 1 11 TYR HE2 H 12.757 -2.795 -2.811 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HE2 . . . . . . . . . c19602_2mgt 1 . 13 . 6896 . 2 1 11 TYR HH H 12.533 -0.834 0.180 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HH . . . . . . . . . c19602_2mgt 1 . 13 . 6897 . 2 1 11 TYR N N 7.385 -6.231 -2.216 . . . 1.0 . . . . . . . . . . . . B . 10 TYR N . . . . . . . . . c19602_2mgt 1 . 13 . 6898 . 2 1 11 TYR O O 5.166 -4.520 -2.545 . . . 1.0 . . . . . . . . . . . . B . 10 TYR O . . . . . . . . . c19602_2mgt 1 . 13 . 6899 . 2 1 11 TYR OH O 12.733 -1.300 -0.636 . . . 1.0 . . . . . . . . . . . . B . 10 TYR OH . . . . . . . . . c19602_2mgt 1 . 13 . 6900 . 2 1 12 GLU C C 6.306 -0.957 -0.714 . . . 1.0 . . . . . . . . . . . . B . 11 GLU C . . . . . . . . . c19602_2mgt 1 . 13 . 6901 . 2 1 12 GLU CA C 5.281 -2.036 -1.076 . . . 1.0 . . . . . . . . . . . . B . 11 GLU CA . . . . . . . . . c19602_2mgt 1 . 13 . 6902 . 2 1 12 GLU CB C 4.015 -1.904 -0.242 . . . 1.0 . . . . . . . . . . . . B . 11 GLU CB . . . . . . . . . c19602_2mgt 1 . 13 . 6903 . 2 1 12 GLU CD C 2.202 -0.238 0.430 . . . 1.0 . . . . . . . . . . . . B . 11 GLU CD . . . . . . . . . c19602_2mgt 1 . 13 . 6904 . 2 1 12 GLU CG C 3.217 -0.655 -0.627 . . . 1.0 . . . . . . . . . . . . B . 11 GLU CG . . . . . . . . . c19602_2mgt 1 . 13 . 6905 . 2 1 12 GLU H H 6.621 -3.253 -0.072 . . . 1.0 . . . . . . . . . . . . B . 11 GLU H . . . . . . . . . c19602_2mgt 1 . 13 . 6906 . 2 1 12 GLU HA H 5.030 -1.988 -2.136 . . . 1.0 . . . . . . . . . . . . B . 11 GLU HA . . . . . . . . . c19602_2mgt 1 . 13 . 6907 . 2 1 12 GLU HB2 H 3.395 -2.782 -0.400 . . . 1.0 . . . . . . . . . . . . B . 11 GLU HB2 . . . . . . . . . c19602_2mgt 1 . 13 . 6908 . 2 1 12 GLU HB3 H 4.303 -1.871 0.806 . . . 1.0 . . . . . . . . . . . . B . 11 GLU HB3 . . . . . . . . . c19602_2mgt 1 . 13 . 6909 . 2 1 12 GLU HG2 H 3.899 0.183 -0.774 . . . 1.0 . . . . . . . . . . . . B . 11 GLU HG2 . . . . . . . . . c19602_2mgt 1 . 13 . 6910 . 2 1 12 GLU HG3 H 2.700 -0.841 -1.568 . . . 1.0 . . . . . . . . . . . . B . 11 GLU HG3 . . . . . . . . . c19602_2mgt 1 . 13 . 6911 . 2 1 12 GLU N N 5.912 -3.303 -0.788 . . . 1.0 . . . . . . . . . . . . B . 11 GLU N . . . . . . . . . c19602_2mgt 1 . 13 . 6912 . 2 1 12 GLU O O 6.772 -0.899 0.423 . . . 1.0 . . . . . . . . . . . . B . 11 GLU O . . . . . . . . . c19602_2mgt 1 . 13 . 6913 . 2 1 12 GLU OE1 O 1.821 -1.066 1.283 . . . 1.0 . . . . . . . . . . . . B . 11 GLU OE1 . . . . . . . . . c19602_2mgt 1 . 13 . 6914 . 2 1 12 GLU OE2 O 1.801 0.931 0.395 . . . 1.0 . . . . . . . . . . . . B . 11 GLU OE2 . . . . . . . . . c19602_2mgt 1 . 13 . 6915 . 2 1 13 VAL C C 7.081 2.205 -1.007 . . . 1.0 . . . . . . . . . . . . B . 12 VAL C . . . . . . . . . c19602_2mgt 1 . 13 . 6916 . 2 1 13 VAL CA C 7.689 0.910 -1.567 . . . 1.0 . . . . . . . . . . . . B . 12 VAL CA . . . . . . . . . c19602_2mgt 1 . 13 . 6917 . 2 1 13 VAL CB C 8.391 1.143 -2.927 . . . 1.0 . . . . . . . . . . . . B . 12 VAL CB . . . . . . . . . c19602_2mgt 1 . 13 . 6918 . 2 1 13 VAL CG1 C 9.587 2.098 -2.787 . . . 1.0 . . . . . . . . . . . . B . 12 VAL CG1 . . . . . . . . . c19602_2mgt 1 . 13 . 6919 . 2 1 13 VAL CG2 C 8.953 -0.164 -3.500 . . . 1.0 . . . . . . . . . . . . B . 12 VAL CG2 . . . . . . . . . c19602_2mgt 1 . 13 . 6920 . 2 1 13 VAL H H 6.231 -0.209 -2.589 . . . 1.0 . . . . . . . . . . . . B . 12 VAL H . . . . . . . . . c19602_2mgt 1 . 13 . 6921 . 2 1 13 VAL HA H 8.448 0.540 -0.894 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HA . . . . . . . . . c19602_2mgt 1 . 13 . 6922 . 2 1 13 VAL HB H 7.677 1.562 -3.638 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HB . . . . . . . . . c19602_2mgt 1 . 13 . 6923 . 2 1 13 VAL HG11 H 10.190 2.094 -3.694 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HG11 . . . . . . . . . c19602_2mgt 1 . 13 . 6924 . 2 1 13 VAL HG12 H 9.231 3.110 -2.619 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HG12 . . . . . . . . . c19602_2mgt 1 . 13 . 6925 . 2 1 13 VAL HG13 H 10.217 1.791 -1.952 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HG13 . . . . . . . . . c19602_2mgt 1 . 13 . 6926 . 2 1 13 VAL HG21 H 9.378 0.012 -4.484 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HG21 . . . . . . . . . c19602_2mgt 1 . 13 . 6927 . 2 1 13 VAL HG22 H 9.729 -0.551 -2.845 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HG22 . . . . . . . . . c19602_2mgt 1 . 13 . 6928 . 2 1 13 VAL HG23 H 8.160 -0.900 -3.605 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HG23 . . . . . . . . . c19602_2mgt 1 . 13 . 6929 . 2 1 13 VAL N N 6.667 -0.120 -1.688 . . . 1.0 . . . . . . . . . . . . B . 12 VAL N . . . . . . . . . c19602_2mgt 1 . 13 . 6930 . 2 1 13 VAL O O 7.809 3.024 -0.451 . . . 1.0 . . . . . . . . . . . . B . 12 VAL O . . . . . . . . . c19602_2mgt 1 . 13 . 6931 . 2 1 14 HIS C C 5.258 4.475 0.172 . . . 1.0 . . . . . . . . . . . . B . 13 HIS C . . . . . . . . . c19602_2mgt 1 . 13 . 6932 . 2 1 14 HIS CA C 5.118 3.704 -1.139 . . . 1.0 . . . . . . . . . . . . B . 13 HIS CA . . . . . . . . . c19602_2mgt 1 . 13 . 6933 . 2 1 14 HIS CB C 3.625 3.561 -1.458 . . . 1.0 . . . . . . . . . . . . B . 13 HIS CB . . . . . . . . . c19602_2mgt 1 . 13 . 6934 . 2 1 14 HIS CD2 C 4.065 2.750 -3.862 . . . 1.0 . . . . . . . . . . . . B . 13 HIS CD2 . . . . . . . . . c19602_2mgt 1 . 13 . 6935 . 2 1 14 HIS CE1 C 2.199 1.676 -4.247 . . . 1.0 . . . . . . . . . . . . B . 13 HIS CE1 . . . . . . . . . c19602_2mgt 1 . 13 . 6936 . 2 1 14 HIS CG C 3.294 2.838 -2.737 . . . 1.0 . . . . . . . . . . . . B . 13 HIS CG . . . . . . . . . c19602_2mgt 1 . 13 . 6937 . 2 1 14 HIS H H 5.212 1.640 -1.546 . . . 1.0 . . . . . . . . . . . . B . 13 HIS H . . . . . . . . . c19602_2mgt 1 . 13 . 6938 . 2 1 14 HIS HA H 5.607 4.282 -1.917 . . . 1.0 . . . . . . . . . . . . B . 13 HIS HA . . . . . . . . . c19602_2mgt 1 . 13 . 6939 . 2 1 14 HIS HB2 H 3.144 3.035 -0.634 . . . 1.0 . . . . . . . . . . . . B . 13 HIS HB2 . . . . . . . . . c19602_2mgt 1 . 13 . 6940 . 2 1 14 HIS HB3 H 3.185 4.558 -1.516 . . . 1.0 . . . . . . . . . . . . B . 13 HIS HB3 . . . . . . . . . c19602_2mgt 1 . 13 . 6941 . 2 1 14 HIS HD1 H 1.347 2.055 -2.368 . . . 1.0 . . . . . . . . . . . . B . 13 HIS HD1 . . . . . . . . . c19602_2mgt 1 . 13 . 6942 . 2 1 14 HIS HD2 H 5.050 3.178 -3.991 . . . 1.0 . . . . . . . . . . . . B . 13 HIS HD2 . . . . . . . . . c19602_2mgt 1 . 13 . 6943 . 2 1 14 HIS HE1 H 1.427 1.102 -4.729 . . . 1.0 . . . . . . . . . . . . B . 13 HIS HE1 . . . . . . . . . c19602_2mgt 1 . 13 . 6944 . 2 1 14 HIS N N 5.758 2.393 -1.155 . . . 1.0 . . . . . . . . . . . . B . 13 HIS N . . . . . . . . . c19602_2mgt 1 . 13 . 6945 . 2 1 14 HIS ND1 N 2.129 2.159 -2.998 . . . 1.0 . . . . . . . . . . . . B . 13 HIS ND1 . . . . . . . . . c19602_2mgt 1 . 13 . 6946 . 2 1 14 HIS NE2 N 3.362 2.009 -4.817 . . . 1.0 . . . . . . . . . . . . B . 13 HIS NE2 . . . . . . . . . c19602_2mgt 1 . 13 . 6947 . 2 1 14 HIS O O 5.273 5.701 0.147 . . . 1.0 . . . . . . . . . . . . B . 13 HIS O . . . . . . . . . c19602_2mgt 1 . 13 . 6948 . 2 1 15 HIS C C 6.570 3.458 3.419 . . . 1.0 . . . . . . . . . . . . B . 14 HIS C . . . . . . . . . c19602_2mgt 1 . 13 . 6949 . 2 1 15 HIS CA C 5.582 4.325 2.626 . . . 1.0 . . . . . . . . . . . . B . 14 HIS CA . . . . . . . . . c19602_2mgt 1 . 13 . 6950 . 2 1 15 HIS CB C 4.234 4.513 3.340 . . . 1.0 . . . . . . . . . . . . B . 14 HIS CB . . . . . . . . . c19602_2mgt 1 . 13 . 6951 . 2 1 15 HIS CD2 C 2.628 2.609 2.760 . . . 1.0 . . . . . . . . . . . . B . 14 HIS CD2 . . . . . . . . . c19602_2mgt 1 . 13 . 6952 . 2 1 15 HIS CE1 C 2.513 1.567 4.678 . . . 1.0 . . . . . . . . . . . . B . 14 HIS CE1 . . . . . . . . . c19602_2mgt 1 . 13 . 6953 . 2 1 15 HIS CG C 3.458 3.253 3.628 . . . 1.0 . . . . . . . . . . . . B . 14 HIS CG . . . . . . . . . c19602_2mgt 1 . 13 . 6954 . 2 1 15 HIS H H 5.351 2.758 1.219 . . . 1.0 . . . . . . . . . . . . B . 14 HIS H . . . . . . . . . c19602_2mgt 1 . 13 . 6955 . 2 1 15 HIS HA H 6.041 5.307 2.518 . . . 1.0 . . . . . . . . . . . . B . 14 HIS HA . . . . . . . . . c19602_2mgt 1 . 13 . 6956 . 2 1 15 HIS HB2 H 4.419 5.013 4.286 . . . 1.0 . . . . . . . . . . . . B . 14 HIS HB2 . . . . . . . . . c19602_2mgt 1 . 13 . 6957 . 2 1 15 HIS HB3 H 3.609 5.174 2.739 . . . 1.0 . . . . . . . . . . . . B . 14 HIS HB3 . . . . . . . . . c19602_2mgt 1 . 13 . 6958 . 2 1 15 HIS HD1 H 3.834 2.849 5.688 . . . 1.0 . . . . . . . . . . . . B . 14 HIS HD1 . . . . . . . . . c19602_2mgt 1 . 13 . 6959 . 2 1 15 HIS HD2 H 2.454 2.894 1.737 . . . 1.0 . . . . . . . . . . . . B . 14 HIS HD2 . . . . . . . . . c19602_2mgt 1 . 13 . 6960 . 2 1 15 HIS HE1 H 2.227 0.878 5.459 . . . 1.0 . . . . . . . . . . . . B . 14 HIS HE1 . . . . . . . . . c19602_2mgt 1 . 13 . 6961 . 2 1 15 HIS N N 5.373 3.768 1.296 . . . 1.0 . . . . . . . . . . . . B . 14 HIS N . . . . . . . . . c19602_2mgt 1 . 13 . 6962 . 2 1 15 HIS ND1 N 3.377 2.582 4.827 . . . 1.0 . . . . . . . . . . . . B . 14 HIS ND1 . . . . . . . . . c19602_2mgt 1 . 13 . 6963 . 2 1 15 HIS NE2 N 2.033 1.538 3.426 . . . 1.0 . . . . . . . . . . . . B . 14 HIS NE2 . . . . . . . . . c19602_2mgt 1 . 13 . 6964 . 2 1 15 HIS O O 6.463 3.344 4.637 . . . 1.0 . . . . . . . . . . . . B . 14 HIS O . . . . . . . . . c19602_2mgt 1 . 13 . 6965 . 2 1 16 GLN C C 9.337 2.358 4.355 . . . 1.0 . . . . . . . . . . . . B . 15 GLN C . . . . . . . . . c19602_2mgt 1 . 13 . 6966 . 2 1 16 GLN CA C 8.398 1.806 3.287 . . . 1.0 . . . . . . . . . . . . B . 15 GLN CA . . . . . . . . . c19602_2mgt 1 . 13 . 6967 . 2 1 16 GLN CB C 9.144 1.088 2.161 . . . 1.0 . . . . . . . . . . . . B . 15 GLN CB . . . . . . . . . c19602_2mgt 1 . 13 . 6968 . 2 1 16 GLN CD C 11.629 1.523 1.959 . . . 1.0 . . . . . . . . . . . . B . 15 GLN CD . . . . . . . . . c19602_2mgt 1 . 13 . 6969 . 2 1 16 GLN CG C 10.238 1.918 1.469 . . . 1.0 . . . . . . . . . . . . B . 15 GLN CG . . . . . . . . . c19602_2mgt 1 . 13 . 6970 . 2 1 16 GLN H H 7.570 2.957 1.727 . . . 1.0 . . . . . . . . . . . . B . 15 GLN H . . . . . . . . . c19602_2mgt 1 . 13 . 6971 . 2 1 16 GLN HA H 7.756 1.075 3.763 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HA . . . . . . . . . c19602_2mgt 1 . 13 . 6972 . 2 1 16 GLN HB2 H 9.579 0.173 2.557 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HB2 . . . . . . . . . c19602_2mgt 1 . 13 . 6973 . 2 1 16 GLN HB3 H 8.410 0.791 1.421 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HB3 . . . . . . . . . c19602_2mgt 1 . 13 . 6974 . 2 1 16 GLN HE21 H 11.904 3.275 2.951 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HE21 . . . . . . . . . c19602_2mgt 1 . 13 . 6975 . 2 1 16 GLN HE22 H 13.229 2.138 3.040 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HE22 . . . . . . . . . c19602_2mgt 1 . 13 . 6976 . 2 1 16 GLN HG2 H 10.197 1.726 0.398 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HG2 . . . . . . . . . c19602_2mgt 1 . 13 . 6977 . 2 1 16 GLN HG3 H 10.066 2.985 1.618 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HG3 . . . . . . . . . c19602_2mgt 1 . 13 . 6978 . 2 1 16 GLN N N 7.520 2.819 2.724 . . . 1.0 . . . . . . . . . . . . B . 15 GLN N . . . . . . . . . c19602_2mgt 1 . 13 . 6979 . 2 1 16 GLN NE2 N 12.303 2.378 2.720 . . . 1.0 . . . . . . . . . . . . B . 15 GLN NE2 . . . . . . . . . c19602_2mgt 1 . 13 . 6980 . 2 1 16 GLN O O 9.581 3.557 4.426 . . . 1.0 . . . . . . . . . . . . B . 15 GLN O . . . . . . . . . c19602_2mgt 1 . 13 . 6981 . 2 1 16 GLN OE1 O 12.096 0.431 1.659 . . . 1.0 . . . . . . . . . . . . B . 15 GLN OE1 . . . . . . . . . c19602_2mgt 1 . 13 . 6982 . 2 1 17 LYS C C 11.936 0.843 6.354 . . . 1.0 . . . . . . . . . . . . B . 16 LYS C . . . . . . . . . c19602_2mgt 1 . 13 . 6983 . 2 1 17 LYS CA C 10.771 1.835 6.285 . . . 1.0 . . . . . . . . . . . . B . 16 LYS CA . . . . . . . . . c19602_2mgt 1 . 13 . 6984 . 2 1 17 LYS CB C 9.978 1.921 7.602 . . . 1.0 . . . . . . . . . . . . B . 16 LYS CB . . . . . . . . . c19602_2mgt 1 . 13 . 6985 . 2 1 17 LYS CD C 8.273 3.331 8.904 . . . 1.0 . . . . . . . . . . . . B . 16 LYS CD . . . . . . . . . c19602_2mgt 1 . 13 . 6986 . 2 1 17 LYS CE C 9.261 3.861 9.938 . . . 1.0 . . . . . . . . . . . . B . 16 LYS CE . . . . . . . . . c19602_2mgt 1 . 13 . 6987 . 2 1 17 LYS CG C 8.965 3.082 7.565 . . . 1.0 . . . . . . . . . . . . B . 16 LYS CG . . . . . . . . . c19602_2mgt 1 . 13 . 6988 . 2 1 17 LYS H H 9.658 0.492 5.058 . . . 1.0 . . . . . . . . . . . . B . 16 LYS H . . . . . . . . . c19602_2mgt 1 . 13 . 6989 . 2 1 17 LYS HA H 11.205 2.814 6.089 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HA . . . . . . . . . c19602_2mgt 1 . 13 . 6990 . 2 1 17 LYS HB2 H 9.452 0.982 7.776 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HB2 . . . . . . . . . c19602_2mgt 1 . 13 . 6991 . 2 1 17 LYS HB3 H 10.677 2.082 8.421 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HB3 . . . . . . . . . c19602_2mgt 1 . 13 . 6992 . 2 1 17 LYS HD2 H 7.482 4.067 8.758 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HD2 . . . . . . . . . c19602_2mgt 1 . 13 . 6993 . 2 1 17 LYS HD3 H 7.827 2.404 9.262 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HD3 . . . . . . . . . c19602_2mgt 1 . 13 . 6994 . 2 1 17 LYS HE2 H 10.008 3.099 10.155 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HE2 . . . . . . . . . c19602_2mgt 1 . 13 . 6995 . 2 1 17 LYS HE3 H 9.758 4.742 9.535 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HE3 . . . . . . . . . c19602_2mgt 1 . 13 . 6996 . 2 1 17 LYS HG2 H 9.471 4.000 7.262 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HG2 . . . . . . . . . c19602_2mgt 1 . 13 . 6997 . 2 1 17 LYS HG3 H 8.190 2.859 6.834 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HG3 . . . . . . . . . c19602_2mgt 1 . 13 . 6998 . 2 1 17 LYS HZ1 H 8.143 3.405 11.591 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HZ1 . . . . . . . . . c19602_2mgt 1 . 13 . 6999 . 2 1 17 LYS HZ2 H 9.228 4.618 11.835 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HZ2 . . . . . . . . . c19602_2mgt 1 . 13 . 7000 . 2 1 17 LYS HZ3 H 7.854 4.907 10.983 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HZ3 . . . . . . . . . c19602_2mgt 1 . 13 . 7001 . 2 1 17 LYS N N 9.873 1.471 5.191 . . . 1.0 . . . . . . . . . . . . B . 16 LYS N . . . . . . . . . c19602_2mgt 1 . 13 . 7002 . 2 1 17 LYS NZ N 8.570 4.222 11.179 . . . 1.0 . . . . . . . . . . . . B . 16 LYS NZ . . . . . . . . . c19602_2mgt 1 . 13 . 7003 . 2 1 17 LYS O O 11.945 -0.142 5.628 . . . 1.0 . . . . . . . . . . . . B . 16 LYS O . . . . . . . . . c19602_2mgt 1 . 13 . 7004 . 2 1 18 NH2 HN1 H 12.926 1.934 7.759 . . . 1.0 . . . . . . . . . . . . B . 17 NH2 HN1 . . . . . . . . . c19602_2mgt 1 . 13 . 7005 . 2 1 18 NH2 HN2 H 13.729 0.471 7.232 . . . 1.0 . . . . . . . . . . . . B . 17 NH2 HN2 . . . . . . . . . c19602_2mgt 1 . 13 . 7006 . 2 1 18 NH2 N N 12.937 1.096 7.197 . . . 1.0 . . . . . . . . . . . . B . 17 NH2 N . . . . . . . . . c19602_2mgt 1 . 13 . 7007 . 3 2 1 ZN ZN Zn 0.800 0.305 2.325 . . . 1.0 . . . . . . . . . . . . A . 101 ZN ZN . . . . . . . . . c19602_2mgt 1 . 14 . 7008 . 1 1 1 ACE C C -17.027 -4.301 -4.616 . . . 1.0 . . . . . . . . . . . . A . 0 ACE C . . . . . . . . . c19602_2mgt 1 . 14 . 7009 . 1 1 1 ACE CH3 C -16.010 -5.187 -5.321 . . . 1.0 . . . . . . . . . . . . A . 0 ACE CH3 . . . . . . . . . c19602_2mgt 1 . 14 . 7010 . 1 1 1 ACE H1 H -16.401 -5.508 -6.287 . . . 1.0 . . . . . . . . . . . . A . 0 ACE H1 . . . . . . . . . c19602_2mgt 1 . 14 . 7011 . 1 1 1 ACE H2 H -15.086 -4.630 -5.469 . . . 1.0 . . . . . . . . . . . . A . 0 ACE H2 . . . . . . . . . c19602_2mgt 1 . 14 . 7012 . 1 1 1 ACE H3 H -15.803 -6.065 -4.713 . . . 1.0 . . . . . . . . . . . . A . 0 ACE H3 . . . . . . . . . c19602_2mgt 1 . 14 . 7013 . 1 1 1 ACE O O -17.999 -3.885 -5.234 . . . 1.0 . . . . . . . . . . . . A . 0 ACE O . . . . . . . . . c19602_2mgt 1 . 14 . 7014 . 1 1 2 ASP C C -17.526 -1.709 -2.736 . . . 1.0 . . . . . . . . . . . . A . 1 ASP C . . . . . . . . . c19602_2mgt 1 . 14 . 7015 . 1 1 2 ASP CA C -17.639 -3.212 -2.455 . . . 1.0 . . . . . . . . . . . . A . 1 ASP CA . . . . . . . . . c19602_2mgt 1 . 14 . 7016 . 1 1 2 ASP CB C -17.311 -3.549 -0.990 . . . 1.0 . . . . . . . . . . . . A . 1 ASP CB . . . . . . . . . c19602_2mgt 1 . 14 . 7017 . 1 1 2 ASP CG C -18.273 -4.598 -0.447 . . . 1.0 . . . . . . . . . . . . A . 1 ASP CG . . . . . . . . . c19602_2mgt 1 . 14 . 7018 . 1 1 2 ASP H H -15.964 -4.410 -2.910 . . . 1.0 . . . . . . . . . . . . A . 1 ASP H . . . . . . . . . c19602_2mgt 1 . 14 . 7019 . 1 1 2 ASP HA H -18.678 -3.487 -2.628 . . . 1.0 . . . . . . . . . . . . A . 1 ASP HA . . . . . . . . . c19602_2mgt 1 . 14 . 7020 . 1 1 2 ASP HB2 H -16.285 -3.910 -0.898 . . . 1.0 . . . . . . . . . . . . A . 1 ASP HB2 . . . . . . . . . c19602_2mgt 1 . 14 . 7021 . 1 1 2 ASP HB3 H -17.394 -2.656 -0.369 . . . 1.0 . . . . . . . . . . . . A . 1 ASP HB3 . . . . . . . . . c19602_2mgt 1 . 14 . 7022 . 1 1 2 ASP N N -16.795 -4.022 -3.331 . . . 1.0 . . . . . . . . . . . . A . 1 ASP N . . . . . . . . . c19602_2mgt 1 . 14 . 7023 . 1 1 2 ASP O O -16.720 -1.267 -3.550 . . . 1.0 . . . . . . . . . . . . A . 1 ASP O . . . . . . . . . c19602_2mgt 1 . 14 . 7024 . 1 1 2 ASP OD1 O -18.160 -5.768 -0.870 . . . 1.0 . . . . . . . . . . . . A . 1 ASP OD1 . . . . . . . . . c19602_2mgt 1 . 14 . 7025 . 1 1 2 ASP OD2 O -19.130 -4.227 0.372 . . . 1.0 . . . . . . . . . . . . A . 1 ASP OD2 . . . . . . . . . c19602_2mgt 1 . 14 . 7026 . 1 1 3 ALA C C -18.187 1.276 -0.953 . . . 1.0 . . . . . . . . . . . . A . 2 ALA C . . . . . . . . . c19602_2mgt 1 . 14 . 7027 . 1 1 3 ALA CA C -18.531 0.504 -2.225 . . . 1.0 . . . . . . . . . . . . A . 2 ALA CA . . . . . . . . . c19602_2mgt 1 . 14 . 7028 . 1 1 3 ALA CB C -19.964 0.762 -2.702 . . . 1.0 . . . . . . . . . . . . A . 2 ALA CB . . . . . . . . . c19602_2mgt 1 . 14 . 7029 . 1 1 3 ALA H H -18.984 -1.369 -1.382 . . . 1.0 . . . . . . . . . . . . A . 2 ALA H . . . . . . . . . c19602_2mgt 1 . 14 . 7030 . 1 1 3 ALA HA H -17.847 0.860 -2.990 . . . 1.0 . . . . . . . . . . . . A . 2 ALA HA . . . . . . . . . c19602_2mgt 1 . 14 . 7031 . 1 1 3 ALA HB1 H -20.150 0.215 -3.625 . . . 1.0 . . . . . . . . . . . . A . 2 ALA HB1 . . . . . . . . . c19602_2mgt 1 . 14 . 7032 . 1 1 3 ALA HB2 H -20.679 0.427 -1.949 . . . 1.0 . . . . . . . . . . . . A . 2 ALA HB2 . . . . . . . . . c19602_2mgt 1 . 14 . 7033 . 1 1 3 ALA HB3 H -20.106 1.825 -2.891 . . . 1.0 . . . . . . . . . . . . A . 2 ALA HB3 . . . . . . . . . c19602_2mgt 1 . 14 . 7034 . 1 1 3 ALA N N -18.365 -0.928 -2.046 . . . 1.0 . . . . . . . . . . . . A . 2 ALA N . . . . . . . . . c19602_2mgt 1 . 14 . 7035 . 1 1 3 ALA O O -17.152 1.933 -0.928 . . . 1.0 . . . . . . . . . . . . A . 2 ALA O . . . . . . . . . c19602_2mgt 1 . 14 . 7036 . 1 1 4 GLU C C -17.793 2.470 1.881 . . . 1.0 . . . . . . . . . . . . A . 3 GLU C . . . . . . . . . c19602_2mgt 1 . 14 . 7037 . 1 1 4 GLU CA C -19.107 2.234 1.138 . . . 1.0 . . . . . . . . . . . . A . 3 GLU CA . . . . . . . . . c19602_2mgt 1 . 14 . 7038 . 1 1 4 GLU CB C -20.230 1.880 2.117 . . . 1.0 . . . . . . . . . . . . A . 3 GLU CB . . . . . . . . . c19602_2mgt 1 . 14 . 7039 . 1 1 4 GLU CD C -21.176 0.229 3.731 . . . 1.0 . . . . . . . . . . . . A . 3 GLU CD . . . . . . . . . c19602_2mgt 1 . 14 . 7040 . 1 1 4 GLU CG C -19.941 0.635 2.953 . . . 1.0 . . . . . . . . . . . . A . 3 GLU CG . . . . . . . . . c19602_2mgt 1 . 14 . 7041 . 1 1 4 GLU H H -19.844 0.619 -0.010 . . . 1.0 . . . . . . . . . . . . A . 3 GLU H . . . . . . . . . c19602_2mgt 1 . 14 . 7042 . 1 1 4 GLU HA H -19.381 3.179 0.679 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HA . . . . . . . . . c19602_2mgt 1 . 14 . 7043 . 1 1 4 GLU HB2 H -20.391 2.724 2.788 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HB2 . . . . . . . . . c19602_2mgt 1 . 14 . 7044 . 1 1 4 GLU HB3 H -21.146 1.713 1.551 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HB3 . . . . . . . . . c19602_2mgt 1 . 14 . 7045 . 1 1 4 GLU HG2 H -19.632 -0.176 2.303 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HG2 . . . . . . . . . c19602_2mgt 1 . 14 . 7046 . 1 1 4 GLU HG3 H -19.138 0.842 3.664 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HG3 . . . . . . . . . c19602_2mgt 1 . 14 . 7047 . 1 1 4 GLU N N -19.048 1.235 0.071 . . . 1.0 . . . . . . . . . . . . A . 3 GLU N . . . . . . . . . c19602_2mgt 1 . 14 . 7048 . 1 1 4 GLU O O -17.522 3.610 2.239 . . . 1.0 . . . . . . . . . . . . A . 3 GLU O . . . . . . . . . c19602_2mgt 1 . 14 . 7049 . 1 1 4 GLU OE1 O -22.062 -0.424 3.104 . . . 1.0 . . . . . . . . . . . . A . 3 GLU OE1 . . . . . . . . . c19602_2mgt 1 . 14 . 7050 . 1 1 4 GLU OE2 O -21.265 0.583 4.897 . . . 1.0 . . . . . . . . . . . . A . 3 GLU OE2 . . . . . . . . . c19602_2mgt 1 . 14 . 7051 . 1 1 5 PHE C C -14.517 1.303 1.830 . . . 1.0 . . . . . . . . . . . . A . 4 PHE C . . . . . . . . . c19602_2mgt 1 . 14 . 7052 . 1 1 5 PHE CA C -15.698 1.503 2.784 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CA . . . . . . . . . c19602_2mgt 1 . 14 . 7053 . 1 1 5 PHE CB C -15.665 0.433 3.867 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CB . . . . . . . . . c19602_2mgt 1 . 14 . 7054 . 1 1 5 PHE CD1 C -16.634 -1.671 2.864 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CD1 . . . . . . . . . c19602_2mgt 1 . 14 . 7055 . 1 1 5 PHE CD2 C -14.235 -1.547 3.218 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CD2 . . . . . . . . . c19602_2mgt 1 . 14 . 7056 . 1 1 5 PHE CE1 C -16.495 -2.985 2.392 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CE1 . . . . . . . . . c19602_2mgt 1 . 14 . 7057 . 1 1 5 PHE CE2 C -14.089 -2.856 2.730 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CE2 . . . . . . . . . c19602_2mgt 1 . 14 . 7058 . 1 1 5 PHE CG C -15.510 -0.963 3.307 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CG . . . . . . . . . c19602_2mgt 1 . 14 . 7059 . 1 1 5 PHE CZ C -15.224 -3.581 2.333 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CZ . . . . . . . . . c19602_2mgt 1 . 14 . 7060 . 1 1 5 PHE H H -17.286 0.515 1.789 . . . 1.0 . . . . . . . . . . . . A . 4 PHE H . . . . . . . . . c19602_2mgt 1 . 14 . 7061 . 1 1 5 PHE HA H -15.594 2.473 3.264 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HA . . . . . . . . . c19602_2mgt 1 . 14 . 7062 . 1 1 5 PHE HB2 H -14.826 0.644 4.531 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HB2 . . . . . . . . . c19602_2mgt 1 . 14 . 7063 . 1 1 5 PHE HB3 H -16.578 0.491 4.461 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HB3 . . . . . . . . . c19602_2mgt 1 . 14 . 7064 . 1 1 5 PHE HD1 H -17.602 -1.197 2.896 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HD1 . . . . . . . . . c19602_2mgt 1 . 14 . 7065 . 1 1 5 PHE HD2 H -13.374 -0.974 3.525 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HD2 . . . . . . . . . c19602_2mgt 1 . 14 . 7066 . 1 1 5 PHE HE1 H -17.365 -3.542 2.085 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HE1 . . . . . . . . . c19602_2mgt 1 . 14 . 7067 . 1 1 5 PHE HE2 H -13.109 -3.306 2.668 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HE2 . . . . . . . . . c19602_2mgt 1 . 14 . 7068 . 1 1 5 PHE HZ H -15.124 -4.594 1.980 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HZ . . . . . . . . . c19602_2mgt 1 . 14 . 7069 . 1 1 5 PHE N N -16.986 1.427 2.099 . . . 1.0 . . . . . . . . . . . . A . 4 PHE N . . . . . . . . . c19602_2mgt 1 . 14 . 7070 . 1 1 5 PHE O O -13.379 1.549 2.231 . . . 1.0 . . . . . . . . . . . . A . 4 PHE O . . . . . . . . . c19602_2mgt 1 . 14 . 7071 . 1 1 6 ARG C C -13.681 2.294 -1.028 . . . 1.0 . . . . . . . . . . . . A . 5 ARG C . . . . . . . . . c19602_2mgt 1 . 14 . 7072 . 1 1 6 ARG CA C -13.863 0.856 -0.532 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CA . . . . . . . . . c19602_2mgt 1 . 14 . 7073 . 1 1 6 ARG CB C -14.386 -0.086 -1.628 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CB . . . . . . . . . c19602_2mgt 1 . 14 . 7074 . 1 1 6 ARG CD C -12.931 -2.094 -0.897 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CD . . . . . . . . . c19602_2mgt 1 . 14 . 7075 . 1 1 6 ARG CG C -14.328 -1.580 -1.263 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CG . . . . . . . . . c19602_2mgt 1 . 14 . 7076 . 1 1 6 ARG CZ C -11.652 -2.234 -3.052 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CZ . . . . . . . . . c19602_2mgt 1 . 14 . 7077 . 1 1 6 ARG H H -15.757 0.675 0.361 . . . 1.0 . . . . . . . . . . . . A . 5 ARG H . . . . . . . . . c19602_2mgt 1 . 14 . 7078 . 1 1 6 ARG HA H -12.903 0.488 -0.187 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HA . . . . . . . . . c19602_2mgt 1 . 14 . 7079 . 1 1 6 ARG HB2 H -15.416 0.182 -1.850 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HB2 . . . . . . . . . c19602_2mgt 1 . 14 . 7080 . 1 1 6 ARG HB3 H -13.806 0.067 -2.539 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HB3 . . . . . . . . . c19602_2mgt 1 . 14 . 7081 . 1 1 6 ARG HD2 H -12.663 -1.711 0.081 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HD2 . . . . . . . . . c19602_2mgt 1 . 14 . 7082 . 1 1 6 ARG HD3 H -12.953 -3.182 -0.826 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HD3 . . . . . . . . . c19602_2mgt 1 . 14 . 7083 . 1 1 6 ARG HE H -11.351 -0.867 -1.602 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HE . . . . . . . . . c19602_2mgt 1 . 14 . 7084 . 1 1 6 ARG HG2 H -14.997 -1.769 -0.424 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HG2 . . . . . . . . . c19602_2mgt 1 . 14 . 7085 . 1 1 6 ARG HG3 H -14.684 -2.154 -2.117 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HG3 . . . . . . . . . c19602_2mgt 1 . 14 . 7086 . 1 1 6 ARG HH11 H -13.071 -3.686 -2.904 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH11 . . . . . . . . . c19602_2mgt 1 . 14 . 7087 . 1 1 6 ARG HH12 H -12.130 -3.704 -4.378 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH12 . . . . . . . . . c19602_2mgt 1 . 14 . 7088 . 1 1 6 ARG HH21 H -10.171 -0.919 -3.527 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH21 . . . . . . . . . c19602_2mgt 1 . 14 . 7089 . 1 1 6 ARG HH22 H -10.509 -2.143 -4.733 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH22 . . . . . . . . . c19602_2mgt 1 . 14 . 7090 . 1 1 6 ARG N N -14.792 0.872 0.588 . . . 1.0 . . . . . . . . . . . . A . 5 ARG N . . . . . . . . . c19602_2mgt 1 . 14 . 7091 . 1 1 6 ARG NE N -11.899 -1.675 -1.859 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NE . . . . . . . . . c19602_2mgt 1 . 14 . 7092 . 1 1 6 ARG NH1 N -12.345 -3.289 -3.483 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NH1 . . . . . . . . . c19602_2mgt 1 . 14 . 7093 . 1 1 6 ARG NH2 N -10.696 -1.726 -3.832 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NH2 . . . . . . . . . c19602_2mgt 1 . 14 . 7094 . 1 1 6 ARG O O -14.062 2.639 -2.143 . . . 1.0 . . . . . . . . . . . . A . 5 ARG O . . . . . . . . . c19602_2mgt 1 . 14 . 7095 . 1 1 7 ARG C C -11.715 5.030 -0.689 . . . 1.0 . . . . . . . . . . . . A . 6 ARG C . . . . . . . . . c19602_2mgt 1 . 14 . 7096 . 1 1 7 ARG CA C -13.110 4.588 -0.307 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CA . . . . . . . . . c19602_2mgt 1 . 14 . 7097 . 1 1 7 ARG CB C -13.555 5.253 0.997 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CB . . . . . . . . . c19602_2mgt 1 . 14 . 7098 . 1 1 7 ARG CD C -15.993 5.677 0.327 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CD . . . . . . . . . c19602_2mgt 1 . 14 . 7099 . 1 1 7 ARG CG C -15.030 5.004 1.312 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CG . . . . . . . . . c19602_2mgt 1 . 14 . 7100 . 1 1 7 ARG CZ C -16.221 4.930 -2.074 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CZ . . . . . . . . . c19602_2mgt 1 . 14 . 7101 . 1 1 7 ARG H H -12.875 2.801 0.749 . . . 1.0 . . . . . . . . . . . . A . 6 ARG H . . . . . . . . . c19602_2mgt 1 . 14 . 7102 . 1 1 7 ARG HA H -13.779 4.882 -1.103 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HA . . . . . . . . . c19602_2mgt 1 . 14 . 7103 . 1 1 7 ARG HB2 H -12.973 4.835 1.812 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HB2 . . . . . . . . . c19602_2mgt 1 . 14 . 7104 . 1 1 7 ARG HB3 H -13.373 6.329 0.950 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HB3 . . . . . . . . . c19602_2mgt 1 . 14 . 7105 . 1 1 7 ARG HD2 H -16.887 5.970 0.874 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HD2 . . . . . . . . . c19602_2mgt 1 . 14 . 7106 . 1 1 7 ARG HD3 H -15.532 6.577 -0.072 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HD3 . . . . . . . . . c19602_2mgt 1 . 14 . 7107 . 1 1 7 ARG HE H -16.903 3.939 -0.456 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HE . . . . . . . . . c19602_2mgt 1 . 14 . 7108 . 1 1 7 ARG HG2 H -15.207 3.931 1.333 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HG2 . . . . . . . . . c19602_2mgt 1 . 14 . 7109 . 1 1 7 ARG HG3 H -15.234 5.389 2.308 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HG3 . . . . . . . . . c19602_2mgt 1 . 14 . 7110 . 1 1 7 ARG HH11 H -15.214 6.699 -1.987 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH11 . . . . . . . . . c19602_2mgt 1 . 14 . 7111 . 1 1 7 ARG HH12 H -15.451 6.043 -3.592 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH12 . . . . . . . . . c19602_2mgt 1 . 14 . 7112 . 1 1 7 ARG HH21 H -17.179 3.204 -2.545 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH21 . . . . . . . . . c19602_2mgt 1 . 14 . 7113 . 1 1 7 ARG HH22 H -16.575 4.118 -3.908 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH22 . . . . . . . . . c19602_2mgt 1 . 14 . 7114 . 1 1 7 ARG N N -13.156 3.152 -0.151 . . . 1.0 . . . . . . . . . . . . A . 6 ARG N . . . . . . . . . c19602_2mgt 1 . 14 . 7115 . 1 1 7 ARG NE N -16.410 4.772 -0.753 . . . 1.0 . . . . . . . . . . . . A . 6 ARG NE . . . . . . . . . c19602_2mgt 1 . 14 . 7116 . 1 1 7 ARG NH1 N -15.572 5.974 -2.591 . . . 1.0 . . . . . . . . . . . . A . 6 ARG NH1 . . . . . . . . . c19602_2mgt 1 . 14 . 7117 . 1 1 7 ARG NH2 N -16.689 4.007 -2.911 . . . 1.0 . . . . . . . . . . . . A . 6 ARG NH2 . . . . . . . . . c19602_2mgt 1 . 14 . 7118 . 1 1 7 ARG O O -10.729 4.407 -0.311 . . . 1.0 . . . . . . . . . . . . A . 6 ARG O . . . . . . . . . c19602_2mgt 1 . 14 . 7119 . 1 1 8 ASP C C -9.856 7.781 -1.045 . . . 1.0 . . . . . . . . . . . . A . 7 ASP C . . . . . . . . . c19602_2mgt 1 . 14 . 7120 . 1 1 8 ASP CA C -10.434 6.696 -1.953 . . . 1.0 . . . . . . . . . . . . A . 7 ASP CA . . . . . . . . . c19602_2mgt 1 . 14 . 7121 . 1 1 8 ASP CB C -10.730 7.264 -3.335 . . . 1.0 . . . . . . . . . . . . A . 7 ASP CB . . . . . . . . . c19602_2mgt 1 . 14 . 7122 . 1 1 8 ASP CG C -9.419 7.399 -4.079 . . . 1.0 . . . . . . . . . . . . A . 7 ASP CG . . . . . . . . . c19602_2mgt 1 . 14 . 7123 . 1 1 8 ASP H H -12.524 6.574 -1.712 . . . 1.0 . . . . . . . . . . . . A . 7 ASP H . . . . . . . . . c19602_2mgt 1 . 14 . 7124 . 1 1 8 ASP HA H -9.696 5.901 -2.057 . . . 1.0 . . . . . . . . . . . . A . 7 ASP HA . . . . . . . . . c19602_2mgt 1 . 14 . 7125 . 1 1 8 ASP HB2 H -11.366 6.566 -3.881 . . . 1.0 . . . . . . . . . . . . A . 7 ASP HB2 . . . . . . . . . c19602_2mgt 1 . 14 . 7126 . 1 1 8 ASP HB3 H -11.240 8.225 -3.260 . . . 1.0 . . . . . . . . . . . . A . 7 ASP HB3 . . . . . . . . . c19602_2mgt 1 . 14 . 7127 . 1 1 8 ASP N N -11.660 6.126 -1.441 . . . 1.0 . . . . . . . . . . . . A . 7 ASP N . . . . . . . . . c19602_2mgt 1 . 14 . 7128 . 1 1 8 ASP O O -8.658 8.043 -1.104 . . . 1.0 . . . . . . . . . . . . A . 7 ASP O . . . . . . . . . c19602_2mgt 1 . 14 . 7129 . 1 1 8 ASP OD1 O -8.993 6.366 -4.620 . . . 1.0 . . . . . . . . . . . . A . 7 ASP OD1 . . . . . . . . . c19602_2mgt 1 . 14 . 7130 . 1 1 8 ASP OD2 O -8.837 8.503 -4.060 . . . 1.0 . . . . . . . . . . . . A . 7 ASP OD2 . . . . . . . . . c19602_2mgt 1 . 14 . 7131 . 1 1 9 SER C C -9.361 9.048 1.831 . . . 1.0 . . . . . . . . . . . . A . 8 SER C . . . . . . . . . c19602_2mgt 1 . 14 . 7132 . 1 1 9 SER CA C -10.262 9.496 0.668 . . . 1.0 . . . . . . . . . . . . A . 8 SER CA . . . . . . . . . c19602_2mgt 1 . 14 . 7133 . 1 1 9 SER CB C -11.486 10.255 1.179 . . . 1.0 . . . . . . . . . . . . A . 8 SER CB . . . . . . . . . c19602_2mgt 1 . 14 . 7134 . 1 1 9 SER H H -11.667 8.191 -0.221 . . . 1.0 . . . . . . . . . . . . A . 8 SER H . . . . . . . . . c19602_2mgt 1 . 14 . 7135 . 1 1 9 SER HA H -9.682 10.185 0.058 . . . 1.0 . . . . . . . . . . . . A . 8 SER HA . . . . . . . . . c19602_2mgt 1 . 14 . 7136 . 1 1 9 SER HB2 H -12.112 9.594 1.776 . . . 1.0 . . . . . . . . . . . . A . 8 SER HB2 . . . . . . . . . c19602_2mgt 1 . 14 . 7137 . 1 1 9 SER HB3 H -11.147 11.082 1.794 . . . 1.0 . . . . . . . . . . . . A . 8 SER HB3 . . . . . . . . . c19602_2mgt 1 . 14 . 7138 . 1 1 9 SER HG H -12.905 11.365 0.452 . . . 1.0 . . . . . . . . . . . . A . 8 SER HG . . . . . . . . . c19602_2mgt 1 . 14 . 7139 . 1 1 9 SER N N -10.683 8.408 -0.201 . . . 1.0 . . . . . . . . . . . . A . 8 SER N . . . . . . . . . c19602_2mgt 1 . 14 . 7140 . 1 1 9 SER O O -8.972 9.884 2.637 . . . 1.0 . . . . . . . . . . . . A . 8 SER O . . . . . . . . . c19602_2mgt 1 . 14 . 7141 . 1 1 9 SER OG O -12.226 10.782 0.103 . . . 1.0 . . . . . . . . . . . . A . 8 SER OG . . . . . . . . . c19602_2mgt 1 . 14 . 7142 . 1 1 10 GLY C C -6.698 7.236 1.673 . . . 1.0 . . . . . . . . . . . . A . 9 GLY C . . . . . . . . . c19602_2mgt 1 . 14 . 7143 . 1 1 10 GLY CA C -7.845 7.312 2.678 . . . 1.0 . . . . . . . . . . . . A . 9 GLY CA . . . . . . . . . c19602_2mgt 1 . 14 . 7144 . 1 1 10 GLY H H -9.279 7.131 1.177 . . . 1.0 . . . . . . . . . . . . A . 9 GLY H . . . . . . . . . c19602_2mgt 1 . 14 . 7145 . 1 1 10 GLY HA2 H -7.589 8.009 3.472 . . . 1.0 . . . . . . . . . . . . A . 9 GLY HA2 . . . . . . . . . c19602_2mgt 1 . 14 . 7146 . 1 1 10 GLY HA3 H -8.062 6.341 3.116 . . . 1.0 . . . . . . . . . . . . A . 9 GLY HA3 . . . . . . . . . c19602_2mgt 1 . 14 . 7147 . 1 1 10 GLY N N -8.988 7.764 1.908 . . . 1.0 . . . . . . . . . . . . A . 9 GLY N . . . . . . . . . c19602_2mgt 1 . 14 . 7148 . 1 1 10 GLY O O -6.228 8.276 1.226 . . . 1.0 . . . . . . . . . . . . A . 9 GLY O . . . . . . . . . c19602_2mgt 1 . 14 . 7149 . 1 1 11 TYR C C -5.710 3.710 1.075 . . . 1.0 . . . . . . . . . . . . A . 10 TYR C . . . . . . . . . c19602_2mgt 1 . 14 . 7150 . 1 1 11 TYR CA C -6.615 4.742 1.728 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CA . . . . . . . . . c19602_2mgt 1 . 14 . 7151 . 1 1 11 TYR CB C -8.065 4.404 1.362 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CB . . . . . . . . . c19602_2mgt 1 . 14 . 7152 . 1 1 11 TYR CD1 C -8.440 2.912 3.383 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CD1 . . . . . . . . . c19602_2mgt 1 . 14 . 7153 . 1 1 11 TYR CD2 C -10.206 4.416 2.690 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CD2 . . . . . . . . . c19602_2mgt 1 . 14 . 7154 . 1 1 11 TYR CE1 C -9.268 2.386 4.380 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CE1 . . . . . . . . . c19602_2mgt 1 . 14 . 7155 . 1 1 11 TYR CE2 C -11.054 3.860 3.659 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CE2 . . . . . . . . . c19602_2mgt 1 . 14 . 7156 . 1 1 11 TYR CG C -8.909 3.915 2.518 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CG . . . . . . . . . c19602_2mgt 1 . 14 . 7157 . 1 1 11 TYR CZ C -10.593 2.842 4.516 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CZ . . . . . . . . . c19602_2mgt 1 . 14 . 7158 . 1 1 11 TYR H H -5.621 6.018 0.472 . . . 1.0 . . . . . . . . . . . . A . 10 TYR H . . . . . . . . . c19602_2mgt 1 . 14 . 7159 . 1 1 11 TYR HA H -6.485 4.718 2.811 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HA . . . . . . . . . c19602_2mgt 1 . 14 . 7160 . 1 1 11 TYR HB2 H -8.547 5.266 0.909 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HB2 . . . . . . . . . c19602_2mgt 1 . 14 . 7161 . 1 1 11 TYR HB3 H -8.064 3.640 0.586 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HB3 . . . . . . . . . c19602_2mgt 1 . 14 . 7162 . 1 1 11 TYR HD1 H -7.451 2.516 3.271 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HD1 . . . . . . . . . c19602_2mgt 1 . 14 . 7163 . 1 1 11 TYR HD2 H -10.560 5.211 2.054 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HD2 . . . . . . . . . c19602_2mgt 1 . 14 . 7164 . 1 1 11 TYR HE1 H -8.897 1.613 5.019 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HE1 . . . . . . . . . c19602_2mgt 1 . 14 . 7165 . 1 1 11 TYR HE2 H -12.065 4.203 3.739 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HE2 . . . . . . . . . c19602_2mgt 1 . 14 . 7166 . 1 1 11 TYR HH H -12.286 2.712 5.465 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HH . . . . . . . . . c19602_2mgt 1 . 14 . 7167 . 1 1 11 TYR N N -6.246 6.050 1.254 . . . 1.0 . . . . . . . . . . . . A . 10 TYR N . . . . . . . . . c19602_2mgt 1 . 14 . 7168 . 1 1 11 TYR O O -5.418 3.776 -0.118 . . . 1.0 . . . . . . . . . . . . A . 10 TYR O . . . . . . . . . c19602_2mgt 1 . 14 . 7169 . 1 1 11 TYR OH O -11.416 2.305 5.461 . . . 1.0 . . . . . . . . . . . . A . 10 TYR OH . . . . . . . . . c19602_2mgt 1 . 14 . 7170 . 1 1 12 GLU C C -6.191 0.465 2.145 . . . 1.0 . . . . . . . . . . . . A . 11 GLU C . . . . . . . . . c19602_2mgt 1 . 14 . 7171 . 1 1 12 GLU CA C -5.216 1.344 1.363 . . . 1.0 . . . . . . . . . . . . A . 11 GLU CA . . . . . . . . . c19602_2mgt 1 . 14 . 7172 . 1 1 12 GLU CB C -3.773 0.929 1.591 . . . 1.0 . . . . . . . . . . . . A . 11 GLU CB . . . . . . . . . c19602_2mgt 1 . 14 . 7173 . 1 1 12 GLU CD C -1.437 0.901 0.772 . . . 1.0 . . . . . . . . . . . . A . 11 GLU CD . . . . . . . . . c19602_2mgt 1 . 14 . 7174 . 1 1 12 GLU CG C -2.828 1.443 0.501 . . . 1.0 . . . . . . . . . . . . A . 11 GLU CG . . . . . . . . . c19602_2mgt 1 . 14 . 7175 . 1 1 12 GLU H H -5.626 2.749 2.837 . . . 1.0 . . . . . . . . . . . . A . 11 GLU H . . . . . . . . . c19602_2mgt 1 . 14 . 7176 . 1 1 12 GLU HA H -5.454 1.294 0.301 . . . 1.0 . . . . . . . . . . . . A . 11 GLU HA . . . . . . . . . c19602_2mgt 1 . 14 . 7177 . 1 1 12 GLU HB2 H -3.437 1.278 2.569 . . . 1.0 . . . . . . . . . . . . A . 11 GLU HB2 . . . . . . . . . c19602_2mgt 1 . 14 . 7178 . 1 1 12 GLU HB3 H -3.764 -0.151 1.592 . . . 1.0 . . . . . . . . . . . . A . 11 GLU HB3 . . . . . . . . . c19602_2mgt 1 . 14 . 7179 . 1 1 12 GLU HG2 H -3.167 1.101 -0.475 . . . 1.0 . . . . . . . . . . . . A . 11 GLU HG2 . . . . . . . . . c19602_2mgt 1 . 14 . 7180 . 1 1 12 GLU HG3 H -2.802 2.534 0.509 . . . 1.0 . . . . . . . . . . . . A . 11 GLU HG3 . . . . . . . . . c19602_2mgt 1 . 14 . 7181 . 1 1 12 GLU N N -5.405 2.682 1.855 . . . 1.0 . . . . . . . . . . . . A . 11 GLU N . . . . . . . . . c19602_2mgt 1 . 14 . 7182 . 1 1 12 GLU O O -5.890 0.013 3.253 . . . 1.0 . . . . . . . . . . . . A . 11 GLU O . . . . . . . . . c19602_2mgt 1 . 14 . 7183 . 1 1 12 GLU OE1 O -0.807 1.393 1.718 . . . 1.0 . . . . . . . . . . . . A . 11 GLU OE1 . . . . . . . . . c19602_2mgt 1 . 14 . 7184 . 1 1 12 GLU OE2 O -1.039 -0.062 0.078 . . . 1.0 . . . . . . . . . . . . A . 11 GLU OE2 . . . . . . . . . c19602_2mgt 1 . 14 . 7185 . 1 1 13 VAL C C -8.117 -1.908 2.436 . . . 1.0 . . . . . . . . . . . . A . 12 VAL C . . . . . . . . . c19602_2mgt 1 . 14 . 7186 . 1 1 13 VAL CA C -8.485 -0.445 2.208 . . . 1.0 . . . . . . . . . . . . A . 12 VAL CA . . . . . . . . . c19602_2mgt 1 . 14 . 7187 . 1 1 13 VAL CB C -9.790 -0.341 1.389 . . . 1.0 . . . . . . . . . . . . A . 12 VAL CB . . . . . . . . . c19602_2mgt 1 . 14 . 7188 . 1 1 13 VAL CG1 C -10.957 -0.952 2.180 . . . 1.0 . . . . . . . . . . . . A . 12 VAL CG1 . . . . . . . . . c19602_2mgt 1 . 14 . 7189 . 1 1 13 VAL CG2 C -10.181 1.098 1.033 . . . 1.0 . . . . . . . . . . . . A . 12 VAL CG2 . . . . . . . . . c19602_2mgt 1 . 14 . 7190 . 1 1 13 VAL H H -7.569 0.682 0.670 . . . 1.0 . . . . . . . . . . . . A . 12 VAL H . . . . . . . . . c19602_2mgt 1 . 14 . 7191 . 1 1 13 VAL HA H -8.653 0.021 3.171 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HA . . . . . . . . . c19602_2mgt 1 . 14 . 7192 . 1 1 13 VAL HB H -9.672 -0.889 0.459 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HB . . . . . . . . . c19602_2mgt 1 . 14 . 7193 . 1 1 13 VAL HG11 H -11.901 -0.678 1.720 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HG11 . . . . . . . . . c19602_2mgt 1 . 14 . 7194 . 1 1 13 VAL HG12 H -10.881 -2.038 2.189 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HG12 . . . . . . . . . c19602_2mgt 1 . 14 . 7195 . 1 1 13 VAL HG13 H -10.953 -0.580 3.205 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HG13 . . . . . . . . . c19602_2mgt 1 . 14 . 7196 . 1 1 13 VAL HG21 H -10.981 1.084 0.304 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HG21 . . . . . . . . . c19602_2mgt 1 . 14 . 7197 . 1 1 13 VAL HG22 H -10.519 1.618 1.924 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HG22 . . . . . . . . . c19602_2mgt 1 . 14 . 7198 . 1 1 13 VAL HG23 H -9.344 1.632 0.592 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HG23 . . . . . . . . . c19602_2mgt 1 . 14 . 7199 . 1 1 13 VAL N N -7.385 0.267 1.571 . . . 1.0 . . . . . . . . . . . . A . 12 VAL N . . . . . . . . . c19602_2mgt 1 . 14 . 7200 . 1 1 13 VAL O O -8.584 -2.490 3.407 . . . 1.0 . . . . . . . . . . . . A . 12 VAL O . . . . . . . . . c19602_2mgt 1 . 14 . 7201 . 1 1 14 HIS C C -5.994 -4.107 2.964 . . . 1.0 . . . . . . . . . . . . A . 13 HIS C . . . . . . . . . c19602_2mgt 1 . 14 . 7202 . 1 1 14 HIS CA C -6.848 -3.874 1.711 . . . 1.0 . . . . . . . . . . . . A . 13 HIS CA . . . . . . . . . c19602_2mgt 1 . 14 . 7203 . 1 1 14 HIS CB C -6.114 -4.301 0.439 . . . 1.0 . . . . . . . . . . . . A . 13 HIS CB . . . . . . . . . c19602_2mgt 1 . 14 . 7204 . 1 1 14 HIS CD2 C -4.411 -6.201 0.660 . . . 1.0 . . . . . . . . . . . . A . 13 HIS CD2 . . . . . . . . . c19602_2mgt 1 . 14 . 7205 . 1 1 14 HIS CE1 C -5.701 -7.932 0.309 . . . 1.0 . . . . . . . . . . . . A . 13 HIS CE1 . . . . . . . . . c19602_2mgt 1 . 14 . 7206 . 1 1 14 HIS CG C -5.678 -5.741 0.439 . . . 1.0 . . . . . . . . . . . . A . 13 HIS CG . . . . . . . . . c19602_2mgt 1 . 14 . 7207 . 1 1 14 HIS H H -6.902 -1.959 0.804 . . . 1.0 . . . . . . . . . . . . A . 13 HIS H . . . . . . . . . c19602_2mgt 1 . 14 . 7208 . 1 1 14 HIS HA H -7.758 -4.461 1.799 . . . 1.0 . . . . . . . . . . . . A . 13 HIS HA . . . . . . . . . c19602_2mgt 1 . 14 . 7209 . 1 1 14 HIS HB2 H -6.774 -4.136 -0.412 . . . 1.0 . . . . . . . . . . . . A . 13 HIS HB2 . . . . . . . . . c19602_2mgt 1 . 14 . 7210 . 1 1 14 HIS HB3 H -5.228 -3.681 0.315 . . . 1.0 . . . . . . . . . . . . A . 13 HIS HB3 . . . . . . . . . c19602_2mgt 1 . 14 . 7211 . 1 1 14 HIS HD1 H -7.469 -6.829 0.039 . . . 1.0 . . . . . . . . . . . . A . 13 HIS HD1 . . . . . . . . . c19602_2mgt 1 . 14 . 7212 . 1 1 14 HIS HD2 H -3.542 -5.591 0.860 . . . 1.0 . . . . . . . . . . . . A . 13 HIS HD2 . . . . . . . . . c19602_2mgt 1 . 14 . 7213 . 1 1 14 HIS HE1 H -6.054 -8.946 0.197 . . . 1.0 . . . . . . . . . . . . A . 13 HIS HE1 . . . . . . . . . c19602_2mgt 1 . 14 . 7214 . 1 1 14 HIS N N -7.263 -2.490 1.584 . . . 1.0 . . . . . . . . . . . . A . 13 HIS N . . . . . . . . . c19602_2mgt 1 . 14 . 7215 . 1 1 14 HIS ND1 N -6.474 -6.839 0.216 . . . 1.0 . . . . . . . . . . . . A . 13 HIS ND1 . . . . . . . . . c19602_2mgt 1 . 14 . 7216 . 1 1 14 HIS NE2 N -4.431 -7.594 0.570 . . . 1.0 . . . . . . . . . . . . A . 13 HIS NE2 . . . . . . . . . c19602_2mgt 1 . 14 . 7217 . 1 1 14 HIS O O -6.109 -5.173 3.563 . . . 1.0 . . . . . . . . . . . . A . 13 HIS O . . . . . . . . . c19602_2mgt 1 . 14 . 7218 . 1 1 15 HIS C C -5.468 -3.029 5.861 . . . 1.0 . . . . . . . . . . . . A . 14 HIS C . . . . . . . . . c19602_2mgt 1 . 14 . 7219 . 1 1 15 HIS CA C -4.508 -3.205 4.690 . . . 1.0 . . . . . . . . . . . . A . 14 HIS CA . . . . . . . . . c19602_2mgt 1 . 14 . 7220 . 1 1 15 HIS CB C -3.398 -2.159 4.803 . . . 1.0 . . . . . . . . . . . . A . 14 HIS CB . . . . . . . . . c19602_2mgt 1 . 14 . 7221 . 1 1 15 HIS CD2 C -1.547 -1.296 3.292 . . . 1.0 . . . . . . . . . . . . A . 14 HIS CD2 . . . . . . . . . c19602_2mgt 1 . 14 . 7222 . 1 1 15 HIS CE1 C -0.634 -3.165 2.625 . . . 1.0 . . . . . . . . . . . . A . 14 HIS CE1 . . . . . . . . . c19602_2mgt 1 . 14 . 7223 . 1 1 15 HIS CG C -2.268 -2.322 3.826 . . . 1.0 . . . . . . . . . . . . A . 14 HIS CG . . . . . . . . . c19602_2mgt 1 . 14 . 7224 . 1 1 15 HIS H H -5.134 -2.254 2.889 . . . 1.0 . . . . . . . . . . . . A . 14 HIS H . . . . . . . . . c19602_2mgt 1 . 14 . 7225 . 1 1 15 HIS HA H -4.061 -4.187 4.788 . . . 1.0 . . . . . . . . . . . . A . 14 HIS HA . . . . . . . . . c19602_2mgt 1 . 14 . 7226 . 1 1 15 HIS HB2 H -3.828 -1.163 4.688 . . . 1.0 . . . . . . . . . . . . A . 14 HIS HB2 . . . . . . . . . c19602_2mgt 1 . 14 . 7227 . 1 1 15 HIS HB3 H -2.969 -2.219 5.804 . . . 1.0 . . . . . . . . . . . . A . 14 HIS HB3 . . . . . . . . . c19602_2mgt 1 . 14 . 7228 . 1 1 15 HIS HD1 H -1.977 -4.429 3.635 . . . 1.0 . . . . . . . . . . . . A . 14 HIS HD1 . . . . . . . . . c19602_2mgt 1 . 14 . 7229 . 1 1 15 HIS HD2 H -1.724 -0.250 3.490 . . . 1.0 . . . . . . . . . . . . A . 14 HIS HD2 . . . . . . . . . c19602_2mgt 1 . 14 . 7230 . 1 1 15 HIS HE1 H 0.031 -3.869 2.150 . . . 1.0 . . . . . . . . . . . . A . 14 HIS HE1 . . . . . . . . . c19602_2mgt 1 . 14 . 7231 . 1 1 15 HIS N N -5.195 -3.121 3.404 . . . 1.0 . . . . . . . . . . . . A . 14 HIS N . . . . . . . . . c19602_2mgt 1 . 14 . 7232 . 1 1 15 HIS ND1 N -1.681 -3.491 3.400 . . . 1.0 . . . . . . . . . . . . A . 14 HIS ND1 . . . . . . . . . c19602_2mgt 1 . 14 . 7233 . 1 1 15 HIS NE2 N -0.516 -1.836 2.521 . . . 1.0 . . . . . . . . . . . . A . 14 HIS NE2 . . . . . . . . . c19602_2mgt 1 . 14 . 7234 . 1 1 15 HIS O O -5.249 -3.625 6.907 . . . 1.0 . . . . . . . . . . . . A . 14 HIS O . . . . . . . . . c19602_2mgt 1 . 14 . 7235 . 1 1 16 GLN C C -8.472 -2.897 7.089 . . . 1.0 . . . . . . . . . . . . A . 15 GLN C . . . . . . . . . c19602_2mgt 1 . 14 . 7236 . 1 1 16 GLN CA C -7.385 -1.866 6.823 . . . 1.0 . . . . . . . . . . . . A . 15 GLN CA . . . . . . . . . c19602_2mgt 1 . 14 . 7237 . 1 1 16 GLN CB C -7.999 -0.494 6.542 . . . 1.0 . . . . . . . . . . . . A . 15 GLN CB . . . . . . . . . c19602_2mgt 1 . 14 . 7238 . 1 1 16 GLN CD C -6.477 0.609 8.223 . . . 1.0 . . . . . . . . . . . . A . 15 GLN CD . . . . . . . . . c19602_2mgt 1 . 14 . 7239 . 1 1 16 GLN CG C -6.979 0.625 6.784 . . . 1.0 . . . . . . . . . . . . A . 15 GLN CG . . . . . . . . . c19602_2mgt 1 . 14 . 7240 . 1 1 16 GLN H H -6.661 -1.745 4.837 . . . 1.0 . . . . . . . . . . . . A . 15 GLN H . . . . . . . . . c19602_2mgt 1 . 14 . 7241 . 1 1 16 GLN HA H -6.781 -1.813 7.724 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HA . . . . . . . . . c19602_2mgt 1 . 14 . 7242 . 1 1 16 GLN HB2 H -8.357 -0.462 5.513 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HB2 . . . . . . . . . c19602_2mgt 1 . 14 . 7243 . 1 1 16 GLN HB3 H -8.849 -0.351 7.204 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HB3 . . . . . . . . . c19602_2mgt 1 . 14 . 7244 . 1 1 16 GLN HE21 H -8.260 1.269 8.927 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HE21 . . . . . . . . . c19602_2mgt 1 . 14 . 7245 . 1 1 16 GLN HE22 H -7.035 0.949 10.136 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HE22 . . . . . . . . . c19602_2mgt 1 . 14 . 7246 . 1 1 16 GLN HG2 H -6.144 0.506 6.095 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HG2 . . . . . . . . . c19602_2mgt 1 . 14 . 7247 . 1 1 16 GLN HG3 H -7.442 1.592 6.598 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HG3 . . . . . . . . . c19602_2mgt 1 . 14 . 7248 . 1 1 16 GLN N N -6.518 -2.219 5.714 . . . 1.0 . . . . . . . . . . . . A . 15 GLN N . . . . . . . . . c19602_2mgt 1 . 14 . 7249 . 1 1 16 GLN NE2 N -7.326 0.981 9.170 . . . 1.0 . . . . . . . . . . . . A . 15 GLN NE2 . . . . . . . . . c19602_2mgt 1 . 14 . 7250 . 1 1 16 GLN O O -8.782 -3.147 8.248 . . . 1.0 . . . . . . . . . . . . A . 15 GLN O . . . . . . . . . c19602_2mgt 1 . 14 . 7251 . 1 1 16 GLN OE1 O -5.354 0.207 8.493 . . . 1.0 . . . . . . . . . . . . A . 15 GLN OE1 . . . . . . . . . c19602_2mgt 1 . 14 . 7252 . 1 1 17 LYS C C -9.943 -5.689 5.370 . . . 1.0 . . . . . . . . . . . . A . 16 LYS C . . . . . . . . . c19602_2mgt 1 . 14 . 7253 . 1 1 17 LYS CA C -10.213 -4.345 6.067 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CA . . . . . . . . . c19602_2mgt 1 . 14 . 7254 . 1 1 17 LYS CB C -11.398 -3.612 5.404 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CB . . . . . . . . . c19602_2mgt 1 . 14 . 7255 . 1 1 17 LYS CD C -12.108 -2.296 7.490 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CD . . . . . . . . . c19602_2mgt 1 . 14 . 7256 . 1 1 17 LYS CE C -12.510 -0.898 7.930 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CE . . . . . . . . . c19602_2mgt 1 . 14 . 7257 . 1 1 17 LYS CG C -11.760 -2.247 6.003 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CG . . . . . . . . . c19602_2mgt 1 . 14 . 7258 . 1 1 17 LYS H H -8.692 -3.238 5.118 . . . 1.0 . . . . . . . . . . . . A . 16 LYS H . . . . . . . . . c19602_2mgt 1 . 14 . 7259 . 1 1 17 LYS HA H -10.476 -4.556 7.100 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HA . . . . . . . . . c19602_2mgt 1 . 14 . 7260 . 1 1 17 LYS HB2 H -11.169 -3.447 4.354 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HB2 . . . . . . . . . c19602_2mgt 1 . 14 . 7261 . 1 1 17 LYS HB3 H -12.277 -4.252 5.454 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HB3 . . . . . . . . . c19602_2mgt 1 . 14 . 7262 . 1 1 17 LYS HD2 H -12.930 -2.984 7.672 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HD2 . . . . . . . . . c19602_2mgt 1 . 14 . 7263 . 1 1 17 LYS HD3 H -11.243 -2.614 8.061 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HD3 . . . . . . . . . c19602_2mgt 1 . 14 . 7264 . 1 1 17 LYS HE2 H -11.729 -0.203 7.628 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HE2 . . . . . . . . . c19602_2mgt 1 . 14 . 7265 . 1 1 17 LYS HE3 H -13.433 -0.618 7.428 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HE3 . . . . . . . . . c19602_2mgt 1 . 14 . 7266 . 1 1 17 LYS HG2 H -10.933 -1.552 5.851 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HG2 . . . . . . . . . c19602_2mgt 1 . 14 . 7267 . 1 1 17 LYS HG3 H -12.623 -1.860 5.465 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HG3 . . . . . . . . . c19602_2mgt 1 . 14 . 7268 . 1 1 17 LYS HZ1 H -11.838 -1.091 9.850 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HZ1 . . . . . . . . . c19602_2mgt 1 . 14 . 7269 . 1 1 17 LYS HZ2 H -12.936 0.118 9.654 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HZ2 . . . . . . . . . c19602_2mgt 1 . 14 . 7270 . 1 1 17 LYS HZ3 H -13.432 -1.453 9.667 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HZ3 . . . . . . . . . c19602_2mgt 1 . 14 . 7271 . 1 1 17 LYS N N -9.038 -3.484 6.032 . . . 1.0 . . . . . . . . . . . . A . 16 LYS N . . . . . . . . . c19602_2mgt 1 . 14 . 7272 . 1 1 17 LYS NZ N -12.694 -0.825 9.386 . . . 1.0 . . . . . . . . . . . . A . 16 LYS NZ . . . . . . . . . c19602_2mgt 1 . 14 . 7273 . 1 1 17 LYS O O -10.867 -6.472 5.186 . . . 1.0 . . . . . . . . . . . . A . 16 LYS O . . . . . . . . . c19602_2mgt 1 . 14 . 7274 . 1 1 18 NH2 HN1 H -8.529 -6.850 4.479 . . . 1.0 . . . . . . . . . . . . A . 17 NH2 HN1 . . . . . . . . . c19602_2mgt 1 . 14 . 7275 . 1 1 18 NH2 HN2 H -7.962 -5.306 5.076 . . . 1.0 . . . . . . . . . . . . A . 17 NH2 HN2 . . . . . . . . . c19602_2mgt 1 . 14 . 7276 . 1 1 18 NH2 N N -8.706 -5.977 4.953 . . . 1.0 . . . . . . . . . . . . A . 17 NH2 N . . . . . . . . . c19602_2mgt 1 . 14 . 7277 . 2 1 1 ACE C C 20.683 6.620 0.800 . . . 1.0 . . . . . . . . . . . . B . 0 ACE C . . . . . . . . . c19602_2mgt 1 . 14 . 7278 . 2 1 1 ACE CH3 C 22.135 6.955 0.497 . . . 1.0 . . . . . . . . . . . . B . 0 ACE CH3 . . . . . . . . . c19602_2mgt 1 . 14 . 7279 . 2 1 1 ACE H1 H 22.667 7.173 1.422 . . . 1.0 . . . . . . . . . . . . B . 0 ACE H1 . . . . . . . . . c19602_2mgt 1 . 14 . 7280 . 2 1 1 ACE H2 H 22.594 6.104 -0.002 . . . 1.0 . . . . . . . . . . . . B . 0 ACE H2 . . . . . . . . . c19602_2mgt 1 . 14 . 7281 . 2 1 1 ACE H3 H 22.196 7.825 -0.153 . . . 1.0 . . . . . . . . . . . . B . 0 ACE H3 . . . . . . . . . c19602_2mgt 1 . 14 . 7282 . 2 1 1 ACE O O 20.354 6.315 1.942 . . . 1.0 . . . . . . . . . . . . B . 0 ACE O . . . . . . . . . c19602_2mgt 1 . 14 . 7283 . 2 1 2 ASP C C 18.093 4.986 -0.776 . . . 1.0 . . . . . . . . . . . . B . 1 ASP C . . . . . . . . . c19602_2mgt 1 . 14 . 7284 . 2 1 2 ASP CA C 18.407 6.322 -0.134 . . . 1.0 . . . . . . . . . . . . B . 1 ASP CA . . . . . . . . . c19602_2mgt 1 . 14 . 7285 . 2 1 2 ASP CB C 17.573 7.352 -0.881 . . . 1.0 . . . . . . . . . . . . B . 1 ASP CB . . . . . . . . . c19602_2mgt 1 . 14 . 7286 . 2 1 2 ASP CG C 17.605 8.742 -0.275 . . . 1.0 . . . . . . . . . . . . B . 1 ASP CG . . . . . . . . . c19602_2mgt 1 . 14 . 7287 . 2 1 2 ASP H H 20.161 6.968 -1.120 . . . 1.0 . . . . . . . . . . . . B . 1 ASP H . . . . . . . . . c19602_2mgt 1 . 14 . 7288 . 2 1 2 ASP HA H 18.091 6.283 0.910 . . . 1.0 . . . . . . . . . . . . B . 1 ASP HA . . . . . . . . . c19602_2mgt 1 . 14 . 7289 . 2 1 2 ASP HB2 H 17.938 7.436 -1.916 . . . 1.0 . . . . . . . . . . . . B . 1 ASP HB2 . . . . . . . . . c19602_2mgt 1 . 14 . 7290 . 2 1 2 ASP HB3 H 16.543 7.008 -0.922 . . . 1.0 . . . . . . . . . . . . B . 1 ASP HB3 . . . . . . . . . c19602_2mgt 1 . 14 . 7291 . 2 1 2 ASP N N 19.821 6.672 -0.216 . . . 1.0 . . . . . . . . . . . . B . 1 ASP N . . . . . . . . . c19602_2mgt 1 . 14 . 7292 . 2 1 2 ASP O O 17.112 4.368 -0.383 . . . 1.0 . . . . . . . . . . . . B . 1 ASP O . . . . . . . . . c19602_2mgt 1 . 14 . 7293 . 2 1 2 ASP OD1 O 17.553 8.757 1.047 . . . 1.0 . . . . . . . . . . . . B . 1 ASP OD1 . . . . . . . . . c19602_2mgt 1 . 14 . 7294 . 2 1 2 ASP OD2 O 17.678 9.693 -0.958 . . . 1.0 . . . . . . . . . . . . B . 1 ASP OD2 . . . . . . . . . c19602_2mgt 1 . 14 . 7295 . 2 1 3 ALA C C 18.424 2.119 -1.819 . . . 1.0 . . . . . . . . . . . . B . 2 ALA C . . . . . . . . . c19602_2mgt 1 . 14 . 7296 . 2 1 3 ALA CA C 18.584 3.415 -2.612 . . . 1.0 . . . . . . . . . . . . B . 2 ALA CA . . . . . . . . . c19602_2mgt 1 . 14 . 7297 . 2 1 3 ALA CB C 19.693 3.245 -3.639 . . . 1.0 . . . . . . . . . . . . B . 2 ALA CB . . . . . . . . . c19602_2mgt 1 . 14 . 7298 . 2 1 3 ALA H H 19.663 5.149 -2.037 . . . 1.0 . . . . . . . . . . . . B . 2 ALA H . . . . . . . . . c19602_2mgt 1 . 14 . 7299 . 2 1 3 ALA HA H 17.657 3.609 -3.148 . . . 1.0 . . . . . . . . . . . . B . 2 ALA HA . . . . . . . . . c19602_2mgt 1 . 14 . 7300 . 2 1 3 ALA HB1 H 19.852 4.176 -4.180 . . . 1.0 . . . . . . . . . . . . B . 2 ALA HB1 . . . . . . . . . c19602_2mgt 1 . 14 . 7301 . 2 1 3 ALA HB2 H 20.611 2.945 -3.138 . . . 1.0 . . . . . . . . . . . . B . 2 ALA HB2 . . . . . . . . . c19602_2mgt 1 . 14 . 7302 . 2 1 3 ALA HB3 H 19.395 2.469 -4.338 . . . 1.0 . . . . . . . . . . . . B . 2 ALA HB3 . . . . . . . . . c19602_2mgt 1 . 14 . 7303 . 2 1 3 ALA N N 18.881 4.570 -1.776 . . . 1.0 . . . . . . . . . . . . B . 2 ALA N . . . . . . . . . c19602_2mgt 1 . 14 . 7304 . 2 1 3 ALA O O 17.742 1.222 -2.290 . . . 1.0 . . . . . . . . . . . . B . 2 ALA O . . . . . . . . . c19602_2mgt 1 . 14 . 7305 . 2 1 4 GLU C C 17.464 0.665 0.784 . . . 1.0 . . . . . . . . . . . . B . 3 GLU C . . . . . . . . . c19602_2mgt 1 . 14 . 7306 . 2 1 4 GLU CA C 18.903 0.955 0.340 . . . 1.0 . . . . . . . . . . . . B . 3 GLU CA . . . . . . . . . c19602_2mgt 1 . 14 . 7307 . 2 1 4 GLU CB C 19.813 1.264 1.541 . . . 1.0 . . . . . . . . . . . . B . 3 GLU CB . . . . . . . . . c19602_2mgt 1 . 14 . 7308 . 2 1 4 GLU CD C 20.450 2.894 3.368 . . . 1.0 . . . . . . . . . . . . B . 3 GLU CD . . . . . . . . . c19602_2mgt 1 . 14 . 7309 . 2 1 4 GLU CG C 19.615 2.677 2.114 . . . 1.0 . . . . . . . . . . . . B . 3 GLU CG . . . . . . . . . c19602_2mgt 1 . 14 . 7310 . 2 1 4 GLU H H 19.571 2.834 -0.330 . . . 1.0 . . . . . . . . . . . . B . 3 GLU H . . . . . . . . . c19602_2mgt 1 . 14 . 7311 . 2 1 4 GLU HA H 19.278 0.052 -0.131 . . . 1.0 . . . . . . . . . . . . B . 3 GLU HA . . . . . . . . . c19602_2mgt 1 . 14 . 7312 . 2 1 4 GLU HB2 H 19.629 0.529 2.324 . . . 1.0 . . . . . . . . . . . . B . 3 GLU HB2 . . . . . . . . . c19602_2mgt 1 . 14 . 7313 . 2 1 4 GLU HB3 H 20.851 1.160 1.225 . . . 1.0 . . . . . . . . . . . . B . 3 GLU HB3 . . . . . . . . . c19602_2mgt 1 . 14 . 7314 . 2 1 4 GLU HG2 H 19.908 3.418 1.370 . . . 1.0 . . . . . . . . . . . . B . 3 GLU HG2 . . . . . . . . . c19602_2mgt 1 . 14 . 7315 . 2 1 4 GLU HG3 H 18.563 2.827 2.353 . . . 1.0 . . . . . . . . . . . . B . 3 GLU HG3 . . . . . . . . . c19602_2mgt 1 . 14 . 7316 . 2 1 4 GLU N N 19.013 2.043 -0.622 . . . 1.0 . . . . . . . . . . . . B . 3 GLU N . . . . . . . . . c19602_2mgt 1 . 14 . 7317 . 2 1 4 GLU O O 17.186 -0.475 1.146 . . . 1.0 . . . . . . . . . . . . B . 3 GLU O . . . . . . . . . c19602_2mgt 1 . 14 . 7318 . 2 1 4 GLU OE1 O 21.689 2.871 3.257 . . . 1.0 . . . . . . . . . . . . B . 3 GLU OE1 . . . . . . . . . c19602_2mgt 1 . 14 . 7319 . 2 1 4 GLU OE2 O 19.851 3.081 4.442 . . . 1.0 . . . . . . . . . . . . B . 3 GLU OE2 . . . . . . . . . c19602_2mgt 1 . 14 . 7320 . 2 1 5 PHE C C 14.263 1.898 -0.235 . . . 1.0 . . . . . . . . . . . . B . 4 PHE C . . . . . . . . . c19602_2mgt 1 . 14 . 7321 . 2 1 5 PHE CA C 15.119 1.455 0.956 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CA . . . . . . . . . c19602_2mgt 1 . 14 . 7322 . 2 1 5 PHE CB C 14.716 2.208 2.217 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CB . . . . . . . . . c19602_2mgt 1 . 14 . 7323 . 2 1 5 PHE CD1 C 13.373 4.272 1.677 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CD1 . . . . . . . . . c19602_2mgt 1 . 14 . 7324 . 2 1 5 PHE CD2 C 15.707 4.525 2.304 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CD2 . . . . . . . . . c19602_2mgt 1 . 14 . 7325 . 2 1 5 PHE CE1 C 13.240 5.669 1.607 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CE1 . . . . . . . . . c19602_2mgt 1 . 14 . 7326 . 2 1 5 PHE CE2 C 15.580 5.921 2.214 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CE2 . . . . . . . . . c19602_2mgt 1 . 14 . 7327 . 2 1 5 PHE CG C 14.600 3.704 2.056 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CG . . . . . . . . . c19602_2mgt 1 . 14 . 7328 . 2 1 5 PHE CZ C 14.345 6.496 1.875 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CZ . . . . . . . . . c19602_2mgt 1 . 14 . 7329 . 2 1 5 PHE H H 16.850 2.573 0.471 . . . 1.0 . . . . . . . . . . . . B . 4 PHE H . . . . . . . . . c19602_2mgt 1 . 14 . 7330 . 2 1 5 PHE HA H 14.917 0.403 1.123 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HA . . . . . . . . . c19602_2mgt 1 . 14 . 7331 . 2 1 5 PHE HB2 H 13.749 1.829 2.524 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HB2 . . . . . . . . . c19602_2mgt 1 . 14 . 7332 . 2 1 5 PHE HB3 H 15.427 1.981 3.014 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HB3 . . . . . . . . . c19602_2mgt 1 . 14 . 7333 . 2 1 5 PHE HD1 H 12.544 3.625 1.435 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HD1 . . . . . . . . . c19602_2mgt 1 . 14 . 7334 . 2 1 5 PHE HD2 H 16.652 4.066 2.550 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HD2 . . . . . . . . . c19602_2mgt 1 . 14 . 7335 . 2 1 5 PHE HE1 H 12.288 6.103 1.345 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HE1 . . . . . . . . . c19602_2mgt 1 . 14 . 7336 . 2 1 5 PHE HE2 H 16.427 6.555 2.410 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HE2 . . . . . . . . . c19602_2mgt 1 . 14 . 7337 . 2 1 5 PHE HZ H 14.249 7.569 1.821 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HZ . . . . . . . . . c19602_2mgt 1 . 14 . 7338 . 2 1 5 PHE N N 16.550 1.643 0.723 . . . 1.0 . . . . . . . . . . . . B . 4 PHE N . . . . . . . . . c19602_2mgt 1 . 14 . 7339 . 2 1 5 PHE O O 13.147 1.405 -0.391 . . . 1.0 . . . . . . . . . . . . B . 4 PHE O . . . . . . . . . c19602_2mgt 1 . 14 . 7340 . 2 1 6 ARG C C 15.030 1.966 -3.362 . . . 1.0 . . . . . . . . . . . . B . 5 ARG C . . . . . . . . . c19602_2mgt 1 . 14 . 7341 . 2 1 6 ARG CA C 14.374 3.022 -2.458 . . . 1.0 . . . . . . . . . . . . B . 5 ARG CA . . . . . . . . . c19602_2mgt 1 . 14 . 7342 . 2 1 6 ARG CB C 14.684 4.472 -2.858 . . . 1.0 . . . . . . . . . . . . B . 5 ARG CB . . . . . . . . . c19602_2mgt 1 . 14 . 7343 . 2 1 6 ARG CD C 12.552 5.340 -1.668 . . . 1.0 . . . . . . . . . . . . B . 5 ARG CD . . . . . . . . . c19602_2mgt 1 . 14 . 7344 . 2 1 6 ARG CG C 14.053 5.519 -1.924 . . . 1.0 . . . . . . . . . . . . B . 5 ARG CG . . . . . . . . . c19602_2mgt 1 . 14 . 7345 . 2 1 6 ARG CZ C 10.547 6.079 -2.965 . . . 1.0 . . . . . . . . . . . . B . 5 ARG CZ . . . . . . . . . c19602_2mgt 1 . 14 . 7346 . 2 1 6 ARG H H 15.706 3.169 -0.848 . . . 1.0 . . . . . . . . . . . . B . 5 ARG H . . . . . . . . . c19602_2mgt 1 . 14 . 7347 . 2 1 6 ARG HA H 13.295 2.892 -2.521 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HA . . . . . . . . . c19602_2mgt 1 . 14 . 7348 . 2 1 6 ARG HB2 H 15.761 4.617 -2.846 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HB2 . . . . . . . . . c19602_2mgt 1 . 14 . 7349 . 2 1 6 ARG HB3 H 14.323 4.641 -3.872 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HB3 . . . . . . . . . c19602_2mgt 1 . 14 . 7350 . 2 1 6 ARG HD2 H 12.356 4.358 -1.237 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HD2 . . . . . . . . . c19602_2mgt 1 . 14 . 7351 . 2 1 6 ARG HD3 H 12.247 6.091 -0.942 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HD3 . . . . . . . . . c19602_2mgt 1 . 14 . 7352 . 2 1 6 ARG HE H 12.136 5.080 -3.728 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HE . . . . . . . . . c19602_2mgt 1 . 14 . 7353 . 2 1 6 ARG HG2 H 14.565 5.481 -0.963 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HG2 . . . . . . . . . c19602_2mgt 1 . 14 . 7354 . 2 1 6 ARG HG3 H 14.223 6.508 -2.343 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HG3 . . . . . . . . . c19602_2mgt 1 . 14 . 7355 . 2 1 6 ARG HH11 H 10.365 6.463 -0.974 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HH11 . . . . . . . . . c19602_2mgt 1 . 14 . 7356 . 2 1 6 ARG HH12 H 9.024 6.991 -1.962 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HH12 . . . . . . . . . c19602_2mgt 1 . 14 . 7357 . 2 1 6 ARG HH21 H 10.362 5.812 -4.977 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HH21 . . . . . . . . . c19602_2mgt 1 . 14 . 7358 . 2 1 6 ARG HH22 H 9.016 6.606 -4.192 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HH22 . . . . . . . . . c19602_2mgt 1 . 14 . 7359 . 2 1 6 ARG N N 14.812 2.773 -1.092 . . . 1.0 . . . . . . . . . . . . B . 5 ARG N . . . . . . . . . c19602_2mgt 1 . 14 . 7360 . 2 1 6 ARG NE N 11.753 5.494 -2.890 . . . 1.0 . . . . . . . . . . . . B . 5 ARG NE . . . . . . . . . c19602_2mgt 1 . 14 . 7361 . 2 1 6 ARG NH1 N 9.940 6.574 -1.884 . . . 1.0 . . . . . . . . . . . . B . 5 ARG NH1 . . . . . . . . . c19602_2mgt 1 . 14 . 7362 . 2 1 6 ARG NH2 N 9.925 6.170 -4.139 . . . 1.0 . . . . . . . . . . . . B . 5 ARG NH2 . . . . . . . . . c19602_2mgt 1 . 14 . 7363 . 2 1 6 ARG O O 15.652 2.275 -4.378 . . . 1.0 . . . . . . . . . . . . B . 5 ARG O . . . . . . . . . c19602_2mgt 1 . 14 . 7364 . 2 1 7 ARG C C 14.627 -0.688 -4.944 . . . 1.0 . . . . . . . . . . . . B . 6 ARG C . . . . . . . . . c19602_2mgt 1 . 14 . 7365 . 2 1 7 ARG CA C 15.236 -0.560 -3.543 . . . 1.0 . . . . . . . . . . . . B . 6 ARG CA . . . . . . . . . c19602_2mgt 1 . 14 . 7366 . 2 1 7 ARG CB C 14.673 -1.638 -2.602 . . . 1.0 . . . . . . . . . . . . B . 6 ARG CB . . . . . . . . . c19602_2mgt 1 . 14 . 7367 . 2 1 7 ARG CD C 16.748 -2.466 -1.299 . . . 1.0 . . . . . . . . . . . . B . 6 ARG CD . . . . . . . . . c19602_2mgt 1 . 14 . 7368 . 2 1 7 ARG CG C 15.372 -1.794 -1.241 . . . 1.0 . . . . . . . . . . . . B . 6 ARG CG . . . . . . . . . c19602_2mgt 1 . 14 . 7369 . 2 1 7 ARG CZ C 18.973 -1.913 -2.292 . . . 1.0 . . . . . . . . . . . . B . 6 ARG CZ . . . . . . . . . c19602_2mgt 1 . 14 . 7370 . 2 1 7 ARG H H 14.400 0.605 -2.048 . . . 1.0 . . . . . . . . . . . . B . 6 ARG H . . . . . . . . . c19602_2mgt 1 . 14 . 7371 . 2 1 7 ARG HA H 16.313 -0.653 -3.618 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HA . . . . . . . . . c19602_2mgt 1 . 14 . 7372 . 2 1 7 ARG HB2 H 13.644 -1.352 -2.388 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HB2 . . . . . . . . . c19602_2mgt 1 . 14 . 7373 . 2 1 7 ARG HB3 H 14.658 -2.602 -3.102 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HB3 . . . . . . . . . c19602_2mgt 1 . 14 . 7374 . 2 1 7 ARG HD2 H 17.039 -2.772 -0.295 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HD2 . . . . . . . . . c19602_2mgt 1 . 14 . 7375 . 2 1 7 ARG HD3 H 16.692 -3.351 -1.929 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HD3 . . . . . . . . . c19602_2mgt 1 . 14 . 7376 . 2 1 7 ARG HE H 17.511 -0.593 -1.889 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HE . . . . . . . . . c19602_2mgt 1 . 14 . 7377 . 2 1 7 ARG HG2 H 15.439 -0.819 -0.764 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HG2 . . . . . . . . . c19602_2mgt 1 . 14 . 7378 . 2 1 7 ARG HG3 H 14.742 -2.415 -0.607 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HG3 . . . . . . . . . c19602_2mgt 1 . 14 . 7379 . 2 1 7 ARG HH11 H 18.859 -3.875 -1.755 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HH11 . . . . . . . . . c19602_2mgt 1 . 14 . 7380 . 2 1 7 ARG HH12 H 20.341 -3.396 -2.553 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HH12 . . . . . . . . . c19602_2mgt 1 . 14 . 7381 . 2 1 7 ARG HH21 H 19.371 -0.038 -2.979 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HH21 . . . . . . . . . c19602_2mgt 1 . 14 . 7382 . 2 1 7 ARG HH22 H 20.631 -1.219 -3.249 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HH22 . . . . . . . . . c19602_2mgt 1 . 14 . 7383 . 2 1 7 ARG N N 14.891 0.708 -2.921 . . . 1.0 . . . . . . . . . . . . B . 6 ARG N . . . . . . . . . c19602_2mgt 1 . 14 . 7384 . 2 1 7 ARG NE N 17.769 -1.566 -1.826 . . . 1.0 . . . . . . . . . . . . B . 6 ARG NE . . . . . . . . . c19602_2mgt 1 . 14 . 7385 . 2 1 7 ARG NH1 N 19.427 -3.163 -2.189 . . . 1.0 . . . . . . . . . . . . B . 6 ARG NH1 . . . . . . . . . c19602_2mgt 1 . 14 . 7386 . 2 1 7 ARG NH2 N 19.724 -0.979 -2.878 . . . 1.0 . . . . . . . . . . . . B . 6 ARG NH2 . . . . . . . . . c19602_2mgt 1 . 14 . 7387 . 2 1 7 ARG O O 13.829 0.155 -5.339 . . . 1.0 . . . . . . . . . . . . B . 6 ARG O . . . . . . . . . c19602_2mgt 1 . 14 . 7388 . 2 1 8 ASP C C 13.242 -3.140 -6.756 . . . 1.0 . . . . . . . . . . . . B . 7 ASP C . . . . . . . . . c19602_2mgt 1 . 14 . 7389 . 2 1 8 ASP CA C 14.316 -2.066 -6.962 . . . 1.0 . . . . . . . . . . . . B . 7 ASP CA . . . . . . . . . c19602_2mgt 1 . 14 . 7390 . 2 1 8 ASP CB C 15.356 -2.480 -8.014 . . . 1.0 . . . . . . . . . . . . B . 7 ASP CB . . . . . . . . . c19602_2mgt 1 . 14 . 7391 . 2 1 8 ASP CG C 15.965 -3.859 -7.788 . . . 1.0 . . . . . . . . . . . . B . 7 ASP CG . . . . . . . . . c19602_2mgt 1 . 14 . 7392 . 2 1 8 ASP H H 15.653 -2.401 -5.335 . . . 1.0 . . . . . . . . . . . . B . 7 ASP H . . . . . . . . . c19602_2mgt 1 . 14 . 7393 . 2 1 8 ASP HA H 13.823 -1.175 -7.350 . . . 1.0 . . . . . . . . . . . . B . 7 ASP HA . . . . . . . . . c19602_2mgt 1 . 14 . 7394 . 2 1 8 ASP HB2 H 14.877 -2.471 -8.989 . . . 1.0 . . . . . . . . . . . . B . 7 ASP HB2 . . . . . . . . . c19602_2mgt 1 . 14 . 7395 . 2 1 8 ASP HB3 H 16.158 -1.743 -8.026 . . . 1.0 . . . . . . . . . . . . B . 7 ASP HB3 . . . . . . . . . c19602_2mgt 1 . 14 . 7396 . 2 1 8 ASP N N 14.977 -1.741 -5.695 . . . 1.0 . . . . . . . . . . . . B . 7 ASP N . . . . . . . . . c19602_2mgt 1 . 14 . 7397 . 2 1 8 ASP O O 12.176 -3.071 -7.360 . . . 1.0 . . . . . . . . . . . . B . 7 ASP O . . . . . . . . . c19602_2mgt 1 . 14 . 7398 . 2 1 8 ASP OD1 O 16.983 -3.930 -7.079 . . . 1.0 . . . . . . . . . . . . B . 7 ASP OD1 . . . . . . . . . c19602_2mgt 1 . 14 . 7399 . 2 1 8 ASP OD2 O 15.416 -4.839 -8.331 . . . 1.0 . . . . . . . . . . . . B . 7 ASP OD2 . . . . . . . . . c19602_2mgt 1 . 14 . 7400 . 2 1 9 SER C C 12.306 -5.108 -4.010 . . . 1.0 . . . . . . . . . . . . B . 8 SER C . . . . . . . . . c19602_2mgt 1 . 14 . 7401 . 2 1 9 SER CA C 12.637 -5.198 -5.500 . . . 1.0 . . . . . . . . . . . . B . 8 SER CA . . . . . . . . . c19602_2mgt 1 . 14 . 7402 . 2 1 9 SER CB C 13.333 -6.528 -5.794 . . . 1.0 . . . . . . . . . . . . B . 8 SER CB . . . . . . . . . c19602_2mgt 1 . 14 . 7403 . 2 1 9 SER H H 14.424 -4.097 -5.445 . . . 1.0 . . . . . . . . . . . . B . 8 SER H . . . . . . . . . c19602_2mgt 1 . 14 . 7404 . 2 1 9 SER HA H 11.726 -5.142 -6.082 . . . 1.0 . . . . . . . . . . . . B . 8 SER HA . . . . . . . . . c19602_2mgt 1 . 14 . 7405 . 2 1 9 SER HB2 H 14.259 -6.583 -5.227 . . . 1.0 . . . . . . . . . . . . B . 8 SER HB2 . . . . . . . . . c19602_2mgt 1 . 14 . 7406 . 2 1 9 SER HB3 H 12.680 -7.346 -5.499 . . . 1.0 . . . . . . . . . . . . B . 8 SER HB3 . . . . . . . . . c19602_2mgt 1 . 14 . 7407 . 2 1 9 SER HG H 14.201 -5.918 -7.424 . . . 1.0 . . . . . . . . . . . . B . 8 SER HG . . . . . . . . . c19602_2mgt 1 . 14 . 7408 . 2 1 9 SER N N 13.516 -4.105 -5.875 . . . 1.0 . . . . . . . . . . . . B . 8 SER N . . . . . . . . . c19602_2mgt 1 . 14 . 7409 . 2 1 9 SER O O 13.144 -4.687 -3.219 . . . 1.0 . . . . . . . . . . . . B . 8 SER O . . . . . . . . . c19602_2mgt 1 . 14 . 7410 . 2 1 9 SER OG O 13.639 -6.656 -7.162 . . . 1.0 . . . . . . . . . . . . B . 8 SER OG . . . . . . . . . c19602_2mgt 1 . 14 . 7411 . 2 1 10 GLY C C 9.262 -6.211 -2.244 . . . 1.0 . . . . . . . . . . . . B . 9 GLY C . . . . . . . . . c19602_2mgt 1 . 14 . 7412 . 2 1 10 GLY CA C 10.614 -5.502 -2.257 . . . 1.0 . . . . . . . . . . . . B . 9 GLY CA . . . . . . . . . c19602_2mgt 1 . 14 . 7413 . 2 1 10 GLY H H 10.424 -5.836 -4.307 . . . 1.0 . . . . . . . . . . . . B . 9 GLY H . . . . . . . . . c19602_2mgt 1 . 14 . 7414 . 2 1 10 GLY HA2 H 11.323 -5.994 -1.593 . . . 1.0 . . . . . . . . . . . . B . 9 GLY HA2 . . . . . . . . . c19602_2mgt 1 . 14 . 7415 . 2 1 10 GLY HA3 H 10.528 -4.470 -1.934 . . . 1.0 . . . . . . . . . . . . B . 9 GLY HA3 . . . . . . . . . c19602_2mgt 1 . 14 . 7416 . 2 1 10 GLY N N 11.097 -5.522 -3.621 . . . 1.0 . . . . . . . . . . . . B . 9 GLY N . . . . . . . . . c19602_2mgt 1 . 14 . 7417 . 2 1 10 GLY O O 9.179 -7.355 -2.671 . . . 1.0 . . . . . . . . . . . . B . 9 GLY O . . . . . . . . . c19602_2mgt 1 . 14 . 7418 . 2 1 11 TYR C C 6.639 -3.873 -0.981 . . . 1.0 . . . . . . . . . . . . B . 10 TYR C . . . . . . . . . c19602_2mgt 1 . 14 . 7419 . 2 1 11 TYR CA C 8.033 -4.174 -1.512 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CA . . . . . . . . . c19602_2mgt 1 . 14 . 7420 . 2 1 11 TYR CB C 8.201 -3.351 -2.801 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CB . . . . . . . . . c19602_2mgt 1 . 14 . 7421 . 2 1 11 TYR CD1 C 9.463 -1.443 -1.717 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CD1 . . . . . . . . . c19602_2mgt 1 . 14 . 7422 . 2 1 11 TYR CD2 C 10.070 -2.176 -3.959 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CD2 . . . . . . . . . c19602_2mgt 1 . 14 . 7423 . 2 1 11 TYR CE1 C 10.396 -0.402 -1.796 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CE1 . . . . . . . . . c19602_2mgt 1 . 14 . 7424 . 2 1 11 TYR CE2 C 11.010 -1.144 -4.042 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CE2 . . . . . . . . . c19602_2mgt 1 . 14 . 7425 . 2 1 11 TYR CG C 9.283 -2.311 -2.808 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CG . . . . . . . . . c19602_2mgt 1 . 14 . 7426 . 2 1 11 TYR CZ C 11.147 -0.228 -2.978 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CZ . . . . . . . . . c19602_2mgt 1 . 14 . 7427 . 2 1 11 TYR H H 7.296 -6.054 -1.967 . . . 1.0 . . . . . . . . . . . . B . 10 TYR H . . . . . . . . . c19602_2mgt 1 . 14 . 7428 . 2 1 11 TYR HA H 8.780 -3.886 -0.772 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HA . . . . . . . . . c19602_2mgt 1 . 14 . 7429 . 2 1 11 TYR HB2 H 8.352 -4.012 -3.651 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HB2 . . . . . . . . . c19602_2mgt 1 . 14 . 7430 . 2 1 11 TYR HB3 H 7.277 -2.820 -3.001 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HB3 . . . . . . . . . c19602_2mgt 1 . 14 . 7431 . 2 1 11 TYR HD1 H 8.874 -1.554 -0.822 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HD1 . . . . . . . . . c19602_2mgt 1 . 14 . 7432 . 2 1 11 TYR HD2 H 9.930 -2.847 -4.791 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HD2 . . . . . . . . . c19602_2mgt 1 . 14 . 7433 . 2 1 11 TYR HE1 H 10.508 0.275 -0.967 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HE1 . . . . . . . . . c19602_2mgt 1 . 14 . 7434 . 2 1 11 TYR HE2 H 11.593 -1.043 -4.937 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HE2 . . . . . . . . . c19602_2mgt 1 . 14 . 7435 . 2 1 11 TYR HH H 12.364 0.905 -3.982 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HH . . . . . . . . . c19602_2mgt 1 . 14 . 7436 . 2 1 11 TYR N N 8.166 -5.582 -1.818 . . . 1.0 . . . . . . . . . . . . B . 10 TYR N . . . . . . . . . c19602_2mgt 1 . 14 . 7437 . 2 1 11 TYR O O 5.654 -4.481 -1.392 . . . 1.0 . . . . . . . . . . . . B . 10 TYR O . . . . . . . . . c19602_2mgt 1 . 14 . 7438 . 2 1 11 TYR OH O 11.944 0.861 -3.118 . . . 1.0 . . . . . . . . . . . . B . 10 TYR OH . . . . . . . . . c19602_2mgt 1 . 14 . 7439 . 2 1 12 GLU C C 6.442 -0.381 -0.554 . . . 1.0 . . . . . . . . . . . . B . 11 GLU C . . . . . . . . . c19602_2mgt 1 . 14 . 7440 . 2 1 12 GLU CA C 5.701 -1.698 -0.772 . . . 1.0 . . . . . . . . . . . . B . 11 GLU CA . . . . . . . . . c19602_2mgt 1 . 14 . 7441 . 2 1 12 GLU CB C 4.364 -1.720 -0.057 . . . 1.0 . . . . . . . . . . . . B . 11 GLU CB . . . . . . . . . c19602_2mgt 1 . 14 . 7442 . 2 1 12 GLU CD C 2.079 -0.665 0.003 . . . 1.0 . . . . . . . . . . . . B . 11 GLU CD . . . . . . . . . c19602_2mgt 1 . 14 . 7443 . 2 1 12 GLU CG C 3.333 -0.894 -0.829 . . . 1.0 . . . . . . . . . . . . B . 11 GLU CG . . . . . . . . . c19602_2mgt 1 . 14 . 7444 . 2 1 12 GLU H H 7.389 -2.404 0.163 . . . 1.0 . . . . . . . . . . . . B . 11 GLU H . . . . . . . . . c19602_2mgt 1 . 14 . 7445 . 2 1 12 GLU HA H 5.531 -1.860 -1.835 . . . 1.0 . . . . . . . . . . . . B . 11 GLU HA . . . . . . . . . c19602_2mgt 1 . 14 . 7446 . 2 1 12 GLU HB2 H 4.017 -2.749 0.034 . . . 1.0 . . . . . . . . . . . . B . 11 GLU HB2 . . . . . . . . . c19602_2mgt 1 . 14 . 7447 . 2 1 12 GLU HB3 H 4.526 -1.306 0.930 . . . 1.0 . . . . . . . . . . . . B . 11 GLU HB3 . . . . . . . . . c19602_2mgt 1 . 14 . 7448 . 2 1 12 GLU HG2 H 3.768 0.070 -1.089 . . . 1.0 . . . . . . . . . . . . B . 11 GLU HG2 . . . . . . . . . c19602_2mgt 1 . 14 . 7449 . 2 1 12 GLU HG3 H 3.073 -1.413 -1.750 . . . 1.0 . . . . . . . . . . . . B . 11 GLU HG3 . . . . . . . . . c19602_2mgt 1 . 14 . 7450 . 2 1 12 GLU N N 6.550 -2.752 -0.273 . . . 1.0 . . . . . . . . . . . . B . 11 GLU N . . . . . . . . . c19602_2mgt 1 . 14 . 7451 . 2 1 12 GLU O O 6.812 -0.050 0.573 . . . 1.0 . . . . . . . . . . . . B . 11 GLU O . . . . . . . . . c19602_2mgt 1 . 14 . 7452 . 2 1 12 GLU OE1 O 1.491 -1.655 0.477 . . . 1.0 . . . . . . . . . . . . B . 11 GLU OE1 . . . . . . . . . c19602_2mgt 1 . 14 . 7453 . 2 1 12 GLU OE2 O 1.726 0.513 0.193 . . . 1.0 . . . . . . . . . . . . B . 11 GLU OE2 . . . . . . . . . c19602_2mgt 1 . 14 . 7454 . 2 1 13 VAL C C 6.908 2.610 -0.712 . . . 1.0 . . . . . . . . . . . . B . 12 VAL C . . . . . . . . . c19602_2mgt 1 . 14 . 7455 . 2 1 13 VAL CA C 7.453 1.575 -1.695 . . . 1.0 . . . . . . . . . . . . B . 12 VAL CA . . . . . . . . . c19602_2mgt 1 . 14 . 7456 . 2 1 13 VAL CB C 7.467 2.140 -3.133 . . . 1.0 . . . . . . . . . . . . B . 12 VAL CB . . . . . . . . . c19602_2mgt 1 . 14 . 7457 . 2 1 13 VAL CG1 C 8.248 3.464 -3.184 . . . 1.0 . . . . . . . . . . . . B . 12 VAL CG1 . . . . . . . . . c19602_2mgt 1 . 14 . 7458 . 2 1 13 VAL CG2 C 8.104 1.166 -4.137 . . . 1.0 . . . . . . . . . . . . B . 12 VAL CG2 . . . . . . . . . c19602_2mgt 1 . 14 . 7459 . 2 1 13 VAL H H 6.323 0.006 -2.538 . . . 1.0 . . . . . . . . . . . . B . 12 VAL H . . . . . . . . . c19602_2mgt 1 . 14 . 7460 . 2 1 13 VAL HA H 8.470 1.326 -1.409 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HA . . . . . . . . . c19602_2mgt 1 . 14 . 7461 . 2 1 13 VAL HB H 6.437 2.327 -3.446 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HB . . . . . . . . . c19602_2mgt 1 . 14 . 7462 . 2 1 13 VAL HG11 H 7.695 4.250 -2.669 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HG11 . . . . . . . . . c19602_2mgt 1 . 14 . 7463 . 2 1 13 VAL HG12 H 9.224 3.339 -2.714 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HG12 . . . . . . . . . c19602_2mgt 1 . 14 . 7464 . 2 1 13 VAL HG13 H 8.397 3.774 -4.215 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HG13 . . . . . . . . . c19602_2mgt 1 . 14 . 7465 . 2 1 13 VAL HG21 H 9.181 1.155 -3.998 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HG21 . . . . . . . . . c19602_2mgt 1 . 14 . 7466 . 2 1 13 VAL HG22 H 7.713 0.158 -4.019 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HG22 . . . . . . . . . c19602_2mgt 1 . 14 . 7467 . 2 1 13 VAL HG23 H 7.896 1.491 -5.153 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HG23 . . . . . . . . . c19602_2mgt 1 . 14 . 7468 . 2 1 13 VAL N N 6.659 0.352 -1.652 . . . 1.0 . . . . . . . . . . . . B . 12 VAL N . . . . . . . . . c19602_2mgt 1 . 14 . 7469 . 2 1 13 VAL O O 7.684 3.327 -0.083 . . . 1.0 . . . . . . . . . . . . B . 12 VAL O . . . . . . . . . c19602_2mgt 1 . 14 . 7470 . 2 1 14 HIS C C 5.139 3.664 1.666 . . . 1.0 . . . . . . . . . . . . B . 13 HIS C . . . . . . . . . c19602_2mgt 1 . 14 . 7471 . 2 1 14 HIS CA C 4.903 3.729 0.156 . . . 1.0 . . . . . . . . . . . . B . 13 HIS CA . . . . . . . . . c19602_2mgt 1 . 14 . 7472 . 2 1 14 HIS CB C 3.395 3.657 -0.108 . . . 1.0 . . . . . . . . . . . . B . 13 HIS CB . . . . . . . . . c19602_2mgt 1 . 14 . 7473 . 2 1 14 HIS CD2 C 3.491 3.998 -2.650 . . . 1.0 . . . . . . . . . . . . B . 13 HIS CD2 . . . . . . . . . c19602_2mgt 1 . 14 . 7474 . 2 1 14 HIS CE1 C 2.262 2.297 -3.285 . . . 1.0 . . . . . . . . . . . . B . 13 HIS CE1 . . . . . . . . . c19602_2mgt 1 . 14 . 7475 . 2 1 14 HIS CG C 3.027 3.363 -1.532 . . . 1.0 . . . . . . . . . . . . B . 13 HIS CG . . . . . . . . . c19602_2mgt 1 . 14 . 7476 . 2 1 14 HIS H H 5.004 2.029 -1.097 . . . 1.0 . . . . . . . . . . . . B . 13 HIS H . . . . . . . . . c19602_2mgt 1 . 14 . 7477 . 2 1 14 HIS HA H 5.296 4.669 -0.229 . . . 1.0 . . . . . . . . . . . . B . 13 HIS HA . . . . . . . . . c19602_2mgt 1 . 14 . 7478 . 2 1 14 HIS HB2 H 2.971 2.876 0.522 . . . 1.0 . . . . . . . . . . . . B . 13 HIS HB2 . . . . . . . . . c19602_2mgt 1 . 14 . 7479 . 2 1 14 HIS HB3 H 2.934 4.599 0.180 . . . 1.0 . . . . . . . . . . . . B . 13 HIS HB3 . . . . . . . . . c19602_2mgt 1 . 14 . 7480 . 2 1 14 HIS HD1 H 1.771 1.656 -1.351 . . . 1.0 . . . . . . . . . . . . B . 13 HIS HD1 . . . . . . . . . c19602_2mgt 1 . 14 . 7481 . 2 1 14 HIS HD2 H 4.167 4.841 -2.671 . . . 1.0 . . . . . . . . . . . . B . 13 HIS HD2 . . . . . . . . . c19602_2mgt 1 . 14 . 7482 . 2 1 14 HIS HE1 H 1.748 1.565 -3.890 . . . 1.0 . . . . . . . . . . . . B . 13 HIS HE1 . . . . . . . . . c19602_2mgt 1 . 14 . 7483 . 2 1 14 HIS N N 5.580 2.669 -0.570 . . . 1.0 . . . . . . . . . . . . B . 13 HIS N . . . . . . . . . c19602_2mgt 1 . 14 . 7484 . 2 1 14 HIS ND1 N 2.245 2.317 -1.950 . . . 1.0 . . . . . . . . . . . . B . 13 HIS ND1 . . . . . . . . . c19602_2mgt 1 . 14 . 7485 . 2 1 14 HIS NE2 N 2.991 3.318 -3.761 . . . 1.0 . . . . . . . . . . . . B . 13 HIS NE2 . . . . . . . . . c19602_2mgt 1 . 14 . 7486 . 2 1 14 HIS O O 4.910 4.665 2.332 . . . 1.0 . . . . . . . . . . . . B . 13 HIS O . . . . . . . . . c19602_2mgt 1 . 14 . 7487 . 2 1 15 HIS C C 7.215 2.357 4.081 . . . 1.0 . . . . . . . . . . . . B . 14 HIS C . . . . . . . . . c19602_2mgt 1 . 14 . 7488 . 2 1 15 HIS CA C 5.756 2.318 3.642 . . . 1.0 . . . . . . . . . . . . B . 14 HIS CA . . . . . . . . . c19602_2mgt 1 . 14 . 7489 . 2 1 15 HIS CB C 5.106 0.995 4.053 . . . 1.0 . . . . . . . . . . . . B . 14 HIS CB . . . . . . . . . c19602_2mgt 1 . 14 . 7490 . 2 1 15 HIS CD2 C 2.890 0.237 3.053 . . . 1.0 . . . . . . . . . . . . B . 14 HIS CD2 . . . . . . . . . c19602_2mgt 1 . 14 . 7491 . 2 1 15 HIS CE1 C 1.550 1.730 3.904 . . . 1.0 . . . . . . . . . . . . B . 14 HIS CE1 . . . . . . . . . c19602_2mgt 1 . 14 . 7492 . 2 1 15 HIS CG C 3.624 1.040 3.870 . . . 1.0 . . . . . . . . . . . . B . 14 HIS CG . . . . . . . . . c19602_2mgt 1 . 14 . 7493 . 2 1 15 HIS H H 5.733 1.721 1.606 . . . 1.0 . . . . . . . . . . . . B . 14 HIS H . . . . . . . . . c19602_2mgt 1 . 14 . 7494 . 2 1 15 HIS HA H 5.250 3.116 4.188 . . . 1.0 . . . . . . . . . . . . B . 14 HIS HA . . . . . . . . . c19602_2mgt 1 . 14 . 7495 . 2 1 15 HIS HB2 H 5.516 0.193 3.444 . . . 1.0 . . . . . . . . . . . . B . 14 HIS HB2 . . . . . . . . . c19602_2mgt 1 . 14 . 7496 . 2 1 15 HIS HB3 H 5.309 0.782 5.103 . . . 1.0 . . . . . . . . . . . . B . 14 HIS HB3 . . . . . . . . . c19602_2mgt 1 . 14 . 7497 . 2 1 15 HIS HD1 H 3.013 2.715 5.036 . . . 1.0 . . . . . . . . . . . . B . 14 HIS HD1 . . . . . . . . . c19602_2mgt 1 . 14 . 7498 . 2 1 15 HIS HD2 H 3.273 -0.579 2.471 . . . 1.0 . . . . . . . . . . . . B . 14 HIS HD2 . . . . . . . . . c19602_2mgt 1 . 14 . 7499 . 2 1 15 HIS HE1 H 0.679 2.319 4.118 . . . 1.0 . . . . . . . . . . . . B . 14 HIS HE1 . . . . . . . . . c19602_2mgt 1 . 14 . 7500 . 2 1 15 HIS N N 5.569 2.516 2.208 . . . 1.0 . . . . . . . . . . . . B . 14 HIS N . . . . . . . . . c19602_2mgt 1 . 14 . 7501 . 2 1 15 HIS ND1 N 2.769 1.971 4.397 . . . 1.0 . . . . . . . . . . . . B . 14 HIS ND1 . . . . . . . . . c19602_2mgt 1 . 14 . 7502 . 2 1 15 HIS NE2 N 1.570 0.680 3.078 . . . 1.0 . . . . . . . . . . . . B . 14 HIS NE2 . . . . . . . . . c19602_2mgt 1 . 14 . 7503 . 2 1 15 HIS O O 7.447 2.255 5.279 . . . 1.0 . . . . . . . . . . . . B . 14 HIS O . . . . . . . . . c19602_2mgt 1 . 14 . 7504 . 2 1 16 GLN C C 10.092 4.001 3.638 . . . 1.0 . . . . . . . . . . . . B . 15 GLN C . . . . . . . . . c19602_2mgt 1 . 14 . 7505 . 2 1 16 GLN CA C 9.599 2.562 3.495 . . . 1.0 . . . . . . . . . . . . B . 15 GLN CA . . . . . . . . . c19602_2mgt 1 . 14 . 7506 . 2 1 16 GLN CB C 10.427 1.802 2.459 . . . 1.0 . . . . . . . . . . . . B . 15 GLN CB . . . . . . . . . c19602_2mgt 1 . 14 . 7507 . 2 1 16 GLN CD C 11.284 -0.550 2.049 . . . 1.0 . . . . . . . . . . . . B . 15 GLN CD . . . . . . . . . c19602_2mgt 1 . 14 . 7508 . 2 1 16 GLN CG C 10.101 0.305 2.487 . . . 1.0 . . . . . . . . . . . . B . 15 GLN CG . . . . . . . . . c19602_2mgt 1 . 14 . 7509 . 2 1 16 GLN H H 7.943 2.578 2.189 . . . 1.0 . . . . . . . . . . . . B . 15 GLN H . . . . . . . . . c19602_2mgt 1 . 14 . 7510 . 2 1 16 GLN HA H 9.748 2.070 4.452 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HA . . . . . . . . . c19602_2mgt 1 . 14 . 7511 . 2 1 16 GLN HB2 H 10.251 2.199 1.461 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HB2 . . . . . . . . . c19602_2mgt 1 . 14 . 7512 . 2 1 16 GLN HB3 H 11.474 1.949 2.700 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HB3 . . . . . . . . . c19602_2mgt 1 . 14 . 7513 . 2 1 16 GLN HE21 H 12.408 0.093 3.612 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HE21 . . . . . . . . . c19602_2mgt 1 . 14 . 7514 . 2 1 16 GLN HE22 H 13.171 -1.077 2.554 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HE22 . . . . . . . . . c19602_2mgt 1 . 14 . 7515 . 2 1 16 GLN HG2 H 9.843 0.008 3.502 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HG2 . . . . . . . . . c19602_2mgt 1 . 14 . 7516 . 2 1 16 GLN HG3 H 9.241 0.117 1.845 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HG3 . . . . . . . . . c19602_2mgt 1 . 14 . 7517 . 2 1 16 GLN N N 8.183 2.501 3.163 . . . 1.0 . . . . . . . . . . . . B . 15 GLN N . . . . . . . . . c19602_2mgt 1 . 14 . 7518 . 2 1 16 GLN NE2 N 12.380 -0.500 2.796 . . . 1.0 . . . . . . . . . . . . B . 15 GLN NE2 . . . . . . . . . c19602_2mgt 1 . 14 . 7519 . 2 1 16 GLN O O 9.519 4.926 3.068 . . . 1.0 . . . . . . . . . . . . B . 15 GLN O . . . . . . . . . c19602_2mgt 1 . 14 . 7520 . 2 1 16 GLN OE1 O 11.218 -1.265 1.059 . . . 1.0 . . . . . . . . . . . . B . 15 GLN OE1 . . . . . . . . . c19602_2mgt 1 . 14 . 7521 . 2 1 17 LYS C C 13.258 5.373 4.963 . . . 1.0 . . . . . . . . . . . . B . 16 LYS C . . . . . . . . . c19602_2mgt 1 . 14 . 7522 . 2 1 17 LYS CA C 11.742 5.463 4.777 . . . 1.0 . . . . . . . . . . . . B . 16 LYS CA . . . . . . . . . c19602_2mgt 1 . 14 . 7523 . 2 1 17 LYS CB C 11.081 5.970 6.069 . . . 1.0 . . . . . . . . . . . . B . 16 LYS CB . . . . . . . . . c19602_2mgt 1 . 14 . 7524 . 2 1 17 LYS CD C 9.120 7.136 7.089 . . . 1.0 . . . . . . . . . . . . B . 16 LYS CD . . . . . . . . . c19602_2mgt 1 . 14 . 7525 . 2 1 17 LYS CE C 7.693 7.580 6.802 . . . 1.0 . . . . . . . . . . . . B . 16 LYS CE . . . . . . . . . c19602_2mgt 1 . 14 . 7526 . 2 1 17 LYS CG C 9.637 6.421 5.847 . . . 1.0 . . . . . . . . . . . . B . 16 LYS CG . . . . . . . . . c19602_2mgt 1 . 14 . 7527 . 2 1 17 LYS H H 11.618 3.347 4.786 . . . 1.0 . . . . . . . . . . . . B . 16 LYS H . . . . . . . . . c19602_2mgt 1 . 14 . 7528 . 2 1 17 LYS HA H 11.559 6.183 3.982 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HA . . . . . . . . . c19602_2mgt 1 . 14 . 7529 . 2 1 17 LYS HB2 H 11.108 5.185 6.826 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HB2 . . . . . . . . . c19602_2mgt 1 . 14 . 7530 . 2 1 17 LYS HB3 H 11.643 6.824 6.443 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HB3 . . . . . . . . . c19602_2mgt 1 . 14 . 7531 . 2 1 17 LYS HD2 H 9.131 6.453 7.937 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HD2 . . . . . . . . . c19602_2mgt 1 . 14 . 7532 . 2 1 17 LYS HD3 H 9.738 8.008 7.307 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HD3 . . . . . . . . . c19602_2mgt 1 . 14 . 7533 . 2 1 17 LYS HE2 H 7.693 8.267 5.960 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HE2 . . . . . . . . . c19602_2mgt 1 . 14 . 7534 . 2 1 17 LYS HE3 H 7.100 6.711 6.532 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HE3 . . . . . . . . . c19602_2mgt 1 . 14 . 7535 . 2 1 17 LYS HG2 H 9.592 7.102 4.998 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HG2 . . . . . . . . . c19602_2mgt 1 . 14 . 7536 . 2 1 17 LYS HG3 H 9.005 5.558 5.647 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HG3 . . . . . . . . . c19602_2mgt 1 . 14 . 7537 . 2 1 17 LYS HZ1 H 6.151 8.505 7.784 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HZ1 . . . . . . . . . c19602_2mgt 1 . 14 . 7538 . 2 1 17 LYS HZ2 H 7.119 7.597 8.758 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HZ2 . . . . . . . . . c19602_2mgt 1 . 14 . 7539 . 2 1 17 LYS HZ3 H 7.642 9.054 8.212 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HZ3 . . . . . . . . . c19602_2mgt 1 . 14 . 7540 . 2 1 17 LYS N N 11.175 4.170 4.402 . . . 1.0 . . . . . . . . . . . . B . 16 LYS N . . . . . . . . . c19602_2mgt 1 . 14 . 7541 . 2 1 17 LYS NZ N 7.104 8.232 7.974 . . . 1.0 . . . . . . . . . . . . B . 16 LYS NZ . . . . . . . . . c19602_2mgt 1 . 14 . 7542 . 2 1 17 LYS O O 13.842 4.297 4.936 . . . 1.0 . . . . . . . . . . . . B . 16 LYS O . . . . . . . . . c19602_2mgt 1 . 14 . 7543 . 2 1 18 NH2 HN1 H 14.913 6.501 5.282 . . . 1.0 . . . . . . . . . . . . B . 17 NH2 HN1 . . . . . . . . . c19602_2mgt 1 . 14 . 7544 . 2 1 18 NH2 HN2 H 13.409 7.390 5.177 . . . 1.0 . . . . . . . . . . . . B . 17 NH2 HN2 . . . . . . . . . c19602_2mgt 1 . 14 . 7545 . 2 1 18 NH2 N N 13.911 6.515 5.160 . . . 1.0 . . . . . . . . . . . . B . 17 NH2 N . . . . . . . . . c19602_2mgt 1 . 14 . 7546 . 3 2 1 ZN ZN Zn 0.439 -0.240 1.602 . . . 1.0 . . . . . . . . . . . . A . 101 ZN ZN . . . . . . . . . c19602_2mgt 1 . 15 . 7547 . 1 1 1 ACE C C -11.150 -4.598 -2.775 . . . 1.0 . . . . . . . . . . . . A . 0 ACE C . . . . . . . . . c19602_2mgt 1 . 15 . 7548 . 1 1 1 ACE CH3 C -9.711 -4.225 -2.463 . . . 1.0 . . . . . . . . . . . . A . 0 ACE CH3 . . . . . . . . . c19602_2mgt 1 . 15 . 7549 . 1 1 1 ACE H1 H -9.565 -3.159 -2.637 . . . 1.0 . . . . . . . . . . . . A . 0 ACE H1 . . . . . . . . . c19602_2mgt 1 . 15 . 7550 . 1 1 1 ACE H2 H -9.497 -4.456 -1.422 . . . 1.0 . . . . . . . . . . . . A . 0 ACE H2 . . . . . . . . . c19602_2mgt 1 . 15 . 7551 . 1 1 1 ACE H3 H -9.038 -4.790 -3.106 . . . 1.0 . . . . . . . . . . . . A . 0 ACE H3 . . . . . . . . . c19602_2mgt 1 . 15 . 7552 . 1 1 1 ACE O O -11.388 -5.647 -3.366 . . . 1.0 . . . . . . . . . . . . A . 0 ACE O . . . . . . . . . c19602_2mgt 1 . 15 . 7553 . 1 1 2 ASP C C -14.228 -2.550 -2.450 . . . 1.0 . . . . . . . . . . . . A . 1 ASP C . . . . . . . . . c19602_2mgt 1 . 15 . 7554 . 1 1 2 ASP CA C -13.530 -3.902 -2.592 . . . 1.0 . . . . . . . . . . . . A . 1 ASP CA . . . . . . . . . c19602_2mgt 1 . 15 . 7555 . 1 1 2 ASP CB C -14.088 -4.886 -1.561 . . . 1.0 . . . . . . . . . . . . A . 1 ASP CB . . . . . . . . . c19602_2mgt 1 . 15 . 7556 . 1 1 2 ASP CG C -15.536 -5.239 -1.855 . . . 1.0 . . . . . . . . . . . . A . 1 ASP CG . . . . . . . . . c19602_2mgt 1 . 15 . 7557 . 1 1 2 ASP H H -11.805 -2.878 -1.935 . . . 1.0 . . . . . . . . . . . . A . 1 ASP H . . . . . . . . . c19602_2mgt 1 . 15 . 7558 . 1 1 2 ASP HA H -13.714 -4.292 -3.592 . . . 1.0 . . . . . . . . . . . . A . 1 ASP HA . . . . . . . . . c19602_2mgt 1 . 15 . 7559 . 1 1 2 ASP HB2 H -13.494 -5.800 -1.557 . . . 1.0 . . . . . . . . . . . . A . 1 ASP HB2 . . . . . . . . . c19602_2mgt 1 . 15 . 7560 . 1 1 2 ASP HB3 H -14.033 -4.428 -0.577 . . . 1.0 . . . . . . . . . . . . A . 1 ASP HB3 . . . . . . . . . c19602_2mgt 1 . 15 . 7561 . 1 1 2 ASP N N -12.093 -3.733 -2.388 . . . 1.0 . . . . . . . . . . . . A . 1 ASP N . . . . . . . . . c19602_2mgt 1 . 15 . 7562 . 1 1 2 ASP O O -13.787 -1.732 -1.651 . . . 1.0 . . . . . . . . . . . . A . 1 ASP O . . . . . . . . . c19602_2mgt 1 . 15 . 7563 . 1 1 2 ASP OD1 O -16.413 -4.445 -1.454 . . . 1.0 . . . . . . . . . . . . A . 1 ASP OD1 . . . . . . . . . c19602_2mgt 1 . 15 . 7564 . 1 1 2 ASP OD2 O -15.754 -6.296 -2.470 . . . 1.0 . . . . . . . . . . . . A . 1 ASP OD2 . . . . . . . . . c19602_2mgt 1 . 15 . 7565 . 1 1 3 ALA C C -16.445 -0.504 -1.899 . . . 1.0 . . . . . . . . . . . . A . 2 ALA C . . . . . . . . . c19602_2mgt 1 . 15 . 7566 . 1 1 3 ALA CA C -16.073 -1.088 -3.258 . . . 1.0 . . . . . . . . . . . . A . 2 ALA CA . . . . . . . . . c19602_2mgt 1 . 15 . 7567 . 1 1 3 ALA CB C -17.350 -1.286 -4.075 . . . 1.0 . . . . . . . . . . . . A . 2 ALA CB . . . . . . . . . c19602_2mgt 1 . 15 . 7568 . 1 1 3 ALA H H -15.667 -3.106 -3.750 . . . 1.0 . . . . . . . . . . . . A . 2 ALA H . . . . . . . . . c19602_2mgt 1 . 15 . 7569 . 1 1 3 ALA HA H -15.452 -0.365 -3.775 . . . 1.0 . . . . . . . . . . . . A . 2 ALA HA . . . . . . . . . c19602_2mgt 1 . 15 . 7570 . 1 1 3 ALA HB1 H -17.929 -0.363 -4.056 . . . 1.0 . . . . . . . . . . . . A . 2 ALA HB1 . . . . . . . . . c19602_2mgt 1 . 15 . 7571 . 1 1 3 ALA HB2 H -17.103 -1.525 -5.107 . . . 1.0 . . . . . . . . . . . . A . 2 ALA HB2 . . . . . . . . . c19602_2mgt 1 . 15 . 7572 . 1 1 3 ALA HB3 H -17.953 -2.081 -3.639 . . . 1.0 . . . . . . . . . . . . A . 2 ALA HB3 . . . . . . . . . c19602_2mgt 1 . 15 . 7573 . 1 1 3 ALA N N -15.333 -2.345 -3.180 . . . 1.0 . . . . . . . . . . . . A . 2 ALA N . . . . . . . . . c19602_2mgt 1 . 15 . 7574 . 1 1 3 ALA O O -16.295 0.700 -1.714 . . . 1.0 . . . . . . . . . . . . A . 2 ALA O . . . . . . . . . c19602_2mgt 1 . 15 . 7575 . 1 1 4 GLU C C -16.183 -0.200 1.117 . . . 1.0 . . . . . . . . . . . . A . 3 GLU C . . . . . . . . . c19602_2mgt 1 . 15 . 7576 . 1 1 4 GLU CA C -17.327 -0.861 0.365 . . . 1.0 . . . . . . . . . . . . A . 3 GLU CA . . . . . . . . . c19602_2mgt 1 . 15 . 7577 . 1 1 4 GLU CB C -17.853 -2.006 1.229 . . . 1.0 . . . . . . . . . . . . A . 3 GLU CB . . . . . . . . . c19602_2mgt 1 . 15 . 7578 . 1 1 4 GLU CD C -19.514 -3.831 1.461 . . . 1.0 . . . . . . . . . . . . A . 3 GLU CD . . . . . . . . . c19602_2mgt 1 . 15 . 7579 . 1 1 4 GLU CG C -18.880 -2.854 0.496 . . . 1.0 . . . . . . . . . . . . A . 3 GLU CG . . . . . . . . . c19602_2mgt 1 . 15 . 7580 . 1 1 4 GLU H H -16.952 -2.323 -1.140 . . . 1.0 . . . . . . . . . . . . A . 3 GLU H . . . . . . . . . c19602_2mgt 1 . 15 . 7581 . 1 1 4 GLU HA H -18.131 -0.136 0.224 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HA . . . . . . . . . c19602_2mgt 1 . 15 . 7582 . 1 1 4 GLU HB2 H -17.026 -2.643 1.543 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HB2 . . . . . . . . . c19602_2mgt 1 . 15 . 7583 . 1 1 4 GLU HB3 H -18.318 -1.578 2.118 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HB3 . . . . . . . . . c19602_2mgt 1 . 15 . 7584 . 1 1 4 GLU HG2 H -19.650 -2.208 0.074 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HG2 . . . . . . . . . c19602_2mgt 1 . 15 . 7585 . 1 1 4 GLU HG3 H -18.381 -3.396 -0.301 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HG3 . . . . . . . . . c19602_2mgt 1 . 15 . 7586 . 1 1 4 GLU N N -16.894 -1.333 -0.948 . . . 1.0 . . . . . . . . . . . . A . 3 GLU N . . . . . . . . . c19602_2mgt 1 . 15 . 7587 . 1 1 4 GLU O O -16.431 0.744 1.855 . . . 1.0 . . . . . . . . . . . . A . 3 GLU O . . . . . . . . . c19602_2mgt 1 . 15 . 7588 . 1 1 4 GLU OE1 O -18.907 -4.894 1.704 . . . 1.0 . . . . . . . . . . . . A . 3 GLU OE1 . . . . . . . . . c19602_2mgt 1 . 15 . 7589 . 1 1 4 GLU OE2 O -20.584 -3.510 1.987 . . . 1.0 . . . . . . . . . . . . A . 3 GLU OE2 . . . . . . . . . c19602_2mgt 1 . 15 . 7590 . 1 1 5 PHE C C -12.956 0.794 0.645 . . . 1.0 . . . . . . . . . . . . A . 4 PHE C . . . . . . . . . c19602_2mgt 1 . 15 . 7591 . 1 1 5 PHE CA C -13.740 -0.164 1.534 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CA . . . . . . . . . c19602_2mgt 1 . 15 . 7592 . 1 1 5 PHE CB C -12.855 -1.325 1.985 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CB . . . . . . . . . c19602_2mgt 1 . 15 . 7593 . 1 1 5 PHE CD1 C -14.385 -3.039 3.017 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CD1 . . . . . . . . . c19602_2mgt 1 . 15 . 7594 . 1 1 5 PHE CD2 C -13.070 -1.620 4.487 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CD2 . . . . . . . . . c19602_2mgt 1 . 15 . 7595 . 1 1 5 PHE CE1 C -14.933 -3.696 4.129 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CE1 . . . . . . . . . c19602_2mgt 1 . 15 . 7596 . 1 1 5 PHE CE2 C -13.631 -2.267 5.603 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CE2 . . . . . . . . . c19602_2mgt 1 . 15 . 7597 . 1 1 5 PHE CG C -13.429 -2.027 3.192 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CG . . . . . . . . . c19602_2mgt 1 . 15 . 7598 . 1 1 5 PHE CZ C -14.549 -3.316 5.427 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CZ . . . . . . . . . c19602_2mgt 1 . 15 . 7599 . 1 1 5 PHE H H -14.866 -1.498 0.320 . . . 1.0 . . . . . . . . . . . . A . 4 PHE H . . . . . . . . . c19602_2mgt 1 . 15 . 7600 . 1 1 5 PHE HA H -14.013 0.403 2.420 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HA . . . . . . . . . c19602_2mgt 1 . 15 . 7601 . 1 1 5 PHE HB2 H -12.730 -2.035 1.164 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HB2 . . . . . . . . . c19602_2mgt 1 . 15 . 7602 . 1 1 5 PHE HB3 H -11.867 -0.944 2.249 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HB3 . . . . . . . . . c19602_2mgt 1 . 15 . 7603 . 1 1 5 PHE HD1 H -14.700 -3.297 2.019 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HD1 . . . . . . . . . c19602_2mgt 1 . 15 . 7604 . 1 1 5 PHE HD2 H -12.382 -0.795 4.622 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HD2 . . . . . . . . . c19602_2mgt 1 . 15 . 7605 . 1 1 5 PHE HE1 H -15.663 -4.475 3.984 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HE1 . . . . . . . . . c19602_2mgt 1 . 15 . 7606 . 1 1 5 PHE HE2 H -13.365 -1.952 6.597 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HE2 . . . . . . . . . c19602_2mgt 1 . 15 . 7607 . 1 1 5 PHE HZ H -14.981 -3.807 6.287 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HZ . . . . . . . . . c19602_2mgt 1 . 15 . 7608 . 1 1 5 PHE N N -14.953 -0.687 0.918 . . . 1.0 . . . . . . . . . . . . A . 4 PHE N . . . . . . . . . c19602_2mgt 1 . 15 . 7609 . 1 1 5 PHE O O -12.168 1.551 1.202 . . . 1.0 . . . . . . . . . . . . A . 4 PHE O . . . . . . . . . c19602_2mgt 1 . 15 . 7610 . 1 1 6 ARG C C -13.317 3.137 -1.496 . . . 1.0 . . . . . . . . . . . . A . 5 ARG C . . . . . . . . . c19602_2mgt 1 . 15 . 7611 . 1 1 6 ARG CA C -12.620 1.772 -1.632 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CA . . . . . . . . . c19602_2mgt 1 . 15 . 7612 . 1 1 6 ARG CB C -12.684 1.208 -3.066 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CB . . . . . . . . . c19602_2mgt 1 . 15 . 7613 . 1 1 6 ARG CD C -10.163 0.560 -3.216 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CD . . . . . . . . . c19602_2mgt 1 . 15 . 7614 . 1 1 6 ARG CG C -11.627 0.149 -3.438 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CG . . . . . . . . . c19602_2mgt 1 . 15 . 7615 . 1 1 6 ARG CZ C -9.509 2.369 -4.849 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CZ . . . . . . . . . c19602_2mgt 1 . 15 . 7616 . 1 1 6 ARG H H -13.854 0.157 -1.056 . . . 1.0 . . . . . . . . . . . . A . 5 ARG H . . . . . . . . . c19602_2mgt 1 . 15 . 7617 . 1 1 6 ARG HA H -11.575 1.928 -1.372 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HA . . . . . . . . . c19602_2mgt 1 . 15 . 7618 . 1 1 6 ARG HB2 H -13.675 0.787 -3.222 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HB2 . . . . . . . . . c19602_2mgt 1 . 15 . 7619 . 1 1 6 ARG HB3 H -12.566 2.023 -3.780 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HB3 . . . . . . . . . c19602_2mgt 1 . 15 . 7620 . 1 1 6 ARG HD2 H -9.946 0.486 -2.155 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HD2 . . . . . . . . . c19602_2mgt 1 . 15 . 7621 . 1 1 6 ARG HD3 H -9.504 -0.136 -3.735 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HD3 . . . . . . . . . c19602_2mgt 1 . 15 . 7622 . 1 1 6 ARG HE H -9.958 2.636 -2.909 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HE . . . . . . . . . c19602_2mgt 1 . 15 . 7623 . 1 1 6 ARG HG2 H -11.804 -0.761 -2.871 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HG2 . . . . . . . . . c19602_2mgt 1 . 15 . 7624 . 1 1 6 ARG HG3 H -11.755 -0.090 -4.493 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HG3 . . . . . . . . . c19602_2mgt 1 . 15 . 7625 . 1 1 6 ARG HH11 H -9.565 0.560 -5.778 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH11 . . . . . . . . . c19602_2mgt 1 . 15 . 7626 . 1 1 6 ARG HH12 H -9.088 1.905 -6.787 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH12 . . . . . . . . . c19602_2mgt 1 . 15 . 7627 . 1 1 6 ARG HH21 H -9.339 4.301 -4.238 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH21 . . . . . . . . . c19602_2mgt 1 . 15 . 7628 . 1 1 6 ARG HH22 H -8.976 4.013 -5.924 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH22 . . . . . . . . . c19602_2mgt 1 . 15 . 7629 . 1 1 6 ARG N N -13.189 0.818 -0.679 . . . 1.0 . . . . . . . . . . . . A . 5 ARG N . . . . . . . . . c19602_2mgt 1 . 15 . 7630 . 1 1 6 ARG NE N -9.875 1.939 -3.634 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NE . . . . . . . . . c19602_2mgt 1 . 15 . 7631 . 1 1 6 ARG NH1 N -9.373 1.545 -5.888 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NH1 . . . . . . . . . c19602_2mgt 1 . 15 . 7632 . 1 1 6 ARG NH2 N -9.270 3.668 -5.022 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NH2 . . . . . . . . . c19602_2mgt 1 . 15 . 7633 . 1 1 6 ARG O O -13.733 3.757 -2.473 . . . 1.0 . . . . . . . . . . . . A . 5 ARG O . . . . . . . . . c19602_2mgt 1 . 15 . 7634 . 1 1 7 ARG C C -13.032 5.981 -0.063 . . . 1.0 . . . . . . . . . . . . A . 6 ARG C . . . . . . . . . c19602_2mgt 1 . 15 . 7635 . 1 1 7 ARG CA C -14.037 4.854 0.147 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CA . . . . . . . . . c19602_2mgt 1 . 15 . 7636 . 1 1 7 ARG CB C -14.472 4.773 1.617 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CB . . . . . . . . . c19602_2mgt 1 . 15 . 7637 . 1 1 7 ARG CD C -16.838 3.778 1.188 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CD . . . . . . . . . c19602_2mgt 1 . 15 . 7638 . 1 1 7 ARG CG C -15.485 3.657 1.908 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CG . . . . . . . . . c19602_2mgt 1 . 15 . 7639 . 1 1 7 ARG CZ C -17.320 3.889 -1.275 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CZ . . . . . . . . . c19602_2mgt 1 . 15 . 7640 . 1 1 7 ARG H H -13.121 3.015 0.504 . . . 1.0 . . . . . . . . . . . . A . 6 ARG H . . . . . . . . . c19602_2mgt 1 . 15 . 7641 . 1 1 7 ARG HA H -14.909 5.040 -0.471 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HA . . . . . . . . . c19602_2mgt 1 . 15 . 7642 . 1 1 7 ARG HB2 H -13.590 4.579 2.228 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HB2 . . . . . . . . . c19602_2mgt 1 . 15 . 7643 . 1 1 7 ARG HB3 H -14.898 5.726 1.927 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HB3 . . . . . . . . . c19602_2mgt 1 . 15 . 7644 . 1 1 7 ARG HD2 H -17.568 3.187 1.740 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HD2 . . . . . . . . . c19602_2mgt 1 . 15 . 7645 . 1 1 7 ARG HD3 H -17.158 4.815 1.215 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HD3 . . . . . . . . . c19602_2mgt 1 . 15 . 7646 . 1 1 7 ARG HE H -16.426 2.345 -0.326 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HE . . . . . . . . . c19602_2mgt 1 . 15 . 7647 . 1 1 7 ARG HG2 H -15.019 2.707 1.661 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HG2 . . . . . . . . . c19602_2mgt 1 . 15 . 7648 . 1 1 7 ARG HG3 H -15.680 3.657 2.980 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HG3 . . . . . . . . . c19602_2mgt 1 . 15 . 7649 . 1 1 7 ARG HH11 H -18.012 5.541 -0.317 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH11 . . . . . . . . . c19602_2mgt 1 . 15 . 7650 . 1 1 7 ARG HH12 H -18.311 5.490 -2.040 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH12 . . . . . . . . . c19602_2mgt 1 . 15 . 7651 . 1 1 7 ARG HH21 H -16.822 2.400 -2.567 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH21 . . . . . . . . . c19602_2mgt 1 . 15 . 7652 . 1 1 7 ARG HH22 H -17.648 3.766 -3.276 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH22 . . . . . . . . . c19602_2mgt 1 . 15 . 7653 . 1 1 7 ARG N N -13.457 3.595 -0.250 . . . 1.0 . . . . . . . . . . . . A . 6 ARG N . . . . . . . . . c19602_2mgt 1 . 15 . 7654 . 1 1 7 ARG NE N -16.813 3.270 -0.194 . . . 1.0 . . . . . . . . . . . . A . 6 ARG NE . . . . . . . . . c19602_2mgt 1 . 15 . 7655 . 1 1 7 ARG NH1 N -17.913 5.077 -1.210 . . . 1.0 . . . . . . . . . . . . A . 6 ARG NH1 . . . . . . . . . c19602_2mgt 1 . 15 . 7656 . 1 1 7 ARG NH2 N -17.251 3.309 -2.468 . . . 1.0 . . . . . . . . . . . . A . 6 ARG NH2 . . . . . . . . . c19602_2mgt 1 . 15 . 7657 . 1 1 7 ARG O O -11.822 5.801 0.047 . . . 1.0 . . . . . . . . . . . . A . 6 ARG O . . . . . . . . . c19602_2mgt 1 . 15 . 7658 . 1 1 8 ASP C C -11.990 8.786 0.718 . . . 1.0 . . . . . . . . . . . . A . 7 ASP C . . . . . . . . . c19602_2mgt 1 . 15 . 7659 . 1 1 8 ASP CA C -12.797 8.384 -0.525 . . . 1.0 . . . . . . . . . . . . A . 7 ASP CA . . . . . . . . . c19602_2mgt 1 . 15 . 7660 . 1 1 8 ASP CB C -13.811 9.474 -0.866 . . . 1.0 . . . . . . . . . . . . A . 7 ASP CB . . . . . . . . . c19602_2mgt 1 . 15 . 7661 . 1 1 8 ASP CG C -13.106 10.781 -1.151 . . . 1.0 . . . . . . . . . . . . A . 7 ASP CG . . . . . . . . . c19602_2mgt 1 . 15 . 7662 . 1 1 8 ASP H H -14.567 7.252 -0.363 . . . 1.0 . . . . . . . . . . . . A . 7 ASP H . . . . . . . . . c19602_2mgt 1 . 15 . 7663 . 1 1 8 ASP HA H -12.114 8.243 -1.364 . . . 1.0 . . . . . . . . . . . . A . 7 ASP HA . . . . . . . . . c19602_2mgt 1 . 15 . 7664 . 1 1 8 ASP HB2 H -14.382 9.183 -1.748 . . . 1.0 . . . . . . . . . . . . A . 7 ASP HB2 . . . . . . . . . c19602_2mgt 1 . 15 . 7665 . 1 1 8 ASP HB3 H -14.502 9.603 -0.031 . . . 1.0 . . . . . . . . . . . . A . 7 ASP HB3 . . . . . . . . . c19602_2mgt 1 . 15 . 7666 . 1 1 8 ASP N N -13.562 7.171 -0.326 . . . 1.0 . . . . . . . . . . . . A . 7 ASP N . . . . . . . . . c19602_2mgt 1 . 15 . 7667 . 1 1 8 ASP O O -10.973 9.461 0.598 . . . 1.0 . . . . . . . . . . . . A . 7 ASP O . . . . . . . . . c19602_2mgt 1 . 15 . 7668 . 1 1 8 ASP OD1 O -12.611 10.949 -2.268 . . . 1.0 . . . . . . . . . . . . A . 7 ASP OD1 . . . . . . . . . c19602_2mgt 1 . 15 . 7669 . 1 1 8 ASP OD2 O -13.046 11.609 -0.215 . . . 1.0 . . . . . . . . . . . . A . 7 ASP OD2 . . . . . . . . . c19602_2mgt 1 . 15 . 7670 . 1 1 9 SER C C -10.612 8.425 3.628 . . . 1.0 . . . . . . . . . . . . A . 8 SER C . . . . . . . . . c19602_2mgt 1 . 15 . 7671 . 1 1 9 SER CA C -11.993 8.916 3.179 . . . 1.0 . . . . . . . . . . . . A . 8 SER CA . . . . . . . . . c19602_2mgt 1 . 15 . 7672 . 1 1 9 SER CB C -13.048 8.567 4.229 . . . 1.0 . . . . . . . . . . . . A . 8 SER CB . . . . . . . . . c19602_2mgt 1 . 15 . 7673 . 1 1 9 SER H H -13.299 7.850 1.931 . . . 1.0 . . . . . . . . . . . . A . 8 SER H . . . . . . . . . c19602_2mgt 1 . 15 . 7674 . 1 1 9 SER HA H -11.948 10.000 3.089 . . . 1.0 . . . . . . . . . . . . A . 8 SER HA . . . . . . . . . c19602_2mgt 1 . 15 . 7675 . 1 1 9 SER HB2 H -13.069 7.487 4.367 . . . 1.0 . . . . . . . . . . . . A . 8 SER HB2 . . . . . . . . . c19602_2mgt 1 . 15 . 7676 . 1 1 9 SER HB3 H -12.797 9.050 5.173 . . . 1.0 . . . . . . . . . . . . A . 8 SER HB3 . . . . . . . . . c19602_2mgt 1 . 15 . 7677 . 1 1 9 SER HG H -14.987 8.504 4.309 . . . 1.0 . . . . . . . . . . . . A . 8 SER HG . . . . . . . . . c19602_2mgt 1 . 15 . 7678 . 1 1 9 SER N N -12.447 8.389 1.905 . . . 1.0 . . . . . . . . . . . . A . 8 SER N . . . . . . . . . c19602_2mgt 1 . 15 . 7679 . 1 1 9 SER O O -10.165 8.866 4.684 . . . 1.0 . . . . . . . . . . . . A . 8 SER O . . . . . . . . . c19602_2mgt 1 . 15 . 7680 . 1 1 9 SER OG O -14.327 8.993 3.808 . . . 1.0 . . . . . . . . . . . . A . 8 SER OG . . . . . . . . . c19602_2mgt 1 . 15 . 7681 . 1 1 10 GLY C C -7.724 7.373 1.944 . . . 1.0 . . . . . . . . . . . . A . 9 GLY C . . . . . . . . . c19602_2mgt 1 . 15 . 7682 . 1 1 10 GLY CA C -8.603 7.045 3.154 . . . 1.0 . . . . . . . . . . . . A . 9 GLY CA . . . . . . . . . c19602_2mgt 1 . 15 . 7683 . 1 1 10 GLY H H -10.304 7.276 1.966 . . . 1.0 . . . . . . . . . . . . A . 9 GLY H . . . . . . . . . c19602_2mgt 1 . 15 . 7684 . 1 1 10 GLY HA2 H -8.188 7.502 4.048 . . . 1.0 . . . . . . . . . . . . A . 9 GLY HA2 . . . . . . . . . c19602_2mgt 1 . 15 . 7685 . 1 1 10 GLY HA3 H -8.662 5.973 3.318 . . . 1.0 . . . . . . . . . . . . A . 9 GLY HA3 . . . . . . . . . c19602_2mgt 1 . 15 . 7686 . 1 1 10 GLY N N -9.941 7.540 2.871 . . . 1.0 . . . . . . . . . . . . A . 9 GLY N . . . . . . . . . c19602_2mgt 1 . 15 . 7687 . 1 1 10 GLY O O -7.653 8.529 1.545 . . . 1.0 . . . . . . . . . . . . A . 9 GLY O . . . . . . . . . c19602_2mgt 1 . 15 . 7688 . 1 1 11 TYR C C -5.846 4.341 0.861 . . . 1.0 . . . . . . . . . . . . A . 10 TYR C . . . . . . . . . c19602_2mgt 1 . 15 . 7689 . 1 1 11 TYR CA C -6.997 5.008 1.612 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CA . . . . . . . . . c19602_2mgt 1 . 15 . 7690 . 1 1 11 TYR CB C -8.320 4.339 1.202 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CB . . . . . . . . . c19602_2mgt 1 . 15 . 7691 . 1 1 11 TYR CD1 C -8.285 2.763 3.189 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CD1 . . . . . . . . . c19602_2mgt 1 . 15 . 7692 . 1 1 11 TYR CD2 C -10.397 3.749 2.505 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CD2 . . . . . . . . . c19602_2mgt 1 . 15 . 7693 . 1 1 11 TYR CE1 C -8.920 2.128 4.259 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CE1 . . . . . . . . . c19602_2mgt 1 . 15 . 7694 . 1 1 11 TYR CE2 C -11.050 3.090 3.554 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CE2 . . . . . . . . . c19602_2mgt 1 . 15 . 7695 . 1 1 11 TYR CG C -9.013 3.598 2.324 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CG . . . . . . . . . c19602_2mgt 1 . 15 . 7696 . 1 1 11 TYR CZ C -10.311 2.280 4.442 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CZ . . . . . . . . . c19602_2mgt 1 . 15 . 7697 . 1 1 11 TYR H H -6.660 6.652 0.412 . . . 1.0 . . . . . . . . . . . . A . 10 TYR H . . . . . . . . . c19602_2mgt 1 . 15 . 7698 . 1 1 11 TYR HA H -6.832 4.901 2.684 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HA . . . . . . . . . c19602_2mgt 1 . 15 . 7699 . 1 1 11 TYR HB2 H -9.009 5.082 0.806 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HB2 . . . . . . . . . c19602_2mgt 1 . 15 . 7700 . 1 1 11 TYR HB3 H -8.131 3.654 0.380 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HB3 . . . . . . . . . c19602_2mgt 1 . 15 . 7701 . 1 1 11 TYR HD1 H -7.236 2.596 3.040 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HD1 . . . . . . . . . c19602_2mgt 1 . 15 . 7702 . 1 1 11 TYR HD2 H -10.964 4.366 1.833 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HD2 . . . . . . . . . c19602_2mgt 1 . 15 . 7703 . 1 1 11 TYR HE1 H -8.331 1.532 4.935 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HE1 . . . . . . . . . c19602_2mgt 1 . 15 . 7704 . 1 1 11 TYR HE2 H -12.111 3.220 3.687 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HE2 . . . . . . . . . c19602_2mgt 1 . 15 . 7705 . 1 1 11 TYR HH H -10.318 1.204 6.064 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HH . . . . . . . . . c19602_2mgt 1 . 15 . 7706 . 1 1 11 TYR N N -7.048 6.416 1.304 . . . 1.0 . . . . . . . . . . . . A . 10 TYR N . . . . . . . . . c19602_2mgt 1 . 15 . 7707 . 1 1 11 TYR O O -5.512 4.716 -0.261 . . . 1.0 . . . . . . . . . . . . A . 10 TYR O . . . . . . . . . c19602_2mgt 1 . 15 . 7708 . 1 1 11 TYR OH O -10.930 1.670 5.489 . . . 1.0 . . . . . . . . . . . . A . 10 TYR OH . . . . . . . . . c19602_2mgt 1 . 15 . 7709 . 1 1 12 GLU C C -5.238 0.914 1.316 . . . 1.0 . . . . . . . . . . . . A . 11 GLU C . . . . . . . . . c19602_2mgt 1 . 15 . 7710 . 1 1 12 GLU CA C -4.589 2.218 0.822 . . . 1.0 . . . . . . . . . . . . A . 11 GLU CA . . . . . . . . . c19602_2mgt 1 . 15 . 7711 . 1 1 12 GLU CB C -3.102 2.351 1.185 . . . 1.0 . . . . . . . . . . . . A . 11 GLU CB . . . . . . . . . c19602_2mgt 1 . 15 . 7712 . 1 1 12 GLU CD C -1.106 0.765 1.048 . . . 1.0 . . . . . . . . . . . . A . 11 GLU CD . . . . . . . . . c19602_2mgt 1 . 15 . 7713 . 1 1 12 GLU CG C -2.238 1.444 0.298 . . . 1.0 . . . . . . . . . . . . A . 11 GLU CG . . . . . . . . . c19602_2mgt 1 . 15 . 7714 . 1 1 12 GLU H H -5.600 3.089 2.420 . . . 1.0 . . . . . . . . . . . . A . 11 GLU H . . . . . . . . . c19602_2mgt 1 . 15 . 7715 . 1 1 12 GLU HA H -4.709 2.309 -0.259 . . . 1.0 . . . . . . . . . . . . A . 11 GLU HA . . . . . . . . . c19602_2mgt 1 . 15 . 7716 . 1 1 12 GLU HB2 H -2.785 3.384 1.039 . . . 1.0 . . . . . . . . . . . . A . 11 GLU HB2 . . . . . . . . . c19602_2mgt 1 . 15 . 7717 . 1 1 12 GLU HB3 H -2.962 2.111 2.240 . . . 1.0 . . . . . . . . . . . . A . 11 GLU HB3 . . . . . . . . . c19602_2mgt 1 . 15 . 7718 . 1 1 12 GLU HG2 H -2.861 0.674 -0.139 . . . 1.0 . . . . . . . . . . . . A . 11 GLU HG2 . . . . . . . . . c19602_2mgt 1 . 15 . 7719 . 1 1 12 GLU HG3 H -1.806 2.038 -0.503 . . . 1.0 . . . . . . . . . . . . A . 11 GLU HG3 . . . . . . . . . c19602_2mgt 1 . 15 . 7720 . 1 1 12 GLU N N -5.326 3.276 1.467 . . . 1.0 . . . . . . . . . . . . A . 11 GLU N . . . . . . . . . c19602_2mgt 1 . 15 . 7721 . 1 1 12 GLU O O -4.789 0.315 2.291 . . . 1.0 . . . . . . . . . . . . A . 11 GLU O . . . . . . . . . c19602_2mgt 1 . 15 . 7722 . 1 1 12 GLU OE1 O -0.360 1.468 1.741 . . . 1.0 . . . . . . . . . . . . A . 11 GLU OE1 . . . . . . . . . c19602_2mgt 1 . 15 . 7723 . 1 1 12 GLU OE2 O -1.010 -0.478 0.961 . . . 1.0 . . . . . . . . . . . . A . 11 GLU OE2 . . . . . . . . . c19602_2mgt 1 . 15 . 7724 . 1 1 13 VAL C C -6.601 -1.941 1.025 . . . 1.0 . . . . . . . . . . . . A . 12 VAL C . . . . . . . . . c19602_2mgt 1 . 15 . 7725 . 1 1 13 VAL CA C -7.256 -0.563 1.056 . . . 1.0 . . . . . . . . . . . . A . 12 VAL CA . . . . . . . . . c19602_2mgt 1 . 15 . 7726 . 1 1 13 VAL CB C -8.533 -0.514 0.186 . . . 1.0 . . . . . . . . . . . . A . 12 VAL CB . . . . . . . . . c19602_2mgt 1 . 15 . 7727 . 1 1 13 VAL CG1 C -9.475 -1.728 0.253 . . . 1.0 . . . . . . . . . . . . A . 12 VAL CG1 . . . . . . . . . c19602_2mgt 1 . 15 . 7728 . 1 1 13 VAL CG2 C -9.362 0.679 0.640 . . . 1.0 . . . . . . . . . . . . A . 12 VAL CG2 . . . . . . . . . c19602_2mgt 1 . 15 . 7729 . 1 1 13 VAL H H -6.658 1.086 -0.107 . . . 1.0 . . . . . . . . . . . . A . 12 VAL H . . . . . . . . . c19602_2mgt 1 . 15 . 7730 . 1 1 13 VAL HA H -7.552 -0.377 2.085 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HA . . . . . . . . . c19602_2mgt 1 . 15 . 7731 . 1 1 13 VAL HB H -8.247 -0.372 -0.854 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HB . . . . . . . . . c19602_2mgt 1 . 15 . 7732 . 1 1 13 VAL HG11 H -8.987 -2.595 -0.184 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HG11 . . . . . . . . . c19602_2mgt 1 . 15 . 7733 . 1 1 13 VAL HG12 H -9.742 -1.941 1.288 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HG12 . . . . . . . . . c19602_2mgt 1 . 15 . 7734 . 1 1 13 VAL HG13 H -10.383 -1.534 -0.318 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HG13 . . . . . . . . . c19602_2mgt 1 . 15 . 7735 . 1 1 13 VAL HG21 H -9.690 0.536 1.671 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HG21 . . . . . . . . . c19602_2mgt 1 . 15 . 7736 . 1 1 13 VAL HG22 H -8.770 1.579 0.561 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HG22 . . . . . . . . . c19602_2mgt 1 . 15 . 7737 . 1 1 13 VAL HG23 H -10.213 0.773 -0.022 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HG23 . . . . . . . . . c19602_2mgt 1 . 15 . 7738 . 1 1 13 VAL N N -6.347 0.522 0.668 . . . 1.0 . . . . . . . . . . . . A . 12 VAL N . . . . . . . . . c19602_2mgt 1 . 15 . 7739 . 1 1 13 VAL O O -7.191 -2.892 1.515 . . . 1.0 . . . . . . . . . . . . A . 12 VAL O . . . . . . . . . c19602_2mgt 1 . 15 . 7740 . 1 1 14 HIS C C -4.348 -3.588 2.197 . . . 1.0 . . . . . . . . . . . . A . 13 HIS C . . . . . . . . . c19602_2mgt 1 . 15 . 7741 . 1 1 14 HIS CA C -4.595 -3.283 0.710 . . . 1.0 . . . . . . . . . . . . A . 13 HIS CA . . . . . . . . . c19602_2mgt 1 . 15 . 7742 . 1 1 14 HIS CB C -3.287 -3.131 -0.063 . . . 1.0 . . . . . . . . . . . . A . 13 HIS CB . . . . . . . . . c19602_2mgt 1 . 15 . 7743 . 1 1 14 HIS CD2 C -1.010 -3.967 0.723 . . . 1.0 . . . . . . . . . . . . A . 13 HIS CD2 . . . . . . . . . c19602_2mgt 1 . 15 . 7744 . 1 1 14 HIS CE1 C -1.267 -6.125 0.495 . . . 1.0 . . . . . . . . . . . . A . 13 HIS CE1 . . . . . . . . . c19602_2mgt 1 . 15 . 7745 . 1 1 14 HIS CG C -2.262 -4.191 0.227 . . . 1.0 . . . . . . . . . . . . A . 13 HIS CG . . . . . . . . . c19602_2mgt 1 . 15 . 7746 . 1 1 14 HIS H H -4.916 -1.274 0.106 . . . 1.0 . . . . . . . . . . . . A . 13 HIS H . . . . . . . . . c19602_2mgt 1 . 15 . 7747 . 1 1 14 HIS HA H -5.185 -4.094 0.287 . . . 1.0 . . . . . . . . . . . . A . 13 HIS HA . . . . . . . . . c19602_2mgt 1 . 15 . 7748 . 1 1 14 HIS HB2 H -3.505 -3.134 -1.128 . . . 1.0 . . . . . . . . . . . . A . 13 HIS HB2 . . . . . . . . . c19602_2mgt 1 . 15 . 7749 . 1 1 14 HIS HB3 H -2.852 -2.167 0.194 . . . 1.0 . . . . . . . . . . . . A . 13 HIS HB3 . . . . . . . . . c19602_2mgt 1 . 15 . 7750 . 1 1 14 HIS HD1 H -3.228 -6.033 -0.258 . . . 1.0 . . . . . . . . . . . . A . 13 HIS HD1 . . . . . . . . . c19602_2mgt 1 . 15 . 7751 . 1 1 14 HIS HD2 H -0.589 -3.007 0.963 . . . 1.0 . . . . . . . . . . . . A . 13 HIS HD2 . . . . . . . . . c19602_2mgt 1 . 15 . 7752 . 1 1 14 HIS HE1 H -1.077 -7.186 0.491 . . . 1.0 . . . . . . . . . . . . A . 13 HIS HE1 . . . . . . . . . c19602_2mgt 1 . 15 . 7753 . 1 1 14 HIS N N -5.368 -2.070 0.535 . . . 1.0 . . . . . . . . . . . . A . 13 HIS N . . . . . . . . . c19602_2mgt 1 . 15 . 7754 . 1 1 14 HIS ND1 N -2.411 -5.551 0.094 . . . 1.0 . . . . . . . . . . . . A . 13 HIS ND1 . . . . . . . . . c19602_2mgt 1 . 15 . 7755 . 1 1 14 HIS NE2 N -0.377 -5.197 0.876 . . . 1.0 . . . . . . . . . . . . A . 13 HIS NE2 . . . . . . . . . c19602_2mgt 1 . 15 . 7756 . 1 1 14 HIS O O -4.095 -4.736 2.538 . . . 1.0 . . . . . . . . . . . . A . 13 HIS O . . . . . . . . . c19602_2mgt 1 . 15 . 7757 . 1 1 15 HIS C C -5.775 -3.188 5.139 . . . 1.0 . . . . . . . . . . . . A . 14 HIS C . . . . . . . . . c19602_2mgt 1 . 15 . 7758 . 1 1 15 HIS CA C -4.431 -2.780 4.529 . . . 1.0 . . . . . . . . . . . . A . 14 HIS CA . . . . . . . . . c19602_2mgt 1 . 15 . 7759 . 1 1 15 HIS CB C -3.885 -1.501 5.168 . . . 1.0 . . . . . . . . . . . . A . 14 HIS CB . . . . . . . . . c19602_2mgt 1 . 15 . 7760 . 1 1 15 HIS CD2 C -1.848 -0.644 3.925 . . . 1.0 . . . . . . . . . . . . A . 14 HIS CD2 . . . . . . . . . c19602_2mgt 1 . 15 . 7761 . 1 1 15 HIS CE1 C -0.284 -1.870 4.840 . . . 1.0 . . . . . . . . . . . . A . 14 HIS CE1 . . . . . . . . . c19602_2mgt 1 . 15 . 7762 . 1 1 15 HIS CG C -2.417 -1.376 4.919 . . . 1.0 . . . . . . . . . . . . A . 14 HIS CG . . . . . . . . . c19602_2mgt 1 . 15 . 7763 . 1 1 15 HIS H H -4.676 -1.664 2.748 . . . 1.0 . . . . . . . . . . . . A . 14 HIS H . . . . . . . . . c19602_2mgt 1 . 15 . 7764 . 1 1 15 HIS HA H -3.737 -3.586 4.745 . . . 1.0 . . . . . . . . . . . . A . 14 HIS HA . . . . . . . . . c19602_2mgt 1 . 15 . 7765 . 1 1 15 HIS HB2 H -4.407 -0.634 4.763 . . . 1.0 . . . . . . . . . . . . A . 14 HIS HB2 . . . . . . . . . c19602_2mgt 1 . 15 . 7766 . 1 1 15 HIS HB3 H -4.036 -1.513 6.241 . . . 1.0 . . . . . . . . . . . . A . 14 HIS HB3 . . . . . . . . . c19602_2mgt 1 . 15 . 7767 . 1 1 15 HIS HD1 H -1.537 -2.800 6.241 . . . 1.0 . . . . . . . . . . . . A . 14 HIS HD1 . . . . . . . . . c19602_2mgt 1 . 15 . 7768 . 1 1 15 HIS HD2 H -2.383 0.008 3.254 . . . 1.0 . . . . . . . . . . . . A . 14 HIS HD2 . . . . . . . . . c19602_2mgt 1 . 15 . 7769 . 1 1 15 HIS HE1 H 0.667 -2.333 5.045 . . . 1.0 . . . . . . . . . . . . A . 14 HIS HE1 . . . . . . . . . c19602_2mgt 1 . 15 . 7770 . 1 1 15 HIS N N -4.473 -2.596 3.086 . . . 1.0 . . . . . . . . . . . . A . 14 HIS N . . . . . . . . . c19602_2mgt 1 . 15 . 7771 . 1 1 15 HIS ND1 N -1.420 -2.126 5.498 . . . 1.0 . . . . . . . . . . . . A . 14 HIS ND1 . . . . . . . . . c19602_2mgt 1 . 15 . 7772 . 1 1 15 HIS NE2 N -0.493 -0.969 3.874 . . . 1.0 . . . . . . . . . . . . A . 14 HIS NE2 . . . . . . . . . c19602_2mgt 1 . 15 . 7773 . 1 1 15 HIS O O -5.835 -3.353 6.349 . . . 1.0 . . . . . . . . . . . . A . 14 HIS O . . . . . . . . . c19602_2mgt 1 . 15 . 7774 . 1 1 16 GLN C C -8.814 -4.835 4.122 . . . 1.0 . . . . . . . . . . . . A . 15 GLN C . . . . . . . . . c19602_2mgt 1 . 15 . 7775 . 1 1 16 GLN CA C -8.200 -3.602 4.781 . . . 1.0 . . . . . . . . . . . . A . 15 GLN CA . . . . . . . . . c19602_2mgt 1 . 15 . 7776 . 1 1 16 GLN CB C -9.041 -2.364 4.442 . . . 1.0 . . . . . . . . . . . . A . 15 GLN CB . . . . . . . . . c19602_2mgt 1 . 15 . 7777 . 1 1 16 GLN CD C -9.513 -1.701 6.809 . . . 1.0 . . . . . . . . . . . . A . 15 GLN CD . . . . . . . . . c19602_2mgt 1 . 15 . 7778 . 1 1 16 GLN CG C -8.882 -1.271 5.496 . . . 1.0 . . . . . . . . . . . . A . 15 GLN CG . . . . . . . . . c19602_2mgt 1 . 15 . 7779 . 1 1 16 GLN H H -6.713 -3.222 3.350 . . . 1.0 . . . . . . . . . . . . A . 15 GLN H . . . . . . . . . c19602_2mgt 1 . 15 . 7780 . 1 1 16 GLN HA H -8.212 -3.772 5.852 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HA . . . . . . . . . c19602_2mgt 1 . 15 . 7781 . 1 1 16 GLN HB2 H -8.756 -1.968 3.469 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HB2 . . . . . . . . . c19602_2mgt 1 . 15 . 7782 . 1 1 16 GLN HB3 H -10.094 -2.636 4.387 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HB3 . . . . . . . . . c19602_2mgt 1 . 15 . 7783 . 1 1 16 GLN HE21 H -7.718 -1.843 7.755 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HE21 . . . . . . . . . c19602_2mgt 1 . 15 . 7784 . 1 1 16 GLN HE22 H -9.113 -2.280 8.715 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HE22 . . . . . . . . . c19602_2mgt 1 . 15 . 7785 . 1 1 16 GLN HG2 H -7.832 -1.012 5.632 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HG2 . . . . . . . . . c19602_2mgt 1 . 15 . 7786 . 1 1 16 GLN HG3 H -9.418 -0.398 5.144 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HG3 . . . . . . . . . c19602_2mgt 1 . 15 . 7787 . 1 1 16 GLN N N -6.835 -3.355 4.339 . . . 1.0 . . . . . . . . . . . . A . 15 GLN N . . . . . . . . . c19602_2mgt 1 . 15 . 7788 . 1 1 16 GLN NE2 N -8.717 -1.956 7.844 . . . 1.0 . . . . . . . . . . . . A . 15 GLN NE2 . . . . . . . . . c19602_2mgt 1 . 15 . 7789 . 1 1 16 GLN O O -9.469 -5.612 4.807 . . . 1.0 . . . . . . . . . . . . A . 15 GLN O . . . . . . . . . c19602_2mgt 1 . 15 . 7790 . 1 1 16 GLN OE1 O -10.725 -1.842 6.870 . . . 1.0 . . . . . . . . . . . . A . 15 GLN OE1 . . . . . . . . . c19602_2mgt 1 . 15 . 7791 . 1 1 17 LYS C C -8.197 -6.425 0.863 . . . 1.0 . . . . . . . . . . . . A . 16 LYS C . . . . . . . . . c19602_2mgt 1 . 15 . 7792 . 1 1 17 LYS CA C -9.152 -6.105 2.016 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CA . . . . . . . . . c19602_2mgt 1 . 15 . 7793 . 1 1 17 LYS CB C -10.553 -5.746 1.485 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CB . . . . . . . . . c19602_2mgt 1 . 15 . 7794 . 1 1 17 LYS CD C -13.043 -5.901 2.140 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CD . . . . . . . . . c19602_2mgt 1 . 15 . 7795 . 1 1 17 LYS CE C -13.245 -7.263 1.474 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CE . . . . . . . . . c19602_2mgt 1 . 15 . 7796 . 1 1 17 LYS CG C -11.602 -5.708 2.610 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CG . . . . . . . . . c19602_2mgt 1 . 15 . 7797 . 1 1 17 LYS H H -8.076 -4.321 2.315 . . . 1.0 . . . . . . . . . . . . A . 16 LYS H . . . . . . . . . c19602_2mgt 1 . 15 . 7798 . 1 1 17 LYS HA H -9.230 -6.999 2.636 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HA . . . . . . . . . c19602_2mgt 1 . 15 . 7799 . 1 1 17 LYS HB2 H -10.528 -4.782 0.975 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HB2 . . . . . . . . . c19602_2mgt 1 . 15 . 7800 . 1 1 17 LYS HB3 H -10.835 -6.498 0.754 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HB3 . . . . . . . . . c19602_2mgt 1 . 15 . 7801 . 1 1 17 LYS HD2 H -13.689 -5.841 3.016 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HD2 . . . . . . . . . c19602_2mgt 1 . 15 . 7802 . 1 1 17 LYS HD3 H -13.308 -5.110 1.443 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HD3 . . . . . . . . . c19602_2mgt 1 . 15 . 7803 . 1 1 17 LYS HE2 H -12.861 -7.218 0.457 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HE2 . . . . . . . . . c19602_2mgt 1 . 15 . 7804 . 1 1 17 LYS HE3 H -12.696 -8.019 2.033 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HE3 . . . . . . . . . c19602_2mgt 1 . 15 . 7805 . 1 1 17 LYS HG2 H -11.392 -6.497 3.328 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HG2 . . . . . . . . . c19602_2mgt 1 . 15 . 7806 . 1 1 17 LYS HG3 H -11.531 -4.751 3.129 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HG3 . . . . . . . . . c19602_2mgt 1 . 15 . 7807 . 1 1 17 LYS HZ1 H -15.202 -6.915 1.011 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HZ1 . . . . . . . . . c19602_2mgt 1 . 15 . 7808 . 1 1 17 LYS HZ2 H -14.772 -8.503 0.912 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HZ2 . . . . . . . . . c19602_2mgt 1 . 15 . 7809 . 1 1 17 LYS HZ3 H -14.991 -7.793 2.385 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HZ3 . . . . . . . . . c19602_2mgt 1 . 15 . 7810 . 1 1 17 LYS N N -8.614 -5.013 2.815 . . . 1.0 . . . . . . . . . . . . A . 16 LYS N . . . . . . . . . c19602_2mgt 1 . 15 . 7811 . 1 1 17 LYS NZ N -14.660 -7.650 1.442 . . . 1.0 . . . . . . . . . . . . A . 16 LYS NZ . . . . . . . . . c19602_2mgt 1 . 15 . 7812 . 1 1 17 LYS O O -7.388 -5.598 0.450 . . . 1.0 . . . . . . . . . . . . A . 16 LYS O . . . . . . . . . c19602_2mgt 1 . 15 . 7813 . 1 1 18 NH2 HN1 H -7.688 -7.899 -0.436 . . . 1.0 . . . . . . . . . . . . A . 17 NH2 HN1 . . . . . . . . . c19602_2mgt 1 . 15 . 7814 . 1 1 18 NH2 HN2 H -8.961 -8.301 0.695 . . . 1.0 . . . . . . . . . . . . A . 17 NH2 HN2 . . . . . . . . . c19602_2mgt 1 . 15 . 7815 . 1 1 18 NH2 N N -8.296 -7.638 0.325 . . . 1.0 . . . . . . . . . . . . A . 17 NH2 N . . . . . . . . . c19602_2mgt 1 . 15 . 7816 . 2 1 1 ACE C C 6.645 7.210 -9.289 . . . 1.0 . . . . . . . . . . . . B . 0 ACE C . . . . . . . . . c19602_2mgt 1 . 15 . 7817 . 2 1 1 ACE CH3 C 5.738 7.276 -8.078 . . . 1.0 . . . . . . . . . . . . B . 0 ACE CH3 . . . . . . . . . c19602_2mgt 1 . 15 . 7818 . 2 1 1 ACE H1 H 5.964 8.183 -7.532 . . . 1.0 . . . . . . . . . . . . B . 0 ACE H1 . . . . . . . . . c19602_2mgt 1 . 15 . 7819 . 2 1 1 ACE H2 H 4.698 7.315 -8.398 . . . 1.0 . . . . . . . . . . . . B . 0 ACE H2 . . . . . . . . . c19602_2mgt 1 . 15 . 7820 . 2 1 1 ACE H3 H 5.898 6.407 -7.440 . . . 1.0 . . . . . . . . . . . . B . 0 ACE H3 . . . . . . . . . c19602_2mgt 1 . 15 . 7821 . 2 1 1 ACE O O 6.206 7.534 -10.381 . . . 1.0 . . . . . . . . . . . . B . 0 ACE O . . . . . . . . . c19602_2mgt 1 . 15 . 7822 . 2 1 2 ASP C C 9.778 5.464 -9.885 . . . 1.0 . . . . . . . . . . . . B . 1 ASP C . . . . . . . . . c19602_2mgt 1 . 15 . 7823 . 2 1 2 ASP CA C 8.848 6.623 -10.205 . . . 1.0 . . . . . . . . . . . . B . 1 ASP CA . . . . . . . . . c19602_2mgt 1 . 15 . 7824 . 2 1 2 ASP CB C 9.657 7.901 -10.433 . . . 1.0 . . . . . . . . . . . . B . 1 ASP CB . . . . . . . . . c19602_2mgt 1 . 15 . 7825 . 2 1 2 ASP CG C 10.384 7.840 -11.767 . . . 1.0 . . . . . . . . . . . . B . 1 ASP CG . . . . . . . . . c19602_2mgt 1 . 15 . 7826 . 2 1 2 ASP H H 8.219 6.551 -8.183 . . . 1.0 . . . . . . . . . . . . B . 1 ASP H . . . . . . . . . c19602_2mgt 1 . 15 . 7827 . 2 1 2 ASP HA H 8.299 6.400 -11.118 . . . 1.0 . . . . . . . . . . . . B . 1 ASP HA . . . . . . . . . c19602_2mgt 1 . 15 . 7828 . 2 1 2 ASP HB2 H 8.992 8.764 -10.427 . . . 1.0 . . . . . . . . . . . . B . 1 ASP HB2 . . . . . . . . . c19602_2mgt 1 . 15 . 7829 . 2 1 2 ASP HB3 H 10.391 8.014 -9.638 . . . 1.0 . . . . . . . . . . . . B . 1 ASP HB3 . . . . . . . . . c19602_2mgt 1 . 15 . 7830 . 2 1 2 ASP N N 7.902 6.797 -9.110 . . . 1.0 . . . . . . . . . . . . B . 1 ASP N . . . . . . . . . c19602_2mgt 1 . 15 . 7831 . 2 1 2 ASP O O 10.237 5.364 -8.754 . . . 1.0 . . . . . . . . . . . . B . 1 ASP O . . . . . . . . . c19602_2mgt 1 . 15 . 7832 . 2 1 2 ASP OD1 O 11.292 7.009 -11.914 . . . 1.0 . . . . . . . . . . . . B . 1 ASP OD1 . . . . . . . . . c19602_2mgt 1 . 15 . 7833 . 2 1 2 ASP OD2 O 10.004 8.631 -12.657 . . . 1.0 . . . . . . . . . . . . B . 1 ASP OD2 . . . . . . . . . c19602_2mgt 1 . 15 . 7834 . 2 1 3 ALA C C 11.970 3.338 -9.926 . . . 1.0 . . . . . . . . . . . . B . 2 ALA C . . . . . . . . . c19602_2mgt 1 . 15 . 7835 . 2 1 3 ALA CA C 10.754 3.352 -10.844 . . . 1.0 . . . . . . . . . . . . B . 2 ALA CA . . . . . . . . . c19602_2mgt 1 . 15 . 7836 . 2 1 3 ALA CB C 11.188 2.981 -12.263 . . . 1.0 . . . . . . . . . . . . B . 2 ALA CB . . . . . . . . . c19602_2mgt 1 . 15 . 7837 . 2 1 3 ALA H H 9.699 4.898 -11.804 . . . 1.0 . . . . . . . . . . . . B . 2 ALA H . . . . . . . . . c19602_2mgt 1 . 15 . 7838 . 2 1 3 ALA HA H 10.052 2.596 -10.494 . . . 1.0 . . . . . . . . . . . . B . 2 ALA HA . . . . . . . . . c19602_2mgt 1 . 15 . 7839 . 2 1 3 ALA HB1 H 11.787 2.072 -12.245 . . . 1.0 . . . . . . . . . . . . B . 2 ALA HB1 . . . . . . . . . c19602_2mgt 1 . 15 . 7840 . 2 1 3 ALA HB2 H 10.312 2.821 -12.883 . . . 1.0 . . . . . . . . . . . . B . 2 ALA HB2 . . . . . . . . . c19602_2mgt 1 . 15 . 7841 . 2 1 3 ALA HB3 H 11.778 3.788 -12.691 . . . 1.0 . . . . . . . . . . . . B . 2 ALA HB3 . . . . . . . . . c19602_2mgt 1 . 15 . 7842 . 2 1 3 ALA N N 10.061 4.636 -10.899 . . . 1.0 . . . . . . . . . . . . B . 2 ALA N . . . . . . . . . c19602_2mgt 1 . 15 . 7843 . 2 1 3 ALA O O 12.144 2.377 -9.185 . . . 1.0 . . . . . . . . . . . . B . 2 ALA O . . . . . . . . . c19602_2mgt 1 . 15 . 7844 . 2 1 4 GLU C C 13.777 4.291 -7.664 . . . 1.0 . . . . . . . . . . . . B . 3 GLU C . . . . . . . . . c19602_2mgt 1 . 15 . 7845 . 2 1 4 GLU CA C 13.994 4.515 -9.157 . . . 1.0 . . . . . . . . . . . . B . 3 GLU CA . . . . . . . . . c19602_2mgt 1 . 15 . 7846 . 2 1 4 GLU CB C 14.672 5.859 -9.438 . . . 1.0 . . . . . . . . . . . . B . 3 GLU CB . . . . . . . . . c19602_2mgt 1 . 15 . 7847 . 2 1 4 GLU CD C 14.453 8.378 -9.388 . . . 1.0 . . . . . . . . . . . . B . 3 GLU CD . . . . . . . . . c19602_2mgt 1 . 15 . 7848 . 2 1 4 GLU CG C 13.770 7.051 -9.100 . . . 1.0 . . . . . . . . . . . . B . 3 GLU CG . . . . . . . . . c19602_2mgt 1 . 15 . 7849 . 2 1 4 GLU H H 12.554 5.166 -10.568 . . . 1.0 . . . . . . . . . . . . B . 3 GLU H . . . . . . . . . c19602_2mgt 1 . 15 . 7850 . 2 1 4 GLU HA H 14.666 3.729 -9.477 . . . 1.0 . . . . . . . . . . . . B . 3 GLU HA . . . . . . . . . c19602_2mgt 1 . 15 . 7851 . 2 1 4 GLU HB2 H 15.592 5.923 -8.855 . . . 1.0 . . . . . . . . . . . . B . 3 GLU HB2 . . . . . . . . . c19602_2mgt 1 . 15 . 7852 . 2 1 4 GLU HB3 H 14.926 5.891 -10.495 . . . 1.0 . . . . . . . . . . . . B . 3 GLU HB3 . . . . . . . . . c19602_2mgt 1 . 15 . 7853 . 2 1 4 GLU HG2 H 12.850 6.985 -9.681 . . . 1.0 . . . . . . . . . . . . B . 3 GLU HG2 . . . . . . . . . c19602_2mgt 1 . 15 . 7854 . 2 1 4 GLU HG3 H 13.522 7.018 -8.044 . . . 1.0 . . . . . . . . . . . . B . 3 GLU HG3 . . . . . . . . . c19602_2mgt 1 . 15 . 7855 . 2 1 4 GLU N N 12.781 4.399 -9.952 . . . 1.0 . . . . . . . . . . . . B . 3 GLU N . . . . . . . . . c19602_2mgt 1 . 15 . 7856 . 2 1 4 GLU O O 14.639 3.675 -7.057 . . . 1.0 . . . . . . . . . . . . B . 3 GLU O . . . . . . . . . c19602_2mgt 1 . 15 . 7857 . 2 1 4 GLU OE1 O 14.463 8.790 -10.562 . . . 1.0 . . . . . . . . . . . . B . 3 GLU OE1 . . . . . . . . . c19602_2mgt 1 . 15 . 7858 . 2 1 4 GLU OE2 O 14.973 8.979 -8.430 . . . 1.0 . . . . . . . . . . . . B . 3 GLU OE2 . . . . . . . . . c19602_2mgt 1 . 15 . 7859 . 2 1 5 PHE C C 11.033 3.492 -5.646 . . . 1.0 . . . . . . . . . . . . B . 4 PHE C . . . . . . . . . c19602_2mgt 1 . 15 . 7860 . 2 1 5 PHE CA C 12.257 4.408 -5.716 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CA . . . . . . . . . c19602_2mgt 1 . 15 . 7861 . 2 1 5 PHE CB C 12.005 5.715 -4.982 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CB . . . . . . . . . c19602_2mgt 1 . 15 . 7862 . 2 1 5 PHE CD1 C 9.523 6.152 -4.930 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CD1 . . . . . . . . . c19602_2mgt 1 . 15 . 7863 . 2 1 5 PHE CD2 C 10.915 7.513 -6.383 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CD2 . . . . . . . . . c19602_2mgt 1 . 15 . 7864 . 2 1 5 PHE CE1 C 8.402 6.929 -5.267 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CE1 . . . . . . . . . c19602_2mgt 1 . 15 . 7865 . 2 1 5 PHE CE2 C 9.795 8.282 -6.735 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CE2 . . . . . . . . . c19602_2mgt 1 . 15 . 7866 . 2 1 5 PHE CG C 10.787 6.478 -5.446 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CG . . . . . . . . . c19602_2mgt 1 . 15 . 7867 . 2 1 5 PHE CZ C 8.550 8.018 -6.143 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CZ . . . . . . . . . c19602_2mgt 1 . 15 . 7868 . 2 1 5 PHE H H 11.985 5.232 -7.647 . . . 1.0 . . . . . . . . . . . . B . 4 PHE H . . . . . . . . . c19602_2mgt 1 . 15 . 7869 . 2 1 5 PHE HA H 13.072 3.903 -5.207 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HA . . . . . . . . . c19602_2mgt 1 . 15 . 7870 . 2 1 5 PHE HB2 H 11.886 5.491 -3.923 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HB2 . . . . . . . . . c19602_2mgt 1 . 15 . 7871 . 2 1 5 PHE HB3 H 12.887 6.347 -5.088 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HB3 . . . . . . . . . c19602_2mgt 1 . 15 . 7872 . 2 1 5 PHE HD1 H 9.428 5.299 -4.275 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HD1 . . . . . . . . . c19602_2mgt 1 . 15 . 7873 . 2 1 5 PHE HD2 H 11.880 7.720 -6.813 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HD2 . . . . . . . . . c19602_2mgt 1 . 15 . 7874 . 2 1 5 PHE HE1 H 7.436 6.697 -4.847 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HE1 . . . . . . . . . c19602_2mgt 1 . 15 . 7875 . 2 1 5 PHE HE2 H 9.888 9.084 -7.450 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HE2 . . . . . . . . . c19602_2mgt 1 . 15 . 7876 . 2 1 5 PHE HZ H 7.708 8.645 -6.375 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HZ . . . . . . . . . c19602_2mgt 1 . 15 . 7877 . 2 1 5 PHE N N 12.644 4.707 -7.091 . . . 1.0 . . . . . . . . . . . . B . 4 PHE N . . . . . . . . . c19602_2mgt 1 . 15 . 7878 . 2 1 5 PHE O O 10.840 2.818 -4.638 . . . 1.0 . . . . . . . . . . . . B . 4 PHE O . . . . . . . . . c19602_2mgt 1 . 15 . 7879 . 2 1 6 ARG C C 9.942 1.134 -7.479 . . . 1.0 . . . . . . . . . . . . B . 5 ARG C . . . . . . . . . c19602_2mgt 1 . 15 . 7880 . 2 1 6 ARG CA C 9.246 2.402 -6.985 . . . 1.0 . . . . . . . . . . . . B . 5 ARG CA . . . . . . . . . c19602_2mgt 1 . 15 . 7881 . 2 1 6 ARG CB C 8.153 2.999 -7.886 . . . 1.0 . . . . . . . . . . . . B . 5 ARG CB . . . . . . . . . c19602_2mgt 1 . 15 . 7882 . 2 1 6 ARG CD C 6.367 1.428 -6.854 . . . 1.0 . . . . . . . . . . . . B . 5 ARG CD . . . . . . . . . c19602_2mgt 1 . 15 . 7883 . 2 1 6 ARG CG C 6.909 2.132 -8.108 . . . 1.0 . . . . . . . . . . . . B . 5 ARG CG . . . . . . . . . c19602_2mgt 1 . 15 . 7884 . 2 1 6 ARG CZ C 6.516 -1.061 -7.122 . . . 1.0 . . . . . . . . . . . . B . 5 ARG CZ . . . . . . . . . c19602_2mgt 1 . 15 . 7885 . 2 1 6 ARG H H 10.447 4.021 -7.510 . . . 1.0 . . . . . . . . . . . . B . 5 ARG H . . . . . . . . . c19602_2mgt 1 . 15 . 7886 . 2 1 6 ARG HA H 8.791 2.145 -6.043 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HA . . . . . . . . . c19602_2mgt 1 . 15 . 7887 . 2 1 6 ARG HB2 H 7.828 3.934 -7.426 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HB2 . . . . . . . . . c19602_2mgt 1 . 15 . 7888 . 2 1 6 ARG HB3 H 8.572 3.237 -8.859 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HB3 . . . . . . . . . c19602_2mgt 1 . 15 . 7889 . 2 1 6 ARG HD2 H 6.533 2.052 -5.976 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HD2 . . . . . . . . . c19602_2mgt 1 . 15 . 7890 . 2 1 6 ARG HD3 H 5.294 1.299 -6.959 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HD3 . . . . . . . . . c19602_2mgt 1 . 15 . 7891 . 2 1 6 ARG HE H 7.789 0.073 -6.044 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HE . . . . . . . . . c19602_2mgt 1 . 15 . 7892 . 2 1 6 ARG HG2 H 6.128 2.784 -8.498 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HG2 . . . . . . . . . c19602_2mgt 1 . 15 . 7893 . 2 1 6 ARG HG3 H 7.133 1.396 -8.877 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HG3 . . . . . . . . . c19602_2mgt 1 . 15 . 7894 . 2 1 6 ARG HH11 H 4.995 -0.281 -8.230 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HH11 . . . . . . . . . c19602_2mgt 1 . 15 . 7895 . 2 1 6 ARG HH12 H 5.140 -2.021 -8.272 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HH12 . . . . . . . . . c19602_2mgt 1 . 15 . 7896 . 2 1 6 ARG HH21 H 7.922 -2.174 -6.163 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HH21 . . . . . . . . . c19602_2mgt 1 . 15 . 7897 . 2 1 6 ARG HH22 H 6.765 -3.081 -7.108 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HH22 . . . . . . . . . c19602_2mgt 1 . 15 . 7898 . 2 1 6 ARG N N 10.249 3.417 -6.730 . . . 1.0 . . . . . . . . . . . . B . 5 ARG N . . . . . . . . . c19602_2mgt 1 . 15 . 7899 . 2 1 6 ARG NE N 6.976 0.104 -6.641 . . . 1.0 . . . . . . . . . . . . B . 5 ARG NE . . . . . . . . . c19602_2mgt 1 . 15 . 7900 . 2 1 6 ARG NH1 N 5.454 -1.127 -7.926 . . . 1.0 . . . . . . . . . . . . B . 5 ARG NH1 . . . . . . . . . c19602_2mgt 1 . 15 . 7901 . 2 1 6 ARG NH2 N 7.126 -2.195 -6.785 . . . 1.0 . . . . . . . . . . . . B . 5 ARG NH2 . . . . . . . . . c19602_2mgt 1 . 15 . 7902 . 2 1 6 ARG O O 9.595 0.556 -8.497 . . . 1.0 . . . . . . . . . . . . B . 5 ARG O . . . . . . . . . c19602_2mgt 1 . 15 . 7903 . 2 1 7 ARG C C 10.864 -1.695 -6.553 . . . 1.0 . . . . . . . . . . . . B . 6 ARG C . . . . . . . . . c19602_2mgt 1 . 15 . 7904 . 2 1 7 ARG CA C 11.749 -0.465 -6.773 . . . 1.0 . . . . . . . . . . . . B . 6 ARG CA . . . . . . . . . c19602_2mgt 1 . 15 . 7905 . 2 1 7 ARG CB C 12.787 -0.341 -5.648 . . . 1.0 . . . . . . . . . . . . B . 6 ARG CB . . . . . . . . . c19602_2mgt 1 . 15 . 7906 . 2 1 7 ARG CD C 14.884 0.478 -6.869 . . . 1.0 . . . . . . . . . . . . B . 6 ARG CD . . . . . . . . . c19602_2mgt 1 . 15 . 7907 . 2 1 7 ARG CG C 13.835 0.769 -5.795 . . . 1.0 . . . . . . . . . . . . B . 6 ARG CG . . . . . . . . . c19602_2mgt 1 . 15 . 7908 . 2 1 7 ARG CZ C 14.918 0.351 -9.350 . . . 1.0 . . . . . . . . . . . . B . 6 ARG CZ . . . . . . . . . c19602_2mgt 1 . 15 . 7909 . 2 1 7 ARG H H 11.182 1.330 -5.929 . . . 1.0 . . . . . . . . . . . . B . 6 ARG H . . . . . . . . . c19602_2mgt 1 . 15 . 7910 . 2 1 7 ARG HA H 12.242 -0.532 -7.739 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HA . . . . . . . . . c19602_2mgt 1 . 15 . 7911 . 2 1 7 ARG HB2 H 12.238 -0.108 -4.735 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HB2 . . . . . . . . . c19602_2mgt 1 . 15 . 7912 . 2 1 7 ARG HB3 H 13.299 -1.293 -5.524 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HB3 . . . . . . . . . c19602_2mgt 1 . 15 . 7913 . 2 1 7 ARG HD2 H 15.780 1.059 -6.658 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HD2 . . . . . . . . . c19602_2mgt 1 . 15 . 7914 . 2 1 7 ARG HD3 H 15.132 -0.580 -6.837 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HD3 . . . . . . . . . c19602_2mgt 1 . 15 . 7915 . 2 1 7 ARG HE H 13.638 1.476 -8.267 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HE . . . . . . . . . c19602_2mgt 1 . 15 . 7916 . 2 1 7 ARG HG2 H 13.345 1.720 -5.992 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HG2 . . . . . . . . . c19602_2mgt 1 . 15 . 7917 . 2 1 7 ARG HG3 H 14.355 0.855 -4.841 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HG3 . . . . . . . . . c19602_2mgt 1 . 15 . 7918 . 2 1 7 ARG HH11 H 16.405 -0.756 -8.504 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HH11 . . . . . . . . . c19602_2mgt 1 . 15 . 7919 . 2 1 7 ARG HH12 H 16.310 -0.831 -10.247 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HH12 . . . . . . . . . c19602_2mgt 1 . 15 . 7920 . 2 1 7 ARG HH21 H 13.521 1.277 -10.497 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HH21 . . . . . . . . . c19602_2mgt 1 . 15 . 7921 . 2 1 7 ARG HH22 H 14.700 0.325 -11.369 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HH22 . . . . . . . . . c19602_2mgt 1 . 15 . 7922 . 2 1 7 ARG N N 10.959 0.739 -6.712 . . . 1.0 . . . . . . . . . . . . B . 6 ARG N . . . . . . . . . c19602_2mgt 1 . 15 . 7923 . 2 1 7 ARG NE N 14.412 0.826 -8.208 . . . 1.0 . . . . . . . . . . . . B . 6 ARG NE . . . . . . . . . c19602_2mgt 1 . 15 . 7924 . 2 1 7 ARG NH1 N 15.971 -0.466 -9.368 . . . 1.0 . . . . . . . . . . . . B . 6 ARG NH1 . . . . . . . . . c19602_2mgt 1 . 15 . 7925 . 2 1 7 ARG NH2 N 14.348 0.697 -10.500 . . . 1.0 . . . . . . . . . . . . B . 6 ARG NH2 . . . . . . . . . c19602_2mgt 1 . 15 . 7926 . 2 1 7 ARG O O 9.808 -1.603 -5.928 . . . 1.0 . . . . . . . . . . . . B . 6 ARG O . . . . . . . . . c19602_2mgt 1 . 15 . 7927 . 2 1 8 ASP C C 11.000 -5.171 -6.226 . . . 1.0 . . . . . . . . . . . . B . 7 ASP C . . . . . . . . . c19602_2mgt 1 . 15 . 7928 . 2 1 8 ASP CA C 10.527 -4.074 -7.171 . . . 1.0 . . . . . . . . . . . . B . 7 ASP CA . . . . . . . . . c19602_2mgt 1 . 15 . 7929 . 2 1 8 ASP CB C 10.628 -4.602 -8.603 . . . 1.0 . . . . . . . . . . . . B . 7 ASP CB . . . . . . . . . c19602_2mgt 1 . 15 . 7930 . 2 1 8 ASP CG C 10.151 -3.555 -9.591 . . . 1.0 . . . . . . . . . . . . B . 7 ASP CG . . . . . . . . . c19602_2mgt 1 . 15 . 7931 . 2 1 8 ASP H H 12.209 -2.841 -7.527 . . . 1.0 . . . . . . . . . . . . B . 7 ASP H . . . . . . . . . c19602_2mgt 1 . 15 . 7932 . 2 1 8 ASP HA H 9.479 -3.862 -6.959 . . . 1.0 . . . . . . . . . . . . B . 7 ASP HA . . . . . . . . . c19602_2mgt 1 . 15 . 7933 . 2 1 8 ASP HB2 H 11.663 -4.860 -8.827 . . . 1.0 . . . . . . . . . . . . B . 7 ASP HB2 . . . . . . . . . c19602_2mgt 1 . 15 . 7934 . 2 1 8 ASP HB3 H 10.020 -5.501 -8.706 . . . 1.0 . . . . . . . . . . . . B . 7 ASP HB3 . . . . . . . . . c19602_2mgt 1 . 15 . 7935 . 2 1 8 ASP N N 11.311 -2.843 -7.066 . . . 1.0 . . . . . . . . . . . . B . 7 ASP N . . . . . . . . . c19602_2mgt 1 . 15 . 7936 . 2 1 8 ASP O O 10.235 -6.089 -5.963 . . . 1.0 . . . . . . . . . . . . B . 7 ASP O . . . . . . . . . c19602_2mgt 1 . 15 . 7937 . 2 1 8 ASP OD1 O 10.971 -2.716 -9.990 . . . 1.0 . . . . . . . . . . . . B . 7 ASP OD1 . . . . . . . . . c19602_2mgt 1 . 15 . 7938 . 2 1 8 ASP OD2 O 8.944 -3.585 -9.916 . . . 1.0 . . . . . . . . . . . . B . 7 ASP OD2 . . . . . . . . . c19602_2mgt 1 . 15 . 7939 . 2 1 9 SER C C 12.273 -5.866 -3.399 . . . 1.0 . . . . . . . . . . . . B . 8 SER C . . . . . . . . . c19602_2mgt 1 . 15 . 7940 . 2 1 9 SER CA C 12.776 -6.109 -4.822 . . . 1.0 . . . . . . . . . . . . B . 8 SER CA . . . . . . . . . c19602_2mgt 1 . 15 . 7941 . 2 1 9 SER CB C 14.303 -6.111 -4.905 . . . 1.0 . . . . . . . . . . . . B . 8 SER CB . . . . . . . . . c19602_2mgt 1 . 15 . 7942 . 2 1 9 SER H H 12.854 -4.369 -6.014 . . . 1.0 . . . . . . . . . . . . B . 8 SER H . . . . . . . . . c19602_2mgt 1 . 15 . 7943 . 2 1 9 SER HA H 12.432 -7.081 -5.154 . . . 1.0 . . . . . . . . . . . . B . 8 SER HA . . . . . . . . . c19602_2mgt 1 . 15 . 7944 . 2 1 9 SER HB2 H 14.693 -5.126 -4.653 . . . 1.0 . . . . . . . . . . . . B . 8 SER HB2 . . . . . . . . . c19602_2mgt 1 . 15 . 7945 . 2 1 9 SER HB3 H 14.706 -6.848 -4.216 . . . 1.0 . . . . . . . . . . . . B . 8 SER HB3 . . . . . . . . . c19602_2mgt 1 . 15 . 7946 . 2 1 9 SER HG H 14.407 -7.343 -6.401 . . . 1.0 . . . . . . . . . . . . B . 8 SER HG . . . . . . . . . c19602_2mgt 1 . 15 . 7947 . 2 1 9 SER N N 12.236 -5.107 -5.722 . . . 1.0 . . . . . . . . . . . . B . 8 SER N . . . . . . . . . c19602_2mgt 1 . 15 . 7948 . 2 1 9 SER O O 12.970 -5.252 -2.602 . . . 1.0 . . . . . . . . . . . . B . 8 SER O . . . . . . . . . c19602_2mgt 1 . 15 . 7949 . 2 1 9 SER OG O 14.712 -6.450 -6.206 . . . 1.0 . . . . . . . . . . . . B . 8 SER OG . . . . . . . . . c19602_2mgt 1 . 15 . 7950 . 2 1 10 GLY C C 9.049 -6.753 -1.819 . . . 1.0 . . . . . . . . . . . . B . 9 GLY C . . . . . . . . . c19602_2mgt 1 . 15 . 7951 . 2 1 10 GLY CA C 10.455 -6.160 -1.766 . . . 1.0 . . . . . . . . . . . . B . 9 GLY CA . . . . . . . . . c19602_2mgt 1 . 15 . 7952 . 2 1 10 GLY H H 10.480 -6.766 -3.777 . . . 1.0 . . . . . . . . . . . . B . 9 GLY H . . . . . . . . . c19602_2mgt 1 . 15 . 7953 . 2 1 10 GLY HA2 H 11.055 -6.686 -1.024 . . . 1.0 . . . . . . . . . . . . B . 9 GLY HA2 . . . . . . . . . c19602_2mgt 1 . 15 . 7954 . 2 1 10 GLY HA3 H 10.457 -5.108 -1.488 . . . 1.0 . . . . . . . . . . . . B . 9 GLY HA3 . . . . . . . . . c19602_2mgt 1 . 15 . 7955 . 2 1 10 GLY N N 11.058 -6.325 -3.075 . . . 1.0 . . . . . . . . . . . . B . 9 GLY N . . . . . . . . . c19602_2mgt 1 . 15 . 7956 . 2 1 10 GLY O O 8.910 -7.966 -1.917 . . . 1.0 . . . . . . . . . . . . B . 9 GLY O . . . . . . . . . c19602_2mgt 1 . 15 . 7957 . 2 1 11 TYR C C 6.457 -4.147 -1.205 . . . 1.0 . . . . . . . . . . . . B . 10 TYR C . . . . . . . . . c19602_2mgt 1 . 15 . 7958 . 2 1 11 TYR CA C 7.898 -4.547 -1.497 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CA . . . . . . . . . c19602_2mgt 1 . 15 . 7959 . 2 1 11 TYR CB C 8.390 -3.726 -2.695 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CB . . . . . . . . . c19602_2mgt 1 . 15 . 7960 . 2 1 11 TYR CD1 C 9.515 -1.983 -1.213 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CD1 . . . . . . . . . c19602_2mgt 1 . 15 . 7961 . 2 1 11 TYR CD2 C 10.647 -2.794 -3.205 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CD2 . . . . . . . . . c19602_2mgt 1 . 15 . 7962 . 2 1 11 TYR CE1 C 10.605 -1.150 -0.921 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CE1 . . . . . . . . . c19602_2mgt 1 . 15 . 7963 . 2 1 11 TYR CE2 C 11.738 -1.973 -2.915 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CE2 . . . . . . . . . c19602_2mgt 1 . 15 . 7964 . 2 1 11 TYR CG C 9.533 -2.800 -2.361 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CG . . . . . . . . . c19602_2mgt 1 . 15 . 7965 . 2 1 11 TYR CZ C 11.717 -1.125 -1.793 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CZ . . . . . . . . . c19602_2mgt 1 . 15 . 7966 . 2 1 11 TYR H H 7.093 -6.372 -2.031 . . . 1.0 . . . . . . . . . . . . B . 10 TYR H . . . . . . . . . c19602_2mgt 1 . 15 . 7967 . 2 1 11 TYR HA H 8.509 -4.339 -0.621 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HA . . . . . . . . . c19602_2mgt 1 . 15 . 7968 . 2 1 11 TYR HB2 H 8.697 -4.391 -3.502 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HB2 . . . . . . . . . c19602_2mgt 1 . 15 . 7969 . 2 1 11 TYR HB3 H 7.571 -3.137 -3.100 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HB3 . . . . . . . . . c19602_2mgt 1 . 15 . 7970 . 2 1 11 TYR HD1 H 8.669 -1.983 -0.549 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HD1 . . . . . . . . . c19602_2mgt 1 . 15 . 7971 . 2 1 11 TYR HD2 H 10.666 -3.430 -4.072 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HD2 . . . . . . . . . c19602_2mgt 1 . 15 . 7972 . 2 1 11 TYR HE1 H 10.583 -0.540 -0.036 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HE1 . . . . . . . . . c19602_2mgt 1 . 15 . 7973 . 2 1 11 TYR HE2 H 12.605 -2.012 -3.544 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HE2 . . . . . . . . . c19602_2mgt 1 . 15 . 7974 . 2 1 11 TYR HH H 12.708 0.162 -0.724 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HH . . . . . . . . . c19602_2mgt 1 . 15 . 7975 . 2 1 11 TYR N N 7.972 -5.963 -1.777 . . . 1.0 . . . . . . . . . . . . B . 10 TYR N . . . . . . . . . c19602_2mgt 1 . 15 . 7976 . 2 1 11 TYR O O 5.510 -4.807 -1.629 . . . 1.0 . . . . . . . . . . . . B . 10 TYR O . . . . . . . . . c19602_2mgt 1 . 15 . 7977 . 2 1 11 TYR OH O 12.777 -0.307 -1.560 . . . 1.0 . . . . . . . . . . . . B . 10 TYR OH . . . . . . . . . c19602_2mgt 1 . 15 . 7978 . 2 1 12 GLU C C 5.698 -0.716 -0.415 . . . 1.0 . . . . . . . . . . . . B . 11 GLU C . . . . . . . . . c19602_2mgt 1 . 15 . 7979 . 2 1 12 GLU CA C 5.154 -2.141 -0.607 . . . 1.0 . . . . . . . . . . . . B . 11 GLU CA . . . . . . . . . c19602_2mgt 1 . 15 . 7980 . 2 1 12 GLU CB C 4.155 -2.626 0.452 . . . 1.0 . . . . . . . . . . . . B . 11 GLU CB . . . . . . . . . c19602_2mgt 1 . 15 . 7981 . 2 1 12 GLU CD C 1.928 -1.505 0.935 . . . 1.0 . . . . . . . . . . . . B . 11 GLU CD . . . . . . . . . c19602_2mgt 1 . 15 . 7982 . 2 1 12 GLU CG C 2.687 -2.462 0.026 . . . 1.0 . . . . . . . . . . . . B . 11 GLU CG . . . . . . . . . c19602_2mgt 1 . 15 . 7983 . 2 1 12 GLU H H 7.145 -2.563 -0.169 . . . 1.0 . . . . . . . . . . . . B . 11 GLU H . . . . . . . . . c19602_2mgt 1 . 15 . 7984 . 2 1 12 GLU HA H 4.712 -2.239 -1.598 . . . 1.0 . . . . . . . . . . . . B . 11 GLU HA . . . . . . . . . c19602_2mgt 1 . 15 . 7985 . 2 1 12 GLU HB2 H 4.314 -3.690 0.607 . . . 1.0 . . . . . . . . . . . . B . 11 GLU HB2 . . . . . . . . . c19602_2mgt 1 . 15 . 7986 . 2 1 12 GLU HB3 H 4.365 -2.143 1.403 . . . 1.0 . . . . . . . . . . . . B . 11 GLU HB3 . . . . . . . . . c19602_2mgt 1 . 15 . 7987 . 2 1 12 GLU HG2 H 2.620 -2.124 -1.008 . . . 1.0 . . . . . . . . . . . . B . 11 GLU HG2 . . . . . . . . . c19602_2mgt 1 . 15 . 7988 . 2 1 12 GLU HG3 H 2.206 -3.440 0.073 . . . 1.0 . . . . . . . . . . . . B . 11 GLU HG3 . . . . . . . . . c19602_2mgt 1 . 15 . 7989 . 2 1 12 GLU N N 6.325 -2.980 -0.576 . . . 1.0 . . . . . . . . . . . . B . 11 GLU N . . . . . . . . . c19602_2mgt 1 . 15 . 7990 . 2 1 12 GLU O O 5.852 -0.230 0.706 . . . 1.0 . . . . . . . . . . . . B . 11 GLU O . . . . . . . . . c19602_2mgt 1 . 15 . 7991 . 2 1 12 GLU OE1 O 1.485 -1.962 2.003 . . . 1.0 . . . . . . . . . . . . B . 11 GLU OE1 . . . . . . . . . c19602_2mgt 1 . 15 . 7992 . 2 1 12 GLU OE2 O 1.810 -0.315 0.585 . . . 1.0 . . . . . . . . . . . . B . 11 GLU OE2 . . . . . . . . . c19602_2mgt 1 . 15 . 7993 . 2 1 13 VAL C C 6.421 2.296 -0.928 . . . 1.0 . . . . . . . . . . . . B . 12 VAL C . . . . . . . . . c19602_2mgt 1 . 15 . 7994 . 2 1 13 VAL CA C 6.963 1.059 -1.641 . . . 1.0 . . . . . . . . . . . . B . 12 VAL CA . . . . . . . . . c19602_2mgt 1 . 15 . 7995 . 2 1 13 VAL CB C 7.305 1.342 -3.123 . . . 1.0 . . . . . . . . . . . . B . 12 VAL CB . . . . . . . . . c19602_2mgt 1 . 15 . 7996 . 2 1 13 VAL CG1 C 7.756 2.790 -3.372 . . . 1.0 . . . . . . . . . . . . B . 12 VAL CG1 . . . . . . . . . c19602_2mgt 1 . 15 . 7997 . 2 1 13 VAL CG2 C 8.435 0.394 -3.555 . . . 1.0 . . . . . . . . . . . . B . 12 VAL CG2 . . . . . . . . . c19602_2mgt 1 . 15 . 7998 . 2 1 13 VAL H H 5.901 -0.577 -2.414 . . . 1.0 . . . . . . . . . . . . B . 12 VAL H . . . . . . . . . c19602_2mgt 1 . 15 . 7999 . 2 1 13 VAL HA H 7.897 0.806 -1.157 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HA . . . . . . . . . c19602_2mgt 1 . 15 . 8000 . 2 1 13 VAL HB H 6.427 1.158 -3.739 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HB . . . . . . . . . c19602_2mgt 1 . 15 . 8001 . 2 1 13 VAL HG11 H 8.014 2.943 -4.408 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HG11 . . . . . . . . . c19602_2mgt 1 . 15 . 8002 . 2 1 13 VAL HG12 H 6.943 3.478 -3.151 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HG12 . . . . . . . . . c19602_2mgt 1 . 15 . 8003 . 2 1 13 VAL HG13 H 8.621 3.018 -2.752 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HG13 . . . . . . . . . c19602_2mgt 1 . 15 . 8004 . 2 1 13 VAL HG21 H 8.716 0.586 -4.584 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HG21 . . . . . . . . . c19602_2mgt 1 . 15 . 8005 . 2 1 13 VAL HG22 H 9.310 0.544 -2.923 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HG22 . . . . . . . . . c19602_2mgt 1 . 15 . 8006 . 2 1 13 VAL HG23 H 8.099 -0.637 -3.473 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HG23 . . . . . . . . . c19602_2mgt 1 . 15 . 8007 . 2 1 13 VAL N N 6.090 -0.108 -1.543 . . . 1.0 . . . . . . . . . . . . B . 12 VAL N . . . . . . . . . c19602_2mgt 1 . 15 . 8008 . 2 1 13 VAL O O 7.230 3.120 -0.515 . . . 1.0 . . . . . . . . . . . . B . 12 VAL O . . . . . . . . . c19602_2mgt 1 . 15 . 8009 . 2 1 14 HIS C C 5.037 3.907 1.254 . . . 1.0 . . . . . . . . . . . . B . 13 HIS C . . . . . . . . . c19602_2mgt 1 . 15 . 8010 . 2 1 14 HIS CA C 4.551 3.659 -0.175 . . . 1.0 . . . . . . . . . . . . B . 13 HIS CA . . . . . . . . . c19602_2mgt 1 . 15 . 8011 . 2 1 14 HIS CB C 3.021 3.675 -0.238 . . . 1.0 . . . . . . . . . . . . B . 13 HIS CB . . . . . . . . . c19602_2mgt 1 . 15 . 8012 . 2 1 14 HIS CD2 C 2.341 5.269 -2.120 . . . 1.0 . . . . . . . . . . . . B . 13 HIS CD2 . . . . . . . . . c19602_2mgt 1 . 15 . 8013 . 2 1 14 HIS CE1 C 1.690 3.830 -3.638 . . . 1.0 . . . . . . . . . . . . B . 13 HIS CE1 . . . . . . . . . c19602_2mgt 1 . 15 . 8014 . 2 1 14 HIS CG C 2.493 4.011 -1.604 . . . 1.0 . . . . . . . . . . . . B . 13 HIS CG . . . . . . . . . c19602_2mgt 1 . 15 . 8015 . 2 1 14 HIS H H 4.467 1.744 -1.111 . . . 1.0 . . . . . . . . . . . . B . 13 HIS H . . . . . . . . . c19602_2mgt 1 . 15 . 8016 . 2 1 14 HIS HA H 4.928 4.482 -0.773 . . . 1.0 . . . . . . . . . . . . B . 13 HIS HA . . . . . . . . . c19602_2mgt 1 . 15 . 8017 . 2 1 14 HIS HB2 H 2.617 2.720 0.098 . . . 1.0 . . . . . . . . . . . . B . 13 HIS HB2 . . . . . . . . . c19602_2mgt 1 . 15 . 8018 . 2 1 14 HIS HB3 H 2.659 4.452 0.436 . . . 1.0 . . . . . . . . . . . . B . 13 HIS HB3 . . . . . . . . . c19602_2mgt 1 . 15 . 8019 . 2 1 14 HIS HD1 H 2.076 2.118 -2.490 . . . 1.0 . . . . . . . . . . . . B . 13 HIS HD1 . . . . . . . . . c19602_2mgt 1 . 15 . 8020 . 2 1 14 HIS HD2 H 2.575 6.195 -1.615 . . . 1.0 . . . . . . . . . . . . B . 13 HIS HD2 . . . . . . . . . c19602_2mgt 1 . 15 . 8021 . 2 1 14 HIS HE1 H 1.322 3.397 -4.554 . . . 1.0 . . . . . . . . . . . . B . 13 HIS HE1 . . . . . . . . . c19602_2mgt 1 . 15 . 8022 . 2 1 14 HIS N N 5.102 2.448 -0.764 . . . 1.0 . . . . . . . . . . . . B . 13 HIS N . . . . . . . . . c19602_2mgt 1 . 15 . 8023 . 2 1 14 HIS ND1 N 2.075 3.124 -2.567 . . . 1.0 . . . . . . . . . . . . B . 13 HIS ND1 . . . . . . . . . c19602_2mgt 1 . 15 . 8024 . 2 1 14 HIS NE2 N 1.837 5.145 -3.415 . . . 1.0 . . . . . . . . . . . . B . 13 HIS NE2 . . . . . . . . . c19602_2mgt 1 . 15 . 8025 . 2 1 14 HIS O O 5.008 5.056 1.673 . . . 1.0 . . . . . . . . . . . . B . 13 HIS O . . . . . . . . . c19602_2mgt 1 . 15 . 8026 . 2 1 15 HIS C C 7.540 3.141 3.423 . . . 1.0 . . . . . . . . . . . . B . 14 HIS C . . . . . . . . . c19602_2mgt 1 . 15 . 8027 . 2 1 15 HIS CA C 6.011 2.982 3.345 . . . 1.0 . . . . . . . . . . . . B . 14 HIS CA . . . . . . . . . c19602_2mgt 1 . 15 . 8028 . 2 1 15 HIS CB C 5.555 1.718 4.083 . . . 1.0 . . . . . . . . . . . . B . 14 HIS CB . . . . . . . . . c19602_2mgt 1 . 15 . 8029 . 2 1 15 HIS CD2 C 3.411 0.726 3.144 . . . 1.0 . . . . . . . . . . . . B . 14 HIS CD2 . . . . . . . . . c19602_2mgt 1 . 15 . 8030 . 2 1 15 HIS CE1 C 1.921 1.963 4.167 . . . 1.0 . . . . . . . . . . . . B . 14 HIS CE1 . . . . . . . . . c19602_2mgt 1 . 15 . 8031 . 2 1 15 HIS CG C 4.068 1.547 4.013 . . . 1.0 . . . . . . . . . . . . B . 14 HIS CG . . . . . . . . . c19602_2mgt 1 . 15 . 8032 . 2 1 15 HIS H H 5.548 1.969 1.535 . . . 1.0 . . . . . . . . . . . . B . 14 HIS H . . . . . . . . . c19602_2mgt 1 . 15 . 8033 . 2 1 15 HIS HA H 5.555 3.845 3.831 . . . 1.0 . . . . . . . . . . . . B . 14 HIS HA . . . . . . . . . c19602_2mgt 1 . 15 . 8034 . 2 1 15 HIS HB2 H 6.033 0.851 3.628 . . . 1.0 . . . . . . . . . . . . B . 14 HIS HB2 . . . . . . . . . c19602_2mgt 1 . 15 . 8035 . 2 1 15 HIS HB3 H 5.847 1.755 5.127 . . . 1.0 . . . . . . . . . . . . B . 14 HIS HB3 . . . . . . . . . c19602_2mgt 1 . 15 . 8036 . 2 1 15 HIS HD1 H 3.301 3.041 5.328 . . . 1.0 . . . . . . . . . . . . B . 14 HIS HD1 . . . . . . . . . c19602_2mgt 1 . 15 . 8037 . 2 1 15 HIS HD2 H 3.879 0.040 2.456 . . . 1.0 . . . . . . . . . . . . B . 14 HIS HD2 . . . . . . . . . c19602_2mgt 1 . 15 . 8038 . 2 1 15 HIS HE1 H 0.983 2.411 4.459 . . . 1.0 . . . . . . . . . . . . B . 14 HIS HE1 . . . . . . . . . c19602_2mgt 1 . 15 . 8039 . 2 1 15 HIS N N 5.519 2.884 1.969 . . . 1.0 . . . . . . . . . . . . B . 14 HIS N . . . . . . . . . c19602_2mgt 1 . 15 . 8040 . 2 1 15 HIS ND1 N 3.122 2.316 4.648 . . . 1.0 . . . . . . . . . . . . B . 14 HIS ND1 . . . . . . . . . c19602_2mgt 1 . 15 . 8041 . 2 1 15 HIS NE2 N 2.050 1.003 3.241 . . . 1.0 . . . . . . . . . . . . B . 14 HIS NE2 . . . . . . . . . c19602_2mgt 1 . 15 . 8042 . 2 1 15 HIS O O 8.098 3.150 4.515 . . . 1.0 . . . . . . . . . . . . B . 14 HIS O . . . . . . . . . c19602_2mgt 1 . 15 . 8043 . 2 1 16 GLN C C 10.260 3.739 1.008 . . . 1.0 . . . . . . . . . . . . B . 15 GLN C . . . . . . . . . c19602_2mgt 1 . 15 . 8044 . 2 1 16 GLN CA C 9.647 2.911 2.141 . . . 1.0 . . . . . . . . . . . . B . 15 GLN CA . . . . . . . . . c19602_2mgt 1 . 15 . 8045 . 2 1 16 GLN CB C 9.788 1.415 1.830 . . . 1.0 . . . . . . . . . . . . B . 15 GLN CB . . . . . . . . . c19602_2mgt 1 . 15 . 8046 . 2 1 16 GLN CD C 9.625 -0.950 2.647 . . . 1.0 . . . . . . . . . . . . B . 15 GLN CD . . . . . . . . . c19602_2mgt 1 . 15 . 8047 . 2 1 16 GLN CG C 9.474 0.513 3.027 . . . 1.0 . . . . . . . . . . . . B . 15 GLN CG . . . . . . . . . c19602_2mgt 1 . 15 . 8048 . 2 1 16 GLN H H 7.721 3.248 1.414 . . . 1.0 . . . . . . . . . . . . B . 15 GLN H . . . . . . . . . c19602_2mgt 1 . 15 . 8049 . 2 1 16 GLN HA H 10.170 3.150 3.062 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HA . . . . . . . . . c19602_2mgt 1 . 15 . 8050 . 2 1 16 GLN HB2 H 9.126 1.158 1.002 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HB2 . . . . . . . . . c19602_2mgt 1 . 15 . 8051 . 2 1 16 GLN HB3 H 10.804 1.212 1.512 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HB3 . . . . . . . . . c19602_2mgt 1 . 15 . 8052 . 2 1 16 GLN HE21 H 11.505 -1.036 3.415 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HE21 . . . . . . . . . c19602_2mgt 1 . 15 . 8053 . 2 1 16 GLN HE22 H 10.915 -2.515 2.689 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HE22 . . . . . . . . . c19602_2mgt 1 . 15 . 8054 . 2 1 16 GLN HG2 H 10.143 0.756 3.853 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HG2 . . . . . . . . . c19602_2mgt 1 . 15 . 8055 . 2 1 16 GLN HG3 H 8.451 0.667 3.358 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HG3 . . . . . . . . . c19602_2mgt 1 . 15 . 8056 . 2 1 16 GLN N N 8.230 3.202 2.280 . . . 1.0 . . . . . . . . . . . . B . 15 GLN N . . . . . . . . . c19602_2mgt 1 . 15 . 8057 . 2 1 16 GLN NE2 N 10.771 -1.549 2.948 . . . 1.0 . . . . . . . . . . . . B . 15 GLN NE2 . . . . . . . . . c19602_2mgt 1 . 15 . 8058 . 2 1 16 GLN O O 9.548 4.423 0.285 . . . 1.0 . . . . . . . . . . . . B . 15 GLN O . . . . . . . . . c19602_2mgt 1 . 15 . 8059 . 2 1 16 GLN OE1 O 8.720 -1.530 2.057 . . . 1.0 . . . . . . . . . . . . B . 15 GLN OE1 . . . . . . . . . c19602_2mgt 1 . 15 . 8060 . 2 1 17 LYS C C 12.172 3.425 -1.605 . . . 1.0 . . . . . . . . . . . . B . 16 LYS C . . . . . . . . . c19602_2mgt 1 . 15 . 8061 . 2 1 17 LYS CA C 12.273 4.275 -0.318 . . . 1.0 . . . . . . . . . . . . B . 16 LYS CA . . . . . . . . . c19602_2mgt 1 . 15 . 8062 . 2 1 17 LYS CB C 13.719 4.612 0.078 . . . 1.0 . . . . . . . . . . . . B . 16 LYS CB . . . . . . . . . c19602_2mgt 1 . 15 . 8063 . 2 1 17 LYS CD C 16.015 3.486 0.358 . . . 1.0 . . . . . . . . . . . . B . 16 LYS CD . . . . . . . . . c19602_2mgt 1 . 15 . 8064 . 2 1 17 LYS CE C 16.450 3.646 -1.099 . . . 1.0 . . . . . . . . . . . . B . 16 LYS CE . . . . . . . . . c19602_2mgt 1 . 15 . 8065 . 2 1 17 LYS CG C 14.500 3.371 0.539 . . . 1.0 . . . . . . . . . . . . B . 16 LYS CG . . . . . . . . . c19602_2mgt 1 . 15 . 8066 . 2 1 17 LYS H H 12.126 3.066 1.427 . . . 1.0 . . . . . . . . . . . . B . 16 LYS H . . . . . . . . . c19602_2mgt 1 . 15 . 8067 . 2 1 17 LYS HA H 11.781 5.220 -0.532 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HA . . . . . . . . . c19602_2mgt 1 . 15 . 8068 . 2 1 17 LYS HB2 H 14.206 5.081 -0.776 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HB2 . . . . . . . . . c19602_2mgt 1 . 15 . 8069 . 2 1 17 LYS HB3 H 13.707 5.342 0.887 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HB3 . . . . . . . . . c19602_2mgt 1 . 15 . 8070 . 2 1 17 LYS HD2 H 16.394 4.317 0.945 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HD2 . . . . . . . . . c19602_2mgt 1 . 15 . 8071 . 2 1 17 LYS HD3 H 16.457 2.577 0.749 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HD3 . . . . . . . . . c19602_2mgt 1 . 15 . 8072 . 2 1 17 LYS HE2 H 16.106 4.603 -1.491 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HE2 . . . . . . . . . c19602_2mgt 1 . 15 . 8073 . 2 1 17 LYS HE3 H 17.539 3.618 -1.147 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HE3 . . . . . . . . . c19602_2mgt 1 . 15 . 8074 . 2 1 17 LYS HG2 H 14.301 3.204 1.594 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HG2 . . . . . . . . . c19602_2mgt 1 . 15 . 8075 . 2 1 17 LYS HG3 H 14.154 2.494 -0.004 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HG3 . . . . . . . . . c19602_2mgt 1 . 15 . 8076 . 2 1 17 LYS HZ1 H 16.304 2.616 -2.862 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HZ1 . . . . . . . . . c19602_2mgt 1 . 15 . 8077 . 2 1 17 LYS HZ2 H 16.153 1.668 -1.531 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HZ2 . . . . . . . . . c19602_2mgt 1 . 15 . 8078 . 2 1 17 LYS HZ3 H 14.908 2.642 -1.996 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HZ3 . . . . . . . . . c19602_2mgt 1 . 15 . 8079 . 2 1 17 LYS N N 11.579 3.653 0.812 . . . 1.0 . . . . . . . . . . . . B . 16 LYS N . . . . . . . . . c19602_2mgt 1 . 15 . 8080 . 2 1 17 LYS NZ N 15.914 2.563 -1.932 . . . 1.0 . . . . . . . . . . . . B . 16 LYS NZ . . . . . . . . . c19602_2mgt 1 . 15 . 8081 . 2 1 17 LYS O O 13.050 3.476 -2.465 . . . 1.0 . . . . . . . . . . . . B . 16 LYS O . . . . . . . . . c19602_2mgt 1 . 15 . 8082 . 2 1 18 NH2 HN1 H 11.020 2.068 -2.590 . . . 1.0 . . . . . . . . . . . . B . 17 NH2 HN1 . . . . . . . . . c19602_2mgt 1 . 15 . 8083 . 2 1 18 NH2 HN2 H 10.395 2.606 -1.046 . . . 1.0 . . . . . . . . . . . . B . 17 NH2 HN2 . . . . . . . . . c19602_2mgt 1 . 15 . 8084 . 2 1 18 NH2 N N 11.124 2.611 -1.745 . . . 1.0 . . . . . . . . . . . . B . 17 NH2 N . . . . . . . . . c19602_2mgt 1 . 15 . 8085 . 3 2 1 ZN ZN Zn 0.614 -0.169 2.329 . . . 1.0 . . . . . . . . . . . . A . 101 ZN ZN . . . . . . . . . c19602_2mgt 1 . 16 . 8086 . 1 1 1 ACE C C -13.283 -4.236 -2.235 . . . 1.0 . . . . . . . . . . . . A . 0 ACE C . . . . . . . . . c19602_2mgt 1 . 16 . 8087 . 1 1 1 ACE CH3 C -11.949 -4.477 -1.555 . . . 1.0 . . . . . . . . . . . . A . 0 ACE CH3 . . . . . . . . . c19602_2mgt 1 . 16 . 8088 . 1 1 1 ACE H1 H -11.878 -3.855 -0.664 . . . 1.0 . . . . . . . . . . . . A . 0 ACE H1 . . . . . . . . . c19602_2mgt 1 . 16 . 8089 . 1 1 1 ACE H2 H -11.879 -5.525 -1.275 . . . 1.0 . . . . . . . . . . . . A . 0 ACE H2 . . . . . . . . . c19602_2mgt 1 . 16 . 8090 . 1 1 1 ACE H3 H -11.132 -4.221 -2.226 . . . 1.0 . . . . . . . . . . . . A . 0 ACE H3 . . . . . . . . . c19602_2mgt 1 . 16 . 8091 . 1 1 1 ACE O O -13.319 -3.821 -3.389 . . . 1.0 . . . . . . . . . . . . A . 0 ACE O . . . . . . . . . c19602_2mgt 1 . 16 . 8092 . 1 1 2 ASP C C -16.279 -2.947 -1.277 . . . 1.0 . . . . . . . . . . . . A . 1 ASP C . . . . . . . . . c19602_2mgt 1 . 16 . 8093 . 1 1 2 ASP CA C -15.740 -4.222 -1.927 . . . 1.0 . . . . . . . . . . . . A . 1 ASP CA . . . . . . . . . c19602_2mgt 1 . 16 . 8094 . 1 1 2 ASP CB C -16.594 -5.439 -1.577 . . . 1.0 . . . . . . . . . . . . A . 1 ASP CB . . . . . . . . . c19602_2mgt 1 . 16 . 8095 . 1 1 2 ASP CG C -17.903 -5.407 -2.341 . . . 1.0 . . . . . . . . . . . . A . 1 ASP CG . . . . . . . . . c19602_2mgt 1 . 16 . 8096 . 1 1 2 ASP H H -14.248 -4.796 -0.550 . . . 1.0 . . . . . . . . . . . . A . 1 ASP H . . . . . . . . . c19602_2mgt 1 . 16 . 8097 . 1 1 2 ASP HA H -15.756 -4.094 -3.009 . . . 1.0 . . . . . . . . . . . . A . 1 ASP HA . . . . . . . . . c19602_2mgt 1 . 16 . 8098 . 1 1 2 ASP HB2 H -16.045 -6.344 -1.814 . . . 1.0 . . . . . . . . . . . . A . 1 ASP HB2 . . . . . . . . . c19602_2mgt 1 . 16 . 8099 . 1 1 2 ASP HB3 H -16.825 -5.433 -0.508 . . . 1.0 . . . . . . . . . . . . A . 1 ASP HB3 . . . . . . . . . c19602_2mgt 1 . 16 . 8100 . 1 1 2 ASP N N -14.370 -4.473 -1.498 . . . 1.0 . . . . . . . . . . . . A . 1 ASP N . . . . . . . . . c19602_2mgt 1 . 16 . 8101 . 1 1 2 ASP O O -15.850 -2.591 -0.182 . . . 1.0 . . . . . . . . . . . . A . 1 ASP O . . . . . . . . . c19602_2mgt 1 . 16 . 8102 . 1 1 2 ASP OD1 O -18.808 -4.731 -1.916 . . . 1.0 . . . . . . . . . . . . A . 1 ASP OD1 . . . . . . . . . c19602_2mgt 1 . 16 . 8103 . 1 1 2 ASP OD2 O -17.939 -6.091 -3.430 . . . 1.0 . . . . . . . . . . . . A . 1 ASP OD2 . . . . . . . . . c19602_2mgt 1 . 16 . 8104 . 1 1 3 ALA C C -17.587 -0.370 -0.369 . . . 1.0 . . . . . . . . . . . . A . 2 ALA C . . . . . . . . . c19602_2mgt 1 . 16 . 8105 . 1 1 3 ALA CA C -17.604 -0.883 -1.807 . . . 1.0 . . . . . . . . . . . . A . 2 ALA CA . . . . . . . . . c19602_2mgt 1 . 16 . 8106 . 1 1 3 ALA CB C -18.975 -0.640 -2.450 . . . 1.0 . . . . . . . . . . . . A . 2 ALA CB . . . . . . . . . c19602_2mgt 1 . 16 . 8107 . 1 1 3 ALA H H -17.575 -2.730 -2.796 . . . 1.0 . . . . . . . . . . . . A . 2 ALA H . . . . . . . . . c19602_2mgt 1 . 16 . 8108 . 1 1 3 ALA HA H -16.876 -0.311 -2.366 . . . 1.0 . . . . . . . . . . . . A . 2 ALA HA . . . . . . . . . c19602_2mgt 1 . 16 . 8109 . 1 1 3 ALA HB1 H -19.292 0.383 -2.253 . . . 1.0 . . . . . . . . . . . . A . 2 ALA HB1 . . . . . . . . . c19602_2mgt 1 . 16 . 8110 . 1 1 3 ALA HB2 H -18.914 -0.784 -3.527 . . . 1.0 . . . . . . . . . . . . A . 2 ALA HB2 . . . . . . . . . c19602_2mgt 1 . 16 . 8111 . 1 1 3 ALA HB3 H -19.716 -1.323 -2.035 . . . 1.0 . . . . . . . . . . . . A . 2 ALA HB3 . . . . . . . . . c19602_2mgt 1 . 16 . 8112 . 1 1 3 ALA N N -17.217 -2.281 -1.966 . . . 1.0 . . . . . . . . . . . . A . 2 ALA N . . . . . . . . . c19602_2mgt 1 . 16 . 8113 . 1 1 3 ALA O O -16.839 0.557 -0.080 . . . 1.0 . . . . . . . . . . . . A . 2 ALA O . . . . . . . . . c19602_2mgt 1 . 16 . 8114 . 1 1 4 GLU C C -17.313 -0.316 2.696 . . . 1.0 . . . . . . . . . . . . A . 3 GLU C . . . . . . . . . c19602_2mgt 1 . 16 . 8115 . 1 1 4 GLU CA C -18.591 -0.592 1.902 . . . 1.0 . . . . . . . . . . . . A . 3 GLU CA . . . . . . . . . c19602_2mgt 1 . 16 . 8116 . 1 1 4 GLU CB C -19.448 -1.658 2.592 . . . 1.0 . . . . . . . . . . . . A . 3 GLU CB . . . . . . . . . c19602_2mgt 1 . 16 . 8117 . 1 1 4 GLU CD C -19.748 -4.119 2.953 . . . 1.0 . . . . . . . . . . . . A . 3 GLU CD . . . . . . . . . c19602_2mgt 1 . 16 . 8118 . 1 1 4 GLU CG C -18.751 -3.024 2.641 . . . 1.0 . . . . . . . . . . . . A . 3 GLU CG . . . . . . . . . c19602_2mgt 1 . 16 . 8119 . 1 1 4 GLU H H -18.941 -1.759 0.175 . . . 1.0 . . . . . . . . . . . . A . 3 GLU H . . . . . . . . . c19602_2mgt 1 . 16 . 8120 . 1 1 4 GLU HA H -19.164 0.327 1.900 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HA . . . . . . . . . c19602_2mgt 1 . 16 . 8121 . 1 1 4 GLU HB2 H -19.679 -1.339 3.608 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HB2 . . . . . . . . . c19602_2mgt 1 . 16 . 8122 . 1 1 4 GLU HB3 H -20.387 -1.750 2.046 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HB3 . . . . . . . . . c19602_2mgt 1 . 16 . 8123 . 1 1 4 GLU HG2 H -18.288 -3.254 1.680 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HG2 . . . . . . . . . c19602_2mgt 1 . 16 . 8124 . 1 1 4 GLU HG3 H -17.979 -3.005 3.409 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HG3 . . . . . . . . . c19602_2mgt 1 . 16 . 8125 . 1 1 4 GLU N N -18.381 -0.988 0.511 . . . 1.0 . . . . . . . . . . . . A . 3 GLU N . . . . . . . . . c19602_2mgt 1 . 16 . 8126 . 1 1 4 GLU O O -17.314 0.618 3.491 . . . 1.0 . . . . . . . . . . . . A . 3 GLU O . . . . . . . . . c19602_2mgt 1 . 16 . 8127 . 1 1 4 GLU OE1 O -20.441 -4.560 2.028 . . . 1.0 . . . . . . . . . . . . A . 3 GLU OE1 . . . . . . . . . c19602_2mgt 1 . 16 . 8128 . 1 1 4 GLU OE2 O -19.809 -4.512 4.138 . . . 1.0 . . . . . . . . . . . . A . 3 GLU OE2 . . . . . . . . . c19602_2mgt 1 . 16 . 8129 . 1 1 5 PHE C C -13.846 -0.448 2.163 . . . 1.0 . . . . . . . . . . . . A . 4 PHE C . . . . . . . . . c19602_2mgt 1 . 16 . 8130 . 1 1 5 PHE CA C -14.945 -0.899 3.127 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CA . . . . . . . . . c19602_2mgt 1 . 16 . 8131 . 1 1 5 PHE CB C -14.566 -2.185 3.854 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CB . . . . . . . . . c19602_2mgt 1 . 16 . 8132 . 1 1 5 PHE CD1 C -15.056 -4.148 2.348 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CD1 . . . . . . . . . c19602_2mgt 1 . 16 . 8133 . 1 1 5 PHE CD2 C -12.739 -3.536 2.755 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CD2 . . . . . . . . . c19602_2mgt 1 . 16 . 8134 . 1 1 5 PHE CE1 C -14.635 -5.237 1.571 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CE1 . . . . . . . . . c19602_2mgt 1 . 16 . 8135 . 1 1 5 PHE CE2 C -12.314 -4.617 1.963 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CE2 . . . . . . . . . c19602_2mgt 1 . 16 . 8136 . 1 1 5 PHE CG C -14.110 -3.315 2.962 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CG . . . . . . . . . c19602_2mgt 1 . 16 . 8137 . 1 1 5 PHE CZ C -13.264 -5.477 1.385 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CZ . . . . . . . . . c19602_2mgt 1 . 16 . 8138 . 1 1 5 PHE H H -16.310 -1.840 1.812 . . . 1.0 . . . . . . . . . . . . A . 4 PHE H . . . . . . . . . c19602_2mgt 1 . 16 . 8139 . 1 1 5 PHE HA H -15.036 -0.125 3.880 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HA . . . . . . . . . c19602_2mgt 1 . 16 . 8140 . 1 1 5 PHE HB2 H -13.770 -1.960 4.562 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HB2 . . . . . . . . . c19602_2mgt 1 . 16 . 8141 . 1 1 5 PHE HB3 H -15.431 -2.514 4.430 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HB3 . . . . . . . . . c19602_2mgt 1 . 16 . 8142 . 1 1 5 PHE HD1 H -16.106 -3.947 2.484 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HD1 . . . . . . . . . c19602_2mgt 1 . 16 . 8143 . 1 1 5 PHE HD2 H -12.020 -2.868 3.208 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HD2 . . . . . . . . . c19602_2mgt 1 . 16 . 8144 . 1 1 5 PHE HE1 H -15.363 -5.890 1.116 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HE1 . . . . . . . . . c19602_2mgt 1 . 16 . 8145 . 1 1 5 PHE HE2 H -11.260 -4.789 1.801 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HE2 . . . . . . . . . c19602_2mgt 1 . 16 . 8146 . 1 1 5 PHE HZ H -12.945 -6.311 0.779 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HZ . . . . . . . . . c19602_2mgt 1 . 16 . 8147 . 1 1 5 PHE N N -16.237 -1.080 2.472 . . . 1.0 . . . . . . . . . . . . A . 4 PHE N . . . . . . . . . c19602_2mgt 1 . 16 . 8148 . 1 1 5 PHE O O -12.807 0.016 2.628 . . . 1.0 . . . . . . . . . . . . A . 4 PHE O . . . . . . . . . c19602_2mgt 1 . 16 . 8149 . 1 1 6 ARG C C -13.627 1.548 -0.335 . . . 1.0 . . . . . . . . . . . . A . 5 ARG C . . . . . . . . . c19602_2mgt 1 . 16 . 8150 . 1 1 6 ARG CA C -13.299 0.062 -0.214 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CA . . . . . . . . . c19602_2mgt 1 . 16 . 8151 . 1 1 6 ARG CB C -13.481 -0.773 -1.482 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CB . . . . . . . . . c19602_2mgt 1 . 16 . 8152 . 1 1 6 ARG CD C -11.150 0.016 -2.318 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CD . . . . . . . . . c19602_2mgt 1 . 16 . 8153 . 1 1 6 ARG CG C -12.601 -0.365 -2.665 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CG . . . . . . . . . c19602_2mgt 1 . 16 . 8154 . 1 1 6 ARG CZ C -11.060 2.443 -2.885 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CZ . . . . . . . . . c19602_2mgt 1 . 16 . 8155 . 1 1 6 ARG H H -14.967 -0.939 0.544 . . . 1.0 . . . . . . . . . . . . A . 5 ARG H . . . . . . . . . c19602_2mgt 1 . 16 . 8156 . 1 1 6 ARG HA H -12.260 -0.009 0.073 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HA . . . . . . . . . c19602_2mgt 1 . 16 . 8157 . 1 1 6 ARG HB2 H -13.230 -1.797 -1.216 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HB2 . . . . . . . . . c19602_2mgt 1 . 16 . 8158 . 1 1 6 ARG HB3 H -14.523 -0.745 -1.797 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HB3 . . . . . . . . . c19602_2mgt 1 . 16 . 8159 . 1 1 6 ARG HD2 H -10.787 -0.599 -1.494 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HD2 . . . . . . . . . c19602_2mgt 1 . 16 . 8160 . 1 1 6 ARG HD3 H -10.528 -0.191 -3.182 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HD3 . . . . . . . . . c19602_2mgt 1 . 16 . 8161 . 1 1 6 ARG HE H -10.841 1.682 -1.022 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HE . . . . . . . . . c19602_2mgt 1 . 16 . 8162 . 1 1 6 ARG HG2 H -12.576 -1.204 -3.357 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HG2 . . . . . . . . . c19602_2mgt 1 . 16 . 8163 . 1 1 6 ARG HG3 H -13.087 0.462 -3.174 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HG3 . . . . . . . . . c19602_2mgt 1 . 16 . 8164 . 1 1 6 ARG HH11 H -11.339 1.249 -4.511 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH11 . . . . . . . . . c19602_2mgt 1 . 16 . 8165 . 1 1 6 ARG HH12 H -11.298 2.964 -4.838 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH12 . . . . . . . . . c19602_2mgt 1 . 16 . 8166 . 1 1 6 ARG HH21 H -10.821 3.930 -1.515 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH21 . . . . . . . . . c19602_2mgt 1 . 16 . 8167 . 1 1 6 ARG HH22 H -11.017 4.453 -3.173 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH22 . . . . . . . . . c19602_2mgt 1 . 16 . 8168 . 1 1 6 ARG N N -14.100 -0.523 0.847 . . . 1.0 . . . . . . . . . . . . A . 5 ARG N . . . . . . . . . c19602_2mgt 1 . 16 . 8169 . 1 1 6 ARG NE N -10.998 1.444 -1.990 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NE . . . . . . . . . c19602_2mgt 1 . 16 . 8170 . 1 1 6 ARG NH1 N -11.238 2.199 -4.183 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NH1 . . . . . . . . . c19602_2mgt 1 . 16 . 8171 . 1 1 6 ARG NH2 N -10.953 3.710 -2.492 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NH2 . . . . . . . . . c19602_2mgt 1 . 16 . 8172 . 1 1 6 ARG O O -14.105 2.048 -1.349 . . . 1.0 . . . . . . . . . . . . A . 5 ARG O . . . . . . . . . c19602_2mgt 1 . 16 . 8173 . 1 1 7 ARG C C -12.666 4.553 0.467 . . . 1.0 . . . . . . . . . . . . A . 6 ARG C . . . . . . . . . c19602_2mgt 1 . 16 . 8174 . 1 1 7 ARG CA C -13.724 3.607 1.027 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CA . . . . . . . . . c19602_2mgt 1 . 16 . 8175 . 1 1 7 ARG CB C -13.908 3.741 2.546 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CB . . . . . . . . . c19602_2mgt 1 . 16 . 8176 . 1 1 7 ARG CD C -16.495 3.583 2.657 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CD . . . . . . . . . c19602_2mgt 1 . 16 . 8177 . 1 1 7 ARG CG C -15.143 3.013 3.103 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CG . . . . . . . . . c19602_2mgt 1 . 16 . 8178 . 1 1 7 ARG CZ C -17.515 3.817 0.373 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CZ . . . . . . . . . c19602_2mgt 1 . 16 . 8179 . 1 1 7 ARG H H -12.954 1.745 1.543 . . . 1.0 . . . . . . . . . . . . A . 6 ARG H . . . . . . . . . c19602_2mgt 1 . 16 . 8180 . 1 1 7 ARG HA H -14.661 3.824 0.526 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HA . . . . . . . . . c19602_2mgt 1 . 16 . 8181 . 1 1 7 ARG HB2 H -13.041 3.286 3.024 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HB2 . . . . . . . . . c19602_2mgt 1 . 16 . 8182 . 1 1 7 ARG HB3 H -13.953 4.793 2.825 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HB3 . . . . . . . . . c19602_2mgt 1 . 16 . 8183 . 1 1 7 ARG HD2 H -17.251 3.256 3.368 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HD2 . . . . . . . . . c19602_2mgt 1 . 16 . 8184 . 1 1 7 ARG HD3 H -16.450 4.668 2.684 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HD3 . . . . . . . . . c19602_2mgt 1 . 16 . 8185 . 1 1 7 ARG HE H -16.767 2.116 1.157 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HE . . . . . . . . . c19602_2mgt 1 . 16 . 8186 . 1 1 7 ARG HG2 H -15.092 1.956 2.845 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HG2 . . . . . . . . . c19602_2mgt 1 . 16 . 8187 . 1 1 7 ARG HG3 H -15.101 3.084 4.189 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HG3 . . . . . . . . . c19602_2mgt 1 . 16 . 8188 . 1 1 7 ARG HH11 H -17.495 5.608 1.347 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH11 . . . . . . . . . c19602_2mgt 1 . 16 . 8189 . 1 1 7 ARG HH12 H -18.239 5.618 -0.238 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH12 . . . . . . . . . c19602_2mgt 1 . 16 . 8190 . 1 1 7 ARG HH21 H -17.694 2.224 -0.878 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH21 . . . . . . . . . c19602_2mgt 1 . 16 . 8191 . 1 1 7 ARG HH22 H -18.352 3.729 -1.479 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH22 . . . . . . . . . c19602_2mgt 1 . 16 . 8192 . 1 1 7 ARG N N -13.366 2.239 0.768 . . . 1.0 . . . . . . . . . . . . A . 6 ARG N . . . . . . . . . c19602_2mgt 1 . 16 . 8193 . 1 1 7 ARG NE N -16.910 3.101 1.334 . . . 1.0 . . . . . . . . . . . . A . 6 ARG NE . . . . . . . . . c19602_2mgt 1 . 16 . 8194 . 1 1 7 ARG NH1 N -17.765 5.122 0.503 . . . 1.0 . . . . . . . . . . . . A . 6 ARG NH1 . . . . . . . . . c19602_2mgt 1 . 16 . 8195 . 1 1 7 ARG NH2 N -17.885 3.208 -0.752 . . . 1.0 . . . . . . . . . . . . A . 6 ARG NH2 . . . . . . . . . c19602_2mgt 1 . 16 . 8196 . 1 1 7 ARG O O -11.489 4.214 0.357 . . . 1.0 . . . . . . . . . . . . A . 6 ARG O . . . . . . . . . c19602_2mgt 1 . 16 . 8197 . 1 1 8 ASP C C -11.746 7.750 0.634 . . . 1.0 . . . . . . . . . . . . A . 7 ASP C . . . . . . . . . c19602_2mgt 1 . 16 . 8198 . 1 1 8 ASP CA C -12.363 6.849 -0.447 . . . 1.0 . . . . . . . . . . . . A . 7 ASP CA . . . . . . . . . c19602_2mgt 1 . 16 . 8199 . 1 1 8 ASP CB C -13.333 7.660 -1.308 . . . 1.0 . . . . . . . . . . . . A . 7 ASP CB . . . . . . . . . c19602_2mgt 1 . 16 . 8200 . 1 1 8 ASP CG C -12.651 8.812 -2.035 . . . 1.0 . . . . . . . . . . . . A . 7 ASP CG . . . . . . . . . c19602_2mgt 1 . 16 . 8201 . 1 1 8 ASP H H -14.119 5.924 0.249 . . . 1.0 . . . . . . . . . . . . A . 7 ASP H . . . . . . . . . c19602_2mgt 1 . 16 . 8202 . 1 1 8 ASP HA H -11.569 6.447 -1.080 . . . 1.0 . . . . . . . . . . . . A . 7 ASP HA . . . . . . . . . c19602_2mgt 1 . 16 . 8203 . 1 1 8 ASP HB2 H -13.802 7.000 -2.033 . . . 1.0 . . . . . . . . . . . . A . 7 ASP HB2 . . . . . . . . . c19602_2mgt 1 . 16 . 8204 . 1 1 8 ASP HB3 H -14.115 8.061 -0.662 . . . 1.0 . . . . . . . . . . . . A . 7 ASP HB3 . . . . . . . . . c19602_2mgt 1 . 16 . 8205 . 1 1 8 ASP N N -13.133 5.749 0.112 . . . 1.0 . . . . . . . . . . . . A . 7 ASP N . . . . . . . . . c19602_2mgt 1 . 16 . 8206 . 1 1 8 ASP O O -10.956 8.636 0.322 . . . 1.0 . . . . . . . . . . . . A . 7 ASP O . . . . . . . . . c19602_2mgt 1 . 16 . 8207 . 1 1 8 ASP OD1 O -11.762 8.526 -2.874 . . . 1.0 . . . . . . . . . . . . A . 7 ASP OD1 . . . . . . . . . c19602_2mgt 1 . 16 . 8208 . 1 1 8 ASP OD2 O -12.993 9.964 -1.736 . . . 1.0 . . . . . . . . . . . . A . 7 ASP OD2 . . . . . . . . . c19602_2mgt 1 . 16 . 8209 . 1 1 9 SER C C -10.286 8.556 3.314 . . . 1.0 . . . . . . . . . . . . A . 8 SER C . . . . . . . . . c19602_2mgt 1 . 16 . 8210 . 1 1 9 SER CA C -11.783 8.466 2.992 . . . 1.0 . . . . . . . . . . . . A . 8 SER CA . . . . . . . . . c19602_2mgt 1 . 16 . 8211 . 1 1 9 SER CB C -12.569 8.043 4.232 . . . 1.0 . . . . . . . . . . . . A . 8 SER CB . . . . . . . . . c19602_2mgt 1 . 16 . 8212 . 1 1 9 SER H H -12.803 6.847 2.100 . . . 1.0 . . . . . . . . . . . . A . 8 SER H . . . . . . . . . c19602_2mgt 1 . 16 . 8213 . 1 1 9 SER HA H -12.122 9.460 2.705 . . . 1.0 . . . . . . . . . . . . A . 8 SER HA . . . . . . . . . c19602_2mgt 1 . 16 . 8214 . 1 1 9 SER HB2 H -12.273 7.041 4.544 . . . 1.0 . . . . . . . . . . . . A . 8 SER HB2 . . . . . . . . . c19602_2mgt 1 . 16 . 8215 . 1 1 9 SER HB3 H -12.386 8.746 5.045 . . . 1.0 . . . . . . . . . . . . A . 8 SER HB3 . . . . . . . . . c19602_2mgt 1 . 16 . 8216 . 1 1 9 SER HG H -14.440 7.833 4.713 . . . 1.0 . . . . . . . . . . . . A . 8 SER HG . . . . . . . . . c19602_2mgt 1 . 16 . 8217 . 1 1 9 SER N N -12.116 7.558 1.902 . . . 1.0 . . . . . . . . . . . . A . 8 SER N . . . . . . . . . c19602_2mgt 1 . 16 . 8218 . 1 1 9 SER O O -9.900 9.449 4.055 . . . 1.0 . . . . . . . . . . . . A . 8 SER O . . . . . . . . . c19602_2mgt 1 . 16 . 8219 . 1 1 9 SER OG O -13.940 8.050 3.919 . . . 1.0 . . . . . . . . . . . . A . 8 SER OG . . . . . . . . . c19602_2mgt 1 . 16 . 8220 . 1 1 10 GLY C C -7.272 7.675 1.748 . . . 1.0 . . . . . . . . . . . . A . 9 GLY C . . . . . . . . . c19602_2mgt 1 . 16 . 8221 . 1 1 10 GLY CA C -8.021 7.614 3.076 . . . 1.0 . . . . . . . . . . . . A . 9 GLY CA . . . . . . . . . c19602_2mgt 1 . 16 . 8222 . 1 1 10 GLY H H -9.762 7.017 2.084 . . . 1.0 . . . . . . . . . . . . A . 9 GLY H . . . . . . . . . c19602_2mgt 1 . 16 . 8223 . 1 1 10 GLY HA2 H -7.711 8.437 3.713 . . . 1.0 . . . . . . . . . . . . A . 9 GLY HA2 . . . . . . . . . c19602_2mgt 1 . 16 . 8224 . 1 1 10 GLY HA3 H -7.828 6.682 3.603 . . . 1.0 . . . . . . . . . . . . A . 9 GLY HA3 . . . . . . . . . c19602_2mgt 1 . 16 . 8225 . 1 1 10 GLY N N -9.436 7.673 2.779 . . . 1.0 . . . . . . . . . . . . A . 9 GLY N . . . . . . . . . c19602_2mgt 1 . 16 . 8226 . 1 1 10 GLY O O -7.239 8.717 1.108 . . . 1.0 . . . . . . . . . . . . A . 9 GLY O . . . . . . . . . c19602_2mgt 1 . 16 . 8227 . 1 1 11 TYR C C -5.671 4.391 1.105 . . . 1.0 . . . . . . . . . . . . A . 10 TYR C . . . . . . . . . c19602_2mgt 1 . 16 . 8228 . 1 1 11 TYR CA C -6.714 5.252 1.804 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CA . . . . . . . . . c19602_2mgt 1 . 16 . 8229 . 1 1 11 TYR CB C -8.116 4.662 1.583 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CB . . . . . . . . . c19602_2mgt 1 . 16 . 8230 . 1 1 11 TYR CD1 C -8.212 3.289 3.703 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CD1 . . . . . . . . . c19602_2mgt 1 . 16 . 8231 . 1 1 11 TYR CD2 C -10.127 4.649 3.089 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CD2 . . . . . . . . . c19602_2mgt 1 . 16 . 8232 . 1 1 11 TYR CE1 C -8.893 2.828 4.836 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CE1 . . . . . . . . . c19602_2mgt 1 . 16 . 8233 . 1 1 11 TYR CE2 C -10.815 4.196 4.217 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CE2 . . . . . . . . . c19602_2mgt 1 . 16 . 8234 . 1 1 11 TYR CG C -8.825 4.201 2.830 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CG . . . . . . . . . c19602_2mgt 1 . 16 . 8235 . 1 1 11 TYR CZ C -10.211 3.264 5.087 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CZ . . . . . . . . . c19602_2mgt 1 . 16 . 8236 . 1 1 11 TYR H H -6.304 6.640 0.340 . . . 1.0 . . . . . . . . . . . . A . 10 TYR H . . . . . . . . . c19602_2mgt 1 . 16 . 8237 . 1 1 11 TYR HA H -6.478 5.273 2.861 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HA . . . . . . . . . c19602_2mgt 1 . 16 . 8238 . 1 1 11 TYR HB2 H -8.753 5.380 1.069 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HB2 . . . . . . . . . c19602_2mgt 1 . 16 . 8239 . 1 1 11 TYR HB3 H -8.034 3.813 0.916 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HB3 . . . . . . . . . c19602_2mgt 1 . 16 . 8240 . 1 1 11 TYR HD1 H -7.227 2.920 3.492 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HD1 . . . . . . . . . c19602_2mgt 1 . 16 . 8241 . 1 1 11 TYR HD2 H -10.603 5.345 2.421 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HD2 . . . . . . . . . c19602_2mgt 1 . 16 . 8242 . 1 1 11 TYR HE1 H -8.402 2.144 5.505 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HE1 . . . . . . . . . c19602_2mgt 1 . 16 . 8243 . 1 1 11 TYR HE2 H -11.795 4.587 4.420 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HE2 . . . . . . . . . c19602_2mgt 1 . 16 . 8244 . 1 1 11 TYR HH H -10.363 2.227 6.728 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HH . . . . . . . . . c19602_2mgt 1 . 16 . 8245 . 1 1 11 TYR N N -6.665 6.590 1.273 . . . 1.0 . . . . . . . . . . . . A . 10 TYR N . . . . . . . . . c19602_2mgt 1 . 16 . 8246 . 1 1 11 TYR O O -5.231 4.693 -0.003 . . . 1.0 . . . . . . . . . . . . A . 10 TYR O . . . . . . . . . c19602_2mgt 1 . 16 . 8247 . 1 1 11 TYR OH O -10.888 2.821 6.183 . . . 1.0 . . . . . . . . . . . . A . 10 TYR OH . . . . . . . . . c19602_2mgt 1 . 16 . 8248 . 1 1 12 GLU C C -5.641 0.902 1.823 . . . 1.0 . . . . . . . . . . . . A . 11 GLU C . . . . . . . . . c19602_2mgt 1 . 16 . 8249 . 1 1 12 GLU CA C -4.926 2.052 1.109 . . . 1.0 . . . . . . . . . . . . A . 11 GLU CA . . . . . . . . . c19602_2mgt 1 . 16 . 8250 . 1 1 12 GLU CB C -3.402 1.979 1.178 . . . 1.0 . . . . . . . . . . . . A . 11 GLU CB . . . . . . . . . c19602_2mgt 1 . 16 . 8251 . 1 1 12 GLU CD C -1.433 0.491 0.565 . . . 1.0 . . . . . . . . . . . . A . 11 GLU CD . . . . . . . . . c19602_2mgt 1 . 16 . 8252 . 1 1 12 GLU CG C -2.870 0.878 0.252 . . . 1.0 . . . . . . . . . . . . A . 11 GLU CG . . . . . . . . . c19602_2mgt 1 . 16 . 8253 . 1 1 12 GLU H H -5.678 3.159 2.700 . . . 1.0 . . . . . . . . . . . . A . 11 GLU H . . . . . . . . . c19602_2mgt 1 . 16 . 8254 . 1 1 12 GLU HA H -5.244 2.069 0.069 . . . 1.0 . . . . . . . . . . . . A . 11 GLU HA . . . . . . . . . c19602_2mgt 1 . 16 . 8255 . 1 1 12 GLU HB2 H -2.979 2.936 0.872 . . . 1.0 . . . . . . . . . . . . A . 11 GLU HB2 . . . . . . . . . c19602_2mgt 1 . 16 . 8256 . 1 1 12 GLU HB3 H -3.109 1.792 2.211 . . . 1.0 . . . . . . . . . . . . A . 11 GLU HB3 . . . . . . . . . c19602_2mgt 1 . 16 . 8257 . 1 1 12 GLU HG2 H -3.491 -0.012 0.354 . . . 1.0 . . . . . . . . . . . . A . 11 GLU HG2 . . . . . . . . . c19602_2mgt 1 . 16 . 8258 . 1 1 12 GLU HG3 H -2.922 1.212 -0.782 . . . 1.0 . . . . . . . . . . . . A . 11 GLU HG3 . . . . . . . . . c19602_2mgt 1 . 16 . 8259 . 1 1 12 GLU N N -5.373 3.265 1.747 . . . 1.0 . . . . . . . . . . . . A . 11 GLU N . . . . . . . . . c19602_2mgt 1 . 16 . 8260 . 1 1 12 GLU O O -5.121 0.301 2.766 . . . 1.0 . . . . . . . . . . . . A . 11 GLU O . . . . . . . . . c19602_2mgt 1 . 16 . 8261 . 1 1 12 GLU OE1 O -0.742 1.241 1.274 . . . 1.0 . . . . . . . . . . . . A . 11 GLU OE1 . . . . . . . . . c19602_2mgt 1 . 16 . 8262 . 1 1 12 GLU OE2 O -1.034 -0.601 0.121 . . . 1.0 . . . . . . . . . . . . A . 11 GLU OE2 . . . . . . . . . c19602_2mgt 1 . 16 . 8263 . 1 1 13 VAL C C -7.275 -1.724 1.991 . . . 1.0 . . . . . . . . . . . . A . 12 VAL C . . . . . . . . . c19602_2mgt 1 . 16 . 8264 . 1 1 13 VAL CA C -7.820 -0.298 1.961 . . . 1.0 . . . . . . . . . . . . A . 12 VAL CA . . . . . . . . . c19602_2mgt 1 . 16 . 8265 . 1 1 13 VAL CB C -9.184 -0.220 1.235 . . . 1.0 . . . . . . . . . . . . A . 12 VAL CB . . . . . . . . . c19602_2mgt 1 . 16 . 8266 . 1 1 13 VAL CG1 C -10.122 -1.388 1.587 . . . 1.0 . . . . . . . . . . . . A . 12 VAL CG1 . . . . . . . . . c19602_2mgt 1 . 16 . 8267 . 1 1 13 VAL CG2 C -9.891 1.088 1.616 . . . 1.0 . . . . . . . . . . . . A . 12 VAL CG2 . . . . . . . . . c19602_2mgt 1 . 16 . 8268 . 1 1 13 VAL H H -7.218 1.184 0.596 . . . 1.0 . . . . . . . . . . . . A . 12 VAL H . . . . . . . . . c19602_2mgt 1 . 16 . 8269 . 1 1 13 VAL HA H -7.979 0.013 2.989 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HA . . . . . . . . . c19602_2mgt 1 . 16 . 8270 . 1 1 13 VAL HB H -9.017 -0.238 0.157 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HB . . . . . . . . . c19602_2mgt 1 . 16 . 8271 . 1 1 13 VAL HG11 H -11.085 -1.269 1.111 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HG11 . . . . . . . . . c19602_2mgt 1 . 16 . 8272 . 1 1 13 VAL HG12 H -9.715 -2.327 1.222 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HG12 . . . . . . . . . c19602_2mgt 1 . 16 . 8273 . 1 1 13 VAL HG13 H -10.260 -1.435 2.667 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HG13 . . . . . . . . . c19602_2mgt 1 . 16 . 8274 . 1 1 13 VAL HG21 H -10.116 1.094 2.683 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HG21 . . . . . . . . . c19602_2mgt 1 . 16 . 8275 . 1 1 13 VAL HG22 H -9.253 1.930 1.376 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HG22 . . . . . . . . . c19602_2mgt 1 . 16 . 8276 . 1 1 13 VAL HG23 H -10.809 1.195 1.049 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HG23 . . . . . . . . . c19602_2mgt 1 . 16 . 8277 . 1 1 13 VAL N N -6.877 0.643 1.375 . . . 1.0 . . . . . . . . . . . . A . 12 VAL N . . . . . . . . . c19602_2mgt 1 . 16 . 8278 . 1 1 13 VAL O O -7.755 -2.502 2.806 . . . 1.0 . . . . . . . . . . . . A . 12 VAL O . . . . . . . . . c19602_2mgt 1 . 16 . 8279 . 1 1 14 HIS C C -5.102 -3.770 2.572 . . . 1.0 . . . . . . . . . . . . A . 13 HIS C . . . . . . . . . c19602_2mgt 1 . 16 . 8280 . 1 1 14 HIS CA C -5.728 -3.435 1.217 . . . 1.0 . . . . . . . . . . . . A . 13 HIS CA . . . . . . . . . c19602_2mgt 1 . 16 . 8281 . 1 1 14 HIS CB C -4.701 -3.651 0.105 . . . 1.0 . . . . . . . . . . . . A . 13 HIS CB . . . . . . . . . c19602_2mgt 1 . 16 . 8282 . 1 1 14 HIS CD2 C -4.599 -2.937 -2.350 . . . 1.0 . . . . . . . . . . . . A . 13 HIS CD2 . . . . . . . . . c19602_2mgt 1 . 16 . 8283 . 1 1 14 HIS CE1 C -6.655 -3.376 -2.969 . . . 1.0 . . . . . . . . . . . . A . 13 HIS CE1 . . . . . . . . . c19602_2mgt 1 . 16 . 8284 . 1 1 14 HIS CG C -5.258 -3.467 -1.278 . . . 1.0 . . . . . . . . . . . . A . 13 HIS CG . . . . . . . . . c19602_2mgt 1 . 16 . 8285 . 1 1 14 HIS H H -5.896 -1.423 0.513 . . . 1.0 . . . . . . . . . . . . A . 13 HIS H . . . . . . . . . c19602_2mgt 1 . 16 . 8286 . 1 1 14 HIS HA H -6.570 -4.107 1.063 . . . 1.0 . . . . . . . . . . . . A . 13 HIS HA . . . . . . . . . c19602_2mgt 1 . 16 . 8287 . 1 1 14 HIS HB2 H -3.876 -2.954 0.253 . . . 1.0 . . . . . . . . . . . . A . 13 HIS HB2 . . . . . . . . . c19602_2mgt 1 . 16 . 8288 . 1 1 14 HIS HB3 H -4.310 -4.667 0.178 . . . 1.0 . . . . . . . . . . . . A . 13 HIS HB3 . . . . . . . . . c19602_2mgt 1 . 16 . 8289 . 1 1 14 HIS HD1 H -7.273 -4.155 -1.123 . . . 1.0 . . . . . . . . . . . . A . 13 HIS HD1 . . . . . . . . . c19602_2mgt 1 . 16 . 8290 . 1 1 14 HIS HD2 H -3.574 -2.595 -2.358 . . . 1.0 . . . . . . . . . . . . A . 13 HIS HD2 . . . . . . . . . c19602_2mgt 1 . 16 . 8291 . 1 1 14 HIS HE1 H -7.547 -3.483 -3.563 . . . 1.0 . . . . . . . . . . . . A . 13 HIS HE1 . . . . . . . . . c19602_2mgt 1 . 16 . 8292 . 1 1 14 HIS N N -6.276 -2.086 1.175 . . . 1.0 . . . . . . . . . . . . A . 13 HIS N . . . . . . . . . c19602_2mgt 1 . 16 . 8293 . 1 1 14 HIS ND1 N -6.540 -3.750 -1.689 . . . 1.0 . . . . . . . . . . . . A . 13 HIS ND1 . . . . . . . . . c19602_2mgt 1 . 16 . 8294 . 1 1 14 HIS NE2 N -5.500 -2.869 -3.418 . . . 1.0 . . . . . . . . . . . . A . 13 HIS NE2 . . . . . . . . . c19602_2mgt 1 . 16 . 8295 . 1 1 14 HIS O O -5.066 -4.944 2.923 . . . 1.0 . . . . . . . . . . . . A . 13 HIS O . . . . . . . . . c19602_2mgt 1 . 16 . 8296 . 1 1 15 HIS C C -5.375 -2.847 5.720 . . . 1.0 . . . . . . . . . . . . A . 14 HIS C . . . . . . . . . c19602_2mgt 1 . 16 . 8297 . 1 1 15 HIS CA C -4.231 -2.961 4.725 . . . 1.0 . . . . . . . . . . . . A . 14 HIS CA . . . . . . . . . c19602_2mgt 1 . 16 . 8298 . 1 1 15 HIS CB C -3.165 -1.943 5.099 . . . 1.0 . . . . . . . . . . . . A . 14 HIS CB . . . . . . . . . c19602_2mgt 1 . 16 . 8299 . 1 1 15 HIS CD2 C -1.436 -1.201 3.384 . . . 1.0 . . . . . . . . . . . . A . 14 HIS CD2 . . . . . . . . . c19602_2mgt 1 . 16 . 8300 . 1 1 15 HIS CE1 C -0.070 -2.903 3.438 . . . 1.0 . . . . . . . . . . . . A . 14 HIS CE1 . . . . . . . . . c19602_2mgt 1 . 16 . 8301 . 1 1 15 HIS CG C -1.915 -2.095 4.292 . . . 1.0 . . . . . . . . . . . . A . 14 HIS CG . . . . . . . . . c19602_2mgt 1 . 16 . 8302 . 1 1 15 HIS H H -4.724 -1.816 3.004 . . . 1.0 . . . . . . . . . . . . A . 14 HIS H . . . . . . . . . c19602_2mgt 1 . 16 . 8303 . 1 1 15 HIS HA H -3.804 -3.955 4.820 . . . 1.0 . . . . . . . . . . . . A . 14 HIS HA . . . . . . . . . c19602_2mgt 1 . 16 . 8304 . 1 1 15 HIS HB2 H -3.581 -0.949 4.964 . . . 1.0 . . . . . . . . . . . . A . 14 HIS HB2 . . . . . . . . . c19602_2mgt 1 . 16 . 8305 . 1 1 15 HIS HB3 H -2.903 -2.064 6.150 . . . 1.0 . . . . . . . . . . . . A . 14 HIS HB3 . . . . . . . . . c19602_2mgt 1 . 16 . 8306 . 1 1 15 HIS HD1 H -1.144 -3.992 4.883 . . . 1.0 . . . . . . . . . . . . A . 14 HIS HD1 . . . . . . . . . c19602_2mgt 1 . 16 . 8307 . 1 1 15 HIS HD2 H -1.903 -0.261 3.138 . . . 1.0 . . . . . . . . . . . . A . 14 HIS HD2 . . . . . . . . . c19602_2mgt 1 . 16 . 8308 . 1 1 15 HIS HE1 H 0.755 -3.563 3.230 . . . 1.0 . . . . . . . . . . . . A . 14 HIS HE1 . . . . . . . . . c19602_2mgt 1 . 16 . 8309 . 1 1 15 HIS N N -4.664 -2.765 3.347 . . . 1.0 . . . . . . . . . . . . A . 14 HIS N . . . . . . . . . c19602_2mgt 1 . 16 . 8310 . 1 1 15 HIS ND1 N -1.055 -3.165 4.310 . . . 1.0 . . . . . . . . . . . . A . 14 HIS ND1 . . . . . . . . . c19602_2mgt 1 . 16 . 8311 . 1 1 15 HIS NE2 N -0.260 -1.721 2.838 . . . 1.0 . . . . . . . . . . . . A . 14 HIS NE2 . . . . . . . . . c19602_2mgt 1 . 16 . 8312 . 1 1 15 HIS O O -5.288 -3.467 6.773 . . . 1.0 . . . . . . . . . . . . A . 14 HIS O . . . . . . . . . c19602_2mgt 1 . 16 . 8313 . 1 1 16 GLN C C -8.210 -3.518 6.263 . . . 1.0 . . . . . . . . . . . . A . 15 GLN C . . . . . . . . . c19602_2mgt 1 . 16 . 8314 . 1 1 16 GLN CA C -7.625 -2.104 6.253 . . . 1.0 . . . . . . . . . . . . A . 15 GLN CA . . . . . . . . . c19602_2mgt 1 . 16 . 8315 . 1 1 16 GLN CB C -8.617 -1.057 5.746 . . . 1.0 . . . . . . . . . . . . A . 15 GLN CB . . . . . . . . . c19602_2mgt 1 . 16 . 8316 . 1 1 16 GLN CD C -9.125 0.152 7.928 . . . 1.0 . . . . . . . . . . . . A . 15 GLN CD . . . . . . . . . c19602_2mgt 1 . 16 . 8317 . 1 1 16 GLN CG C -9.677 -0.710 6.794 . . . 1.0 . . . . . . . . . . . . A . 15 GLN CG . . . . . . . . . c19602_2mgt 1 . 16 . 8318 . 1 1 16 GLN H H -6.485 -1.567 4.565 . . . 1.0 . . . . . . . . . . . . A . 15 GLN H . . . . . . . . . c19602_2mgt 1 . 16 . 8319 . 1 1 16 GLN HA H -7.312 -1.838 7.252 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HA . . . . . . . . . c19602_2mgt 1 . 16 . 8320 . 1 1 16 GLN HB2 H -8.084 -0.151 5.465 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HB2 . . . . . . . . . c19602_2mgt 1 . 16 . 8321 . 1 1 16 GLN HB3 H -9.115 -1.447 4.866 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HB3 . . . . . . . . . c19602_2mgt 1 . 16 . 8322 . 1 1 16 GLN HE21 H -8.498 -1.461 9.003 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HE21 . . . . . . . . . c19602_2mgt 1 . 16 . 8323 . 1 1 16 GLN HE22 H -8.172 0.104 9.711 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HE22 . . . . . . . . . c19602_2mgt 1 . 16 . 8324 . 1 1 16 GLN HG2 H -10.469 -0.159 6.293 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HG2 . . . . . . . . . c19602_2mgt 1 . 16 . 8325 . 1 1 16 GLN HG3 H -10.099 -1.630 7.198 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HG3 . . . . . . . . . c19602_2mgt 1 . 16 . 8326 . 1 1 16 GLN N N -6.441 -2.094 5.421 . . . 1.0 . . . . . . . . . . . . A . 15 GLN N . . . . . . . . . c19602_2mgt 1 . 16 . 8327 . 1 1 16 GLN NE2 N -8.547 -0.455 8.958 . . . 1.0 . . . . . . . . . . . . A . 15 GLN NE2 . . . . . . . . . c19602_2mgt 1 . 16 . 8328 . 1 1 16 GLN O O -8.416 -4.083 7.328 . . . 1.0 . . . . . . . . . . . . A . 15 GLN O . . . . . . . . . c19602_2mgt 1 . 16 . 8329 . 1 1 16 GLN OE1 O -9.200 1.372 7.882 . . . 1.0 . . . . . . . . . . . . A . 15 GLN OE1 . . . . . . . . . c19602_2mgt 1 . 16 . 8330 . 1 1 17 LYS C C -8.249 -6.014 3.557 . . . 1.0 . . . . . . . . . . . . A . 16 LYS C . . . . . . . . . c19602_2mgt 1 . 16 . 8331 . 1 1 17 LYS CA C -8.756 -5.510 4.910 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CA . . . . . . . . . c19602_2mgt 1 . 16 . 8332 . 1 1 17 LYS CB C -10.278 -5.630 5.008 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CB . . . . . . . . . c19602_2mgt 1 . 16 . 8333 . 1 1 17 LYS CD C -12.193 -7.252 5.033 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CD . . . . . . . . . c19602_2mgt 1 . 16 . 8334 . 1 1 17 LYS CE C -12.517 -8.742 5.001 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CE . . . . . . . . . c19602_2mgt 1 . 16 . 8335 . 1 1 17 LYS CG C -10.685 -7.094 5.175 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CG . . . . . . . . . c19602_2mgt 1 . 16 . 8336 . 1 1 17 LYS H H -8.160 -3.601 4.246 . . . 1.0 . . . . . . . . . . . . A . 16 LYS H . . . . . . . . . c19602_2mgt 1 . 16 . 8337 . 1 1 17 LYS HA H -8.301 -6.098 5.707 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HA . . . . . . . . . c19602_2mgt 1 . 16 . 8338 . 1 1 17 LYS HB2 H -10.650 -5.062 5.858 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HB2 . . . . . . . . . c19602_2mgt 1 . 16 . 8339 . 1 1 17 LYS HB3 H -10.726 -5.215 4.108 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HB3 . . . . . . . . . c19602_2mgt 1 . 16 . 8340 . 1 1 17 LYS HD2 H -12.691 -6.772 5.875 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HD2 . . . . . . . . . c19602_2mgt 1 . 16 . 8341 . 1 1 17 LYS HD3 H -12.527 -6.793 4.102 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HD3 . . . . . . . . . c19602_2mgt 1 . 16 . 8342 . 1 1 17 LYS HE2 H -12.056 -9.188 4.122 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HE2 . . . . . . . . . c19602_2mgt 1 . 16 . 8343 . 1 1 17 LYS HE3 H -12.119 -9.216 5.897 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HE3 . . . . . . . . . c19602_2mgt 1 . 16 . 8344 . 1 1 17 LYS HG2 H -10.196 -7.699 4.415 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HG2 . . . . . . . . . c19602_2mgt 1 . 16 . 8345 . 1 1 17 LYS HG3 H -10.370 -7.451 6.155 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HG3 . . . . . . . . . c19602_2mgt 1 . 16 . 8346 . 1 1 17 LYS HZ1 H -14.404 -8.571 5.754 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HZ1 . . . . . . . . . c19602_2mgt 1 . 16 . 8347 . 1 1 17 LYS HZ2 H -14.341 -8.529 4.115 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HZ2 . . . . . . . . . c19602_2mgt 1 . 16 . 8348 . 1 1 17 LYS HZ3 H -14.153 -9.962 4.906 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HZ3 . . . . . . . . . c19602_2mgt 1 . 16 . 8349 . 1 1 17 LYS N N -8.370 -4.124 5.084 . . . 1.0 . . . . . . . . . . . . A . 16 LYS N . . . . . . . . . c19602_2mgt 1 . 16 . 8350 . 1 1 17 LYS NZ N -13.961 -8.972 4.939 . . . 1.0 . . . . . . . . . . . . A . 16 LYS NZ . . . . . . . . . c19602_2mgt 1 . 16 . 8351 . 1 1 17 LYS O O -8.399 -5.350 2.535 . . . 1.0 . . . . . . . . . . . . A . 16 LYS O . . . . . . . . . c19602_2mgt 1 . 16 . 8352 . 1 1 18 NH2 HN1 H -7.329 -7.584 2.659 . . . 1.0 . . . . . . . . . . . . A . 17 NH2 HN1 . . . . . . . . . c19602_2mgt 1 . 16 . 8353 . 1 1 18 NH2 HN2 H -7.579 -7.745 4.385 . . . 1.0 . . . . . . . . . . . . A . 17 NH2 HN2 . . . . . . . . . c19602_2mgt 1 . 16 . 8354 . 1 1 18 NH2 N N -7.673 -7.212 3.533 . . . 1.0 . . . . . . . . . . . . A . 17 NH2 N . . . . . . . . . c19602_2mgt 1 . 16 . 8355 . 2 1 1 ACE C C 10.292 7.462 -8.712 . . . 1.0 . . . . . . . . . . . . B . 0 ACE C . . . . . . . . . c19602_2mgt 1 . 16 . 8356 . 2 1 1 ACE CH3 C 9.355 7.543 -7.525 . . . 1.0 . . . . . . . . . . . . B . 0 ACE CH3 . . . . . . . . . c19602_2mgt 1 . 16 . 8357 . 2 1 1 ACE H1 H 9.897 7.969 -6.684 . . . 1.0 . . . . . . . . . . . . B . 0 ACE H1 . . . . . . . . . c19602_2mgt 1 . 16 . 8358 . 2 1 1 ACE H2 H 8.502 8.180 -7.765 . . . 1.0 . . . . . . . . . . . . B . 0 ACE H2 . . . . . . . . . c19602_2mgt 1 . 16 . 8359 . 2 1 1 ACE H3 H 9.002 6.546 -7.266 . . . 1.0 . . . . . . . . . . . . B . 0 ACE H3 . . . . . . . . . c19602_2mgt 1 . 16 . 8360 . 2 1 1 ACE O O 10.172 8.256 -9.635 . . . 1.0 . . . . . . . . . . . . B . 0 ACE O . . . . . . . . . c19602_2mgt 1 . 16 . 8361 . 2 1 2 ASP C C 12.789 4.962 -9.732 . . . 1.0 . . . . . . . . . . . . B . 1 ASP C . . . . . . . . . c19602_2mgt 1 . 16 . 8362 . 2 1 2 ASP CA C 12.291 6.404 -9.674 . . . 1.0 . . . . . . . . . . . . B . 1 ASP CA . . . . . . . . . c19602_2mgt 1 . 16 . 8363 . 2 1 2 ASP CB C 13.429 7.358 -9.286 . . . 1.0 . . . . . . . . . . . . B . 1 ASP CB . . . . . . . . . c19602_2mgt 1 . 16 . 8364 . 2 1 2 ASP CG C 14.389 7.568 -10.438 . . . 1.0 . . . . . . . . . . . . B . 1 ASP CG . . . . . . . . . c19602_2mgt 1 . 16 . 8365 . 2 1 2 ASP H H 11.275 5.890 -7.897 . . . 1.0 . . . . . . . . . . . . B . 1 ASP H . . . . . . . . . c19602_2mgt 1 . 16 . 8366 . 2 1 2 ASP HA H 11.905 6.693 -10.651 . . . 1.0 . . . . . . . . . . . . B . 1 ASP HA . . . . . . . . . c19602_2mgt 1 . 16 . 8367 . 2 1 2 ASP HB2 H 13.027 8.317 -8.964 . . . 1.0 . . . . . . . . . . . . B . 1 ASP HB2 . . . . . . . . . c19602_2mgt 1 . 16 . 8368 . 2 1 2 ASP HB3 H 13.991 6.913 -8.467 . . . 1.0 . . . . . . . . . . . . B . 1 ASP HB3 . . . . . . . . . c19602_2mgt 1 . 16 . 8369 . 2 1 2 ASP N N 11.232 6.518 -8.686 . . . 1.0 . . . . . . . . . . . . B . 1 ASP N . . . . . . . . . c19602_2mgt 1 . 16 . 8370 . 2 1 2 ASP O O 12.917 4.319 -8.695 . . . 1.0 . . . . . . . . . . . . B . 1 ASP O . . . . . . . . . c19602_2mgt 1 . 16 . 8371 . 2 1 2 ASP OD1 O 15.027 6.610 -10.841 . . . 1.0 . . . . . . . . . . . . B . 1 ASP OD1 . . . . . . . . . c19602_2mgt 1 . 16 . 8372 . 2 1 2 ASP OD2 O 14.453 8.738 -10.922 . . . 1.0 . . . . . . . . . . . . B . 1 ASP OD2 . . . . . . . . . c19602_2mgt 1 . 16 . 8373 . 2 1 3 ALA C C 14.685 2.581 -10.401 . . . 1.0 . . . . . . . . . . . . B . 2 ALA C . . . . . . . . . c19602_2mgt 1 . 16 . 8374 . 2 1 3 ALA CA C 13.533 3.124 -11.251 . . . 1.0 . . . . . . . . . . . . B . 2 ALA CA . . . . . . . . . c19602_2mgt 1 . 16 . 8375 . 2 1 3 ALA CB C 13.941 3.072 -12.722 . . . 1.0 . . . . . . . . . . . . B . 2 ALA CB . . . . . . . . . c19602_2mgt 1 . 16 . 8376 . 2 1 3 ALA H H 13.058 5.129 -11.719 . . . 1.0 . . . . . . . . . . . . B . 2 ALA H . . . . . . . . . c19602_2mgt 1 . 16 . 8377 . 2 1 3 ALA HA H 12.682 2.463 -11.104 . . . 1.0 . . . . . . . . . . . . B . 2 ALA HA . . . . . . . . . c19602_2mgt 1 . 16 . 8378 . 2 1 3 ALA HB1 H 13.100 3.359 -13.350 . . . 1.0 . . . . . . . . . . . . B . 2 ALA HB1 . . . . . . . . . c19602_2mgt 1 . 16 . 8379 . 2 1 3 ALA HB2 H 14.781 3.746 -12.896 . . . 1.0 . . . . . . . . . . . . B . 2 ALA HB2 . . . . . . . . . c19602_2mgt 1 . 16 . 8380 . 2 1 3 ALA HB3 H 14.247 2.057 -12.972 . . . 1.0 . . . . . . . . . . . . B . 2 ALA HB3 . . . . . . . . . c19602_2mgt 1 . 16 . 8381 . 2 1 3 ALA N N 13.116 4.489 -10.942 . . . 1.0 . . . . . . . . . . . . B . 2 ALA N . . . . . . . . . c19602_2mgt 1 . 16 . 8382 . 2 1 3 ALA O O 14.800 1.363 -10.290 . . . 1.0 . . . . . . . . . . . . B . 2 ALA O . . . . . . . . . c19602_2mgt 1 . 16 . 8383 . 2 1 4 GLU C C 16.131 2.246 -7.736 . . . 1.0 . . . . . . . . . . . . B . 3 GLU C . . . . . . . . . c19602_2mgt 1 . 16 . 8384 . 2 1 4 GLU CA C 16.623 3.024 -8.949 . . . 1.0 . . . . . . . . . . . . B . 3 GLU CA . . . . . . . . . c19602_2mgt 1 . 16 . 8385 . 2 1 4 GLU CB C 17.449 4.225 -8.476 . . . 1.0 . . . . . . . . . . . . B . 3 GLU CB . . . . . . . . . c19602_2mgt 1 . 16 . 8386 . 2 1 4 GLU CD C 18.958 6.087 -9.274 . . . 1.0 . . . . . . . . . . . . B . 3 GLU CD . . . . . . . . . c19602_2mgt 1 . 16 . 8387 . 2 1 4 GLU CG C 17.855 5.118 -9.644 . . . 1.0 . . . . . . . . . . . . B . 3 GLU CG . . . . . . . . . c19602_2mgt 1 . 16 . 8388 . 2 1 4 GLU H H 15.363 4.436 -9.921 . . . 1.0 . . . . . . . . . . . . B . 3 GLU H . . . . . . . . . c19602_2mgt 1 . 16 . 8389 . 2 1 4 GLU HA H 17.271 2.372 -9.531 . . . 1.0 . . . . . . . . . . . . B . 3 GLU HA . . . . . . . . . c19602_2mgt 1 . 16 . 8390 . 2 1 4 GLU HB2 H 16.877 4.818 -7.760 . . . 1.0 . . . . . . . . . . . . B . 3 GLU HB2 . . . . . . . . . c19602_2mgt 1 . 16 . 8391 . 2 1 4 GLU HB3 H 18.345 3.848 -7.982 . . . 1.0 . . . . . . . . . . . . B . 3 GLU HB3 . . . . . . . . . c19602_2mgt 1 . 16 . 8392 . 2 1 4 GLU HG2 H 18.186 4.516 -10.486 . . . 1.0 . . . . . . . . . . . . B . 3 GLU HG2 . . . . . . . . . c19602_2mgt 1 . 16 . 8393 . 2 1 4 GLU HG3 H 16.978 5.673 -9.936 . . . 1.0 . . . . . . . . . . . . B . 3 GLU HG3 . . . . . . . . . c19602_2mgt 1 . 16 . 8394 . 2 1 4 GLU N N 15.512 3.444 -9.796 . . . 1.0 . . . . . . . . . . . . B . 3 GLU N . . . . . . . . . c19602_2mgt 1 . 16 . 8395 . 2 1 4 GLU O O 16.734 1.236 -7.400 . . . 1.0 . . . . . . . . . . . . B . 3 GLU O . . . . . . . . . c19602_2mgt 1 . 16 . 8396 . 2 1 4 GLU OE1 O 20.125 5.679 -9.303 . . . 1.0 . . . . . . . . . . . . B . 3 GLU OE1 . . . . . . . . . c19602_2mgt 1 . 16 . 8397 . 2 1 4 GLU OE2 O 18.615 7.254 -8.976 . . . 1.0 . . . . . . . . . . . . B . 3 GLU OE2 . . . . . . . . . c19602_2mgt 1 . 16 . 8398 . 2 1 5 PHE C C 13.058 1.700 -5.942 . . . 1.0 . . . . . . . . . . . . B . 4 PHE C . . . . . . . . . c19602_2mgt 1 . 16 . 8399 . 2 1 5 PHE CA C 14.523 2.150 -5.853 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CA . . . . . . . . . c19602_2mgt 1 . 16 . 8400 . 2 1 5 PHE CB C 14.725 3.186 -4.745 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CB . . . . . . . . . c19602_2mgt 1 . 16 . 8401 . 2 1 5 PHE CD1 C 13.755 5.290 -5.763 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CD1 . . . . . . . . . c19602_2mgt 1 . 16 . 8402 . 2 1 5 PHE CD2 C 12.701 4.350 -3.780 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CD2 . . . . . . . . . c19602_2mgt 1 . 16 . 8403 . 2 1 5 PHE CE1 C 12.784 6.303 -5.793 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CE1 . . . . . . . . . c19602_2mgt 1 . 16 . 8404 . 2 1 5 PHE CE2 C 11.753 5.388 -3.794 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CE2 . . . . . . . . . c19602_2mgt 1 . 16 . 8405 . 2 1 5 PHE CG C 13.712 4.309 -4.758 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CG . . . . . . . . . c19602_2mgt 1 . 16 . 8406 . 2 1 5 PHE CZ C 11.787 6.355 -4.809 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CZ . . . . . . . . . c19602_2mgt 1 . 16 . 8407 . 2 1 5 PHE H H 14.607 3.534 -7.472 . . . 1.0 . . . . . . . . . . . . B . 4 PHE H . . . . . . . . . c19602_2mgt 1 . 16 . 8408 . 2 1 5 PHE HA H 15.105 1.273 -5.591 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HA . . . . . . . . . c19602_2mgt 1 . 16 . 8409 . 2 1 5 PHE HB2 H 14.667 2.674 -3.786 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HB2 . . . . . . . . . c19602_2mgt 1 . 16 . 8410 . 2 1 5 PHE HB3 H 15.728 3.606 -4.828 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HB3 . . . . . . . . . c19602_2mgt 1 . 16 . 8411 . 2 1 5 PHE HD1 H 14.523 5.252 -6.521 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HD1 . . . . . . . . . c19602_2mgt 1 . 16 . 8412 . 2 1 5 PHE HD2 H 12.650 3.575 -3.029 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HD2 . . . . . . . . . c19602_2mgt 1 . 16 . 8413 . 2 1 5 PHE HE1 H 12.811 7.059 -6.561 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HE1 . . . . . . . . . c19602_2mgt 1 . 16 . 8414 . 2 1 5 PHE HE2 H 10.990 5.438 -3.033 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HE2 . . . . . . . . . c19602_2mgt 1 . 16 . 8415 . 2 1 5 PHE HZ H 11.051 7.141 -4.830 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HZ . . . . . . . . . c19602_2mgt 1 . 16 . 8416 . 2 1 5 PHE N N 15.042 2.698 -7.106 . . . 1.0 . . . . . . . . . . . . B . 4 PHE N . . . . . . . . . c19602_2mgt 1 . 16 . 8417 . 2 1 5 PHE O O 12.569 1.047 -5.019 . . . 1.0 . . . . . . . . . . . . B . 4 PHE O . . . . . . . . . c19602_2mgt 1 . 16 . 8418 . 2 1 6 ARG C C 11.324 0.072 -8.041 . . . 1.0 . . . . . . . . . . . . B . 5 ARG C . . . . . . . . . c19602_2mgt 1 . 16 . 8419 . 2 1 6 ARG CA C 11.090 1.449 -7.434 . . . 1.0 . . . . . . . . . . . . B . 5 ARG CA . . . . . . . . . c19602_2mgt 1 . 16 . 8420 . 2 1 6 ARG CB C 10.358 2.402 -8.385 . . . 1.0 . . . . . . . . . . . . B . 5 ARG CB . . . . . . . . . c19602_2mgt 1 . 16 . 8421 . 2 1 6 ARG CD C 8.891 3.423 -6.525 . . . 1.0 . . . . . . . . . . . . B . 5 ARG CD . . . . . . . . . c19602_2mgt 1 . 16 . 8422 . 2 1 6 ARG CG C 9.841 3.676 -7.699 . . . 1.0 . . . . . . . . . . . . B . 5 ARG CG . . . . . . . . . c19602_2mgt 1 . 16 . 8423 . 2 1 6 ARG CZ C 6.727 2.628 -7.520 . . . 1.0 . . . . . . . . . . . . B . 5 ARG CZ . . . . . . . . . c19602_2mgt 1 . 16 . 8424 . 2 1 6 ARG H H 12.841 2.574 -7.754 . . . 1.0 . . . . . . . . . . . . B . 5 ARG H . . . . . . . . . c19602_2mgt 1 . 16 . 8425 . 2 1 6 ARG HA H 10.486 1.314 -6.545 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HA . . . . . . . . . c19602_2mgt 1 . 16 . 8426 . 2 1 6 ARG HB2 H 11.037 2.683 -9.188 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HB2 . . . . . . . . . c19602_2mgt 1 . 16 . 8427 . 2 1 6 ARG HB3 H 9.516 1.876 -8.835 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HB3 . . . . . . . . . c19602_2mgt 1 . 16 . 8428 . 2 1 6 ARG HD2 H 9.483 3.032 -5.708 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HD2 . . . . . . . . . c19602_2mgt 1 . 16 . 8429 . 2 1 6 ARG HD3 H 8.441 4.356 -6.195 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HD3 . . . . . . . . . c19602_2mgt 1 . 16 . 8430 . 2 1 6 ARG HE H 8.118 1.470 -6.656 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HE . . . . . . . . . c19602_2mgt 1 . 16 . 8431 . 2 1 6 ARG HG2 H 10.683 4.254 -7.325 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HG2 . . . . . . . . . c19602_2mgt 1 . 16 . 8432 . 2 1 6 ARG HG3 H 9.326 4.269 -8.447 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HG3 . . . . . . . . . c19602_2mgt 1 . 16 . 8433 . 2 1 6 ARG HH11 H 6.735 4.659 -7.422 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HH11 . . . . . . . . . c19602_2mgt 1 . 16 . 8434 . 2 1 6 ARG HH12 H 5.373 3.955 -8.260 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HH12 . . . . . . . . . c19602_2mgt 1 . 16 . 8435 . 2 1 6 ARG HH21 H 6.405 0.639 -7.770 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HH21 . . . . . . . . . c19602_2mgt 1 . 16 . 8436 . 2 1 6 ARG HH22 H 5.180 1.687 -8.445 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HH22 . . . . . . . . . c19602_2mgt 1 . 16 . 8437 . 2 1 6 ARG N N 12.380 2.004 -7.058 . . . 1.0 . . . . . . . . . . . . B . 5 ARG N . . . . . . . . . c19602_2mgt 1 . 16 . 8438 . 2 1 6 ARG NE N 7.864 2.428 -6.846 . . . 1.0 . . . . . . . . . . . . B . 5 ARG NE . . . . . . . . . c19602_2mgt 1 . 16 . 8439 . 2 1 6 ARG NH1 N 6.250 3.846 -7.773 . . . 1.0 . . . . . . . . . . . . B . 5 ARG NH1 . . . . . . . . . c19602_2mgt 1 . 16 . 8440 . 2 1 6 ARG NH2 N 6.056 1.568 -7.956 . . . 1.0 . . . . . . . . . . . . B . 5 ARG NH2 . . . . . . . . . c19602_2mgt 1 . 16 . 8441 . 2 1 6 ARG O O 11.339 -0.105 -9.258 . . . 1.0 . . . . . . . . . . . . B . 5 ARG O . . . . . . . . . c19602_2mgt 1 . 16 . 8442 . 2 1 7 ARG C C 11.278 -3.320 -6.945 . . . 1.0 . . . . . . . . . . . . B . 6 ARG C . . . . . . . . . c19602_2mgt 1 . 16 . 8443 . 2 1 7 ARG CA C 12.183 -2.166 -7.373 . . . 1.0 . . . . . . . . . . . . B . 6 ARG CA . . . . . . . . . c19602_2mgt 1 . 16 . 8444 . 2 1 7 ARG CB C 13.476 -2.191 -6.544 . . . 1.0 . . . . . . . . . . . . B . 6 ARG CB . . . . . . . . . c19602_2mgt 1 . 16 . 8445 . 2 1 7 ARG CD C 15.258 -2.019 -8.287 . . . 1.0 . . . . . . . . . . . . B . 6 ARG CD . . . . . . . . . c19602_2mgt 1 . 16 . 8446 . 2 1 7 ARG CG C 14.557 -1.293 -7.142 . . . 1.0 . . . . . . . . . . . . B . 6 ARG CG . . . . . . . . . c19602_2mgt 1 . 16 . 8447 . 2 1 7 ARG CZ C 16.991 -1.345 -9.949 . . . 1.0 . . . . . . . . . . . . B . 6 ARG CZ . . . . . . . . . c19602_2mgt 1 . 16 . 8448 . 2 1 7 ARG H H 11.536 -0.600 -6.169 . . . 1.0 . . . . . . . . . . . . B . 6 ARG H . . . . . . . . . c19602_2mgt 1 . 16 . 8449 . 2 1 7 ARG HA H 12.426 -2.263 -8.426 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HA . . . . . . . . . c19602_2mgt 1 . 16 . 8450 . 2 1 7 ARG HB2 H 13.259 -1.840 -5.537 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HB2 . . . . . . . . . c19602_2mgt 1 . 16 . 8451 . 2 1 7 ARG HB3 H 13.859 -3.208 -6.485 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HB3 . . . . . . . . . c19602_2mgt 1 . 16 . 8452 . 2 1 7 ARG HD2 H 15.982 -2.706 -7.851 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HD2 . . . . . . . . . c19602_2mgt 1 . 16 . 8453 . 2 1 7 ARG HD3 H 14.535 -2.584 -8.876 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HD3 . . . . . . . . . c19602_2mgt 1 . 16 . 8454 . 2 1 7 ARG HE H 15.528 -0.155 -9.217 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HE . . . . . . . . . c19602_2mgt 1 . 16 . 8455 . 2 1 7 ARG HG2 H 14.113 -0.359 -7.488 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HG2 . . . . . . . . . c19602_2mgt 1 . 16 . 8456 . 2 1 7 ARG HG3 H 15.295 -1.063 -6.376 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HG3 . . . . . . . . . c19602_2mgt 1 . 16 . 8457 . 2 1 7 ARG HH11 H 17.167 -3.303 -9.424 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HH11 . . . . . . . . . c19602_2mgt 1 . 16 . 8458 . 2 1 7 ARG HH12 H 18.345 -2.732 -10.581 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HH12 . . . . . . . . . c19602_2mgt 1 . 16 . 8459 . 2 1 7 ARG HH21 H 17.077 0.538 -10.710 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HH21 . . . . . . . . . c19602_2mgt 1 . 16 . 8460 . 2 1 7 ARG HH22 H 18.292 -0.567 -11.304 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HH22 . . . . . . . . . c19602_2mgt 1 . 16 . 8461 . 2 1 7 ARG N N 11.558 -0.881 -7.136 . . . 1.0 . . . . . . . . . . . . B . 6 ARG N . . . . . . . . . c19602_2mgt 1 . 16 . 8462 . 2 1 7 ARG NE N 15.933 -1.079 -9.173 . . . 1.0 . . . . . . . . . . . . B . 6 ARG NE . . . . . . . . . c19602_2mgt 1 . 16 . 8463 . 2 1 7 ARG NH1 N 17.542 -2.560 -9.993 . . . 1.0 . . . . . . . . . . . . B . 6 ARG NH1 . . . . . . . . . c19602_2mgt 1 . 16 . 8464 . 2 1 7 ARG NH2 N 17.505 -0.377 -10.703 . . . 1.0 . . . . . . . . . . . . B . 6 ARG NH2 . . . . . . . . . c19602_2mgt 1 . 16 . 8465 . 2 1 7 ARG O O 10.339 -3.142 -6.176 . . . 1.0 . . . . . . . . . . . . B . 6 ARG O . . . . . . . . . c19602_2mgt 1 . 16 . 8466 . 2 1 8 ASP C C 11.598 -6.064 -5.424 . . . 1.0 . . . . . . . . . . . . B . 7 ASP C . . . . . . . . . c19602_2mgt 1 . 16 . 8467 . 2 1 8 ASP CA C 11.117 -5.796 -6.858 . . . 1.0 . . . . . . . . . . . . B . 7 ASP CA . . . . . . . . . c19602_2mgt 1 . 16 . 8468 . 2 1 8 ASP CB C 11.605 -6.934 -7.767 . . . 1.0 . . . . . . . . . . . . B . 7 ASP CB . . . . . . . . . c19602_2mgt 1 . 16 . 8469 . 2 1 8 ASP CG C 13.104 -7.200 -7.621 . . . 1.0 . . . . . . . . . . . . B . 7 ASP CG . . . . . . . . . c19602_2mgt 1 . 16 . 8470 . 2 1 8 ASP H H 12.399 -4.598 -8.041 . . . 1.0 . . . . . . . . . . . . B . 7 ASP H . . . . . . . . . c19602_2mgt 1 . 16 . 8471 . 2 1 8 ASP HA H 10.028 -5.770 -6.878 . . . 1.0 . . . . . . . . . . . . B . 7 ASP HA . . . . . . . . . c19602_2mgt 1 . 16 . 8472 . 2 1 8 ASP HB2 H 11.058 -7.836 -7.507 . . . 1.0 . . . . . . . . . . . . B . 7 ASP HB2 . . . . . . . . . c19602_2mgt 1 . 16 . 8473 . 2 1 8 ASP HB3 H 11.395 -6.687 -8.807 . . . 1.0 . . . . . . . . . . . . B . 7 ASP HB3 . . . . . . . . . c19602_2mgt 1 . 16 . 8474 . 2 1 8 ASP N N 11.633 -4.530 -7.383 . . . 1.0 . . . . . . . . . . . . B . 7 ASP N . . . . . . . . . c19602_2mgt 1 . 16 . 8475 . 2 1 8 ASP O O 11.049 -6.913 -4.731 . . . 1.0 . . . . . . . . . . . . B . 7 ASP O . . . . . . . . . c19602_2mgt 1 . 16 . 8476 . 2 1 8 ASP OD1 O 13.880 -6.246 -7.793 . . . 1.0 . . . . . . . . . . . . B . 7 ASP OD1 . . . . . . . . . c19602_2mgt 1 . 16 . 8477 . 2 1 8 ASP OD2 O 13.462 -8.356 -7.308 . . . 1.0 . . . . . . . . . . . . B . 7 ASP OD2 . . . . . . . . . c19602_2mgt 1 . 16 . 8478 . 2 1 9 SER C C 12.893 -5.637 -2.502 . . . 1.0 . . . . . . . . . . . . B . 8 SER C . . . . . . . . . c19602_2mgt 1 . 16 . 8479 . 2 1 9 SER CA C 13.534 -5.655 -3.895 . . . 1.0 . . . . . . . . . . . . B . 8 SER CA . . . . . . . . . c19602_2mgt 1 . 16 . 8480 . 2 1 9 SER CB C 14.684 -4.654 -3.948 . . . 1.0 . . . . . . . . . . . . B . 8 SER CB . . . . . . . . . c19602_2mgt 1 . 16 . 8481 . 2 1 9 SER H H 13.048 -4.742 -5.710 . . . 1.0 . . . . . . . . . . . . B . 8 SER H . . . . . . . . . c19602_2mgt 1 . 16 . 8482 . 2 1 9 SER HA H 13.946 -6.649 -4.056 . . . 1.0 . . . . . . . . . . . . B . 8 SER HA . . . . . . . . . c19602_2mgt 1 . 16 . 8483 . 2 1 9 SER HB2 H 14.286 -3.640 -3.905 . . . 1.0 . . . . . . . . . . . . B . 8 SER HB2 . . . . . . . . . c19602_2mgt 1 . 16 . 8484 . 2 1 9 SER HB3 H 15.350 -4.813 -3.102 . . . 1.0 . . . . . . . . . . . . B . 8 SER HB3 . . . . . . . . . c19602_2mgt 1 . 16 . 8485 . 2 1 9 SER HG H 16.158 -4.213 -5.125 . . . 1.0 . . . . . . . . . . . . B . 8 SER HG . . . . . . . . . c19602_2mgt 1 . 16 . 8486 . 2 1 9 SER N N 12.658 -5.362 -5.018 . . . 1.0 . . . . . . . . . . . . B . 8 SER N . . . . . . . . . c19602_2mgt 1 . 16 . 8487 . 2 1 9 SER O O 13.581 -5.959 -1.538 . . . 1.0 . . . . . . . . . . . . B . 8 SER O . . . . . . . . . c19602_2mgt 1 . 16 . 8488 . 2 1 9 SER OG O 15.413 -4.823 -5.139 . . . 1.0 . . . . . . . . . . . . B . 8 SER OG . . . . . . . . . c19602_2mgt 1 . 16 . 8489 . 2 1 10 GLY C C 9.548 -6.143 -1.517 . . . 1.0 . . . . . . . . . . . . B . 9 GLY C . . . . . . . . . c19602_2mgt 1 . 16 . 8490 . 2 1 10 GLY CA C 10.845 -5.426 -1.143 . . . 1.0 . . . . . . . . . . . . B . 9 GLY CA . . . . . . . . . c19602_2mgt 1 . 16 . 8491 . 2 1 10 GLY H H 11.081 -5.045 -3.193 . . . 1.0 . . . . . . . . . . . . B . 9 GLY H . . . . . . . . . c19602_2mgt 1 . 16 . 8492 . 2 1 10 GLY HA2 H 11.384 -6.000 -0.392 . . . 1.0 . . . . . . . . . . . . B . 9 GLY HA2 . . . . . . . . . c19602_2mgt 1 . 16 . 8493 . 2 1 10 GLY HA3 H 10.657 -4.434 -0.743 . . . 1.0 . . . . . . . . . . . . B . 9 GLY HA3 . . . . . . . . . c19602_2mgt 1 . 16 . 8494 . 2 1 10 GLY N N 11.610 -5.294 -2.367 . . . 1.0 . . . . . . . . . . . . B . 9 GLY N . . . . . . . . . c19602_2mgt 1 . 16 . 8495 . 2 1 10 GLY O O 9.570 -7.357 -1.675 . . . 1.0 . . . . . . . . . . . . B . 9 GLY O . . . . . . . . . c19602_2mgt 1 . 16 . 8496 . 2 1 11 TYR C C 6.804 -3.618 -1.470 . . . 1.0 . . . . . . . . . . . . B . 10 TYR C . . . . . . . . . c19602_2mgt 1 . 16 . 8497 . 2 1 11 TYR CA C 8.264 -4.019 -1.534 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CA . . . . . . . . . c19602_2mgt 1 . 16 . 8498 . 2 1 11 TYR CB C 8.929 -3.259 -2.695 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CB . . . . . . . . . c19602_2mgt 1 . 16 . 8499 . 2 1 11 TYR CD1 C 9.968 -1.566 -1.116 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CD1 . . . . . . . . . c19602_2mgt 1 . 16 . 8500 . 2 1 11 TYR CD2 C 11.223 -2.300 -3.060 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CD2 . . . . . . . . . c19602_2mgt 1 . 16 . 8501 . 2 1 11 TYR CE1 C 11.045 -0.765 -0.712 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CE1 . . . . . . . . . c19602_2mgt 1 . 16 . 8502 . 2 1 11 TYR CE2 C 12.297 -1.495 -2.673 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CE2 . . . . . . . . . c19602_2mgt 1 . 16 . 8503 . 2 1 11 TYR CG C 10.061 -2.349 -2.280 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CG . . . . . . . . . c19602_2mgt 1 . 16 . 8504 . 2 1 11 TYR CZ C 12.222 -0.732 -1.489 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CZ . . . . . . . . . c19602_2mgt 1 . 16 . 8505 . 2 1 11 TYR H H 7.625 -5.900 -2.110 . . . 1.0 . . . . . . . . . . . . B . 10 TYR H . . . . . . . . . c19602_2mgt 1 . 16 . 8506 . 2 1 11 TYR HA H 8.714 -3.744 -0.583 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HA . . . . . . . . . c19602_2mgt 1 . 16 . 8507 . 2 1 11 TYR HB2 H 9.296 -3.966 -3.441 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HB2 . . . . . . . . . c19602_2mgt 1 . 16 . 8508 . 2 1 11 TYR HB3 H 8.183 -2.655 -3.203 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HB3 . . . . . . . . . c19602_2mgt 1 . 16 . 8509 . 2 1 11 TYR HD1 H 9.073 -1.590 -0.517 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HD1 . . . . . . . . . c19602_2mgt 1 . 16 . 8510 . 2 1 11 TYR HD2 H 11.306 -2.911 -3.941 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HD2 . . . . . . . . . c19602_2mgt 1 . 16 . 8511 . 2 1 11 TYR HE1 H 10.970 -0.189 0.195 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HE1 . . . . . . . . . c19602_2mgt 1 . 16 . 8512 . 2 1 11 TYR HE2 H 13.185 -1.487 -3.273 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HE2 . . . . . . . . . c19602_2mgt 1 . 16 . 8513 . 2 1 11 TYR HH H 14.003 0.010 -1.736 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HH . . . . . . . . . c19602_2mgt 1 . 16 . 8514 . 2 1 11 TYR N N 8.423 -5.443 -1.706 . . . 1.0 . . . . . . . . . . . . B . 10 TYR N . . . . . . . . . c19602_2mgt 1 . 16 . 8515 . 2 1 11 TYR O O 5.928 -4.279 -2.025 . . . 1.0 . . . . . . . . . . . . B . 10 TYR O . . . . . . . . . c19602_2mgt 1 . 16 . 8516 . 2 1 11 TYR OH O 13.289 0.015 -1.094 . . . 1.0 . . . . . . . . . . . . B . 10 TYR OH . . . . . . . . . c19602_2mgt 1 . 16 . 8517 . 2 1 12 GLU C C 6.104 -0.114 -0.948 . . . 1.0 . . . . . . . . . . . . B . 11 GLU C . . . . . . . . . c19602_2mgt 1 . 16 . 8518 . 2 1 12 GLU CA C 5.562 -1.517 -1.256 . . . 1.0 . . . . . . . . . . . . B . 11 GLU CA . . . . . . . . . c19602_2mgt 1 . 16 . 8519 . 2 1 12 GLU CB C 4.298 -1.875 -0.484 . . . 1.0 . . . . . . . . . . . . B . 11 GLU CB . . . . . . . . . c19602_2mgt 1 . 16 . 8520 . 2 1 12 GLU CD C 2.020 -0.913 -0.115 . . . 1.0 . . . . . . . . . . . . B . 11 GLU CD . . . . . . . . . c19602_2mgt 1 . 16 . 8521 . 2 1 12 GLU CG C 3.070 -1.259 -1.152 . . . 1.0 . . . . . . . . . . . . B . 11 GLU CG . . . . . . . . . c19602_2mgt 1 . 16 . 8522 . 2 1 12 GLU H H 7.369 -2.029 -0.370 . . . 1.0 . . . . . . . . . . . . B . 11 GLU H . . . . . . . . . c19602_2mgt 1 . 16 . 8523 . 2 1 12 GLU HA H 5.371 -1.612 -2.324 . . . 1.0 . . . . . . . . . . . . B . 11 GLU HA . . . . . . . . . c19602_2mgt 1 . 16 . 8524 . 2 1 12 GLU HB2 H 4.174 -2.955 -0.441 . . . 1.0 . . . . . . . . . . . . B . 11 GLU HB2 . . . . . . . . . c19602_2mgt 1 . 16 . 8525 . 2 1 12 GLU HB3 H 4.406 -1.514 0.533 . . . 1.0 . . . . . . . . . . . . B . 11 GLU HB3 . . . . . . . . . c19602_2mgt 1 . 16 . 8526 . 2 1 12 GLU HG2 H 3.357 -0.347 -1.676 . . . 1.0 . . . . . . . . . . . . B . 11 GLU HG2 . . . . . . . . . c19602_2mgt 1 . 16 . 8527 . 2 1 12 GLU HG3 H 2.661 -1.961 -1.879 . . . 1.0 . . . . . . . . . . . . B . 11 GLU HG3 . . . . . . . . . c19602_2mgt 1 . 16 . 8528 . 2 1 12 GLU N N 6.612 -2.433 -0.895 . . . 1.0 . . . . . . . . . . . . B . 11 GLU N . . . . . . . . . c19602_2mgt 1 . 16 . 8529 . 2 1 12 GLU O O 5.769 0.472 0.078 . . . 1.0 . . . . . . . . . . . . B . 11 GLU O . . . . . . . . . c19602_2mgt 1 . 16 . 8530 . 2 1 12 GLU OE1 O 1.598 -1.815 0.631 . . . 1.0 . . . . . . . . . . . . B . 11 GLU OE1 . . . . . . . . . c19602_2mgt 1 . 16 . 8531 . 2 1 12 GLU OE2 O 1.678 0.282 -0.037 . . . 1.0 . . . . . . . . . . . . B . 11 GLU OE2 . . . . . . . . . c19602_2mgt 1 . 16 . 8532 . 2 1 13 VAL C C 7.451 2.623 -0.831 . . . 1.0 . . . . . . . . . . . . B . 12 VAL C . . . . . . . . . c19602_2mgt 1 . 16 . 8533 . 2 1 13 VAL CA C 7.980 1.438 -1.625 . . . 1.0 . . . . . . . . . . . . B . 12 VAL CA . . . . . . . . . c19602_2mgt 1 . 16 . 8534 . 2 1 13 VAL CB C 8.524 1.915 -2.991 . . . 1.0 . . . . . . . . . . . . B . 12 VAL CB . . . . . . . . . c19602_2mgt 1 . 16 . 8535 . 2 1 13 VAL CG1 C 9.400 3.171 -2.845 . . . 1.0 . . . . . . . . . . . . B . 12 VAL CG1 . . . . . . . . . c19602_2mgt 1 . 16 . 8536 . 2 1 13 VAL CG2 C 9.383 0.827 -3.647 . . . 1.0 . . . . . . . . . . . . B . 12 VAL CG2 . . . . . . . . . c19602_2mgt 1 . 16 . 8537 . 2 1 13 VAL H H 7.133 -0.170 -2.668 . . . 1.0 . . . . . . . . . . . . B . 12 VAL H . . . . . . . . . c19602_2mgt 1 . 16 . 8538 . 2 1 13 VAL HA H 8.819 1.029 -1.073 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HA . . . . . . . . . c19602_2mgt 1 . 16 . 8539 . 2 1 13 VAL HB H 7.687 2.149 -3.653 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HB . . . . . . . . . c19602_2mgt 1 . 16 . 8540 . 2 1 13 VAL HG11 H 10.134 3.023 -2.053 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HG11 . . . . . . . . . c19602_2mgt 1 . 16 . 8541 . 2 1 13 VAL HG12 H 9.938 3.368 -3.764 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HG12 . . . . . . . . . c19602_2mgt 1 . 16 . 8542 . 2 1 13 VAL HG13 H 8.784 4.043 -2.621 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HG13 . . . . . . . . . c19602_2mgt 1 . 16 . 8543 . 2 1 13 VAL HG21 H 8.857 -0.124 -3.669 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HG21 . . . . . . . . . c19602_2mgt 1 . 16 . 8544 . 2 1 13 VAL HG22 H 9.610 1.110 -4.668 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HG22 . . . . . . . . . c19602_2mgt 1 . 16 . 8545 . 2 1 13 VAL HG23 H 10.314 0.710 -3.095 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HG23 . . . . . . . . . c19602_2mgt 1 . 16 . 8546 . 2 1 13 VAL N N 7.004 0.362 -1.822 . . . 1.0 . . . . . . . . . . . . B . 12 VAL N . . . . . . . . . c19602_2mgt 1 . 16 . 8547 . 2 1 13 VAL O O 8.163 3.113 0.043 . . . 1.0 . . . . . . . . . . . . B . 12 VAL O . . . . . . . . . c19602_2mgt 1 . 16 . 8548 . 2 1 14 HIS C C 5.655 4.327 0.938 . . . 1.0 . . . . . . . . . . . . B . 13 HIS C . . . . . . . . . c19602_2mgt 1 . 16 . 8549 . 2 1 14 HIS CA C 5.717 4.325 -0.593 . . . 1.0 . . . . . . . . . . . . B . 13 HIS CA . . . . . . . . . c19602_2mgt 1 . 16 . 8550 . 2 1 14 HIS CB C 4.347 4.652 -1.202 . . . 1.0 . . . . . . . . . . . . B . 13 HIS CB . . . . . . . . . c19602_2mgt 1 . 16 . 8551 . 2 1 14 HIS CD2 C 4.174 7.157 -1.777 . . . 1.0 . . . . . . . . . . . . B . 13 HIS CD2 . . . . . . . . . c19602_2mgt 1 . 16 . 8552 . 2 1 14 HIS CE1 C 3.358 7.921 0.100 . . . 1.0 . . . . . . . . . . . . B . 13 HIS CE1 . . . . . . . . . c19602_2mgt 1 . 16 . 8553 . 2 1 14 HIS CG C 3.946 6.085 -0.956 . . . 1.0 . . . . . . . . . . . . B . 13 HIS CG . . . . . . . . . c19602_2mgt 1 . 16 . 8554 . 2 1 14 HIS H H 5.680 2.590 -1.825 . . . 1.0 . . . . . . . . . . . . B . 13 HIS H . . . . . . . . . c19602_2mgt 1 . 16 . 8555 . 2 1 14 HIS HA H 6.423 5.096 -0.903 . . . 1.0 . . . . . . . . . . . . B . 13 HIS HA . . . . . . . . . c19602_2mgt 1 . 16 . 8556 . 2 1 14 HIS HB2 H 4.390 4.482 -2.274 . . . 1.0 . . . . . . . . . . . . B . 13 HIS HB2 . . . . . . . . . c19602_2mgt 1 . 16 . 8557 . 2 1 14 HIS HB3 H 3.591 3.986 -0.781 . . . 1.0 . . . . . . . . . . . . B . 13 HIS HB3 . . . . . . . . . c19602_2mgt 1 . 16 . 8558 . 2 1 14 HIS HD1 H 3.190 6.056 1.036 . . . 1.0 . . . . . . . . . . . . B . 13 HIS HD1 . . . . . . . . . c19602_2mgt 1 . 16 . 8559 . 2 1 14 HIS HD2 H 4.642 7.131 -2.747 . . . 1.0 . . . . . . . . . . . . B . 13 HIS HD2 . . . . . . . . . c19602_2mgt 1 . 16 . 8560 . 2 1 14 HIS HE1 H 2.999 8.582 0.871 . . . 1.0 . . . . . . . . . . . . B . 13 HIS HE1 . . . . . . . . . c19602_2mgt 1 . 16 . 8561 . 2 1 14 HIS N N 6.231 3.081 -1.132 . . . 1.0 . . . . . . . . . . . . B . 13 HIS N . . . . . . . . . c19602_2mgt 1 . 16 . 8562 . 2 1 14 HIS ND1 N 3.421 6.589 0.209 . . . 1.0 . . . . . . . . . . . . B . 13 HIS ND1 . . . . . . . . . c19602_2mgt 1 . 16 . 8563 . 2 1 14 HIS NE2 N 3.781 8.317 -1.107 . . . 1.0 . . . . . . . . . . . . B . 13 HIS NE2 . . . . . . . . . c19602_2mgt 1 . 16 . 8564 . 2 1 14 HIS O O 5.715 5.407 1.513 . . . 1.0 . . . . . . . . . . . . B . 13 HIS O . . . . . . . . . c19602_2mgt 1 . 16 . 8565 . 2 1 15 HIS C C 6.246 1.782 3.615 . . . 1.0 . . . . . . . . . . . . B . 14 HIS C . . . . . . . . . c19602_2mgt 1 . 16 . 8566 . 2 1 15 HIS CA C 5.675 3.094 3.063 . . . 1.0 . . . . . . . . . . . . B . 14 HIS CA . . . . . . . . . c19602_2mgt 1 . 16 . 8567 . 2 1 15 HIS CB C 4.303 3.424 3.674 . . . 1.0 . . . . . . . . . . . . B . 14 HIS CB . . . . . . . . . c19602_2mgt 1 . 16 . 8568 . 2 1 15 HIS CD2 C 2.592 1.971 2.420 . . . 1.0 . . . . . . . . . . . . B . 14 HIS CD2 . . . . . . . . . c19602_2mgt 1 . 16 . 8569 . 2 1 15 HIS CE1 C 1.880 0.715 4.068 . . . 1.0 . . . . . . . . . . . . B . 14 HIS CE1 . . . . . . . . . c19602_2mgt 1 . 16 . 8570 . 2 1 15 HIS CG C 3.268 2.338 3.549 . . . 1.0 . . . . . . . . . . . . B . 14 HIS CG . . . . . . . . . c19602_2mgt 1 . 16 . 8571 . 2 1 15 HIS H H 5.603 2.294 1.082 . . . 1.0 . . . . . . . . . . . . B . 14 HIS H . . . . . . . . . c19602_2mgt 1 . 16 . 8572 . 2 1 15 HIS HA H 6.366 3.874 3.385 . . . 1.0 . . . . . . . . . . . . B . 14 HIS HA . . . . . . . . . c19602_2mgt 1 . 16 . 8573 . 2 1 15 HIS HB2 H 4.437 3.632 4.733 . . . 1.0 . . . . . . . . . . . . B . 14 HIS HB2 . . . . . . . . . c19602_2mgt 1 . 16 . 8574 . 2 1 15 HIS HB3 H 3.919 4.336 3.224 . . . 1.0 . . . . . . . . . . . . B . 14 HIS HB3 . . . . . . . . . c19602_2mgt 1 . 16 . 8575 . 2 1 15 HIS HD1 H 3.135 1.550 5.527 . . . 1.0 . . . . . . . . . . . . B . 14 HIS HD1 . . . . . . . . . c19602_2mgt 1 . 16 . 8576 . 2 1 15 HIS HD2 H 2.709 2.403 1.436 . . . 1.0 . . . . . . . . . . . . B . 14 HIS HD2 . . . . . . . . . c19602_2mgt 1 . 16 . 8577 . 2 1 15 HIS HE1 H 1.349 -0.034 4.637 . . . 1.0 . . . . . . . . . . . . B . 14 HIS HE1 . . . . . . . . . c19602_2mgt 1 . 16 . 8578 . 2 1 15 HIS N N 5.608 3.162 1.605 . . . 1.0 . . . . . . . . . . . . B . 14 HIS N . . . . . . . . . c19602_2mgt 1 . 16 . 8579 . 2 1 15 HIS ND1 N 2.807 1.542 4.571 . . . 1.0 . . . . . . . . . . . . B . 14 HIS ND1 . . . . . . . . . c19602_2mgt 1 . 16 . 8580 . 2 1 15 HIS NE2 N 1.715 0.939 2.757 . . . 1.0 . . . . . . . . . . . . B . 14 HIS NE2 . . . . . . . . . c19602_2mgt 1 . 16 . 8581 . 2 1 15 HIS O O 6.344 1.665 4.830 . . . 1.0 . . . . . . . . . . . . B . 14 HIS O . . . . . . . . . c19602_2mgt 1 . 16 . 8582 . 2 1 16 GLN C C 8.505 -0.787 2.608 . . . 1.0 . . . . . . . . . . . . B . 15 GLN C . . . . . . . . . c19602_2mgt 1 . 16 . 8583 . 2 1 16 GLN CA C 7.147 -0.482 3.224 . . . 1.0 . . . . . . . . . . . . B . 15 GLN CA . . . . . . . . . c19602_2mgt 1 . 16 . 8584 . 2 1 16 GLN CB C 6.179 -1.616 2.886 . . . 1.0 . . . . . . . . . . . . B . 15 GLN CB . . . . . . . . . c19602_2mgt 1 . 16 . 8585 . 2 1 16 GLN CD C 3.951 -2.684 3.423 . . . 1.0 . . . . . . . . . . . . B . 15 GLN CD . . . . . . . . . c19602_2mgt 1 . 16 . 8586 . 2 1 16 GLN CG C 4.766 -1.396 3.437 . . . 1.0 . . . . . . . . . . . . B . 15 GLN CG . . . . . . . . . c19602_2mgt 1 . 16 . 8587 . 2 1 16 GLN H H 6.563 0.938 1.789 . . . 1.0 . . . . . . . . . . . . B . 15 GLN H . . . . . . . . . c19602_2mgt 1 . 16 . 8588 . 2 1 16 GLN HA H 7.273 -0.457 4.301 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HA . . . . . . . . . c19602_2mgt 1 . 16 . 8589 . 2 1 16 GLN HB2 H 6.147 -1.747 1.808 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HB2 . . . . . . . . . c19602_2mgt 1 . 16 . 8590 . 2 1 16 GLN HB3 H 6.580 -2.532 3.311 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HB3 . . . . . . . . . c19602_2mgt 1 . 16 . 8591 . 2 1 16 GLN HE21 H 2.981 -2.174 5.138 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HE21 . . . . . . . . . c19602_2mgt 1 . 16 . 8592 . 2 1 16 GLN HE22 H 2.553 -3.728 4.454 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HE22 . . . . . . . . . c19602_2mgt 1 . 16 . 8593 . 2 1 16 GLN HG2 H 4.840 -1.035 4.461 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HG2 . . . . . . . . . c19602_2mgt 1 . 16 . 8594 . 2 1 16 GLN HG3 H 4.250 -0.641 2.844 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HG3 . . . . . . . . . c19602_2mgt 1 . 16 . 8595 . 2 1 16 GLN N N 6.632 0.808 2.783 . . . 1.0 . . . . . . . . . . . . B . 15 GLN N . . . . . . . . . c19602_2mgt 1 . 16 . 8596 . 2 1 16 GLN NE2 N 3.082 -2.869 4.413 . . . 1.0 . . . . . . . . . . . . B . 15 GLN NE2 . . . . . . . . . c19602_2mgt 1 . 16 . 8597 . 2 1 16 GLN O O 8.854 -0.261 1.556 . . . 1.0 . . . . . . . . . . . . B . 15 GLN O . . . . . . . . . c19602_2mgt 1 . 16 . 8598 . 2 1 16 GLN OE1 O 4.108 -3.522 2.541 . . . 1.0 . . . . . . . . . . . . B . 15 GLN OE1 . . . . . . . . . c19602_2mgt 1 . 16 . 8599 . 2 1 17 LYS C C 10.874 -2.972 1.973 . . . 1.0 . . . . . . . . . . . . B . 16 LYS C . . . . . . . . . c19602_2mgt 1 . 16 . 8600 . 2 1 17 LYS CA C 10.651 -1.974 3.113 . . . 1.0 . . . . . . . . . . . . B . 16 LYS CA . . . . . . . . . c19602_2mgt 1 . 16 . 8601 . 2 1 17 LYS CB C 11.169 -2.533 4.448 . . . 1.0 . . . . . . . . . . . . B . 16 LYS CB . . . . . . . . . c19602_2mgt 1 . 16 . 8602 . 2 1 17 LYS CD C 11.168 -2.013 6.957 . . . 1.0 . . . . . . . . . . . . B . 16 LYS CD . . . . . . . . . c19602_2mgt 1 . 16 . 8603 . 2 1 17 LYS CE C 12.245 -3.049 7.250 . . . 1.0 . . . . . . . . . . . . B . 16 LYS CE . . . . . . . . . c19602_2mgt 1 . 16 . 8604 . 2 1 17 LYS CG C 11.239 -1.446 5.536 . . . 1.0 . . . . . . . . . . . . B . 16 LYS CG . . . . . . . . . c19602_2mgt 1 . 16 . 8605 . 2 1 17 LYS H H 8.815 -2.080 4.109 . . . 1.0 . . . . . . . . . . . . B . 16 LYS H . . . . . . . . . c19602_2mgt 1 . 16 . 8606 . 2 1 17 LYS HA H 11.188 -1.055 2.883 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HA . . . . . . . . . c19602_2mgt 1 . 16 . 8607 . 2 1 17 LYS HB2 H 10.510 -3.342 4.771 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HB2 . . . . . . . . . c19602_2mgt 1 . 16 . 8608 . 2 1 17 LYS HB3 H 12.165 -2.947 4.303 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HB3 . . . . . . . . . c19602_2mgt 1 . 16 . 8609 . 2 1 17 LYS HD2 H 11.287 -1.193 7.661 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HD2 . . . . . . . . . c19602_2mgt 1 . 16 . 8610 . 2 1 17 LYS HD3 H 10.189 -2.463 7.117 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HD3 . . . . . . . . . c19602_2mgt 1 . 16 . 8611 . 2 1 17 LYS HE2 H 12.107 -3.916 6.606 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HE2 . . . . . . . . . c19602_2mgt 1 . 16 . 8612 . 2 1 17 LYS HE3 H 13.225 -2.616 7.063 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HE3 . . . . . . . . . c19602_2mgt 1 . 16 . 8613 . 2 1 17 LYS HG2 H 12.163 -0.880 5.417 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HG2 . . . . . . . . . c19602_2mgt 1 . 16 . 8614 . 2 1 17 LYS HG3 H 10.408 -0.751 5.427 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HG3 . . . . . . . . . c19602_2mgt 1 . 16 . 8615 . 2 1 17 LYS HZ1 H 11.287 -3.936 8.823 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HZ1 . . . . . . . . . c19602_2mgt 1 . 16 . 8616 . 2 1 17 LYS HZ2 H 12.924 -4.095 8.870 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HZ2 . . . . . . . . . c19602_2mgt 1 . 16 . 8617 . 2 1 17 LYS HZ3 H 12.226 -2.657 9.255 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HZ3 . . . . . . . . . c19602_2mgt 1 . 16 . 8618 . 2 1 17 LYS N N 9.243 -1.660 3.297 . . . 1.0 . . . . . . . . . . . . B . 16 LYS N . . . . . . . . . c19602_2mgt 1 . 16 . 8619 . 2 1 17 LYS NZ N 12.166 -3.466 8.653 . . . 1.0 . . . . . . . . . . . . B . 16 LYS NZ . . . . . . . . . c19602_2mgt 1 . 16 . 8620 . 2 1 17 LYS O O 9.982 -3.726 1.609 . . . 1.0 . . . . . . . . . . . . B . 16 LYS O . . . . . . . . . c19602_2mgt 1 . 16 . 8621 . 2 1 18 NH2 HN1 H 12.260 -3.658 0.657 . . . 1.0 . . . . . . . . . . . . B . 17 NH2 HN1 . . . . . . . . . c19602_2mgt 1 . 16 . 8622 . 2 1 18 NH2 HN2 H 12.802 -2.379 1.721 . . . 1.0 . . . . . . . . . . . . B . 17 NH2 HN2 . . . . . . . . . c19602_2mgt 1 . 16 . 8623 . 2 1 18 NH2 N N 12.078 -3.007 1.406 . . . 1.0 . . . . . . . . . . . . B . 17 NH2 N . . . . . . . . . c19602_2mgt 1 . 16 . 8624 . 3 2 1 ZN ZN Zn 0.556 -0.306 1.557 . . . 1.0 . . . . . . . . . . . . A . 101 ZN ZN . . . . . . . . . c19602_2mgt 1 . 17 . 8625 . 1 1 1 ACE C C -9.933 -6.284 -1.464 . . . 1.0 . . . . . . . . . . . . A . 0 ACE C . . . . . . . . . c19602_2mgt 1 . 17 . 8626 . 1 1 1 ACE CH3 C -8.682 -5.422 -1.515 . . . 1.0 . . . . . . . . . . . . A . 0 ACE CH3 . . . . . . . . . c19602_2mgt 1 . 17 . 8627 . 1 1 1 ACE H1 H -8.368 -5.190 -0.498 . . . 1.0 . . . . . . . . . . . . A . 0 ACE H1 . . . . . . . . . c19602_2mgt 1 . 17 . 8628 . 1 1 1 ACE H2 H -7.883 -5.957 -2.028 . . . 1.0 . . . . . . . . . . . . A . 0 ACE H2 . . . . . . . . . c19602_2mgt 1 . 17 . 8629 . 1 1 1 ACE H3 H -8.894 -4.497 -2.053 . . . 1.0 . . . . . . . . . . . . A . 0 ACE H3 . . . . . . . . . c19602_2mgt 1 . 17 . 8630 . 1 1 1 ACE O O -9.843 -7.496 -1.611 . . . 1.0 . . . . . . . . . . . . A . 0 ACE O . . . . . . . . . c19602_2mgt 1 . 17 . 8631 . 1 1 2 ASP C C -13.498 -5.268 -1.054 . . . 1.0 . . . . . . . . . . . . A . 1 ASP C . . . . . . . . . c19602_2mgt 1 . 17 . 8632 . 1 1 2 ASP CA C -12.398 -6.325 -1.159 . . . 1.0 . . . . . . . . . . . . A . 1 ASP CA . . . . . . . . . c19602_2mgt 1 . 17 . 8633 . 1 1 2 ASP CB C -12.440 -7.280 0.052 . . . 1.0 . . . . . . . . . . . . A . 1 ASP CB . . . . . . . . . c19602_2mgt 1 . 17 . 8634 . 1 1 2 ASP CG C -13.157 -8.581 -0.261 . . . 1.0 . . . . . . . . . . . . A . 1 ASP CG . . . . . . . . . c19602_2mgt 1 . 17 . 8635 . 1 1 2 ASP H H -11.098 -4.657 -1.159 . . . 1.0 . . . . . . . . . . . . A . 1 ASP H . . . . . . . . . c19602_2mgt 1 . 17 . 8636 . 1 1 2 ASP HA H -12.551 -6.899 -2.072 . . . 1.0 . . . . . . . . . . . . A . 1 ASP HA . . . . . . . . . c19602_2mgt 1 . 17 . 8637 . 1 1 2 ASP HB2 H -11.434 -7.538 0.377 . . . 1.0 . . . . . . . . . . . . A . 1 ASP HB2 . . . . . . . . . c19602_2mgt 1 . 17 . 8638 . 1 1 2 ASP HB3 H -12.931 -6.791 0.890 . . . 1.0 . . . . . . . . . . . . A . 1 ASP HB3 . . . . . . . . . c19602_2mgt 1 . 17 . 8639 . 1 1 2 ASP N N -11.097 -5.661 -1.259 . . . 1.0 . . . . . . . . . . . . A . 1 ASP N . . . . . . . . . c19602_2mgt 1 . 17 . 8640 . 1 1 2 ASP O O -13.209 -4.164 -0.611 . . . 1.0 . . . . . . . . . . . . A . 1 ASP O . . . . . . . . . c19602_2mgt 1 . 17 . 8641 . 1 1 2 ASP OD1 O -14.140 -8.534 -1.033 . . . 1.0 . . . . . . . . . . . . A . 1 ASP OD1 . . . . . . . . . c19602_2mgt 1 . 17 . 8642 . 1 1 2 ASP OD2 O -12.720 -9.618 0.253 . . . 1.0 . . . . . . . . . . . . A . 1 ASP OD2 . . . . . . . . . c19602_2mgt 1 . 17 . 8643 . 1 1 3 ALA C C -16.080 -4.034 0.009 . . . 1.0 . . . . . . . . . . . . A . 2 ALA C . . . . . . . . . c19602_2mgt 1 . 17 . 8644 . 1 1 3 ALA CA C -15.861 -4.629 -1.387 . . . 1.0 . . . . . . . . . . . . A . 2 ALA CA . . . . . . . . . c19602_2mgt 1 . 17 . 8645 . 1 1 3 ALA CB C -17.140 -5.308 -1.880 . . . 1.0 . . . . . . . . . . . . A . 2 ALA CB . . . . . . . . . c19602_2mgt 1 . 17 . 8646 . 1 1 3 ALA H H -14.948 -6.517 -1.753 . . . 1.0 . . . . . . . . . . . . A . 2 ALA H . . . . . . . . . c19602_2mgt 1 . 17 . 8647 . 1 1 3 ALA HA H -15.632 -3.813 -2.070 . . . 1.0 . . . . . . . . . . . . A . 2 ALA HA . . . . . . . . . c19602_2mgt 1 . 17 . 8648 . 1 1 3 ALA HB1 H -17.025 -5.594 -2.924 . . . 1.0 . . . . . . . . . . . . A . 2 ALA HB1 . . . . . . . . . c19602_2mgt 1 . 17 . 8649 . 1 1 3 ALA HB2 H -17.355 -6.192 -1.283 . . . 1.0 . . . . . . . . . . . . A . 2 ALA HB2 . . . . . . . . . c19602_2mgt 1 . 17 . 8650 . 1 1 3 ALA HB3 H -17.978 -4.620 -1.786 . . . 1.0 . . . . . . . . . . . . A . 2 ALA HB3 . . . . . . . . . c19602_2mgt 1 . 17 . 8651 . 1 1 3 ALA N N -14.751 -5.585 -1.417 . . . 1.0 . . . . . . . . . . . . A . 2 ALA N . . . . . . . . . c19602_2mgt 1 . 17 . 8652 . 1 1 3 ALA O O -16.258 -2.824 0.135 . . . 1.0 . . . . . . . . . . . . A . 2 ALA O . . . . . . . . . c19602_2mgt 1 . 17 . 8653 . 1 1 4 GLU C C -14.979 -3.655 2.996 . . . 1.0 . . . . . . . . . . . . A . 3 GLU C . . . . . . . . . c19602_2mgt 1 . 17 . 8654 . 1 1 4 GLU CA C -16.131 -4.503 2.453 . . . 1.0 . . . . . . . . . . . . A . 3 GLU CA . . . . . . . . . c19602_2mgt 1 . 17 . 8655 . 1 1 4 GLU CB C -16.303 -5.774 3.290 . . . 1.0 . . . . . . . . . . . . A . 3 GLU CB . . . . . . . . . c19602_2mgt 1 . 17 . 8656 . 1 1 4 GLU CD C -15.402 -8.064 3.740 . . . 1.0 . . . . . . . . . . . . A . 3 GLU CD . . . . . . . . . c19602_2mgt 1 . 17 . 8657 . 1 1 4 GLU CG C -15.064 -6.675 3.237 . . . 1.0 . . . . . . . . . . . . A . 3 GLU CG . . . . . . . . . c19602_2mgt 1 . 17 . 8658 . 1 1 4 GLU H H -15.852 -5.855 0.850 . . . 1.0 . . . . . . . . . . . . A . 3 GLU H . . . . . . . . . c19602_2mgt 1 . 17 . 8659 . 1 1 4 GLU HA H -17.030 -3.907 2.550 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HA . . . . . . . . . c19602_2mgt 1 . 17 . 8660 . 1 1 4 GLU HB2 H -16.502 -5.504 4.328 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HB2 . . . . . . . . . c19602_2mgt 1 . 17 . 8661 . 1 1 4 GLU HB3 H -17.164 -6.322 2.908 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HB3 . . . . . . . . . c19602_2mgt 1 . 17 . 8662 . 1 1 4 GLU HG2 H -14.713 -6.758 2.211 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HG2 . . . . . . . . . c19602_2mgt 1 . 17 . 8663 . 1 1 4 GLU HG3 H -14.268 -6.247 3.846 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HG3 . . . . . . . . . c19602_2mgt 1 . 17 . 8664 . 1 1 4 GLU N N -16.004 -4.877 1.046 . . . 1.0 . . . . . . . . . . . . A . 3 GLU N . . . . . . . . . c19602_2mgt 1 . 17 . 8665 . 1 1 4 GLU O O -15.092 -3.148 4.106 . . . 1.0 . . . . . . . . . . . . A . 3 GLU O . . . . . . . . . c19602_2mgt 1 . 17 . 8666 . 1 1 4 GLU OE1 O -15.865 -8.879 2.917 . . . 1.0 . . . . . . . . . . . . A . 3 GLU OE1 . . . . . . . . . c19602_2mgt 1 . 17 . 8667 . 1 1 4 GLU OE2 O -15.221 -8.302 4.943 . . . 1.0 . . . . . . . . . . . . A . 3 GLU OE2 . . . . . . . . . c19602_2mgt 1 . 17 . 8668 . 1 1 5 PHE C C -12.741 -1.389 1.571 . . . 1.0 . . . . . . . . . . . . A . 4 PHE C . . . . . . . . . c19602_2mgt 1 . 17 . 8669 . 1 1 5 PHE CA C -12.809 -2.556 2.549 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CA . . . . . . . . . c19602_2mgt 1 . 17 . 8670 . 1 1 5 PHE CB C -11.486 -3.303 2.524 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CB . . . . . . . . . c19602_2mgt 1 . 17 . 8671 . 1 1 5 PHE CD1 C -11.878 -4.512 4.709 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CD1 . . . . . . . . . c19602_2mgt 1 . 17 . 8672 . 1 1 5 PHE CD2 C -11.080 -5.764 2.781 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CD2 . . . . . . . . . c19602_2mgt 1 . 17 . 8673 . 1 1 5 PHE CE1 C -11.867 -5.688 5.475 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CE1 . . . . . . . . . c19602_2mgt 1 . 17 . 8674 . 1 1 5 PHE CE2 C -11.093 -6.943 3.535 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CE2 . . . . . . . . . c19602_2mgt 1 . 17 . 8675 . 1 1 5 PHE CG C -11.466 -4.551 3.367 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CG . . . . . . . . . c19602_2mgt 1 . 17 . 8676 . 1 1 5 PHE CZ C -11.476 -6.903 4.884 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CZ . . . . . . . . . c19602_2mgt 1 . 17 . 8677 . 1 1 5 PHE H H -13.820 -4.017 1.383 . . . 1.0 . . . . . . . . . . . . A . 4 PHE H . . . . . . . . . c19602_2mgt 1 . 17 . 8678 . 1 1 5 PHE HA H -12.954 -2.141 3.544 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HA . . . . . . . . . c19602_2mgt 1 . 17 . 8679 . 1 1 5 PHE HB2 H -11.268 -3.572 1.489 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HB2 . . . . . . . . . c19602_2mgt 1 . 17 . 8680 . 1 1 5 PHE HB3 H -10.709 -2.632 2.885 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HB3 . . . . . . . . . c19602_2mgt 1 . 17 . 8681 . 1 1 5 PHE HD1 H -12.209 -3.579 5.144 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HD1 . . . . . . . . . c19602_2mgt 1 . 17 . 8682 . 1 1 5 PHE HD2 H -10.786 -5.783 1.744 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HD2 . . . . . . . . . c19602_2mgt 1 . 17 . 8683 . 1 1 5 PHE HE1 H -12.174 -5.655 6.509 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HE1 . . . . . . . . . c19602_2mgt 1 . 17 . 8684 . 1 1 5 PHE HE2 H -10.812 -7.876 3.079 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HE2 . . . . . . . . . c19602_2mgt 1 . 17 . 8685 . 1 1 5 PHE HZ H -11.473 -7.815 5.452 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HZ . . . . . . . . . c19602_2mgt 1 . 17 . 8686 . 1 1 5 PHE N N -13.891 -3.487 2.237 . . . 1.0 . . . . . . . . . . . . A . 4 PHE N . . . . . . . . . c19602_2mgt 1 . 17 . 8687 . 1 1 5 PHE O O -12.236 -0.332 1.944 . . . 1.0 . . . . . . . . . . . . A . 4 PHE O . . . . . . . . . c19602_2mgt 1 . 17 . 8688 . 1 1 6 ARG C C -14.829 0.285 -0.128 . . . 1.0 . . . . . . . . . . . . A . 5 ARG C . . . . . . . . . c19602_2mgt 1 . 17 . 8689 . 1 1 6 ARG CA C -13.594 -0.498 -0.591 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CA . . . . . . . . . c19602_2mgt 1 . 17 . 8690 . 1 1 6 ARG CB C -13.764 -1.091 -1.996 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CB . . . . . . . . . c19602_2mgt 1 . 17 . 8691 . 1 1 6 ARG CD C -11.307 -0.629 -2.716 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CD . . . . . . . . . c19602_2mgt 1 . 17 . 8692 . 1 1 6 ARG CG C -12.474 -1.613 -2.653 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CG . . . . . . . . . c19602_2mgt 1 . 17 . 8693 . 1 1 6 ARG CZ C -11.071 1.477 -4.066 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CZ . . . . . . . . . c19602_2mgt 1 . 17 . 8694 . 1 1 6 ARG H H -13.697 -2.456 0.150 . . . 1.0 . . . . . . . . . . . . A . 5 ARG H . . . . . . . . . c19602_2mgt 1 . 17 . 8695 . 1 1 6 ARG HA H -12.753 0.189 -0.605 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HA . . . . . . . . . c19602_2mgt 1 . 17 . 8696 . 1 1 6 ARG HB2 H -14.494 -1.896 -1.951 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HB2 . . . . . . . . . c19602_2mgt 1 . 17 . 8697 . 1 1 6 ARG HB3 H -14.170 -0.322 -2.650 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HB3 . . . . . . . . . c19602_2mgt 1 . 17 . 8698 . 1 1 6 ARG HD2 H -10.885 -0.505 -1.724 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HD2 . . . . . . . . . c19602_2mgt 1 . 17 . 8699 . 1 1 6 ARG HD3 H -10.546 -1.058 -3.366 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HD3 . . . . . . . . . c19602_2mgt 1 . 17 . 8700 . 1 1 6 ARG HE H -12.624 1.010 -2.882 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HE . . . . . . . . . c19602_2mgt 1 . 17 . 8701 . 1 1 6 ARG HG2 H -12.133 -2.511 -2.146 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HG2 . . . . . . . . . c19602_2mgt 1 . 17 . 8702 . 1 1 6 ARG HG3 H -12.715 -1.871 -3.679 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HG3 . . . . . . . . . c19602_2mgt 1 . 17 . 8703 . 1 1 6 ARG HH11 H -9.447 0.277 -4.306 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH11 . . . . . . . . . c19602_2mgt 1 . 17 . 8704 . 1 1 6 ARG HH12 H -9.417 1.772 -5.211 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH12 . . . . . . . . . c19602_2mgt 1 . 17 . 8705 . 1 1 6 ARG HH21 H -12.518 2.903 -4.034 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH21 . . . . . . . . . c19602_2mgt 1 . 17 . 8706 . 1 1 6 ARG HH22 H -11.143 3.253 -5.057 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH22 . . . . . . . . . c19602_2mgt 1 . 17 . 8707 . 1 1 6 ARG N N -13.307 -1.552 0.368 . . . 1.0 . . . . . . . . . . . . A . 5 ARG N . . . . . . . . . c19602_2mgt 1 . 17 . 8708 . 1 1 6 ARG NE N -11.733 0.680 -3.222 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NE . . . . . . . . . c19602_2mgt 1 . 17 . 8709 . 1 1 6 ARG NH1 N -9.883 1.148 -4.570 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NH1 . . . . . . . . . c19602_2mgt 1 . 17 . 8710 . 1 1 6 ARG NH2 N -11.619 2.641 -4.410 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NH2 . . . . . . . . . c19602_2mgt 1 . 17 . 8711 . 1 1 6 ARG O O -15.744 0.551 -0.899 . . . 1.0 . . . . . . . . . . . . A . 5 ARG O . . . . . . . . . c19602_2mgt 1 . 17 . 8712 . 1 1 7 ARG C C -15.591 2.936 1.410 . . . 1.0 . . . . . . . . . . . . A . 6 ARG C . . . . . . . . . c19602_2mgt 1 . 17 . 8713 . 1 1 7 ARG CA C -15.784 1.481 1.848 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CA . . . . . . . . . c19602_2mgt 1 . 17 . 8714 . 1 1 7 ARG CB C -15.562 1.297 3.357 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CB . . . . . . . . . c19602_2mgt 1 . 17 . 8715 . 1 1 7 ARG CD C -17.106 -0.731 3.766 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CD . . . . . . . . . c19602_2mgt 1 . 17 . 8716 . 1 1 7 ARG CG C -15.698 -0.145 3.868 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CG . . . . . . . . . c19602_2mgt 1 . 17 . 8717 . 1 1 7 ARG CZ C -18.687 -1.182 1.899 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CZ . . . . . . . . . c19602_2mgt 1 . 17 . 8718 . 1 1 7 ARG H H -14.077 0.301 1.733 . . . 1.0 . . . . . . . . . . . . A . 6 ARG H . . . . . . . . . c19602_2mgt 1 . 17 . 8719 . 1 1 7 ARG HA H -16.792 1.174 1.595 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HA . . . . . . . . . c19602_2mgt 1 . 17 . 8720 . 1 1 7 ARG HB2 H -14.553 1.628 3.588 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HB2 . . . . . . . . . c19602_2mgt 1 . 17 . 8721 . 1 1 7 ARG HB3 H -16.256 1.918 3.908 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HB3 . . . . . . . . . c19602_2mgt 1 . 17 . 8722 . 1 1 7 ARG HD2 H -17.163 -1.612 4.404 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HD2 . . . . . . . . . c19602_2mgt 1 . 17 . 8723 . 1 1 7 ARG HD3 H -17.820 0.009 4.126 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HD3 . . . . . . . . . c19602_2mgt 1 . 17 . 8724 . 1 1 7 ARG HE H -16.681 -1.426 1.803 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HE . . . . . . . . . c19602_2mgt 1 . 17 . 8725 . 1 1 7 ARG HG2 H -14.997 -0.776 3.333 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HG2 . . . . . . . . . c19602_2mgt 1 . 17 . 8726 . 1 1 7 ARG HG3 H -15.421 -0.164 4.921 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HG3 . . . . . . . . . c19602_2mgt 1 . 17 . 8727 . 1 1 7 ARG HH11 H -19.647 -0.739 3.637 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH11 . . . . . . . . . c19602_2mgt 1 . 17 . 8728 . 1 1 7 ARG HH12 H -20.682 -0.989 2.252 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH12 . . . . . . . . . c19602_2mgt 1 . 17 . 8729 . 1 1 7 ARG HH21 H -18.073 -1.705 0.031 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH21 . . . . . . . . . c19602_2mgt 1 . 17 . 8730 . 1 1 7 ARG HH22 H -19.802 -1.542 0.242 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH22 . . . . . . . . . c19602_2mgt 1 . 17 . 8731 . 1 1 7 ARG N N -14.841 0.628 1.162 . . . 1.0 . . . . . . . . . . . . A . 6 ARG N . . . . . . . . . c19602_2mgt 1 . 17 . 8732 . 1 1 7 ARG NE N -17.446 -1.146 2.401 . . . 1.0 . . . . . . . . . . . . A . 6 ARG NE . . . . . . . . . c19602_2mgt 1 . 17 . 8733 . 1 1 7 ARG NH1 N -19.757 -0.925 2.652 . . . 1.0 . . . . . . . . . . . . A . 6 ARG NH1 . . . . . . . . . c19602_2mgt 1 . 17 . 8734 . 1 1 7 ARG NH2 N -18.866 -1.489 0.617 . . . 1.0 . . . . . . . . . . . . A . 6 ARG NH2 . . . . . . . . . c19602_2mgt 1 . 17 . 8735 . 1 1 7 ARG O O -14.746 3.244 0.571 . . . 1.0 . . . . . . . . . . . . A . 6 ARG O . . . . . . . . . c19602_2mgt 1 . 17 . 8736 . 1 1 8 ASP C C -15.278 5.992 1.358 . . . 1.0 . . . . . . . . . . . . A . 7 ASP C . . . . . . . . . c19602_2mgt 1 . 17 . 8737 . 1 1 8 ASP CA C -16.577 5.176 1.458 . . . 1.0 . . . . . . . . . . . . A . 7 ASP CA . . . . . . . . . c19602_2mgt 1 . 17 . 8738 . 1 1 8 ASP CB C -17.608 5.877 2.343 . . . 1.0 . . . . . . . . . . . . A . 7 ASP CB . . . . . . . . . c19602_2mgt 1 . 17 . 8739 . 1 1 8 ASP CG C -17.926 7.249 1.793 . . . 1.0 . . . . . . . . . . . . A . 7 ASP CG . . . . . . . . . c19602_2mgt 1 . 17 . 8740 . 1 1 8 ASP H H -17.078 3.515 2.648 . . . 1.0 . . . . . . . . . . . . A . 7 ASP H . . . . . . . . . c19602_2mgt 1 . 17 . 8741 . 1 1 8 ASP HA H -16.996 5.086 0.458 . . . 1.0 . . . . . . . . . . . . A . 7 ASP HA . . . . . . . . . c19602_2mgt 1 . 17 . 8742 . 1 1 8 ASP HB2 H -18.524 5.288 2.376 . . . 1.0 . . . . . . . . . . . . A . 7 ASP HB2 . . . . . . . . . c19602_2mgt 1 . 17 . 8743 . 1 1 8 ASP HB3 H -17.221 5.983 3.357 . . . 1.0 . . . . . . . . . . . . A . 7 ASP HB3 . . . . . . . . . c19602_2mgt 1 . 17 . 8744 . 1 1 8 ASP N N -16.401 3.832 1.968 . . . 1.0 . . . . . . . . . . . . A . 7 ASP N . . . . . . . . . c19602_2mgt 1 . 17 . 8745 . 1 1 8 ASP O O -15.064 6.636 0.337 . . . 1.0 . . . . . . . . . . . . A . 7 ASP O . . . . . . . . . c19602_2mgt 1 . 17 . 8746 . 1 1 8 ASP OD1 O -17.077 8.138 1.994 . . . 1.0 . . . . . . . . . . . . A . 7 ASP OD1 . . . . . . . . . c19602_2mgt 1 . 17 . 8747 . 1 1 8 ASP OD2 O -18.965 7.412 1.151 . . . 1.0 . . . . . . . . . . . . A . 7 ASP OD2 . . . . . . . . . c19602_2mgt 1 . 17 . 8748 . 1 1 9 SER C C -12.157 6.303 3.297 . . . 1.0 . . . . . . . . . . . . A . 8 SER C . . . . . . . . . c19602_2mgt 1 . 17 . 8749 . 1 1 9 SER CA C -13.336 6.933 2.568 . . . 1.0 . . . . . . . . . . . . A . 8 SER CA . . . . . . . . . c19602_2mgt 1 . 17 . 8750 . 1 1 9 SER CB C -13.821 8.116 3.401 . . . 1.0 . . . . . . . . . . . . A . 8 SER CB . . . . . . . . . c19602_2mgt 1 . 17 . 8751 . 1 1 9 SER H H -14.665 5.441 3.205 . . . 1.0 . . . . . . . . . . . . A . 8 SER H . . . . . . . . . c19602_2mgt 1 . 17 . 8752 . 1 1 9 SER HA H -13.003 7.286 1.596 . . . 1.0 . . . . . . . . . . . . A . 8 SER HA . . . . . . . . . c19602_2mgt 1 . 17 . 8753 . 1 1 9 SER HB2 H -14.386 7.762 4.263 . . . 1.0 . . . . . . . . . . . . A . 8 SER HB2 . . . . . . . . . c19602_2mgt 1 . 17 . 8754 . 1 1 9 SER HB3 H -12.964 8.693 3.747 . . . 1.0 . . . . . . . . . . . . A . 8 SER HB3 . . . . . . . . . c19602_2mgt 1 . 17 . 8755 . 1 1 9 SER HG H -15.449 8.480 2.407 . . . 1.0 . . . . . . . . . . . . A . 8 SER HG . . . . . . . . . c19602_2mgt 1 . 17 . 8756 . 1 1 9 SER N N -14.437 5.994 2.398 . . . 1.0 . . . . . . . . . . . . A . 8 SER N . . . . . . . . . c19602_2mgt 1 . 17 . 8757 . 1 1 9 SER O O -12.342 5.430 4.135 . . . 1.0 . . . . . . . . . . . . A . 8 SER O . . . . . . . . . c19602_2mgt 1 . 17 . 8758 . 1 1 9 SER OG O -14.630 8.946 2.615 . . . 1.0 . . . . . . . . . . . . A . 8 SER OG . . . . . . . . . c19602_2mgt 1 . 17 . 8759 . 1 1 10 GLY C C -8.586 6.987 2.803 . . . 1.0 . . . . . . . . . . . . A . 9 GLY C . . . . . . . . . c19602_2mgt 1 . 17 . 8760 . 1 1 10 GLY CA C -9.711 6.403 3.647 . . . 1.0 . . . . . . . . . . . . A . 9 GLY CA . . . . . . . . . c19602_2mgt 1 . 17 . 8761 . 1 1 10 GLY H H -10.847 7.449 2.249 . . . 1.0 . . . . . . . . . . . . A . 9 GLY H . . . . . . . . . c19602_2mgt 1 . 17 . 8762 . 1 1 10 GLY HA2 H -9.658 6.796 4.657 . . . 1.0 . . . . . . . . . . . . A . 9 GLY HA2 . . . . . . . . . c19602_2mgt 1 . 17 . 8763 . 1 1 10 GLY HA3 H -9.668 5.324 3.718 . . . 1.0 . . . . . . . . . . . . A . 9 GLY HA3 . . . . . . . . . c19602_2mgt 1 . 17 . 8764 . 1 1 10 GLY N N -10.951 6.802 3.020 . . . 1.0 . . . . . . . . . . . . A . 9 GLY N . . . . . . . . . c19602_2mgt 1 . 17 . 8765 . 1 1 10 GLY O O -8.535 8.197 2.625 . . . 1.0 . . . . . . . . . . . . A . 9 GLY O . . . . . . . . . c19602_2mgt 1 . 17 . 8766 . 1 1 11 TYR C C -6.159 4.378 1.768 . . . 1.0 . . . . . . . . . . . . A . 10 TYR C . . . . . . . . . c19602_2mgt 1 . 17 . 8767 . 1 1 11 TYR CA C -7.472 4.777 2.419 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CA . . . . . . . . . c19602_2mgt 1 . 17 . 8768 . 1 1 11 TYR CB C -8.590 3.962 1.752 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CB . . . . . . . . . c19602_2mgt 1 . 17 . 8769 . 1 1 11 TYR CD1 C -8.573 2.171 3.552 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CD1 . . . . . . . . . c19602_2mgt 1 . 17 . 8770 . 1 1 11 TYR CD2 C -10.699 3.034 2.746 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CD2 . . . . . . . . . c19602_2mgt 1 . 17 . 8771 . 1 1 11 TYR CE1 C -9.245 1.343 4.459 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CE1 . . . . . . . . . c19602_2mgt 1 . 17 . 8772 . 1 1 11 TYR CE2 C -11.379 2.183 3.626 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CE2 . . . . . . . . . c19602_2mgt 1 . 17 . 8773 . 1 1 11 TYR CG C -9.299 3.026 2.700 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CG . . . . . . . . . c19602_2mgt 1 . 17 . 8774 . 1 1 11 TYR CZ C -10.655 1.333 4.490 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CZ . . . . . . . . . c19602_2mgt 1 . 17 . 8775 . 1 1 11 TYR H H -7.094 6.606 1.536 . . . 1.0 . . . . . . . . . . . . A . 10 TYR H . . . . . . . . . c19602_2mgt 1 . 17 . 8776 . 1 1 11 TYR HA H -7.427 4.557 3.484 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HA . . . . . . . . . c19602_2mgt 1 . 17 . 8777 . 1 1 11 TYR HB2 H -9.319 4.629 1.295 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HB2 . . . . . . . . . c19602_2mgt 1 . 17 . 8778 . 1 1 11 TYR HB3 H -8.173 3.378 0.934 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HB3 . . . . . . . . . c19602_2mgt 1 . 17 . 8779 . 1 1 11 TYR HD1 H -7.499 2.158 3.532 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HD1 . . . . . . . . . c19602_2mgt 1 . 17 . 8780 . 1 1 11 TYR HD2 H -11.252 3.715 2.117 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HD2 . . . . . . . . . c19602_2mgt 1 . 17 . 8781 . 1 1 11 TYR HE1 H -8.676 0.740 5.143 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HE1 . . . . . . . . . c19602_2mgt 1 . 17 . 8782 . 1 1 11 TYR HE2 H -12.453 2.213 3.661 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HE2 . . . . . . . . . c19602_2mgt 1 . 17 . 8783 . 1 1 11 TYR HH H -12.268 0.648 5.339 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HH . . . . . . . . . c19602_2mgt 1 . 17 . 8784 . 1 1 11 TYR N N -7.679 6.195 2.238 . . . 1.0 . . . . . . . . . . . . A . 10 TYR N . . . . . . . . . c19602_2mgt 1 . 17 . 8785 . 1 1 11 TYR O O -5.750 4.973 0.777 . . . 1.0 . . . . . . . . . . . . A . 10 TYR O . . . . . . . . . c19602_2mgt 1 . 17 . 8786 . 1 1 11 TYR OH O -11.314 0.541 5.380 . . . 1.0 . . . . . . . . . . . . A . 10 TYR OH . . . . . . . . . c19602_2mgt 1 . 17 . 8787 . 1 1 12 GLU C C -5.391 0.916 1.831 . . . 1.0 . . . . . . . . . . . . A . 11 GLU C . . . . . . . . . c19602_2mgt 1 . 17 . 8788 . 1 1 12 GLU CA C -4.897 2.316 1.429 . . . 1.0 . . . . . . . . . . . . A . 11 GLU CA . . . . . . . . . c19602_2mgt 1 . 17 . 8789 . 1 1 12 GLU CB C -3.395 2.505 1.609 . . . 1.0 . . . . . . . . . . . . A . 11 GLU CB . . . . . . . . . c19602_2mgt 1 . 17 . 8790 . 1 1 12 GLU CD C -1.241 1.480 0.796 . . . 1.0 . . . . . . . . . . . . A . 11 GLU CD . . . . . . . . . c19602_2mgt 1 . 17 . 8791 . 1 1 12 GLU CG C -2.675 1.820 0.448 . . . 1.0 . . . . . . . . . . . . A . 11 GLU CG . . . . . . . . . c19602_2mgt 1 . 17 . 8792 . 1 1 12 GLU H H -5.933 2.912 3.131 . . . 1.0 . . . . . . . . . . . . A . 11 GLU H . . . . . . . . . c19602_2mgt 1 . 17 . 8793 . 1 1 12 GLU HA H -5.142 2.506 0.384 . . . 1.0 . . . . . . . . . . . . A . 11 GLU HA . . . . . . . . . c19602_2mgt 1 . 17 . 8794 . 1 1 12 GLU HB2 H -3.154 3.568 1.606 . . . 1.0 . . . . . . . . . . . . A . 11 GLU HB2 . . . . . . . . . c19602_2mgt 1 . 17 . 8795 . 1 1 12 GLU HB3 H -3.088 2.084 2.565 . . . 1.0 . . . . . . . . . . . . A . 11 GLU HB3 . . . . . . . . . c19602_2mgt 1 . 17 . 8796 . 1 1 12 GLU HG2 H -3.190 0.892 0.205 . . . 1.0 . . . . . . . . . . . . A . 11 GLU HG2 . . . . . . . . . c19602_2mgt 1 . 17 . 8797 . 1 1 12 GLU HG3 H -2.694 2.464 -0.431 . . . 1.0 . . . . . . . . . . . . A . 11 GLU HG3 . . . . . . . . . c19602_2mgt 1 . 17 . 8798 . 1 1 12 GLU N N -5.607 3.267 2.247 . . . 1.0 . . . . . . . . . . . . A . 11 GLU N . . . . . . . . . c19602_2mgt 1 . 17 . 8799 . 1 1 12 GLU O O -4.879 0.302 2.766 . . . 1.0 . . . . . . . . . . . . A . 11 GLU O . . . . . . . . . c19602_2mgt 1 . 17 . 8800 . 1 1 12 GLU OE1 O -0.532 2.349 1.341 . . . 1.0 . . . . . . . . . . . . A . 11 GLU OE1 . . . . . . . . . c19602_2mgt 1 . 17 . 8801 . 1 1 12 GLU OE2 O -0.867 0.321 0.553 . . . 1.0 . . . . . . . . . . . . A . 11 GLU OE2 . . . . . . . . . c19602_2mgt 1 . 17 . 8802 . 1 1 13 VAL C C -6.331 -2.054 1.370 . . . 1.0 . . . . . . . . . . . . A . 12 VAL C . . . . . . . . . c19602_2mgt 1 . 17 . 8803 . 1 1 13 VAL CA C -7.184 -0.785 1.390 . . . 1.0 . . . . . . . . . . . . A . 12 VAL CA . . . . . . . . . c19602_2mgt 1 . 17 . 8804 . 1 1 13 VAL CB C -8.353 -0.860 0.386 . . . 1.0 . . . . . . . . . . . . A . 12 VAL CB . . . . . . . . . c19602_2mgt 1 . 17 . 8805 . 1 1 13 VAL CG1 C -9.003 -2.241 0.274 . . . 1.0 . . . . . . . . . . . . A . 12 VAL CG1 . . . . . . . . . c19602_2mgt 1 . 17 . 8806 . 1 1 13 VAL CG2 C -9.418 0.134 0.843 . . . 1.0 . . . . . . . . . . . . A . 12 VAL CG2 . . . . . . . . . c19602_2mgt 1 . 17 . 8807 . 1 1 13 VAL H H -6.774 1.012 0.369 . . . 1.0 . . . . . . . . . . . . A . 12 VAL H . . . . . . . . . c19602_2mgt 1 . 17 . 8808 . 1 1 13 VAL HA H -7.595 -0.699 2.389 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HA . . . . . . . . . c19602_2mgt 1 . 17 . 8809 . 1 1 13 VAL HB H -8.001 -0.572 -0.604 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HB . . . . . . . . . c19602_2mgt 1 . 17 . 8810 . 1 1 13 VAL HG11 H -9.201 -2.625 1.270 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HG11 . . . . . . . . . c19602_2mgt 1 . 17 . 8811 . 1 1 13 VAL HG12 H -9.928 -2.191 -0.299 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HG12 . . . . . . . . . c19602_2mgt 1 . 17 . 8812 . 1 1 13 VAL HG13 H -8.322 -2.919 -0.228 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HG13 . . . . . . . . . c19602_2mgt 1 . 17 . 8813 . 1 1 13 VAL HG21 H -9.704 -0.094 1.869 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HG21 . . . . . . . . . c19602_2mgt 1 . 17 . 8814 . 1 1 13 VAL HG22 H -9.014 1.140 0.791 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HG22 . . . . . . . . . c19602_2mgt 1 . 17 . 8815 . 1 1 13 VAL HG23 H -10.289 0.079 0.199 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HG23 . . . . . . . . . c19602_2mgt 1 . 17 . 8816 . 1 1 13 VAL N N -6.422 0.439 1.121 . . . 1.0 . . . . . . . . . . . . A . 12 VAL N . . . . . . . . . c19602_2mgt 1 . 17 . 8817 . 1 1 13 VAL O O -6.721 -3.075 1.937 . . . 1.0 . . . . . . . . . . . . A . 12 VAL O . . . . . . . . . c19602_2mgt 1 . 17 . 8818 . 1 1 14 HIS C C -3.783 -3.428 2.181 . . . 1.0 . . . . . . . . . . . . A . 13 HIS C . . . . . . . . . c19602_2mgt 1 . 17 . 8819 . 1 1 14 HIS CA C -4.176 -3.043 0.755 . . . 1.0 . . . . . . . . . . . . A . 13 HIS CA . . . . . . . . . c19602_2mgt 1 . 17 . 8820 . 1 1 14 HIS CB C -2.998 -2.538 -0.080 . . . 1.0 . . . . . . . . . . . . A . 13 HIS CB . . . . . . . . . c19602_2mgt 1 . 17 . 8821 . 1 1 14 HIS CD2 C -1.411 -4.566 0.101 . . . 1.0 . . . . . . . . . . . . A . 13 HIS CD2 . . . . . . . . . c19602_2mgt 1 . 17 . 8822 . 1 1 14 HIS CE1 C 0.496 -3.497 0.267 . . . 1.0 . . . . . . . . . . . . A . 13 HIS CE1 . . . . . . . . . c19602_2mgt 1 . 17 . 8823 . 1 1 14 HIS CG C -1.674 -3.224 0.093 . . . 1.0 . . . . . . . . . . . . A . 13 HIS CG . . . . . . . . . c19602_2mgt 1 . 17 . 8824 . 1 1 14 HIS H H -4.899 -1.120 0.293 . . . 1.0 . . . . . . . . . . . . A . 13 HIS H . . . . . . . . . c19602_2mgt 1 . 17 . 8825 . 1 1 14 HIS HA H -4.649 -3.899 0.281 . . . 1.0 . . . . . . . . . . . . A . 13 HIS HA . . . . . . . . . c19602_2mgt 1 . 17 . 8826 . 1 1 14 HIS HB2 H -3.282 -2.593 -1.130 . . . 1.0 . . . . . . . . . . . . A . 13 HIS HB2 . . . . . . . . . c19602_2mgt 1 . 17 . 8827 . 1 1 14 HIS HB3 H -2.835 -1.490 0.167 . . . 1.0 . . . . . . . . . . . . A . 13 HIS HB3 . . . . . . . . . c19602_2mgt 1 . 17 . 8828 . 1 1 14 HIS HD1 H -0.332 -1.574 0.215 . . . 1.0 . . . . . . . . . . . . A . 13 HIS HD1 . . . . . . . . . c19602_2mgt 1 . 17 . 8829 . 1 1 14 HIS HD2 H -2.135 -5.361 0.019 . . . 1.0 . . . . . . . . . . . . A . 13 HIS HD2 . . . . . . . . . c19602_2mgt 1 . 17 . 8830 . 1 1 14 HIS HE1 H 1.548 -3.274 0.361 . . . 1.0 . . . . . . . . . . . . A . 13 HIS HE1 . . . . . . . . . c19602_2mgt 1 . 17 . 8831 . 1 1 14 HIS N N -5.152 -1.980 0.758 . . . 1.0 . . . . . . . . . . . . A . 13 HIS N . . . . . . . . . c19602_2mgt 1 . 17 . 8832 . 1 1 14 HIS ND1 N -0.468 -2.574 0.195 . . . 1.0 . . . . . . . . . . . . A . 13 HIS ND1 . . . . . . . . . c19602_2mgt 1 . 17 . 8833 . 1 1 14 HIS NE2 N -0.030 -4.728 0.213 . . . 1.0 . . . . . . . . . . . . A . 13 HIS NE2 . . . . . . . . . c19602_2mgt 1 . 17 . 8834 . 1 1 14 HIS O O -3.674 -4.613 2.470 . . . 1.0 . . . . . . . . . . . . A . 13 HIS O . . . . . . . . . c19602_2mgt 1 . 17 . 8835 . 1 1 15 HIS C C -4.659 -3.031 5.279 . . . 1.0 . . . . . . . . . . . . A . 14 HIS C . . . . . . . . . c19602_2mgt 1 . 17 . 8836 . 1 1 15 HIS CA C -3.388 -2.729 4.493 . . . 1.0 . . . . . . . . . . . . A . 14 HIS CA . . . . . . . . . c19602_2mgt 1 . 17 . 8837 . 1 1 15 HIS CB C -2.599 -1.567 5.096 . . . 1.0 . . . . . . . . . . . . A . 14 HIS CB . . . . . . . . . c19602_2mgt 1 . 17 . 8838 . 1 1 15 HIS CD2 C -0.892 -0.284 3.698 . . . 1.0 . . . . . . . . . . . . A . 14 HIS CD2 . . . . . . . . . c19602_2mgt 1 . 17 . 8839 . 1 1 15 HIS CE1 C 0.532 -1.891 3.262 . . . 1.0 . . . . . . . . . . . . A . 14 HIS CE1 . . . . . . . . . c19602_2mgt 1 . 17 . 8840 . 1 1 15 HIS CG C -1.286 -1.394 4.386 . . . 1.0 . . . . . . . . . . . . A . 14 HIS CG . . . . . . . . . c19602_2mgt 1 . 17 . 8841 . 1 1 15 HIS H H -3.807 -1.495 2.815 . . . 1.0 . . . . . . . . . . . . A . 14 HIS H . . . . . . . . . c19602_2mgt 1 . 17 . 8842 . 1 1 15 HIS HA H -2.761 -3.619 4.560 . . . 1.0 . . . . . . . . . . . . A . 14 HIS HA . . . . . . . . . c19602_2mgt 1 . 17 . 8843 . 1 1 15 HIS HB2 H -3.184 -0.651 5.013 . . . 1.0 . . . . . . . . . . . . A . 14 HIS HB2 . . . . . . . . . c19602_2mgt 1 . 17 . 8844 . 1 1 15 HIS HB3 H -2.405 -1.761 6.148 . . . 1.0 . . . . . . . . . . . . A . 14 HIS HB3 . . . . . . . . . c19602_2mgt 1 . 17 . 8845 . 1 1 15 HIS HD1 H -0.412 -3.342 4.446 . . . 1.0 . . . . . . . . . . . . A . 14 HIS HD1 . . . . . . . . . c19602_2mgt 1 . 17 . 8846 . 1 1 15 HIS HD2 H -1.433 0.647 3.647 . . . 1.0 . . . . . . . . . . . . A . 14 HIS HD2 . . . . . . . . . c19602_2mgt 1 . 17 . 8847 . 1 1 15 HIS HE1 H 1.363 -2.442 2.850 . . . 1.0 . . . . . . . . . . . . A . 14 HIS HE1 . . . . . . . . . c19602_2mgt 1 . 17 . 8848 . 1 1 15 HIS N N -3.652 -2.456 3.089 . . . 1.0 . . . . . . . . . . . . A . 14 HIS N . . . . . . . . . c19602_2mgt 1 . 17 . 8849 . 1 1 15 HIS ND1 N -0.374 -2.388 4.114 . . . 1.0 . . . . . . . . . . . . A . 14 HIS ND1 . . . . . . . . . c19602_2mgt 1 . 17 . 8850 . 1 1 15 HIS NE2 N 0.267 -0.607 2.990 . . . 1.0 . . . . . . . . . . . . A . 14 HIS NE2 . . . . . . . . . c19602_2mgt 1 . 17 . 8851 . 1 1 15 HIS O O -4.547 -3.612 6.350 . . . 1.0 . . . . . . . . . . . . A . 14 HIS O . . . . . . . . . c19602_2mgt 1 . 17 . 8852 . 1 1 16 GLN C C -7.390 -4.542 5.342 . . . 1.0 . . . . . . . . . . . . A . 15 GLN C . . . . . . . . . c19602_2mgt 1 . 17 . 8853 . 1 1 16 GLN CA C -7.101 -3.051 5.431 . . . 1.0 . . . . . . . . . . . . A . 15 GLN CA . . . . . . . . . c19602_2mgt 1 . 17 . 8854 . 1 1 16 GLN CB C -8.244 -2.263 4.800 . . . 1.0 . . . . . . . . . . . . A . 15 GLN CB . . . . . . . . . c19602_2mgt 1 . 17 . 8855 . 1 1 16 GLN CD C -9.287 -1.487 7.011 . . . 1.0 . . . . . . . . . . . . A . 15 GLN CD . . . . . . . . . c19602_2mgt 1 . 17 . 8856 . 1 1 16 GLN CG C -9.478 -2.261 5.706 . . . 1.0 . . . . . . . . . . . . A . 15 GLN CG . . . . . . . . . c19602_2mgt 1 . 17 . 8857 . 1 1 16 GLN H H -5.929 -2.209 3.902 . . . 1.0 . . . . . . . . . . . . A . 15 GLN H . . . . . . . . . c19602_2mgt 1 . 17 . 8858 . 1 1 16 GLN HA H -7.010 -2.771 6.473 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HA . . . . . . . . . c19602_2mgt 1 . 17 . 8859 . 1 1 16 GLN HB2 H -7.921 -1.246 4.602 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HB2 . . . . . . . . . c19602_2mgt 1 . 17 . 8860 . 1 1 16 GLN HB3 H -8.505 -2.727 3.855 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HB3 . . . . . . . . . c19602_2mgt 1 . 17 . 8861 . 1 1 16 GLN HE21 H -11.021 -2.212 7.764 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HE21 . . . . . . . . . c19602_2mgt 1 . 17 . 8862 . 1 1 16 GLN HE22 H -10.132 -1.141 8.821 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HE22 . . . . . . . . . c19602_2mgt 1 . 17 . 8863 . 1 1 16 GLN HG2 H -10.305 -1.827 5.153 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HG2 . . . . . . . . . c19602_2mgt 1 . 17 . 8864 . 1 1 16 GLN HG3 H -9.744 -3.289 5.945 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HG3 . . . . . . . . . c19602_2mgt 1 . 17 . 8865 . 1 1 16 GLN N N -5.856 -2.708 4.772 . . . 1.0 . . . . . . . . . . . . A . 15 GLN N . . . . . . . . . c19602_2mgt 1 . 17 . 8866 . 1 1 16 GLN NE2 N -10.226 -1.618 7.934 . . . 1.0 . . . . . . . . . . . . A . 15 GLN NE2 . . . . . . . . . c19602_2mgt 1 . 17 . 8867 . 1 1 16 GLN O O -7.823 -5.130 6.322 . . . 1.0 . . . . . . . . . . . . A . 15 GLN O . . . . . . . . . c19602_2mgt 1 . 17 . 8868 . 1 1 16 GLN OE1 O -8.307 -0.780 7.205 . . . 1.0 . . . . . . . . . . . . A . 15 GLN OE1 . . . . . . . . . c19602_2mgt 1 . 17 . 8869 . 1 1 17 LYS C C -5.947 -7.285 4.530 . . . 1.0 . . . . . . . . . . . . A . 16 LYS C . . . . . . . . . c19602_2mgt 1 . 17 . 8870 . 1 1 17 LYS CA C -7.230 -6.599 4.030 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CA . . . . . . . . . c19602_2mgt 1 . 17 . 8871 . 1 1 17 LYS CB C -7.528 -6.892 2.558 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CB . . . . . . . . . c19602_2mgt 1 . 17 . 8872 . 1 1 17 LYS CD C -8.301 -8.648 0.919 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CD . . . . . . . . . c19602_2mgt 1 . 17 . 8873 . 1 1 17 LYS CE C -8.743 -10.099 0.722 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CE . . . . . . . . . c19602_2mgt 1 . 17 . 8874 . 1 1 17 LYS CG C -7.775 -8.386 2.331 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CG . . . . . . . . . c19602_2mgt 1 . 17 . 8875 . 1 1 17 LYS H H -6.821 -4.610 3.399 . . . 1.0 . . . . . . . . . . . . A . 16 LYS H . . . . . . . . . c19602_2mgt 1 . 17 . 8876 . 1 1 17 LYS HA H -8.069 -6.967 4.624 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HA . . . . . . . . . c19602_2mgt 1 . 17 . 8877 . 1 1 17 LYS HB2 H -8.416 -6.334 2.266 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HB2 . . . . . . . . . c19602_2mgt 1 . 17 . 8878 . 1 1 17 LYS HB3 H -6.697 -6.551 1.946 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HB3 . . . . . . . . . c19602_2mgt 1 . 17 . 8879 . 1 1 17 LYS HD2 H -9.167 -8.013 0.759 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HD2 . . . . . . . . . c19602_2mgt 1 . 17 . 8880 . 1 1 17 LYS HD3 H -7.532 -8.399 0.189 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HD3 . . . . . . . . . c19602_2mgt 1 . 17 . 8881 . 1 1 17 LYS HE2 H -9.602 -10.291 1.359 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HE2 . . . . . . . . . c19602_2mgt 1 . 17 . 8882 . 1 1 17 LYS HE3 H -9.038 -10.249 -0.317 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HE3 . . . . . . . . . c19602_2mgt 1 . 17 . 8883 . 1 1 17 LYS HG2 H -6.835 -8.919 2.463 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HG2 . . . . . . . . . c19602_2mgt 1 . 17 . 8884 . 1 1 17 LYS HG3 H -8.506 -8.747 3.057 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HG3 . . . . . . . . . c19602_2mgt 1 . 17 . 8885 . 1 1 17 LYS HZ1 H -6.866 -10.898 0.506 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HZ1 . . . . . . . . . c19602_2mgt 1 . 17 . 8886 . 1 1 17 LYS HZ2 H -7.440 -10.950 2.046 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HZ2 . . . . . . . . . c19602_2mgt 1 . 17 . 8887 . 1 1 17 LYS HZ3 H -8.019 -12.003 0.931 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HZ3 . . . . . . . . . c19602_2mgt 1 . 17 . 8888 . 1 1 17 LYS N N -7.140 -5.157 4.186 . . . 1.0 . . . . . . . . . . . . A . 16 LYS N . . . . . . . . . c19602_2mgt 1 . 17 . 8889 . 1 1 17 LYS NZ N -7.687 -11.059 1.071 . . . 1.0 . . . . . . . . . . . . A . 16 LYS NZ . . . . . . . . . c19602_2mgt 1 . 17 . 8890 . 1 1 17 LYS O O -5.990 -8.439 4.939 . . . 1.0 . . . . . . . . . . . . A . 16 LYS O . . . . . . . . . c19602_2mgt 1 . 17 . 8891 . 1 1 18 NH2 HN1 H -3.970 -7.023 4.909 . . . 1.0 . . . . . . . . . . . . A . 17 NH2 HN1 . . . . . . . . . c19602_2mgt 1 . 17 . 8892 . 1 1 18 NH2 HN2 H -4.791 -5.635 4.222 . . . 1.0 . . . . . . . . . . . . A . 17 NH2 HN2 . . . . . . . . . c19602_2mgt 1 . 17 . 8893 . 1 1 18 NH2 N N -4.807 -6.590 4.548 . . . 1.0 . . . . . . . . . . . . A . 17 NH2 N . . . . . . . . . c19602_2mgt 1 . 17 . 8894 . 2 1 1 ACE C C 15.532 1.741 -12.775 . . . 1.0 . . . . . . . . . . . . B . 0 ACE C . . . . . . . . . c19602_2mgt 1 . 17 . 8895 . 2 1 1 ACE CH3 C 15.359 1.609 -14.280 . . . 1.0 . . . . . . . . . . . . B . 0 ACE CH3 . . . . . . . . . c19602_2mgt 1 . 17 . 8896 . 2 1 1 ACE H1 H 14.815 0.694 -14.507 . . . 1.0 . . . . . . . . . . . . B . 0 ACE H1 . . . . . . . . . c19602_2mgt 1 . 17 . 8897 . 2 1 1 ACE H2 H 14.800 2.460 -14.661 . . . 1.0 . . . . . . . . . . . . B . 0 ACE H2 . . . . . . . . . c19602_2mgt 1 . 17 . 8898 . 2 1 1 ACE H3 H 16.336 1.574 -14.760 . . . 1.0 . . . . . . . . . . . . B . 0 ACE H3 . . . . . . . . . c19602_2mgt 1 . 17 . 8899 . 2 1 1 ACE O O 16.638 1.583 -12.274 . . . 1.0 . . . . . . . . . . . . B . 0 ACE O . . . . . . . . . c19602_2mgt 1 . 17 . 8900 . 2 1 2 ASP C C 14.551 0.741 -9.889 . . . 1.0 . . . . . . . . . . . . B . 1 ASP C . . . . . . . . . c19602_2mgt 1 . 17 . 8901 . 2 1 2 ASP CA C 14.431 2.096 -10.589 . . . 1.0 . . . . . . . . . . . . B . 1 ASP CA . . . . . . . . . c19602_2mgt 1 . 17 . 8902 . 2 1 2 ASP CB C 13.121 2.747 -10.147 . . . 1.0 . . . . . . . . . . . . B . 1 ASP CB . . . . . . . . . c19602_2mgt 1 . 17 . 8903 . 2 1 2 ASP CG C 13.137 4.237 -10.429 . . . 1.0 . . . . . . . . . . . . B . 1 ASP CG . . . . . . . . . c19602_2mgt 1 . 17 . 8904 . 2 1 2 ASP H H 13.558 2.127 -12.525 . . . 1.0 . . . . . . . . . . . . B . 1 ASP H . . . . . . . . . c19602_2mgt 1 . 17 . 8905 . 2 1 2 ASP HA H 15.269 2.714 -10.261 . . . 1.0 . . . . . . . . . . . . B . 1 ASP HA . . . . . . . . . c19602_2mgt 1 . 17 . 8906 . 2 1 2 ASP HB2 H 12.279 2.269 -10.647 . . . 1.0 . . . . . . . . . . . . B . 1 ASP HB2 . . . . . . . . . c19602_2mgt 1 . 17 . 8907 . 2 1 2 ASP HB3 H 13.000 2.603 -9.076 . . . 1.0 . . . . . . . . . . . . B . 1 ASP HB3 . . . . . . . . . c19602_2mgt 1 . 17 . 8908 . 2 1 2 ASP N N 14.442 2.014 -12.051 . . . 1.0 . . . . . . . . . . . . B . 1 ASP N . . . . . . . . . c19602_2mgt 1 . 17 . 8909 . 2 1 2 ASP O O 14.777 0.716 -8.684 . . . 1.0 . . . . . . . . . . . . B . 1 ASP O . . . . . . . . . c19602_2mgt 1 . 17 . 8910 . 2 1 2 ASP OD1 O 13.906 4.942 -9.762 . . . 1.0 . . . . . . . . . . . . B . 1 ASP OD1 . . . . . . . . . c19602_2mgt 1 . 17 . 8911 . 2 1 2 ASP OD2 O 12.380 4.654 -11.336 . . . 1.0 . . . . . . . . . . . . B . 1 ASP OD2 . . . . . . . . . c19602_2mgt 1 . 17 . 8912 . 2 1 3 ALA C C 15.175 -2.161 -9.065 . . . 1.0 . . . . . . . . . . . . B . 2 ALA C . . . . . . . . . c19602_2mgt 1 . 17 . 8913 . 2 1 3 ALA CA C 14.263 -1.742 -10.213 . . . 1.0 . . . . . . . . . . . . B . 2 ALA CA . . . . . . . . . c19602_2mgt 1 . 17 . 8914 . 2 1 3 ALA CB C 14.566 -2.613 -11.427 . . . 1.0 . . . . . . . . . . . . B . 2 ALA CB . . . . . . . . . c19602_2mgt 1 . 17 . 8915 . 2 1 3 ALA H H 14.160 -0.181 -11.612 . . . 1.0 . . . . . . . . . . . . B . 2 ALA H . . . . . . . . . c19602_2mgt 1 . 17 . 8916 . 2 1 3 ALA HA H 13.236 -1.922 -9.906 . . . 1.0 . . . . . . . . . . . . B . 2 ALA HA . . . . . . . . . c19602_2mgt 1 . 17 . 8917 . 2 1 3 ALA HB1 H 14.699 -3.648 -11.120 . . . 1.0 . . . . . . . . . . . . B . 2 ALA HB1 . . . . . . . . . c19602_2mgt 1 . 17 . 8918 . 2 1 3 ALA HB2 H 13.741 -2.542 -12.132 . . . 1.0 . . . . . . . . . . . . B . 2 ALA HB2 . . . . . . . . . c19602_2mgt 1 . 17 . 8919 . 2 1 3 ALA HB3 H 15.482 -2.268 -11.904 . . . 1.0 . . . . . . . . . . . . B . 2 ALA HB3 . . . . . . . . . c19602_2mgt 1 . 17 . 8920 . 2 1 3 ALA N N 14.375 -0.351 -10.641 . . . 1.0 . . . . . . . . . . . . B . 2 ALA N . . . . . . . . . c19602_2mgt 1 . 17 . 8921 . 2 1 3 ALA O O 14.733 -2.917 -8.210 . . . 1.0 . . . . . . . . . . . . B . 2 ALA O . . . . . . . . . c19602_2mgt 1 . 17 . 8922 . 2 1 4 GLU C C 16.918 -1.693 -6.578 . . . 1.0 . . . . . . . . . . . . B . 3 GLU C . . . . . . . . . c19602_2mgt 1 . 17 . 8923 . 2 1 4 GLU CA C 17.404 -1.976 -8.003 . . . 1.0 . . . . . . . . . . . . B . 3 GLU CA . . . . . . . . . c19602_2mgt 1 . 17 . 8924 . 2 1 4 GLU CB C 18.701 -1.223 -8.307 . . . 1.0 . . . . . . . . . . . . B . 3 GLU CB . . . . . . . . . c19602_2mgt 1 . 17 . 8925 . 2 1 4 GLU CD C 19.750 0.989 -8.890 . . . 1.0 . . . . . . . . . . . . B . 3 GLU CD . . . . . . . . . c19602_2mgt 1 . 17 . 8926 . 2 1 4 GLU CG C 18.508 0.300 -8.360 . . . 1.0 . . . . . . . . . . . . B . 3 GLU CG . . . . . . . . . c19602_2mgt 1 . 17 . 8927 . 2 1 4 GLU H H 16.710 -1.060 -9.779 . . . 1.0 . . . . . . . . . . . . B . 3 GLU H . . . . . . . . . c19602_2mgt 1 . 17 . 8928 . 2 1 4 GLU HA H 17.626 -3.036 -8.059 . . . 1.0 . . . . . . . . . . . . B . 3 GLU HA . . . . . . . . . c19602_2mgt 1 . 17 . 8929 . 2 1 4 GLU HB2 H 19.440 -1.462 -7.543 . . . 1.0 . . . . . . . . . . . . B . 3 GLU HB2 . . . . . . . . . c19602_2mgt 1 . 17 . 8930 . 2 1 4 GLU HB3 H 19.085 -1.567 -9.267 . . . 1.0 . . . . . . . . . . . . B . 3 GLU HB3 . . . . . . . . . c19602_2mgt 1 . 17 . 8931 . 2 1 4 GLU HG2 H 17.671 0.543 -9.018 . . . 1.0 . . . . . . . . . . . . B . 3 GLU HG2 . . . . . . . . . c19602_2mgt 1 . 17 . 8932 . 2 1 4 GLU HG3 H 18.296 0.678 -7.362 . . . 1.0 . . . . . . . . . . . . B . 3 GLU HG3 . . . . . . . . . c19602_2mgt 1 . 17 . 8933 . 2 1 4 GLU N N 16.419 -1.677 -9.034 . . . 1.0 . . . . . . . . . . . . B . 3 GLU N . . . . . . . . . c19602_2mgt 1 . 17 . 8934 . 2 1 4 GLU O O 17.263 -2.446 -5.679 . . . 1.0 . . . . . . . . . . . . B . 3 GLU O . . . . . . . . . c19602_2mgt 1 . 17 . 8935 . 2 1 4 GLU OE1 O 20.863 0.542 -8.590 . . . 1.0 . . . . . . . . . . . . B . 3 GLU OE1 . . . . . . . . . c19602_2mgt 1 . 17 . 8936 . 2 1 4 GLU OE2 O 19.576 1.987 -9.623 . . . 1.0 . . . . . . . . . . . . B . 3 GLU OE2 . . . . . . . . . c19602_2mgt 1 . 17 . 8937 . 2 1 5 PHE C C 13.931 -0.596 -5.169 . . . 1.0 . . . . . . . . . . . . B . 4 PHE C . . . . . . . . . c19602_2mgt 1 . 17 . 8938 . 2 1 5 PHE CA C 15.449 -0.419 -5.075 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CA . . . . . . . . . c19602_2mgt 1 . 17 . 8939 . 2 1 5 PHE CB C 15.855 0.963 -4.576 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CB . . . . . . . . . c19602_2mgt 1 . 17 . 8940 . 2 1 5 PHE CD1 C 13.908 2.508 -4.912 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CD1 . . . . . . . . . c19602_2mgt 1 . 17 . 8941 . 2 1 5 PHE CD2 C 15.788 2.656 -6.449 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CD2 . . . . . . . . . c19602_2mgt 1 . 17 . 8942 . 2 1 5 PHE CE1 C 13.253 3.534 -5.607 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CE1 . . . . . . . . . c19602_2mgt 1 . 17 . 8943 . 2 1 5 PHE CE2 C 15.138 3.687 -7.144 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CE2 . . . . . . . . . c19602_2mgt 1 . 17 . 8944 . 2 1 5 PHE CG C 15.180 2.084 -5.320 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CG . . . . . . . . . c19602_2mgt 1 . 17 . 8945 . 2 1 5 PHE CZ C 13.866 4.122 -6.724 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CZ . . . . . . . . . c19602_2mgt 1 . 17 . 8946 . 2 1 5 PHE H H 15.846 -0.061 -7.129 . . . 1.0 . . . . . . . . . . . . B . 4 PHE H . . . . . . . . . c19602_2mgt 1 . 17 . 8947 . 2 1 5 PHE HA H 15.807 -1.136 -4.342 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HA . . . . . . . . . c19602_2mgt 1 . 17 . 8948 . 2 1 5 PHE HB2 H 15.599 1.038 -3.521 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HB2 . . . . . . . . . c19602_2mgt 1 . 17 . 8949 . 2 1 5 PHE HB3 H 16.937 1.071 -4.661 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HB3 . . . . . . . . . c19602_2mgt 1 . 17 . 8950 . 2 1 5 PHE HD1 H 13.434 2.014 -4.076 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HD1 . . . . . . . . . c19602_2mgt 1 . 17 . 8951 . 2 1 5 PHE HD2 H 16.736 2.274 -6.790 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HD2 . . . . . . . . . c19602_2mgt 1 . 17 . 8952 . 2 1 5 PHE HE1 H 12.280 3.864 -5.281 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HE1 . . . . . . . . . c19602_2mgt 1 . 17 . 8953 . 2 1 5 PHE HE2 H 15.612 4.134 -8.004 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HE2 . . . . . . . . . c19602_2mgt 1 . 17 . 8954 . 2 1 5 PHE HZ H 13.359 4.913 -7.256 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HZ . . . . . . . . . c19602_2mgt 1 . 17 . 8955 . 2 1 5 PHE N N 16.091 -0.668 -6.361 . . . 1.0 . . . . . . . . . . . . B . 4 PHE N . . . . . . . . . c19602_2mgt 1 . 17 . 8956 . 2 1 5 PHE O O 13.307 -0.915 -4.162 . . . 1.0 . . . . . . . . . . . . B . 4 PHE O . . . . . . . . . c19602_2mgt 1 . 17 . 8957 . 2 1 6 ARG C C 12.110 -2.504 -6.899 . . . 1.0 . . . . . . . . . . . . B . 5 ARG C . . . . . . . . . c19602_2mgt 1 . 17 . 8958 . 2 1 6 ARG CA C 12.014 -0.991 -6.683 . . . 1.0 . . . . . . . . . . . . B . 5 ARG CA . . . . . . . . . c19602_2mgt 1 . 17 . 8959 . 2 1 6 ARG CB C 11.426 -0.230 -7.877 . . . 1.0 . . . . . . . . . . . . B . 5 ARG CB . . . . . . . . . c19602_2mgt 1 . 17 . 8960 . 2 1 6 ARG CD C 9.846 1.222 -6.435 . . . 1.0 . . . . . . . . . . . . B . 5 ARG CD . . . . . . . . . c19602_2mgt 1 . 17 . 8961 . 2 1 6 ARG CG C 10.939 1.181 -7.516 . . . 1.0 . . . . . . . . . . . . B . 5 ARG CG . . . . . . . . . c19602_2mgt 1 . 17 . 8962 . 2 1 6 ARG CZ C 7.655 0.559 -7.454 . . . 1.0 . . . . . . . . . . . . B . 5 ARG CZ . . . . . . . . . c19602_2mgt 1 . 17 . 8963 . 2 1 6 ARG H H 13.902 -0.174 -7.153 . . . 1.0 . . . . . . . . . . . . B . 5 ARG H . . . . . . . . . c19602_2mgt 1 . 17 . 8964 . 2 1 6 ARG HA H 11.364 -0.841 -5.826 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HA . . . . . . . . . c19602_2mgt 1 . 17 . 8965 . 2 1 6 ARG HB2 H 12.184 -0.155 -8.653 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HB2 . . . . . . . . . c19602_2mgt 1 . 17 . 8966 . 2 1 6 ARG HB3 H 10.585 -0.791 -8.284 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HB3 . . . . . . . . . c19602_2mgt 1 . 17 . 8967 . 2 1 6 ARG HD2 H 10.284 0.959 -5.477 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HD2 . . . . . . . . . c19602_2mgt 1 . 17 . 8968 . 2 1 6 ARG HD3 H 9.455 2.232 -6.342 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HD3 . . . . . . . . . c19602_2mgt 1 . 17 . 8969 . 2 1 6 ARG HE H 8.830 -0.629 -6.324 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HE . . . . . . . . . c19602_2mgt 1 . 17 . 8970 . 2 1 6 ARG HG2 H 11.784 1.776 -7.174 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HG2 . . . . . . . . . c19602_2mgt 1 . 17 . 8971 . 2 1 6 ARG HG3 H 10.553 1.639 -8.422 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HG3 . . . . . . . . . c19602_2mgt 1 . 17 . 8972 . 2 1 6 ARG HH11 H 8.117 2.493 -7.885 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HH11 . . . . . . . . . c19602_2mgt 1 . 17 . 8973 . 2 1 6 ARG HH12 H 6.630 1.903 -8.586 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HH12 . . . . . . . . . c19602_2mgt 1 . 17 . 8974 . 2 1 6 ARG HH21 H 6.880 -1.310 -7.236 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HH21 . . . . . . . . . c19602_2mgt 1 . 17 . 8975 . 2 1 6 ARG HH22 H 5.945 -0.217 -8.228 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HH22 . . . . . . . . . c19602_2mgt 1 . 17 . 8976 . 2 1 6 ARG N N 13.343 -0.481 -6.370 . . . 1.0 . . . . . . . . . . . . B . 5 ARG N . . . . . . . . . c19602_2mgt 1 . 17 . 8977 . 2 1 6 ARG NE N 8.742 0.297 -6.718 . . . 1.0 . . . . . . . . . . . . B . 5 ARG NE . . . . . . . . . c19602_2mgt 1 . 17 . 8978 . 2 1 6 ARG NH1 N 7.442 1.753 -8.005 . . . 1.0 . . . . . . . . . . . . B . 5 ARG NH1 . . . . . . . . . c19602_2mgt 1 . 17 . 8979 . 2 1 6 ARG NH2 N 6.754 -0.399 -7.653 . . . 1.0 . . . . . . . . . . . . B . 5 ARG NH2 . . . . . . . . . c19602_2mgt 1 . 17 . 8980 . 2 1 6 ARG O O 11.864 -3.036 -7.977 . . . 1.0 . . . . . . . . . . . . B . 5 ARG O . . . . . . . . . c19602_2mgt 1 . 17 . 8981 . 2 1 7 ARG C C 11.419 -5.350 -5.682 . . . 1.0 . . . . . . . . . . . . B . 6 ARG C . . . . . . . . . c19602_2mgt 1 . 17 . 8982 . 2 1 7 ARG CA C 12.753 -4.604 -5.721 . . . 1.0 . . . . . . . . . . . . B . 6 ARG CA . . . . . . . . . c19602_2mgt 1 . 17 . 8983 . 2 1 7 ARG CB C 13.530 -4.812 -4.412 . . . 1.0 . . . . . . . . . . . . B . 6 ARG CB . . . . . . . . . c19602_2mgt 1 . 17 . 8984 . 2 1 7 ARG CD C 15.952 -5.207 -5.173 . . . 1.0 . . . . . . . . . . . . B . 6 ARG CD . . . . . . . . . c19602_2mgt 1 . 17 . 8985 . 2 1 7 ARG CG C 14.976 -4.305 -4.412 . . . 1.0 . . . . . . . . . . . . B . 6 ARG CG . . . . . . . . . c19602_2mgt 1 . 17 . 8986 . 2 1 7 ARG CZ C 16.517 -5.712 -7.545 . . . 1.0 . . . . . . . . . . . . B . 6 ARG CZ . . . . . . . . . c19602_2mgt 1 . 17 . 8987 . 2 1 7 ARG H H 12.727 -2.655 -4.999 . . . 1.0 . . . . . . . . . . . . B . 6 ARG H . . . . . . . . . c19602_2mgt 1 . 17 . 8988 . 2 1 7 ARG HA H 13.343 -4.938 -6.569 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HA . . . . . . . . . c19602_2mgt 1 . 17 . 8989 . 2 1 7 ARG HB2 H 13.021 -4.238 -3.640 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HB2 . . . . . . . . . c19602_2mgt 1 . 17 . 8990 . 2 1 7 ARG HB3 H 13.514 -5.863 -4.126 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HB3 . . . . . . . . . c19602_2mgt 1 . 17 . 8991 . 2 1 7 ARG HD2 H 16.963 -5.009 -4.820 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HD2 . . . . . . . . . c19602_2mgt 1 . 17 . 8992 . 2 1 7 ARG HD3 H 15.710 -6.246 -4.973 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HD3 . . . . . . . . . c19602_2mgt 1 . 17 . 8993 . 2 1 7 ARG HE H 15.426 -4.140 -6.919 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HE . . . . . . . . . c19602_2mgt 1 . 17 . 8994 . 2 1 7 ARG HG2 H 15.013 -3.288 -4.802 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HG2 . . . . . . . . . c19602_2mgt 1 . 17 . 8995 . 2 1 7 ARG HG3 H 15.302 -4.267 -3.375 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HG3 . . . . . . . . . c19602_2mgt 1 . 17 . 8996 . 2 1 7 ARG HH11 H 17.318 -7.074 -6.263 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HH11 . . . . . . . . . c19602_2mgt 1 . 17 . 8997 . 2 1 7 ARG HH12 H 17.650 -7.350 -7.958 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HH12 . . . . . . . . . c19602_2mgt 1 . 17 . 8998 . 2 1 7 ARG HH21 H 15.858 -4.552 -9.080 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HH21 . . . . . . . . . c19602_2mgt 1 . 17 . 8999 . 2 1 7 ARG HH22 H 16.831 -5.929 -9.544 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HH22 . . . . . . . . . c19602_2mgt 1 . 17 . 9000 . 2 1 7 ARG N N 12.516 -3.186 -5.829 . . . 1.0 . . . . . . . . . . . . B . 6 ARG N . . . . . . . . . c19602_2mgt 1 . 17 . 9001 . 2 1 7 ARG NE N 15.919 -4.965 -6.613 . . . 1.0 . . . . . . . . . . . . B . 6 ARG NE . . . . . . . . . c19602_2mgt 1 . 17 . 9002 . 2 1 7 ARG NH1 N 17.228 -6.793 -7.229 . . . 1.0 . . . . . . . . . . . . B . 6 ARG NH1 . . . . . . . . . c19602_2mgt 1 . 17 . 9003 . 2 1 7 ARG NH2 N 16.397 -5.366 -8.825 . . . 1.0 . . . . . . . . . . . . B . 6 ARG NH2 . . . . . . . . . c19602_2mgt 1 . 17 . 9004 . 2 1 7 ARG O O 10.543 -4.998 -4.897 . . . 1.0 . . . . . . . . . . . . B . 6 ARG O . . . . . . . . . c19602_2mgt 1 . 17 . 9005 . 2 1 8 ASP C C 10.159 -8.104 -5.058 . . . 1.0 . . . . . . . . . . . . B . 7 ASP C . . . . . . . . . c19602_2mgt 1 . 17 . 9006 . 2 1 8 ASP CA C 10.140 -7.325 -6.371 . . . 1.0 . . . . . . . . . . . . B . 7 ASP CA . . . . . . . . . c19602_2mgt 1 . 17 . 9007 . 2 1 8 ASP CB C 10.134 -8.311 -7.544 . . . 1.0 . . . . . . . . . . . . B . 7 ASP CB . . . . . . . . . c19602_2mgt 1 . 17 . 9008 . 2 1 8 ASP CG C 9.856 -7.609 -8.861 . . . 1.0 . . . . . . . . . . . . B . 7 ASP CG . . . . . . . . . c19602_2mgt 1 . 17 . 9009 . 2 1 8 ASP H H 12.019 -6.661 -7.115 . . . 1.0 . . . . . . . . . . . . B . 7 ASP H . . . . . . . . . c19602_2mgt 1 . 17 . 9010 . 2 1 8 ASP HA H 9.218 -6.742 -6.396 . . . 1.0 . . . . . . . . . . . . B . 7 ASP HA . . . . . . . . . c19602_2mgt 1 . 17 . 9011 . 2 1 8 ASP HB2 H 11.092 -8.830 -7.592 . . . 1.0 . . . . . . . . . . . . B . 7 ASP HB2 . . . . . . . . . c19602_2mgt 1 . 17 . 9012 . 2 1 8 ASP HB3 H 9.349 -9.052 -7.387 . . . 1.0 . . . . . . . . . . . . B . 7 ASP HB3 . . . . . . . . . c19602_2mgt 1 . 17 . 9013 . 2 1 8 ASP N N 11.273 -6.411 -6.481 . . . 1.0 . . . . . . . . . . . . B . 7 ASP N . . . . . . . . . c19602_2mgt 1 . 17 . 9014 . 2 1 8 ASP O O 9.106 -8.572 -4.644 . . . 1.0 . . . . . . . . . . . . B . 7 ASP O . . . . . . . . . c19602_2mgt 1 . 17 . 9015 . 2 1 8 ASP OD1 O 8.880 -6.843 -8.918 . . . 1.0 . . . . . . . . . . . . B . 7 ASP OD1 . . . . . . . . . c19602_2mgt 1 . 17 . 9016 . 2 1 8 ASP OD2 O 10.620 -7.834 -9.813 . . . 1.0 . . . . . . . . . . . . B . 7 ASP OD2 . . . . . . . . . c19602_2mgt 1 . 17 . 9017 . 2 1 9 SER C C 10.714 -8.461 -1.978 . . . 1.0 . . . . . . . . . . . . B . 8 SER C . . . . . . . . . c19602_2mgt 1 . 17 . 9018 . 2 1 9 SER CA C 11.521 -8.982 -3.175 . . . 1.0 . . . . . . . . . . . . B . 8 SER CA . . . . . . . . . c19602_2mgt 1 . 17 . 9019 . 2 1 9 SER CB C 13.015 -9.009 -2.845 . . . 1.0 . . . . . . . . . . . . B . 8 SER CB . . . . . . . . . c19602_2mgt 1 . 17 . 9020 . 2 1 9 SER H H 12.153 -7.847 -4.830 . . . 1.0 . . . . . . . . . . . . B . 8 SER H . . . . . . . . . c19602_2mgt 1 . 17 . 9021 . 2 1 9 SER HA H 11.203 -10.006 -3.365 . . . 1.0 . . . . . . . . . . . . B . 8 SER HA . . . . . . . . . c19602_2mgt 1 . 17 . 9022 . 2 1 9 SER HB2 H 13.438 -8.011 -2.961 . . . 1.0 . . . . . . . . . . . . B . 8 SER HB2 . . . . . . . . . c19602_2mgt 1 . 17 . 9023 . 2 1 9 SER HB3 H 13.161 -9.339 -1.817 . . . 1.0 . . . . . . . . . . . . B . 8 SER HB3 . . . . . . . . . c19602_2mgt 1 . 17 . 9024 . 2 1 9 SER HG H 14.617 -9.923 -3.460 . . . 1.0 . . . . . . . . . . . . B . 8 SER HG . . . . . . . . . c19602_2mgt 1 . 17 . 9025 . 2 1 9 SER N N 11.321 -8.229 -4.404 . . . 1.0 . . . . . . . . . . . . B . 8 SER N . . . . . . . . . c19602_2mgt 1 . 17 . 9026 . 2 1 9 SER O O 10.607 -9.182 -0.991 . . . 1.0 . . . . . . . . . . . . B . 8 SER O . . . . . . . . . c19602_2mgt 1 . 17 . 9027 . 2 1 9 SER OG O 13.684 -9.910 -3.698 . . . 1.0 . . . . . . . . . . . . B . 8 SER OG . . . . . . . . . c19602_2mgt 1 . 17 . 9028 . 2 1 10 GLY C C 7.767 -6.877 -1.807 . . . 1.0 . . . . . . . . . . . . B . 9 GLY C . . . . . . . . . c19602_2mgt 1 . 17 . 9029 . 2 1 10 GLY CA C 9.108 -6.840 -1.084 . . . 1.0 . . . . . . . . . . . . B . 9 GLY CA . . . . . . . . . c19602_2mgt 1 . 17 . 9030 . 2 1 10 GLY H H 10.113 -6.754 -2.919 . . . 1.0 . . . . . . . . . . . . B . 9 GLY H . . . . . . . . . c19602_2mgt 1 . 17 . 9031 . 2 1 10 GLY HA2 H 9.062 -7.509 -0.228 . . . 1.0 . . . . . . . . . . . . B . 9 GLY HA2 . . . . . . . . . c19602_2mgt 1 . 17 . 9032 . 2 1 10 GLY HA3 H 9.350 -5.844 -0.728 . . . 1.0 . . . . . . . . . . . . B . 9 GLY HA3 . . . . . . . . . c19602_2mgt 1 . 17 . 9033 . 2 1 10 GLY N N 10.101 -7.271 -2.050 . . . 1.0 . . . . . . . . . . . . B . 9 GLY N . . . . . . . . . c19602_2mgt 1 . 17 . 9034 . 2 1 10 GLY O O 7.348 -7.957 -2.206 . . . 1.0 . . . . . . . . . . . . B . 9 GLY O . . . . . . . . . c19602_2mgt 1 . 17 . 9035 . 2 1 11 TYR C C 6.222 -3.468 -1.775 . . . 1.0 . . . . . . . . . . . . B . 10 TYR C . . . . . . . . . c19602_2mgt 1 . 17 . 9036 . 2 1 11 TYR CA C 7.398 -4.414 -1.557 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CA . . . . . . . . . c19602_2mgt 1 . 17 . 9037 . 2 1 11 TYR CB C 8.609 -3.864 -2.325 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CB . . . . . . . . . c19602_2mgt 1 . 17 . 9038 . 2 1 11 TYR CD1 C 9.624 -2.493 -0.435 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CD1 . . . . . . . . . c19602_2mgt 1 . 17 . 9039 . 2 1 11 TYR CD2 C 11.048 -3.964 -1.741 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CD2 . . . . . . . . . c19602_2mgt 1 . 17 . 9040 . 2 1 11 TYR CE1 C 10.737 -2.079 0.311 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CE1 . . . . . . . . . c19602_2mgt 1 . 17 . 9041 . 2 1 11 TYR CE2 C 12.162 -3.567 -0.991 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CE2 . . . . . . . . . c19602_2mgt 1 . 17 . 9042 . 2 1 11 TYR CG C 9.780 -3.430 -1.473 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CG . . . . . . . . . c19602_2mgt 1 . 17 . 9043 . 2 1 11 TYR CZ C 12.009 -2.628 0.047 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CZ . . . . . . . . . c19602_2mgt 1 . 17 . 9044 . 2 1 11 TYR H H 6.326 -5.787 -2.681 . . . 1.0 . . . . . . . . . . . . B . 10 TYR H . . . . . . . . . c19602_2mgt 1 . 17 . 9045 . 2 1 11 TYR HA H 7.625 -4.453 -0.492 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HA . . . . . . . . . c19602_2mgt 1 . 17 . 9046 . 2 1 11 TYR HB2 H 8.954 -4.617 -3.027 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HB2 . . . . . . . . . c19602_2mgt 1 . 17 . 9047 . 2 1 11 TYR HB3 H 8.298 -3.023 -2.937 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HB3 . . . . . . . . . c19602_2mgt 1 . 17 . 9048 . 2 1 11 TYR HD1 H 8.659 -2.075 -0.213 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HD1 . . . . . . . . . c19602_2mgt 1 . 17 . 9049 . 2 1 11 TYR HD2 H 11.163 -4.709 -2.508 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HD2 . . . . . . . . . c19602_2mgt 1 . 17 . 9050 . 2 1 11 TYR HE1 H 10.617 -1.364 1.105 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HE1 . . . . . . . . . c19602_2mgt 1 . 17 . 9051 . 2 1 11 TYR HE2 H 13.125 -4.003 -1.193 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HE2 . . . . . . . . . c19602_2mgt 1 . 17 . 9052 . 2 1 11 TYR HH H 12.864 -1.620 1.474 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HH . . . . . . . . . c19602_2mgt 1 . 17 . 9053 . 2 1 11 TYR N N 7.076 -5.751 -2.018 . . . 1.0 . . . . . . . . . . . . B . 10 TYR N . . . . . . . . . c19602_2mgt 1 . 17 . 9054 . 2 1 11 TYR O O 5.360 -3.671 -2.629 . . . 1.0 . . . . . . . . . . . . B . 10 TYR O . . . . . . . . . c19602_2mgt 1 . 17 . 9055 . 2 1 11 TYR OH O 13.081 -2.282 0.810 . . . 1.0 . . . . . . . . . . . . B . 10 TYR OH . . . . . . . . . c19602_2mgt 1 . 17 . 9056 . 2 1 12 GLU C C 6.502 -0.015 -0.894 . . . 1.0 . . . . . . . . . . . . B . 11 GLU C . . . . . . . . . c19602_2mgt 1 . 17 . 9057 . 2 1 12 GLU CA C 5.580 -1.141 -1.361 . . . 1.0 . . . . . . . . . . . . B . 11 GLU CA . . . . . . . . . c19602_2mgt 1 . 17 . 9058 . 2 1 12 GLU CB C 4.233 -1.172 -0.654 . . . 1.0 . . . . . . . . . . . . B . 11 GLU CB . . . . . . . . . c19602_2mgt 1 . 17 . 9059 . 2 1 12 GLU CD C 2.194 0.216 -0.192 . . . 1.0 . . . . . . . . . . . . B . 11 GLU CD . . . . . . . . . c19602_2mgt 1 . 17 . 9060 . 2 1 12 GLU CG C 3.338 -0.040 -1.155 . . . 1.0 . . . . . . . . . . . . B . 11 GLU CG . . . . . . . . . c19602_2mgt 1 . 17 . 9061 . 2 1 12 GLU H H 6.951 -2.301 -0.303 . . . 1.0 . . . . . . . . . . . . B . 11 GLU H . . . . . . . . . c19602_2mgt 1 . 17 . 9062 . 2 1 12 GLU HA H 5.427 -1.081 -2.439 . . . 1.0 . . . . . . . . . . . . B . 11 GLU HA . . . . . . . . . c19602_2mgt 1 . 17 . 9063 . 2 1 12 GLU HB2 H 3.739 -2.123 -0.847 . . . 1.0 . . . . . . . . . . . . B . 11 GLU HB2 . . . . . . . . . c19602_2mgt 1 . 17 . 9064 . 2 1 12 GLU HB3 H 4.394 -1.083 0.417 . . . 1.0 . . . . . . . . . . . . B . 11 GLU HB3 . . . . . . . . . c19602_2mgt 1 . 17 . 9065 . 2 1 12 GLU HG2 H 3.921 0.876 -1.246 . . . 1.0 . . . . . . . . . . . . B . 11 GLU HG2 . . . . . . . . . c19602_2mgt 1 . 17 . 9066 . 2 1 12 GLU HG3 H 2.940 -0.299 -2.134 . . . 1.0 . . . . . . . . . . . . B . 11 GLU HG3 . . . . . . . . . c19602_2mgt 1 . 17 . 9067 . 2 1 12 GLU N N 6.281 -2.356 -1.053 . . . 1.0 . . . . . . . . . . . . B . 11 GLU N . . . . . . . . . c19602_2mgt 1 . 17 . 9068 . 2 1 12 GLU O O 6.303 0.564 0.169 . . . 1.0 . . . . . . . . . . . . B . 11 GLU O . . . . . . . . . c19602_2mgt 1 . 17 . 9069 . 2 1 12 GLU OE1 O 1.898 -0.640 0.656 . . . 1.0 . . . . . . . . . . . . B . 11 GLU OE1 . . . . . . . . . c19602_2mgt 1 . 17 . 9070 . 2 1 12 GLU OE2 O 1.626 1.324 -0.292 . . . 1.0 . . . . . . . . . . . . B . 11 GLU OE2 . . . . . . . . . c19602_2mgt 1 . 17 . 9071 . 2 1 13 VAL C C 8.344 2.439 -0.862 . . . 1.0 . . . . . . . . . . . . B . 12 VAL C . . . . . . . . . c19602_2mgt 1 . 17 . 9072 . 2 1 13 VAL CA C 8.715 1.058 -1.396 . . . 1.0 . . . . . . . . . . . . B . 12 VAL CA . . . . . . . . . c19602_2mgt 1 . 17 . 9073 . 2 1 13 VAL CB C 9.596 1.134 -2.662 . . . 1.0 . . . . . . . . . . . . B . 12 VAL CB . . . . . . . . . c19602_2mgt 1 . 17 . 9074 . 2 1 13 VAL CG1 C 10.602 2.291 -2.647 . . . 1.0 . . . . . . . . . . . . B . 12 VAL CG1 . . . . . . . . . c19602_2mgt 1 . 17 . 9075 . 2 1 13 VAL CG2 C 10.383 -0.177 -2.810 . . . 1.0 . . . . . . . . . . . . B . 12 VAL CG2 . . . . . . . . . c19602_2mgt 1 . 17 . 9076 . 2 1 13 VAL H H 7.597 -0.279 -2.556 . . . 1.0 . . . . . . . . . . . . B . 12 VAL H . . . . . . . . . c19602_2mgt 1 . 17 . 9077 . 2 1 13 VAL HA H 9.295 0.556 -0.630 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HA . . . . . . . . . c19602_2mgt 1 . 17 . 9078 . 2 1 13 VAL HB H 8.956 1.267 -3.535 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HB . . . . . . . . . c19602_2mgt 1 . 17 . 9079 . 2 1 13 VAL HG11 H 11.188 2.251 -1.732 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HG11 . . . . . . . . . c19602_2mgt 1 . 17 . 9080 . 2 1 13 VAL HG12 H 11.258 2.220 -3.512 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HG12 . . . . . . . . . c19602_2mgt 1 . 17 . 9081 . 2 1 13 VAL HG13 H 10.080 3.245 -2.698 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HG13 . . . . . . . . . c19602_2mgt 1 . 17 . 9082 . 2 1 13 VAL HG21 H 9.696 -1.016 -2.878 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HG21 . . . . . . . . . c19602_2mgt 1 . 17 . 9083 . 2 1 13 VAL HG22 H 10.968 -0.143 -3.722 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HG22 . . . . . . . . . c19602_2mgt 1 . 17 . 9084 . 2 1 13 VAL HG23 H 11.051 -0.312 -1.960 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HG23 . . . . . . . . . c19602_2mgt 1 . 17 . 9085 . 2 1 13 VAL N N 7.554 0.226 -1.685 . . . 1.0 . . . . . . . . . . . . B . 12 VAL N . . . . . . . . . c19602_2mgt 1 . 17 . 9086 . 2 1 13 VAL O O 9.098 2.982 -0.062 . . . 1.0 . . . . . . . . . . . . B . 12 VAL O . . . . . . . . . c19602_2mgt 1 . 17 . 9087 . 2 1 14 HIS C C 6.586 4.487 0.655 . . . 1.0 . . . . . . . . . . . . B . 13 HIS C . . . . . . . . . c19602_2mgt 1 . 17 . 9088 . 2 1 14 HIS CA C 6.789 4.329 -0.857 . . . 1.0 . . . . . . . . . . . . B . 13 HIS CA . . . . . . . . . c19602_2mgt 1 . 17 . 9089 . 2 1 14 HIS CB C 5.519 4.721 -1.616 . . . 1.0 . . . . . . . . . . . . B . 13 HIS CB . . . . . . . . . c19602_2mgt 1 . 17 . 9090 . 2 1 14 HIS CD2 C 4.082 6.507 -0.479 . . . 1.0 . . . . . . . . . . . . B . 13 HIS CD2 . . . . . . . . . c19602_2mgt 1 . 17 . 9091 . 2 1 14 HIS CE1 C 5.073 8.327 -1.197 . . . 1.0 . . . . . . . . . . . . B . 13 HIS CE1 . . . . . . . . . c19602_2mgt 1 . 17 . 9092 . 2 1 14 HIS CG C 5.088 6.132 -1.322 . . . 1.0 . . . . . . . . . . . . B . 13 HIS CG . . . . . . . . . c19602_2mgt 1 . 17 . 9093 . 2 1 14 HIS H H 6.597 2.490 -1.892 . . . 1.0 . . . . . . . . . . . . B . 13 HIS H . . . . . . . . . c19602_2mgt 1 . 17 . 9094 . 2 1 14 HIS HA H 7.602 4.988 -1.155 . . . 1.0 . . . . . . . . . . . . B . 13 HIS HA . . . . . . . . . c19602_2mgt 1 . 17 . 9095 . 2 1 14 HIS HB2 H 5.700 4.638 -2.684 . . . 1.0 . . . . . . . . . . . . B . 13 HIS HB2 . . . . . . . . . c19602_2mgt 1 . 17 . 9096 . 2 1 14 HIS HB3 H 4.713 4.037 -1.348 . . . 1.0 . . . . . . . . . . . . B . 13 HIS HB3 . . . . . . . . . c19602_2mgt 1 . 17 . 9097 . 2 1 14 HIS HD1 H 6.507 7.337 -2.364 . . . 1.0 . . . . . . . . . . . . B . 13 HIS HD1 . . . . . . . . . c19602_2mgt 1 . 17 . 9098 . 2 1 14 HIS HD2 H 3.430 5.840 0.063 . . . 1.0 . . . . . . . . . . . . B . 13 HIS HD2 . . . . . . . . . c19602_2mgt 1 . 17 . 9099 . 2 1 14 HIS HE1 H 5.326 9.364 -1.362 . . . 1.0 . . . . . . . . . . . . B . 13 HIS HE1 . . . . . . . . . c19602_2mgt 1 . 17 . 9100 . 2 1 14 HIS N N 7.194 2.995 -1.253 . . . 1.0 . . . . . . . . . . . . B . 13 HIS N . . . . . . . . . c19602_2mgt 1 . 17 . 9101 . 2 1 14 HIS ND1 N 5.705 7.283 -1.754 . . . 1.0 . . . . . . . . . . . . B . 13 HIS ND1 . . . . . . . . . c19602_2mgt 1 . 17 . 9102 . 2 1 14 HIS NE2 N 4.073 7.902 -0.415 . . . 1.0 . . . . . . . . . . . . B . 13 HIS NE2 . . . . . . . . . c19602_2mgt 1 . 17 . 9103 . 2 1 14 HIS O O 6.659 5.615 1.132 . . . 1.0 . . . . . . . . . . . . B . 13 HIS O . . . . . . . . . c19602_2mgt 1 . 17 . 9104 . 2 1 15 HIS C C 6.500 2.189 3.637 . . . 1.0 . . . . . . . . . . . . B . 14 HIS C . . . . . . . . . c19602_2mgt 1 . 17 . 9105 . 2 1 15 HIS CA C 6.314 3.507 2.875 . . . 1.0 . . . . . . . . . . . . B . 14 HIS CA . . . . . . . . . c19602_2mgt 1 . 17 . 9106 . 2 1 15 HIS CB C 5.034 4.234 3.328 . . . 1.0 . . . . . . . . . . . . B . 14 HIS CB . . . . . . . . . c19602_2mgt 1 . 17 . 9107 . 2 1 15 HIS CD2 C 3.236 2.798 2.181 . . . 1.0 . . . . . . . . . . . . B . 14 HIS CD2 . . . . . . . . . c19602_2mgt 1 . 17 . 9108 . 2 1 15 HIS CE1 C 1.957 2.379 3.905 . . . 1.0 . . . . . . . . . . . . B . 14 HIS CE1 . . . . . . . . . c19602_2mgt 1 . 17 . 9109 . 2 1 15 HIS CG C 3.791 3.398 3.279 . . . 1.0 . . . . . . . . . . . . B . 14 HIS CG . . . . . . . . . c19602_2mgt 1 . 17 . 9110 . 2 1 15 HIS H H 6.349 2.489 0.992 . . . 1.0 . . . . . . . . . . . . B . 14 HIS H . . . . . . . . . c19602_2mgt 1 . 17 . 9111 . 2 1 15 HIS HA H 7.149 4.138 3.161 . . . 1.0 . . . . . . . . . . . . B . 14 HIS HA . . . . . . . . . c19602_2mgt 1 . 17 . 9112 . 2 1 15 HIS HB2 H 5.183 4.563 4.356 . . . 1.0 . . . . . . . . . . . . B . 14 HIS HB2 . . . . . . . . . c19602_2mgt 1 . 17 . 9113 . 2 1 15 HIS HB3 H 4.862 5.132 2.738 . . . 1.0 . . . . . . . . . . . . B . 14 HIS HB3 . . . . . . . . . c19602_2mgt 1 . 17 . 9114 . 2 1 15 HIS HD1 H 3.104 3.454 5.296 . . . 1.0 . . . . . . . . . . . . B . 14 HIS HD1 . . . . . . . . . c19602_2mgt 1 . 17 . 9115 . 2 1 15 HIS HD2 H 3.623 2.821 1.174 . . . 1.0 . . . . . . . . . . . . B . 14 HIS HD2 . . . . . . . . . c19602_2mgt 1 . 17 . 9116 . 2 1 15 HIS HE1 H 1.143 2.030 4.524 . . . 1.0 . . . . . . . . . . . . B . 14 HIS HE1 . . . . . . . . . c19602_2mgt 1 . 17 . 9117 . 2 1 15 HIS N N 6.376 3.405 1.421 . . . 1.0 . . . . . . . . . . . . B . 14 HIS N . . . . . . . . . c19602_2mgt 1 . 17 . 9118 . 2 1 15 HIS ND1 N 2.979 3.123 4.347 . . . 1.0 . . . . . . . . . . . . B . 14 HIS ND1 . . . . . . . . . c19602_2mgt 1 . 17 . 9119 . 2 1 15 HIS NE2 N 2.067 2.154 2.589 . . . 1.0 . . . . . . . . . . . . B . 14 HIS NE2 . . . . . . . . . c19602_2mgt 1 . 17 . 9120 . 2 1 15 HIS O O 6.677 2.240 4.845 . . . 1.0 . . . . . . . . . . . . B . 14 HIS O . . . . . . . . . c19602_2mgt 1 . 17 . 9121 . 2 1 16 GLN C C 7.995 -0.886 3.244 . . . 1.0 . . . . . . . . . . . . B . 15 GLN C . . . . . . . . . c19602_2mgt 1 . 17 . 9122 . 2 1 16 GLN CA C 6.658 -0.270 3.628 . . . 1.0 . . . . . . . . . . . . B . 15 GLN CA . . . . . . . . . c19602_2mgt 1 . 17 . 9123 . 2 1 16 GLN CB C 5.542 -1.233 3.216 . . . 1.0 . . . . . . . . . . . . B . 15 GLN CB . . . . . . . . . c19602_2mgt 1 . 17 . 9124 . 2 1 16 GLN CD C 3.714 -0.499 4.865 . . . 1.0 . . . . . . . . . . . . B . 15 GLN CD . . . . . . . . . c19602_2mgt 1 . 17 . 9125 . 2 1 16 GLN CG C 4.103 -0.732 3.407 . . . 1.0 . . . . . . . . . . . . B . 15 GLN CG . . . . . . . . . c19602_2mgt 1 . 17 . 9126 . 2 1 16 GLN H H 6.321 1.007 1.995 . . . 1.0 . . . . . . . . . . . . B . 15 GLN H . . . . . . . . . c19602_2mgt 1 . 17 . 9127 . 2 1 16 GLN HA H 6.653 -0.147 4.705 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HA . . . . . . . . . c19602_2mgt 1 . 17 . 9128 . 2 1 16 GLN HB2 H 5.687 -1.453 2.164 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HB2 . . . . . . . . . c19602_2mgt 1 . 17 . 9129 . 2 1 16 GLN HB3 H 5.667 -2.159 3.773 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HB3 . . . . . . . . . c19602_2mgt 1 . 17 . 9130 . 2 1 16 GLN HE21 H 1.727 -0.522 4.444 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HE21 . . . . . . . . . c19602_2mgt 1 . 17 . 9131 . 2 1 16 GLN HE22 H 2.143 -0.288 6.125 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HE22 . . . . . . . . . c19602_2mgt 1 . 17 . 9132 . 2 1 16 GLN HG2 H 3.960 0.187 2.846 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HG2 . . . . . . . . . c19602_2mgt 1 . 17 . 9133 . 2 1 16 GLN HG3 H 3.433 -1.476 2.982 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HG3 . . . . . . . . . c19602_2mgt 1 . 17 . 9134 . 2 1 16 GLN N N 6.478 1.023 2.987 . . . 1.0 . . . . . . . . . . . . B . 15 GLN N . . . . . . . . . c19602_2mgt 1 . 17 . 9135 . 2 1 16 GLN NE2 N 2.425 -0.420 5.164 . . . 1.0 . . . . . . . . . . . . B . 15 GLN NE2 . . . . . . . . . c19602_2mgt 1 . 17 . 9136 . 2 1 16 GLN O O 8.467 -0.694 2.127 . . . 1.0 . . . . . . . . . . . . B . 15 GLN O . . . . . . . . . c19602_2mgt 1 . 17 . 9137 . 2 1 16 GLN OE1 O 4.559 -0.390 5.738 . . . 1.0 . . . . . . . . . . . . B . 15 GLN OE1 . . . . . . . . . c19602_2mgt 1 . 17 . 9138 . 2 1 17 LYS C C 9.764 -3.551 3.041 . . . 1.0 . . . . . . . . . . . . B . 16 LYS C . . . . . . . . . c19602_2mgt 1 . 17 . 9139 . 2 1 17 LYS CA C 9.843 -2.352 3.995 . . . 1.0 . . . . . . . . . . . . B . 16 LYS CA . . . . . . . . . c19602_2mgt 1 . 17 . 9140 . 2 1 17 LYS CB C 10.384 -2.825 5.353 . . . 1.0 . . . . . . . . . . . . B . 16 LYS CB . . . . . . . . . c19602_2mgt 1 . 17 . 9141 . 2 1 17 LYS CD C 11.251 -2.209 7.619 . . . 1.0 . . . . . . . . . . . . B . 16 LYS CD . . . . . . . . . c19602_2mgt 1 . 17 . 9142 . 2 1 17 LYS CE C 11.479 -1.100 8.642 . . . 1.0 . . . . . . . . . . . . B . 16 LYS CE . . . . . . . . . c19602_2mgt 1 . 17 . 9143 . 2 1 17 LYS CG C 10.466 -1.711 6.402 . . . 1.0 . . . . . . . . . . . . B . 16 LYS CG . . . . . . . . . c19602_2mgt 1 . 17 . 9144 . 2 1 17 LYS H H 8.059 -1.846 5.022 . . . 1.0 . . . . . . . . . . . . B . 16 LYS H . . . . . . . . . c19602_2mgt 1 . 17 . 9145 . 2 1 17 LYS HA H 10.552 -1.634 3.581 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HA . . . . . . . . . c19602_2mgt 1 . 17 . 9146 . 2 1 17 LYS HB2 H 9.758 -3.627 5.739 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HB2 . . . . . . . . . c19602_2mgt 1 . 17 . 9147 . 2 1 17 LYS HB3 H 11.385 -3.230 5.193 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HB3 . . . . . . . . . c19602_2mgt 1 . 17 . 9148 . 2 1 17 LYS HD2 H 10.731 -3.046 8.085 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HD2 . . . . . . . . . c19602_2mgt 1 . 17 . 9149 . 2 1 17 LYS HD3 H 12.225 -2.554 7.281 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HD3 . . . . . . . . . c19602_2mgt 1 . 17 . 9150 . 2 1 17 LYS HE2 H 12.260 -1.416 9.333 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HE2 . . . . . . . . . c19602_2mgt 1 . 17 . 9151 . 2 1 17 LYS HE3 H 11.806 -0.198 8.129 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HE3 . . . . . . . . . c19602_2mgt 1 . 17 . 9152 . 2 1 17 LYS HG2 H 10.984 -0.854 5.972 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HG2 . . . . . . . . . c19602_2mgt 1 . 17 . 9153 . 2 1 17 LYS HG3 H 9.458 -1.417 6.704 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HG3 . . . . . . . . . c19602_2mgt 1 . 17 . 9154 . 2 1 17 LYS HZ1 H 9.512 -0.559 8.793 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HZ1 . . . . . . . . . c19602_2mgt 1 . 17 . 9155 . 2 1 17 LYS HZ2 H 9.996 -1.636 9.936 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HZ2 . . . . . . . . . c19602_2mgt 1 . 17 . 9156 . 2 1 17 LYS HZ3 H 10.440 -0.057 10.062 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HZ3 . . . . . . . . . c19602_2mgt 1 . 17 . 9157 . 2 1 17 LYS N N 8.560 -1.675 4.163 . . . 1.0 . . . . . . . . . . . . B . 16 LYS N . . . . . . . . . c19602_2mgt 1 . 17 . 9158 . 2 1 17 LYS NZ N 10.266 -0.813 9.415 . . . 1.0 . . . . . . . . . . . . B . 16 LYS NZ . . . . . . . . . c19602_2mgt 1 . 17 . 9159 . 2 1 17 LYS O O 10.798 -4.067 2.641 . . . 1.0 . . . . . . . . . . . . B . 16 LYS O . . . . . . . . . c19602_2mgt 1 . 17 . 9160 . 2 1 18 NH2 HN1 H 8.528 -4.809 2.036 . . . 1.0 . . . . . . . . . . . . B . 17 NH2 HN1 . . . . . . . . . c19602_2mgt 1 . 17 . 9161 . 2 1 18 NH2 HN2 H 7.729 -3.586 3.003 . . . 1.0 . . . . . . . . . . . . B . 17 NH2 HN2 . . . . . . . . . c19602_2mgt 1 . 17 . 9162 . 2 1 18 NH2 N N 8.575 -4.018 2.661 . . . 1.0 . . . . . . . . . . . . B . 17 NH2 N . . . . . . . . . c19602_2mgt 1 . 17 . 9163 . 3 2 1 ZN ZN Zn 0.842 0.824 1.586 . . . 1.0 . . . . . . . . . . . . A . 101 ZN ZN . . . . . . . . . c19602_2mgt 1 . 18 . 9164 . 1 1 1 ACE C C -13.598 -3.597 -5.034 . . . 1.0 . . . . . . . . . . . . A . 0 ACE C . . . . . . . . . c19602_2mgt 1 . 18 . 9165 . 1 1 1 ACE CH3 C -12.250 -4.022 -4.482 . . . 1.0 . . . . . . . . . . . . A . 0 ACE CH3 . . . . . . . . . c19602_2mgt 1 . 18 . 9166 . 1 1 1 ACE H1 H -11.851 -3.232 -3.847 . . . 1.0 . . . . . . . . . . . . A . 0 ACE H1 . . . . . . . . . c19602_2mgt 1 . 18 . 9167 . 1 1 1 ACE H2 H -12.372 -4.937 -3.908 . . . 1.0 . . . . . . . . . . . . A . 0 ACE H2 . . . . . . . . . c19602_2mgt 1 . 18 . 9168 . 1 1 1 ACE H3 H -11.557 -4.212 -5.302 . . . 1.0 . . . . . . . . . . . . A . 0 ACE H3 . . . . . . . . . c19602_2mgt 1 . 18 . 9169 . 1 1 1 ACE O O -13.768 -3.585 -6.244 . . . 1.0 . . . . . . . . . . . . A . 0 ACE O . . . . . . . . . c19602_2mgt 1 . 18 . 9170 . 1 1 2 ASP C C -16.359 -1.595 -3.900 . . . 1.0 . . . . . . . . . . . . A . 1 ASP C . . . . . . . . . c19602_2mgt 1 . 18 . 9171 . 1 1 2 ASP CA C -15.923 -2.924 -4.530 . . . 1.0 . . . . . . . . . . . . A . 1 ASP CA . . . . . . . . . c19602_2mgt 1 . 18 . 9172 . 1 1 2 ASP CB C -16.831 -4.079 -4.103 . . . 1.0 . . . . . . . . . . . . A . 1 ASP CB . . . . . . . . . c19602_2mgt 1 . 18 . 9173 . 1 1 2 ASP CG C -18.197 -4.071 -4.771 . . . 1.0 . . . . . . . . . . . . A . 1 ASP CG . . . . . . . . . c19602_2mgt 1 . 18 . 9174 . 1 1 2 ASP H H -14.346 -3.300 -3.174 . . . 1.0 . . . . . . . . . . . . A . 1 ASP H . . . . . . . . . c19602_2mgt 1 . 18 . 9175 . 1 1 2 ASP HA H -15.981 -2.825 -5.613 . . . 1.0 . . . . . . . . . . . . A . 1 ASP HA . . . . . . . . . c19602_2mgt 1 . 18 . 9176 . 1 1 2 ASP HB2 H -16.352 -5.024 -4.358 . . . 1.0 . . . . . . . . . . . . A . 1 ASP HB2 . . . . . . . . . c19602_2mgt 1 . 18 . 9177 . 1 1 2 ASP HB3 H -16.974 -4.039 -3.023 . . . 1.0 . . . . . . . . . . . . A . 1 ASP HB3 . . . . . . . . . c19602_2mgt 1 . 18 . 9178 . 1 1 2 ASP N N -14.552 -3.260 -4.161 . . . 1.0 . . . . . . . . . . . . A . 1 ASP N . . . . . . . . . c19602_2mgt 1 . 18 . 9179 . 1 1 2 ASP O O -15.825 -1.200 -2.866 . . . 1.0 . . . . . . . . . . . . A . 1 ASP O . . . . . . . . . c19602_2mgt 1 . 18 . 9180 . 1 1 2 ASP OD1 O -18.309 -3.516 -5.891 . . . 1.0 . . . . . . . . . . . . A . 1 ASP OD1 . . . . . . . . . c19602_2mgt 1 . 18 . 9181 . 1 1 2 ASP OD2 O -19.117 -4.635 -4.168 . . . 1.0 . . . . . . . . . . . . A . 1 ASP OD2 . . . . . . . . . c19602_2mgt 1 . 18 . 9182 . 1 1 3 ALA C C -17.708 0.985 -2.945 . . . 1.0 . . . . . . . . . . . . A . 2 ALA C . . . . . . . . . c19602_2mgt 1 . 18 . 9183 . 1 1 3 ALA CA C -17.647 0.501 -4.394 . . . 1.0 . . . . . . . . . . . . A . 2 ALA CA . . . . . . . . . c19602_2mgt 1 . 18 . 9184 . 1 1 3 ALA CB C -18.985 0.776 -5.088 . . . 1.0 . . . . . . . . . . . . A . 2 ALA CB . . . . . . . . . c19602_2mgt 1 . 18 . 9185 . 1 1 3 ALA H H -17.749 -1.377 -5.341 . . . 1.0 . . . . . . . . . . . . A . 2 ALA H . . . . . . . . . c19602_2mgt 1 . 18 . 9186 . 1 1 3 ALA HA H -16.882 1.077 -4.913 . . . 1.0 . . . . . . . . . . . . A . 2 ALA HA . . . . . . . . . c19602_2mgt 1 . 18 . 9187 . 1 1 3 ALA HB1 H -19.238 1.833 -4.998 . . . 1.0 . . . . . . . . . . . . A . 2 ALA HB1 . . . . . . . . . c19602_2mgt 1 . 18 . 9188 . 1 1 3 ALA HB2 H -18.902 0.522 -6.141 . . . 1.0 . . . . . . . . . . . . A . 2 ALA HB2 . . . . . . . . . c19602_2mgt 1 . 18 . 9189 . 1 1 3 ALA HB3 H -19.779 0.182 -4.637 . . . 1.0 . . . . . . . . . . . . A . 2 ALA HB3 . . . . . . . . . c19602_2mgt 1 . 18 . 9190 . 1 1 3 ALA N N -17.322 -0.919 -4.547 . . . 1.0 . . . . . . . . . . . . A . 2 ALA N . . . . . . . . . c19602_2mgt 1 . 18 . 9191 . 1 1 3 ALA O O -17.034 1.949 -2.595 . . . 1.0 . . . . . . . . . . . . A . 2 ALA O . . . . . . . . . c19602_2mgt 1 . 18 . 9192 . 1 1 4 GLU C C -17.589 0.774 0.206 . . . 1.0 . . . . . . . . . . . . A . 3 GLU C . . . . . . . . . c19602_2mgt 1 . 18 . 9193 . 1 1 4 GLU CA C -18.793 0.683 -0.733 . . . 1.0 . . . . . . . . . . . . A . 3 GLU CA . . . . . . . . . c19602_2mgt 1 . 18 . 9194 . 1 1 4 GLU CB C -19.783 -0.327 -0.167 . . . 1.0 . . . . . . . . . . . . A . 3 GLU CB . . . . . . . . . c19602_2mgt 1 . 18 . 9195 . 1 1 4 GLU CD C -20.170 -2.719 0.442 . . . 1.0 . . . . . . . . . . . . A . 3 GLU CD . . . . . . . . . c19602_2mgt 1 . 18 . 9196 . 1 1 4 GLU CG C -19.129 -1.698 -0.010 . . . 1.0 . . . . . . . . . . . . A . 3 GLU CG . . . . . . . . . c19602_2mgt 1 . 18 . 9197 . 1 1 4 GLU H H -18.985 -0.499 -2.477 . . . 1.0 . . . . . . . . . . . . A . 3 GLU H . . . . . . . . . c19602_2mgt 1 . 18 . 9198 . 1 1 4 GLU HA H -19.271 1.660 -0.756 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HA . . . . . . . . . c19602_2mgt 1 . 18 . 9199 . 1 1 4 GLU HB2 H -20.141 0.013 0.800 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HB2 . . . . . . . . . c19602_2mgt 1 . 18 . 9200 . 1 1 4 GLU HB3 H -20.634 -0.404 -0.842 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HB3 . . . . . . . . . c19602_2mgt 1 . 18 . 9201 . 1 1 4 GLU HG2 H -18.622 -1.990 -0.915 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HG2 . . . . . . . . . c19602_2mgt 1 . 18 . 9202 . 1 1 4 GLU HG3 H -18.400 -1.664 0.818 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HG3 . . . . . . . . . c19602_2mgt 1 . 18 . 9203 . 1 1 4 GLU N N -18.493 0.303 -2.109 . . . 1.0 . . . . . . . . . . . . A . 3 GLU N . . . . . . . . . c19602_2mgt 1 . 18 . 9204 . 1 1 4 GLU O O -17.734 1.317 1.294 . . . 1.0 . . . . . . . . . . . . A . 3 GLU O . . . . . . . . . c19602_2mgt 1 . 18 . 9205 . 1 1 4 GLU OE1 O -20.915 -3.150 -0.633 . . . 1.0 . . . . . . . . . . . . A . 3 GLU OE1 . . . . . . . . . c19602_2mgt 1 . 18 . 9206 . 1 1 4 GLU OE2 O -20.297 -3.029 1.487 . . . 1.0 . . . . . . . . . . . . A . 3 GLU OE2 . . . . . . . . . c19602_2mgt 1 . 18 . 9207 . 1 1 5 PHE C C -14.031 0.868 -0.405 . . . 1.0 . . . . . . . . . . . . A . 4 PHE C . . . . . . . . . c19602_2mgt 1 . 18 . 9208 . 1 1 5 PHE CA C -15.163 0.414 0.523 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CA . . . . . . . . . c19602_2mgt 1 . 18 . 9209 . 1 1 5 PHE CB C -14.831 -0.888 1.228 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CB . . . . . . . . . c19602_2mgt 1 . 18 . 9210 . 1 1 5 PHE CD1 C -13.210 -2.153 -0.221 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CD1 . . . . . . . . . c19602_2mgt 1 . 18 . 9211 . 1 1 5 PHE CD2 C -15.504 -2.940 -0.068 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CD2 . . . . . . . . . c19602_2mgt 1 . 18 . 9212 . 1 1 5 PHE CE1 C -12.894 -3.245 -1.038 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CE1 . . . . . . . . . c19602_2mgt 1 . 18 . 9213 . 1 1 5 PHE CE2 C -15.179 -4.051 -0.860 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CE2 . . . . . . . . . c19602_2mgt 1 . 18 . 9214 . 1 1 5 PHE CG C -14.509 -2.020 0.287 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CG . . . . . . . . . c19602_2mgt 1 . 18 . 9215 . 1 1 5 PHE CZ C -13.868 -4.215 -1.328 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CZ . . . . . . . . . c19602_2mgt 1 . 18 . 9216 . 1 1 5 PHE H H -16.397 -0.278 -1.044 . . . 1.0 . . . . . . . . . . . . A . 4 PHE H . . . . . . . . . c19602_2mgt 1 . 18 . 9217 . 1 1 5 PHE HA H -15.275 1.182 1.283 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HA . . . . . . . . . c19602_2mgt 1 . 18 . 9218 . 1 1 5 PHE HB2 H -13.976 -0.717 1.877 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HB2 . . . . . . . . . c19602_2mgt 1 . 18 . 9219 . 1 1 5 PHE HB3 H -15.675 -1.172 1.856 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HB3 . . . . . . . . . c19602_2mgt 1 . 18 . 9220 . 1 1 5 PHE HD1 H -12.459 -1.416 0.025 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HD1 . . . . . . . . . c19602_2mgt 1 . 18 . 9221 . 1 1 5 PHE HD2 H -16.511 -2.802 0.291 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HD2 . . . . . . . . . c19602_2mgt 1 . 18 . 9222 . 1 1 5 PHE HE1 H -11.897 -3.338 -1.425 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HE1 . . . . . . . . . c19602_2mgt 1 . 18 . 9223 . 1 1 5 PHE HE2 H -15.934 -4.779 -1.107 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HE2 . . . . . . . . . c19602_2mgt 1 . 18 . 9224 . 1 1 5 PHE HZ H -13.625 -5.065 -1.945 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HZ . . . . . . . . . c19602_2mgt 1 . 18 . 9225 . 1 1 5 PHE N N -16.424 0.250 -0.185 . . . 1.0 . . . . . . . . . . . . A . 4 PHE N . . . . . . . . . c19602_2mgt 1 . 18 . 9226 . 1 1 5 PHE O O -12.943 1.171 0.075 . . . 1.0 . . . . . . . . . . . . A . 4 PHE O . . . . . . . . . c19602_2mgt 1 . 18 . 9227 . 1 1 6 ARG C C -14.036 3.296 -2.439 . . . 1.0 . . . . . . . . . . . . A . 5 ARG C . . . . . . . . . c19602_2mgt 1 . 18 . 9228 . 1 1 6 ARG CA C -13.546 1.849 -2.612 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CA . . . . . . . . . c19602_2mgt 1 . 18 . 9229 . 1 1 6 ARG CB C -13.634 1.314 -4.050 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CB . . . . . . . . . c19602_2mgt 1 . 18 . 9230 . 1 1 6 ARG CD C -11.398 0.027 -3.785 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CD . . . . . . . . . c19602_2mgt 1 . 18 . 9231 . 1 1 6 ARG CG C -12.855 0.002 -4.259 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CG . . . . . . . . . c19602_2mgt 1 . 18 . 9232 . 1 1 6 ARG CZ C -9.371 1.358 -4.454 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CZ . . . . . . . . . c19602_2mgt 1 . 18 . 9233 . 1 1 6 ARG H H -15.182 0.651 -2.061 . . . 1.0 . . . . . . . . . . . . A . 5 ARG H . . . . . . . . . c19602_2mgt 1 . 18 . 9234 . 1 1 6 ARG HA H -12.506 1.830 -2.304 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HA . . . . . . . . . c19602_2mgt 1 . 18 . 9235 . 1 1 6 ARG HB2 H -14.680 1.157 -4.312 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HB2 . . . . . . . . . c19602_2mgt 1 . 18 . 9236 . 1 1 6 ARG HB3 H -13.231 2.061 -4.731 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HB3 . . . . . . . . . c19602_2mgt 1 . 18 . 9237 . 1 1 6 ARG HD2 H -11.382 0.005 -2.697 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HD2 . . . . . . . . . c19602_2mgt 1 . 18 . 9238 . 1 1 6 ARG HD3 H -10.903 -0.869 -4.154 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HD3 . . . . . . . . . c19602_2mgt 1 . 18 . 9239 . 1 1 6 ARG HE H -11.272 2.014 -4.502 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HE . . . . . . . . . c19602_2mgt 1 . 18 . 9240 . 1 1 6 ARG HG2 H -13.362 -0.804 -3.734 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HG2 . . . . . . . . . c19602_2mgt 1 . 18 . 9241 . 1 1 6 ARG HG3 H -12.859 -0.232 -5.322 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HG3 . . . . . . . . . c19602_2mgt 1 . 18 . 9242 . 1 1 6 ARG HH11 H -8.823 -0.473 -3.752 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH11 . . . . . . . . . c19602_2mgt 1 . 18 . 9243 . 1 1 6 ARG HH12 H -7.512 0.540 -4.312 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH12 . . . . . . . . . c19602_2mgt 1 . 18 . 9244 . 1 1 6 ARG HH21 H -9.560 3.225 -5.237 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH21 . . . . . . . . . c19602_2mgt 1 . 18 . 9245 . 1 1 6 ARG HH22 H -7.929 2.600 -5.166 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH22 . . . . . . . . . c19602_2mgt 1 . 18 . 9246 . 1 1 6 ARG N N -14.296 0.989 -1.712 . . . 1.0 . . . . . . . . . . . . A . 5 ARG N . . . . . . . . . c19602_2mgt 1 . 18 . 9247 . 1 1 6 ARG NE N -10.690 1.222 -4.267 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NE . . . . . . . . . c19602_2mgt 1 . 18 . 9248 . 1 1 6 ARG NH1 N -8.498 0.398 -4.143 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NH1 . . . . . . . . . c19602_2mgt 1 . 18 . 9249 . 1 1 6 ARG NH2 N -8.916 2.489 -4.988 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NH2 . . . . . . . . . c19602_2mgt 1 . 18 . 9250 . 1 1 6 ARG O O -14.398 3.974 -3.395 . . . 1.0 . . . . . . . . . . . . A . 5 ARG O . . . . . . . . . c19602_2mgt 1 . 18 . 9251 . 1 1 7 ARG C C -13.416 6.039 -0.680 . . . 1.0 . . . . . . . . . . . . A . 6 ARG C . . . . . . . . . c19602_2mgt 1 . 18 . 9252 . 1 1 7 ARG CA C -14.566 5.037 -0.739 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CA . . . . . . . . . c19602_2mgt 1 . 18 . 9253 . 1 1 7 ARG CB C -15.173 4.872 0.658 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CB . . . . . . . . . c19602_2mgt 1 . 18 . 9254 . 1 1 7 ARG CD C -17.727 4.488 0.290 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CD . . . . . . . . . c19602_2mgt 1 . 18 . 9255 . 1 1 7 ARG CG C -16.375 3.925 0.729 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CG . . . . . . . . . c19602_2mgt 1 . 18 . 9256 . 1 1 7 ARG CZ C -19.184 4.584 -1.710 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CZ . . . . . . . . . c19602_2mgt 1 . 18 . 9257 . 1 1 7 ARG H H -13.737 3.139 -0.455 . . . 1.0 . . . . . . . . . . . . A . 6 ARG H . . . . . . . . . c19602_2mgt 1 . 18 . 9258 . 1 1 7 ARG HA H -15.332 5.387 -1.425 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HA . . . . . . . . . c19602_2mgt 1 . 18 . 9259 . 1 1 7 ARG HB2 H -14.404 4.449 1.305 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HB2 . . . . . . . . . c19602_2mgt 1 . 18 . 9260 . 1 1 7 ARG HB3 H -15.460 5.847 1.053 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HB3 . . . . . . . . . c19602_2mgt 1 . 18 . 9261 . 1 1 7 ARG HD2 H -18.497 3.959 0.848 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HD2 . . . . . . . . . c19602_2mgt 1 . 18 . 9262 . 1 1 7 ARG HD3 H -17.791 5.545 0.538 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HD3 . . . . . . . . . c19602_2mgt 1 . 18 . 9263 . 1 1 7 ARG HE H -17.367 3.694 -1.651 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HE . . . . . . . . . c19602_2mgt 1 . 18 . 9264 . 1 1 7 ARG HG2 H -16.156 3.022 0.165 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HG2 . . . . . . . . . c19602_2mgt 1 . 18 . 9265 . 1 1 7 ARG HG3 H -16.484 3.648 1.774 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HG3 . . . . . . . . . c19602_2mgt 1 . 18 . 9266 . 1 1 7 ARG HH11 H -19.978 5.557 -0.102 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH11 . . . . . . . . . c19602_2mgt 1 . 18 . 9267 . 1 1 7 ARG HH12 H -20.995 5.500 -1.521 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH12 . . . . . . . . . c19602_2mgt 1 . 18 . 9268 . 1 1 7 ARG HH21 H -18.714 3.704 -3.486 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH21 . . . . . . . . . c19602_2mgt 1 . 18 . 9269 . 1 1 7 ARG HH22 H -20.288 4.458 -3.416 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH22 . . . . . . . . . c19602_2mgt 1 . 18 . 9270 . 1 1 7 ARG N N -14.074 3.748 -1.183 . . . 1.0 . . . . . . . . . . . . A . 6 ARG N . . . . . . . . . c19602_2mgt 1 . 18 . 9271 . 1 1 7 ARG NE N -18.019 4.263 -1.129 . . . 1.0 . . . . . . . . . . . . A . 6 ARG NE . . . . . . . . . c19602_2mgt 1 . 18 . 9272 . 1 1 7 ARG NH1 N -20.130 5.265 -1.055 . . . 1.0 . . . . . . . . . . . . A . 6 ARG NH1 . . . . . . . . . c19602_2mgt 1 . 18 . 9273 . 1 1 7 ARG NH2 N -19.419 4.208 -2.966 . . . 1.0 . . . . . . . . . . . . A . 6 ARG NH2 . . . . . . . . . c19602_2mgt 1 . 18 . 9274 . 1 1 7 ARG O O -12.248 5.672 -0.591 . . . 1.0 . . . . . . . . . . . . A . 6 ARG O . . . . . . . . . c19602_2mgt 1 . 18 . 9275 . 1 1 8 ASP C C -12.235 8.598 0.868 . . . 1.0 . . . . . . . . . . . . A . 7 ASP C . . . . . . . . . c19602_2mgt 1 . 18 . 9276 . 1 1 8 ASP CA C -12.795 8.409 -0.547 . . . 1.0 . . . . . . . . . . . . A . 7 ASP CA . . . . . . . . . c19602_2mgt 1 . 18 . 9277 . 1 1 8 ASP CB C -13.483 9.695 -0.993 . . . 1.0 . . . . . . . . . . . . A . 7 ASP CB . . . . . . . . . c19602_2mgt 1 . 18 . 9278 . 1 1 8 ASP CG C -14.622 10.144 -0.080 . . . 1.0 . . . . . . . . . . . . A . 7 ASP CG . . . . . . . . . c19602_2mgt 1 . 18 . 9279 . 1 1 8 ASP H H -14.728 7.574 -0.744 . . . 1.0 . . . . . . . . . . . . A . 7 ASP H . . . . . . . . . c19602_2mgt 1 . 18 . 9280 . 1 1 8 ASP HA H -11.963 8.220 -1.227 . . . 1.0 . . . . . . . . . . . . A . 7 ASP HA . . . . . . . . . c19602_2mgt 1 . 18 . 9281 . 1 1 8 ASP HB2 H -12.726 10.465 -1.004 . . . 1.0 . . . . . . . . . . . . A . 7 ASP HB2 . . . . . . . . . c19602_2mgt 1 . 18 . 9282 . 1 1 8 ASP HB3 H -13.860 9.558 -2.002 . . . 1.0 . . . . . . . . . . . . A . 7 ASP HB3 . . . . . . . . . c19602_2mgt 1 . 18 . 9283 . 1 1 8 ASP N N -13.752 7.322 -0.670 . . . 1.0 . . . . . . . . . . . . A . 7 ASP N . . . . . . . . . c19602_2mgt 1 . 18 . 9284 . 1 1 8 ASP O O -11.185 9.212 1.022 . . . 1.0 . . . . . . . . . . . . A . 7 ASP O . . . . . . . . . c19602_2mgt 1 . 18 . 9285 . 1 1 8 ASP OD1 O -15.415 9.326 0.370 . . . 1.0 . . . . . . . . . . . . A . 7 ASP OD1 . . . . . . . . . c19602_2mgt 1 . 18 . 9286 . 1 1 8 ASP OD2 O -14.672 11.383 0.162 . . . 1.0 . . . . . . . . . . . . A . 7 ASP OD2 . . . . . . . . . c19602_2mgt 1 . 18 . 9287 . 1 1 9 SER C C -11.339 7.884 3.863 . . . 1.0 . . . . . . . . . . . . A . 8 SER C . . . . . . . . . c19602_2mgt 1 . 18 . 9288 . 1 1 9 SER CA C -12.651 8.444 3.291 . . . 1.0 . . . . . . . . . . . . A . 8 SER CA . . . . . . . . . c19602_2mgt 1 . 18 . 9289 . 1 1 9 SER CB C -13.843 8.044 4.172 . . . 1.0 . . . . . . . . . . . . A . 8 SER CB . . . . . . . . . c19602_2mgt 1 . 18 . 9290 . 1 1 9 SER H H -13.836 7.712 1.694 . . . 1.0 . . . . . . . . . . . . A . 8 SER H . . . . . . . . . c19602_2mgt 1 . 18 . 9291 . 1 1 9 SER HA H -12.561 9.522 3.328 . . . 1.0 . . . . . . . . . . . . A . 8 SER HA . . . . . . . . . c19602_2mgt 1 . 18 . 9292 . 1 1 9 SER HB2 H -14.024 6.974 4.082 . . . 1.0 . . . . . . . . . . . . A . 8 SER HB2 . . . . . . . . . c19602_2mgt 1 . 18 . 9293 . 1 1 9 SER HB3 H -13.622 8.283 5.211 . . . 1.0 . . . . . . . . . . . . A . 8 SER HB3 . . . . . . . . . c19602_2mgt 1 . 18 . 9294 . 1 1 9 SER HG H -15.711 8.512 4.408 . . . 1.0 . . . . . . . . . . . . A . 8 SER HG . . . . . . . . . c19602_2mgt 1 . 18 . 9295 . 1 1 9 SER N N -12.933 8.110 1.898 . . . 1.0 . . . . . . . . . . . . A . 8 SER N . . . . . . . . . c19602_2mgt 1 . 18 . 9296 . 1 1 9 SER O O -11.054 8.149 5.028 . . . 1.0 . . . . . . . . . . . . A . 8 SER O . . . . . . . . . c19602_2mgt 1 . 18 . 9297 . 1 1 9 SER OG O -15.002 8.753 3.804 . . . 1.0 . . . . . . . . . . . . A . 8 SER OG . . . . . . . . . c19602_2mgt 1 . 18 . 9298 . 1 1 10 GLY C C -8.152 7.230 2.689 . . . 1.0 . . . . . . . . . . . . A . 9 GLY C . . . . . . . . . c19602_2mgt 1 . 18 . 9299 . 1 1 10 GLY CA C -9.255 6.614 3.552 . . . 1.0 . . . . . . . . . . . . A . 9 GLY CA . . . . . . . . . c19602_2mgt 1 . 18 . 9300 . 1 1 10 GLY H H -10.693 7.054 2.105 . . . 1.0 . . . . . . . . . . . . A . 9 GLY H . . . . . . . . . c19602_2mgt 1 . 18 . 9301 . 1 1 10 GLY HA2 H -9.069 6.843 4.600 . . . 1.0 . . . . . . . . . . . . A . 9 GLY HA2 . . . . . . . . . c19602_2mgt 1 . 18 . 9302 . 1 1 10 GLY HA3 H -9.291 5.535 3.445 . . . 1.0 . . . . . . . . . . . . A . 9 GLY HA3 . . . . . . . . . c19602_2mgt 1 . 18 . 9303 . 1 1 10 GLY N N -10.528 7.140 3.098 . . . 1.0 . . . . . . . . . . . . A . 9 GLY N . . . . . . . . . c19602_2mgt 1 . 18 . 9304 . 1 1 10 GLY O O -8.143 8.436 2.476 . . . 1.0 . . . . . . . . . . . . A . 9 GLY O . . . . . . . . . c19602_2mgt 1 . 18 . 9305 . 1 1 11 TYR C C -5.765 4.497 1.804 . . . 1.0 . . . . . . . . . . . . A . 10 TYR C . . . . . . . . . c19602_2mgt 1 . 18 . 9306 . 1 1 11 TYR CA C -7.139 5.014 2.206 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CA . . . . . . . . . c19602_2mgt 1 . 18 . 9307 . 1 1 11 TYR CB C -8.165 4.434 1.221 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CB . . . . . . . . . c19602_2mgt 1 . 18 . 9308 . 1 1 11 TYR CD1 C -8.872 2.425 2.613 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CD1 . . . . . . . . . c19602_2mgt 1 . 18 . 9309 . 1 1 11 TYR CD2 C -10.564 3.818 1.569 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CD2 . . . . . . . . . c19602_2mgt 1 . 18 . 9310 . 1 1 11 TYR CE1 C -9.869 1.545 3.060 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CE1 . . . . . . . . . c19602_2mgt 1 . 18 . 9311 . 1 1 11 TYR CE2 C -11.566 2.947 2.011 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CE2 . . . . . . . . . c19602_2mgt 1 . 18 . 9312 . 1 1 11 TYR CG C -9.217 3.540 1.831 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CG . . . . . . . . . c19602_2mgt 1 . 18 . 9313 . 1 1 11 TYR CZ C -11.222 1.785 2.735 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CZ . . . . . . . . . c19602_2mgt 1 . 18 . 9314 . 1 1 11 TYR H H -6.625 6.873 1.456 . . . 1.0 . . . . . . . . . . . . A . 10 TYR H . . . . . . . . . c19602_2mgt 1 . 18 . 9315 . 1 1 11 TYR HA H -7.352 4.676 3.221 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HA . . . . . . . . . c19602_2mgt 1 . 18 . 9316 . 1 1 11 TYR HB2 H -8.663 5.244 0.687 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HB2 . . . . . . . . . c19602_2mgt 1 . 18 . 9317 . 1 1 11 TYR HB3 H -7.648 3.863 0.451 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HB3 . . . . . . . . . c19602_2mgt 1 . 18 . 9318 . 1 1 11 TYR HD1 H -7.844 2.219 2.851 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HD1 . . . . . . . . . c19602_2mgt 1 . 18 . 9319 . 1 1 11 TYR HD2 H -10.820 4.705 1.021 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HD2 . . . . . . . . . c19602_2mgt 1 . 18 . 9320 . 1 1 11 TYR HE1 H -9.591 0.680 3.629 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HE1 . . . . . . . . . c19602_2mgt 1 . 18 . 9321 . 1 1 11 TYR HE2 H -12.596 3.170 1.800 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HE2 . . . . . . . . . c19602_2mgt 1 . 18 . 9322 . 1 1 11 TYR HH H -11.857 0.190 3.655 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HH . . . . . . . . . c19602_2mgt 1 . 18 . 9323 . 1 1 11 TYR N N -7.206 6.456 2.155 . . . 1.0 . . . . . . . . . . . . A . 10 TYR N . . . . . . . . . c19602_2mgt 1 . 18 . 9324 . 1 1 11 TYR O O -5.022 5.117 1.046 . . . 1.0 . . . . . . . . . . . . A . 10 TYR O . . . . . . . . . c19602_2mgt 1 . 18 . 9325 . 1 1 11 TYR OH O -12.197 0.929 3.143 . . . 1.0 . . . . . . . . . . . . A . 10 TYR OH . . . . . . . . . c19602_2mgt 1 . 18 . 9326 . 1 1 12 GLU C C -5.729 0.982 1.648 . . . 1.0 . . . . . . . . . . . . A . 11 GLU C . . . . . . . . . c19602_2mgt 1 . 18 . 9327 . 1 1 12 GLU CA C -4.931 2.259 1.379 . . . 1.0 . . . . . . . . . . . . A . 11 GLU CA . . . . . . . . . c19602_2mgt 1 . 18 . 9328 . 1 1 12 GLU CB C -3.454 2.141 1.732 . . . 1.0 . . . . . . . . . . . . A . 11 GLU CB . . . . . . . . . c19602_2mgt 1 . 18 . 9329 . 1 1 12 GLU CD C -1.385 0.792 1.183 . . . 1.0 . . . . . . . . . . . . A . 11 GLU CD . . . . . . . . . c19602_2mgt 1 . 18 . 9330 . 1 1 12 GLU CG C -2.721 1.308 0.683 . . . 1.0 . . . . . . . . . . . . A . 11 GLU CG . . . . . . . . . c19602_2mgt 1 . 18 . 9331 . 1 1 12 GLU H H -6.127 2.882 2.944 . . . 1.0 . . . . . . . . . . . . A . 11 GLU H . . . . . . . . . c19602_2mgt 1 . 18 . 9332 . 1 1 12 GLU HA H -5.036 2.560 0.336 . . . 1.0 . . . . . . . . . . . . A . 11 GLU HA . . . . . . . . . c19602_2mgt 1 . 18 . 9333 . 1 1 12 GLU HB2 H -3.019 3.136 1.766 . . . 1.0 . . . . . . . . . . . . A . 11 GLU HB2 . . . . . . . . . c19602_2mgt 1 . 18 . 9334 . 1 1 12 GLU HB3 H -3.366 1.688 2.716 . . . 1.0 . . . . . . . . . . . . A . 11 GLU HB3 . . . . . . . . . c19602_2mgt 1 . 18 . 9335 . 1 1 12 GLU HG2 H -3.337 0.448 0.426 . . . 1.0 . . . . . . . . . . . . A . 11 GLU HG2 . . . . . . . . . c19602_2mgt 1 . 18 . 9336 . 1 1 12 GLU HG3 H -2.559 1.908 -0.210 . . . 1.0 . . . . . . . . . . . . A . 11 GLU HG3 . . . . . . . . . c19602_2mgt 1 . 18 . 9337 . 1 1 12 GLU N N -5.539 3.255 2.215 . . . 1.0 . . . . . . . . . . . . A . 11 GLU N . . . . . . . . . c19602_2mgt 1 . 18 . 9338 . 1 1 12 GLU O O -5.556 0.330 2.679 . . . 1.0 . . . . . . . . . . . . A . 11 GLU O . . . . . . . . . c19602_2mgt 1 . 18 . 9339 . 1 1 12 GLU OE1 O -0.655 1.546 1.857 . . . 1.0 . . . . . . . . . . . . A . 11 GLU OE1 . . . . . . . . . c19602_2mgt 1 . 18 . 9340 . 1 1 12 GLU OE2 O -1.108 -0.391 0.925 . . . 1.0 . . . . . . . . . . . . A . 11 GLU OE2 . . . . . . . . . c19602_2mgt 1 . 18 . 9341 . 1 1 13 VAL C C -6.891 -1.764 0.970 . . . 1.0 . . . . . . . . . . . . A . 12 VAL C . . . . . . . . . c19602_2mgt 1 . 18 . 9342 . 1 1 13 VAL CA C -7.606 -0.425 0.804 . . . 1.0 . . . . . . . . . . . . A . 12 VAL CA . . . . . . . . . c19602_2mgt 1 . 18 . 9343 . 1 1 13 VAL CB C -8.503 -0.419 -0.456 . . . 1.0 . . . . . . . . . . . . A . 12 VAL CB . . . . . . . . . c19602_2mgt 1 . 18 . 9344 . 1 1 13 VAL CG1 C -9.435 -1.638 -0.537 . . . 1.0 . . . . . . . . . . . . A . 12 VAL CG1 . . . . . . . . . c19602_2mgt 1 . 18 . 9345 . 1 1 13 VAL CG2 C -9.389 0.834 -0.489 . . . 1.0 . . . . . . . . . . . . A . 12 VAL CG2 . . . . . . . . . c19602_2mgt 1 . 18 . 9346 . 1 1 13 VAL H H -6.709 1.256 -0.098 . . . 1.0 . . . . . . . . . . . . A . 12 VAL H . . . . . . . . . c19602_2mgt 1 . 18 . 9347 . 1 1 13 VAL HA H -8.232 -0.266 1.675 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HA . . . . . . . . . c19602_2mgt 1 . 18 . 9348 . 1 1 13 VAL HB H -7.867 -0.418 -1.340 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HB . . . . . . . . . c19602_2mgt 1 . 18 . 9349 . 1 1 13 VAL HG11 H -8.853 -2.550 -0.674 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HG11 . . . . . . . . . c19602_2mgt 1 . 18 . 9350 . 1 1 13 VAL HG12 H -10.021 -1.713 0.376 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HG12 . . . . . . . . . c19602_2mgt 1 . 18 . 9351 . 1 1 13 VAL HG13 H -10.110 -1.537 -1.386 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HG13 . . . . . . . . . c19602_2mgt 1 . 18 . 9352 . 1 1 13 VAL HG21 H -10.128 0.780 0.307 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HG21 . . . . . . . . . c19602_2mgt 1 . 18 . 9353 . 1 1 13 VAL HG22 H -8.790 1.731 -0.364 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HG22 . . . . . . . . . c19602_2mgt 1 . 18 . 9354 . 1 1 13 VAL HG23 H -9.895 0.898 -1.447 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HG23 . . . . . . . . . c19602_2mgt 1 . 18 . 9355 . 1 1 13 VAL N N -6.646 0.675 0.722 . . . 1.0 . . . . . . . . . . . . A . 12 VAL N . . . . . . . . . c19602_2mgt 1 . 18 . 9356 . 1 1 13 VAL O O -7.455 -2.685 1.557 . . . 1.0 . . . . . . . . . . . . A . 12 VAL O . . . . . . . . . c19602_2mgt 1 . 18 . 9357 . 1 1 14 HIS C C -4.642 -3.534 1.980 . . . 1.0 . . . . . . . . . . . . A . 13 HIS C . . . . . . . . . c19602_2mgt 1 . 18 . 9358 . 1 1 14 HIS CA C -4.849 -3.053 0.544 . . . 1.0 . . . . . . . . . . . . A . 13 HIS CA . . . . . . . . . c19602_2mgt 1 . 18 . 9359 . 1 1 14 HIS CB C -3.503 -2.806 -0.146 . . . 1.0 . . . . . . . . . . . . A . 13 HIS CB . . . . . . . . . c19602_2mgt 1 . 18 . 9360 . 1 1 14 HIS CD2 C -1.452 -4.045 0.766 . . . 1.0 . . . . . . . . . . . . A . 13 HIS CD2 . . . . . . . . . c19602_2mgt 1 . 18 . 9361 . 1 1 14 HIS CE1 C -1.767 -6.018 -0.130 . . . 1.0 . . . . . . . . . . . . A . 13 HIS CE1 . . . . . . . . . c19602_2mgt 1 . 18 . 9362 . 1 1 14 HIS CG C -2.571 -3.978 -0.016 . . . 1.0 . . . . . . . . . . . . A . 13 HIS CG . . . . . . . . . c19602_2mgt 1 . 18 . 9363 . 1 1 14 HIS H H -5.241 -1.051 0.033 . . . 1.0 . . . . . . . . . . . . A . 13 HIS H . . . . . . . . . c19602_2mgt 1 . 18 . 9364 . 1 1 14 HIS HA H -5.409 -3.809 -0.003 . . . 1.0 . . . . . . . . . . . . A . 13 HIS HA . . . . . . . . . c19602_2mgt 1 . 18 . 9365 . 1 1 14 HIS HB2 H -3.663 -2.599 -1.204 . . . 1.0 . . . . . . . . . . . . A . 13 HIS HB2 . . . . . . . . . c19602_2mgt 1 . 18 . 9366 . 1 1 14 HIS HB3 H -3.030 -1.936 0.303 . . . 1.0 . . . . . . . . . . . . A . 13 HIS HB3 . . . . . . . . . c19602_2mgt 1 . 18 . 9367 . 1 1 14 HIS HD1 H -3.501 -5.492 -1.191 . . . 1.0 . . . . . . . . . . . . A . 13 HIS HD1 . . . . . . . . . c19602_2mgt 1 . 18 . 9368 . 1 1 14 HIS HD2 H -1.052 -3.244 1.369 . . . 1.0 . . . . . . . . . . . . A . 13 HIS HD2 . . . . . . . . . c19602_2mgt 1 . 18 . 9369 . 1 1 14 HIS HE1 H -1.648 -7.055 -0.401 . . . 1.0 . . . . . . . . . . . . A . 13 HIS HE1 . . . . . . . . . c19602_2mgt 1 . 18 . 9370 . 1 1 14 HIS N N -5.644 -1.853 0.495 . . . 1.0 . . . . . . . . . . . . A . 13 HIS N . . . . . . . . . c19602_2mgt 1 . 18 . 9371 . 1 1 14 HIS ND1 N -2.754 -5.224 -0.565 . . . 1.0 . . . . . . . . . . . . A . 13 HIS ND1 . . . . . . . . . c19602_2mgt 1 . 18 . 9372 . 1 1 14 HIS NE2 N -0.944 -5.342 0.683 . . . 1.0 . . . . . . . . . . . . A . 13 HIS NE2 . . . . . . . . . c19602_2mgt 1 . 18 . 9373 . 1 1 14 HIS O O -4.729 -4.733 2.207 . . . 1.0 . . . . . . . . . . . . A . 13 HIS O . . . . . . . . . c19602_2mgt 1 . 18 . 9374 . 1 1 15 HIS C C -5.529 -3.381 5.041 . . . 1.0 . . . . . . . . . . . . A . 14 HIS C . . . . . . . . . c19602_2mgt 1 . 18 . 9375 . 1 1 15 HIS CA C -4.208 -3.103 4.329 . . . 1.0 . . . . . . . . . . . . A . 14 HIS CA . . . . . . . . . c19602_2mgt 1 . 18 . 9376 . 1 1 15 HIS CB C -3.334 -2.126 5.106 . . . 1.0 . . . . . . . . . . . . A . 14 HIS CB . . . . . . . . . c19602_2mgt 1 . 18 . 9377 . 1 1 15 HIS CD2 C -1.402 -1.098 3.808 . . . 1.0 . . . . . . . . . . . . A . 14 HIS CD2 . . . . . . . . . c19602_2mgt 1 . 18 . 9378 . 1 1 15 HIS CE1 C 0.083 -2.696 3.937 . . . 1.0 . . . . . . . . . . . . A . 14 HIS CE1 . . . . . . . . . c19602_2mgt 1 . 18 . 9379 . 1 1 15 HIS CG C -1.937 -2.100 4.554 . . . 1.0 . . . . . . . . . . . . A . 14 HIS CG . . . . . . . . . c19602_2mgt 1 . 18 . 9380 . 1 1 15 HIS H H -4.381 -1.656 2.754 . . . 1.0 . . . . . . . . . . . . A . 14 HIS H . . . . . . . . . c19602_2mgt 1 . 18 . 9381 . 1 1 15 HIS HA H -3.665 -4.044 4.292 . . . 1.0 . . . . . . . . . . . . A . 14 HIS HA . . . . . . . . . c19602_2mgt 1 . 18 . 9382 . 1 1 15 HIS HB2 H -3.768 -1.125 5.076 . . . 1.0 . . . . . . . . . . . . A . 14 HIS HB2 . . . . . . . . . c19602_2mgt 1 . 18 . 9383 . 1 1 15 HIS HB3 H -3.285 -2.450 6.144 . . . 1.0 . . . . . . . . . . . . A . 14 HIS HB3 . . . . . . . . . c19602_2mgt 1 . 18 . 9384 . 1 1 15 HIS HD1 H -1.093 -3.975 5.121 . . . 1.0 . . . . . . . . . . . . A . 14 HIS HD1 . . . . . . . . . c19602_2mgt 1 . 18 . 9385 . 1 1 15 HIS HD2 H -1.907 -0.175 3.574 . . . 1.0 . . . . . . . . . . . . A . 14 HIS HD2 . . . . . . . . . c19602_2mgt 1 . 18 . 9386 . 1 1 15 HIS HE1 H 0.996 -3.260 3.837 . . . 1.0 . . . . . . . . . . . . A . 14 HIS HE1 . . . . . . . . . c19602_2mgt 1 . 18 . 9387 . 1 1 15 HIS N N -4.407 -2.648 2.956 . . . 1.0 . . . . . . . . . . . . A . 14 HIS N . . . . . . . . . c19602_2mgt 1 . 18 . 9388 . 1 1 15 HIS ND1 N -0.996 -3.100 4.626 . . . 1.0 . . . . . . . . . . . . A . 14 HIS ND1 . . . . . . . . . c19602_2mgt 1 . 18 . 9389 . 1 1 15 HIS NE2 N -0.117 -1.481 3.409 . . . 1.0 . . . . . . . . . . . . A . 14 HIS NE2 . . . . . . . . . c19602_2mgt 1 . 18 . 9390 . 1 1 15 HIS O O -5.612 -4.360 5.778 . . . 1.0 . . . . . . . . . . . . A . 14 HIS O . . . . . . . . . c19602_2mgt 1 . 18 . 9391 . 1 1 16 GLN C C -8.600 -3.972 5.065 . . . 1.0 . . . . . . . . . . . . A . 15 GLN C . . . . . . . . . c19602_2mgt 1 . 18 . 9392 . 1 1 16 GLN CA C -7.839 -2.727 5.493 . . . 1.0 . . . . . . . . . . . . A . 15 GLN CA . . . . . . . . . c19602_2mgt 1 . 18 . 9393 . 1 1 16 GLN CB C -8.729 -1.508 5.248 . . . 1.0 . . . . . . . . . . . . A . 15 GLN CB . . . . . . . . . c19602_2mgt 1 . 18 . 9394 . 1 1 16 GLN CD C -7.785 -0.427 7.307 . . . 1.0 . . . . . . . . . . . . A . 15 GLN CD . . . . . . . . . c19602_2mgt 1 . 18 . 9395 . 1 1 16 GLN CG C -8.172 -0.217 5.851 . . . 1.0 . . . . . . . . . . . . A . 15 GLN CG . . . . . . . . . c19602_2mgt 1 . 18 . 9396 . 1 1 16 GLN H H -6.462 -1.787 4.181 . . . 1.0 . . . . . . . . . . . . A . 15 GLN H . . . . . . . . . c19602_2mgt 1 . 18 . 9397 . 1 1 16 GLN HA H -7.634 -2.828 6.557 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HA . . . . . . . . . c19602_2mgt 1 . 18 . 9398 . 1 1 16 GLN HB2 H -8.886 -1.381 4.177 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HB2 . . . . . . . . . c19602_2mgt 1 . 18 . 9399 . 1 1 16 GLN HB3 H -9.686 -1.715 5.716 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HB3 . . . . . . . . . c19602_2mgt 1 . 18 . 9400 . 1 1 16 GLN HE21 H -9.688 -0.152 7.963 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HE21 . . . . . . . . . c19602_2mgt 1 . 18 . 9401 . 1 1 16 GLN HE22 H -8.504 -0.508 9.202 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HE22 . . . . . . . . . c19602_2mgt 1 . 18 . 9402 . 1 1 16 GLN HG2 H -7.295 0.094 5.282 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HG2 . . . . . . . . . c19602_2mgt 1 . 18 . 9403 . 1 1 16 GLN HG3 H -8.923 0.570 5.786 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HG3 . . . . . . . . . c19602_2mgt 1 . 18 . 9404 . 1 1 16 GLN N N -6.567 -2.571 4.803 . . . 1.0 . . . . . . . . . . . . A . 15 GLN N . . . . . . . . . c19602_2mgt 1 . 18 . 9405 . 1 1 16 GLN NE2 N -8.740 -0.374 8.229 . . . 1.0 . . . . . . . . . . . . A . 15 GLN NE2 . . . . . . . . . c19602_2mgt 1 . 18 . 9406 . 1 1 16 GLN O O -9.271 -4.587 5.886 . . . 1.0 . . . . . . . . . . . . A . 15 GLN O . . . . . . . . . c19602_2mgt 1 . 18 . 9407 . 1 1 16 GLN OE1 O -6.630 -0.705 7.591 . . . 1.0 . . . . . . . . . . . . A . 15 GLN OE1 . . . . . . . . . c19602_2mgt 1 . 18 . 9408 . 1 1 17 LYS C C -8.281 -6.712 3.157 . . . 1.0 . . . . . . . . . . . . A . 16 LYS C . . . . . . . . . c19602_2mgt 1 . 18 . 9409 . 1 1 17 LYS CA C -9.205 -5.493 3.250 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CA . . . . . . . . . c19602_2mgt 1 . 18 . 9410 . 1 1 17 LYS CB C -9.877 -5.089 1.929 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CB . . . . . . . . . c19602_2mgt 1 . 18 . 9411 . 1 1 17 LYS CD C -11.882 -4.112 3.206 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CD . . . . . . . . . c19602_2mgt 1 . 18 . 9412 . 1 1 17 LYS CE C -12.938 -3.018 3.144 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CE . . . . . . . . . c19602_2mgt 1 . 18 . 9413 . 1 1 17 LYS CG C -10.841 -3.899 2.100 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CG . . . . . . . . . c19602_2mgt 1 . 18 . 9414 . 1 1 17 LYS H H -7.963 -3.775 3.156 . . . 1.0 . . . . . . . . . . . . A . 16 LYS H . . . . . . . . . c19602_2mgt 1 . 18 . 9415 . 1 1 17 LYS HA H -9.995 -5.782 3.937 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HA . . . . . . . . . c19602_2mgt 1 . 18 . 9416 . 1 1 17 LYS HB2 H -9.118 -4.832 1.190 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HB2 . . . . . . . . . c19602_2mgt 1 . 18 . 9417 . 1 1 17 LYS HB3 H -10.450 -5.933 1.550 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HB3 . . . . . . . . . c19602_2mgt 1 . 18 . 9418 . 1 1 17 LYS HD2 H -12.360 -5.082 3.079 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HD2 . . . . . . . . . c19602_2mgt 1 . 18 . 9419 . 1 1 17 LYS HD3 H -11.405 -4.075 4.185 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HD3 . . . . . . . . . c19602_2mgt 1 . 18 . 9420 . 1 1 17 LYS HE2 H -12.448 -2.045 3.196 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HE2 . . . . . . . . . c19602_2mgt 1 . 18 . 9421 . 1 1 17 LYS HE3 H -13.475 -3.099 2.202 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HE3 . . . . . . . . . c19602_2mgt 1 . 18 . 9422 . 1 1 17 LYS HG2 H -10.278 -2.994 2.325 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HG2 . . . . . . . . . c19602_2mgt 1 . 18 . 9423 . 1 1 17 LYS HG3 H -11.354 -3.747 1.155 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HG3 . . . . . . . . . c19602_2mgt 1 . 18 . 9424 . 1 1 17 LYS HZ1 H -14.553 -2.376 4.221 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HZ1 . . . . . . . . . c19602_2mgt 1 . 18 . 9425 . 1 1 17 LYS HZ2 H -14.389 -4.016 4.186 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HZ2 . . . . . . . . . c19602_2mgt 1 . 18 . 9426 . 1 1 17 LYS HZ3 H -13.395 -3.106 5.131 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HZ3 . . . . . . . . . c19602_2mgt 1 . 18 . 9427 . 1 1 17 LYS N N -8.507 -4.340 3.791 . . . 1.0 . . . . . . . . . . . . A . 16 LYS N . . . . . . . . . c19602_2mgt 1 . 18 . 9428 . 1 1 17 LYS NZ N -13.892 -3.138 4.253 . . . 1.0 . . . . . . . . . . . . A . 16 LYS NZ . . . . . . . . . c19602_2mgt 1 . 18 . 9429 . 1 1 17 LYS O O -8.696 -7.748 2.654 . . . 1.0 . . . . . . . . . . . . A . 16 LYS O . . . . . . . . . c19602_2mgt 1 . 18 . 9430 . 1 1 18 NH2 HN1 H -6.428 -7.422 3.601 . . . 1.0 . . . . . . . . . . . . A . 17 NH2 HN1 . . . . . . . . . c19602_2mgt 1 . 18 . 9431 . 1 1 18 NH2 HN2 H -6.730 -5.767 4.084 . . . 1.0 . . . . . . . . . . . . A . 17 NH2 HN2 . . . . . . . . . c19602_2mgt 1 . 18 . 9432 . 1 1 18 NH2 N N -7.048 -6.628 3.663 . . . 1.0 . . . . . . . . . . . . A . 17 NH2 N . . . . . . . . . c19602_2mgt 1 . 18 . 9433 . 2 1 1 ACE C C 9.264 3.239 -7.053 . . . 1.0 . . . . . . . . . . . . B . 0 ACE C . . . . . . . . . c19602_2mgt 1 . 18 . 9434 . 2 1 1 ACE CH3 C 8.029 2.707 -6.358 . . . 1.0 . . . . . . . . . . . . B . 0 ACE CH3 . . . . . . . . . c19602_2mgt 1 . 18 . 9435 . 2 1 1 ACE H1 H 8.265 1.748 -5.905 . . . 1.0 . . . . . . . . . . . . B . 0 ACE H1 . . . . . . . . . c19602_2mgt 1 . 18 . 9436 . 2 1 1 ACE H2 H 7.681 3.398 -5.592 . . . 1.0 . . . . . . . . . . . . B . 0 ACE H2 . . . . . . . . . c19602_2mgt 1 . 18 . 9437 . 2 1 1 ACE H3 H 7.250 2.572 -7.103 . . . 1.0 . . . . . . . . . . . . B . 0 ACE H3 . . . . . . . . . c19602_2mgt 1 . 18 . 9438 . 2 1 1 ACE O O 9.629 2.718 -8.103 . . . 1.0 . . . . . . . . . . . . B . 0 ACE O . . . . . . . . . c19602_2mgt 1 . 18 . 9439 . 2 1 2 ASP C C 12.257 3.952 -7.041 . . . 1.0 . . . . . . . . . . . . B . 1 ASP C . . . . . . . . . c19602_2mgt 1 . 18 . 9440 . 2 1 2 ASP CA C 11.076 4.909 -7.030 . . . 1.0 . . . . . . . . . . . . B . 1 ASP CA . . . . . . . . . c19602_2mgt 1 . 18 . 9441 . 2 1 2 ASP CB C 11.440 6.150 -6.211 . . . 1.0 . . . . . . . . . . . . B . 1 ASP CB . . . . . . . . . c19602_2mgt 1 . 18 . 9442 . 2 1 2 ASP CG C 10.256 7.097 -6.176 . . . 1.0 . . . . . . . . . . . . B . 1 ASP CG . . . . . . . . . c19602_2mgt 1 . 18 . 9443 . 2 1 2 ASP H H 9.529 4.640 -5.607 . . . 1.0 . . . . . . . . . . . . B . 1 ASP H . . . . . . . . . c19602_2mgt 1 . 18 . 9444 . 2 1 2 ASP HA H 10.853 5.214 -8.052 . . . 1.0 . . . . . . . . . . . . B . 1 ASP HA . . . . . . . . . c19602_2mgt 1 . 18 . 9445 . 2 1 2 ASP HB2 H 11.759 5.859 -5.226 . . . 1.0 . . . . . . . . . . . . B . 1 ASP HB2 . . . . . . . . . c19602_2mgt 1 . 18 . 9446 . 2 1 2 ASP HB3 H 12.265 6.675 -6.703 . . . 1.0 . . . . . . . . . . . . B . 1 ASP HB3 . . . . . . . . . c19602_2mgt 1 . 18 . 9447 . 2 1 2 ASP N N 9.891 4.268 -6.472 . . . 1.0 . . . . . . . . . . . . B . 1 ASP N . . . . . . . . . c19602_2mgt 1 . 18 . 9448 . 2 1 2 ASP O O 12.384 3.115 -6.151 . . . 1.0 . . . . . . . . . . . . B . 1 ASP O . . . . . . . . . c19602_2mgt 1 . 18 . 9449 . 2 1 2 ASP OD1 O 9.903 7.608 -7.165 . . . 1.0 . . . . . . . . . . . . B . 1 ASP OD1 . . . . . . . . . c19602_2mgt 1 . 18 . 9450 . 2 1 2 ASP OD2 O 9.688 7.221 -4.991 . . . 1.0 . . . . . . . . . . . . B . 1 ASP OD2 . . . . . . . . . c19602_2mgt 1 . 18 . 9451 . 2 1 3 ALA C C 15.147 3.065 -7.117 . . . 1.0 . . . . . . . . . . . . B . 2 ALA C . . . . . . . . . c19602_2mgt 1 . 18 . 9452 . 2 1 3 ALA CA C 14.221 3.200 -8.320 . . . 1.0 . . . . . . . . . . . . B . 2 ALA CA . . . . . . . . . c19602_2mgt 1 . 18 . 9453 . 2 1 3 ALA CB C 14.970 3.691 -9.559 . . . 1.0 . . . . . . . . . . . . B . 2 ALA CB . . . . . . . . . c19602_2mgt 1 . 18 . 9454 . 2 1 3 ALA H H 12.955 4.842 -8.722 . . . 1.0 . . . . . . . . . . . . B . 2 ALA H . . . . . . . . . c19602_2mgt 1 . 18 . 9455 . 2 1 3 ALA HA H 13.805 2.219 -8.529 . . . 1.0 . . . . . . . . . . . . B . 2 ALA HA . . . . . . . . . c19602_2mgt 1 . 18 . 9456 . 2 1 3 ALA HB1 H 15.768 2.990 -9.800 . . . 1.0 . . . . . . . . . . . . B . 2 ALA HB1 . . . . . . . . . c19602_2mgt 1 . 18 . 9457 . 2 1 3 ALA HB2 H 14.282 3.756 -10.403 . . . 1.0 . . . . . . . . . . . . B . 2 ALA HB2 . . . . . . . . . c19602_2mgt 1 . 18 . 9458 . 2 1 3 ALA HB3 H 15.399 4.675 -9.377 . . . 1.0 . . . . . . . . . . . . B . 2 ALA HB3 . . . . . . . . . c19602_2mgt 1 . 18 . 9459 . 2 1 3 ALA N N 13.122 4.109 -8.047 . . . 1.0 . . . . . . . . . . . . B . 2 ALA N . . . . . . . . . c19602_2mgt 1 . 18 . 9460 . 2 1 3 ALA O O 15.460 1.946 -6.735 . . . 1.0 . . . . . . . . . . . . B . 2 ALA O . . . . . . . . . c19602_2mgt 1 . 18 . 9461 . 2 1 4 GLU C C 15.797 3.488 -4.080 . . . 1.0 . . . . . . . . . . . . B . 3 GLU C . . . . . . . . . c19602_2mgt 1 . 18 . 9462 . 2 1 4 GLU CA C 16.319 4.286 -5.283 . . . 1.0 . . . . . . . . . . . . B . 3 GLU CA . . . . . . . . . c19602_2mgt 1 . 18 . 9463 . 2 1 4 GLU CB C 16.464 5.773 -4.935 . . . 1.0 . . . . . . . . . . . . B . 3 GLU CB . . . . . . . . . c19602_2mgt 1 . 18 . 9464 . 2 1 4 GLU CD C 15.206 7.923 -4.564 . . . 1.0 . . . . . . . . . . . . B . 3 GLU CD . . . . . . . . . c19602_2mgt 1 . 18 . 9465 . 2 1 4 GLU CG C 15.130 6.406 -4.523 . . . 1.0 . . . . . . . . . . . . B . 3 GLU CG . . . . . . . . . c19602_2mgt 1 . 18 . 9466 . 2 1 4 GLU H H 15.131 5.061 -6.840 . . . 1.0 . . . . . . . . . . . . B . 3 GLU H . . . . . . . . . c19602_2mgt 1 . 18 . 9467 . 2 1 4 GLU HA H 17.305 3.898 -5.526 . . . 1.0 . . . . . . . . . . . . B . 3 GLU HA . . . . . . . . . c19602_2mgt 1 . 18 . 9468 . 2 1 4 GLU HB2 H 17.175 5.891 -4.119 . . . 1.0 . . . . . . . . . . . . B . 3 GLU HB2 . . . . . . . . . c19602_2mgt 1 . 18 . 9469 . 2 1 4 GLU HB3 H 16.857 6.297 -5.805 . . . 1.0 . . . . . . . . . . . . B . 3 GLU HB3 . . . . . . . . . c19602_2mgt 1 . 18 . 9470 . 2 1 4 GLU HG2 H 14.330 6.078 -5.186 . . . 1.0 . . . . . . . . . . . . B . 3 GLU HG2 . . . . . . . . . c19602_2mgt 1 . 18 . 9471 . 2 1 4 GLU HG3 H 14.895 6.087 -3.509 . . . 1.0 . . . . . . . . . . . . B . 3 GLU HG3 . . . . . . . . . c19602_2mgt 1 . 18 . 9472 . 2 1 4 GLU N N 15.490 4.189 -6.479 . . . 1.0 . . . . . . . . . . . . B . 3 GLU N . . . . . . . . . c19602_2mgt 1 . 18 . 9473 . 2 1 4 GLU O O 16.571 3.217 -3.172 . . . 1.0 . . . . . . . . . . . . B . 3 GLU O . . . . . . . . . c19602_2mgt 1 . 18 . 9474 . 2 1 4 GLU OE1 O 15.609 8.514 -3.557 . . . 1.0 . . . . . . . . . . . . B . 3 GLU OE1 . . . . . . . . . c19602_2mgt 1 . 18 . 9475 . 2 1 4 GLU OE2 O 14.860 8.484 -5.632 . . . 1.0 . . . . . . . . . . . . B . 3 GLU OE2 . . . . . . . . . c19602_2mgt 1 . 18 . 9476 . 2 1 5 PHE C C 13.494 0.874 -3.550 . . . 1.0 . . . . . . . . . . . . B . 4 PHE C . . . . . . . . . c19602_2mgt 1 . 18 . 9477 . 2 1 5 PHE CA C 13.930 2.244 -3.035 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CA . . . . . . . . . c19602_2mgt 1 . 18 . 9478 . 2 1 5 PHE CB C 12.724 2.957 -2.449 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CB . . . . . . . . . c19602_2mgt 1 . 18 . 9479 . 2 1 5 PHE CD1 C 13.909 4.326 -0.678 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CD1 . . . . . . . . . c19602_2mgt 1 . 18 . 9480 . 2 1 5 PHE CD2 C 12.519 5.452 -2.323 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CD2 . . . . . . . . . c19602_2mgt 1 . 18 . 9481 . 2 1 5 PHE CE1 C 14.197 5.563 -0.079 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CE1 . . . . . . . . . c19602_2mgt 1 . 18 . 9482 . 2 1 5 PHE CE2 C 12.850 6.690 -1.760 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CE2 . . . . . . . . . c19602_2mgt 1 . 18 . 9483 . 2 1 5 PHE CG C 13.049 4.272 -1.789 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CG . . . . . . . . . c19602_2mgt 1 . 18 . 9484 . 2 1 5 PHE CZ C 13.665 6.746 -0.619 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CZ . . . . . . . . . c19602_2mgt 1 . 18 . 9485 . 2 1 5 PHE H H 13.910 3.424 -4.800 . . . 1.0 . . . . . . . . . . . . B . 4 PHE H . . . . . . . . . c19602_2mgt 1 . 18 . 9486 . 2 1 5 PHE HA H 14.652 2.072 -2.239 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HA . . . . . . . . . c19602_2mgt 1 . 18 . 9487 . 2 1 5 PHE HB2 H 12.025 3.128 -3.263 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HB2 . . . . . . . . . c19602_2mgt 1 . 18 . 9488 . 2 1 5 PHE HB3 H 12.243 2.311 -1.718 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HB3 . . . . . . . . . c19602_2mgt 1 . 18 . 9489 . 2 1 5 PHE HD1 H 14.351 3.417 -0.291 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HD1 . . . . . . . . . c19602_2mgt 1 . 18 . 9490 . 2 1 5 PHE HD2 H 11.881 5.403 -3.187 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HD2 . . . . . . . . . c19602_2mgt 1 . 18 . 9491 . 2 1 5 PHE HE1 H 14.852 5.606 0.776 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HE1 . . . . . . . . . c19602_2mgt 1 . 18 . 9492 . 2 1 5 PHE HE2 H 12.479 7.593 -2.209 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HE2 . . . . . . . . . c19602_2mgt 1 . 18 . 9493 . 2 1 5 PHE HZ H 13.891 7.699 -0.172 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HZ . . . . . . . . . c19602_2mgt 1 . 18 . 9494 . 2 1 5 PHE N N 14.518 3.098 -4.064 . . . 1.0 . . . . . . . . . . . . B . 4 PHE N . . . . . . . . . c19602_2mgt 1 . 18 . 9495 . 2 1 5 PHE O O 13.269 -0.006 -2.725 . . . 1.0 . . . . . . . . . . . . B . 4 PHE O . . . . . . . . . c19602_2mgt 1 . 18 . 9496 . 2 1 6 ARG C C 14.628 -1.343 -5.528 . . . 1.0 . . . . . . . . . . . . B . 5 ARG C . . . . . . . . . c19602_2mgt 1 . 18 . 9497 . 2 1 6 ARG CA C 13.259 -0.645 -5.495 . . . 1.0 . . . . . . . . . . . . B . 5 ARG CA . . . . . . . . . c19602_2mgt 1 . 18 . 9498 . 2 1 6 ARG CB C 12.643 -0.498 -6.899 . . . 1.0 . . . . . . . . . . . . B . 5 ARG CB . . . . . . . . . c19602_2mgt 1 . 18 . 9499 . 2 1 6 ARG CD C 10.183 -0.846 -6.133 . . . 1.0 . . . . . . . . . . . . B . 5 ARG CD . . . . . . . . . c19602_2mgt 1 . 18 . 9500 . 2 1 6 ARG CG C 11.184 -0.013 -6.940 . . . 1.0 . . . . . . . . . . . . B . 5 ARG CG . . . . . . . . . c19602_2mgt 1 . 18 . 9501 . 2 1 6 ARG CZ C 9.144 -3.081 -6.569 . . . 1.0 . . . . . . . . . . . . B . 5 ARG CZ . . . . . . . . . c19602_2mgt 1 . 18 . 9502 . 2 1 6 ARG H H 13.581 1.444 -5.495 . . . 1.0 . . . . . . . . . . . . B . 5 ARG H . . . . . . . . . c19602_2mgt 1 . 18 . 9503 . 2 1 6 ARG HA H 12.590 -1.251 -4.884 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HA . . . . . . . . . c19602_2mgt 1 . 18 . 9504 . 2 1 6 ARG HB2 H 13.256 0.199 -7.469 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HB2 . . . . . . . . . c19602_2mgt 1 . 18 . 9505 . 2 1 6 ARG HB3 H 12.683 -1.465 -7.397 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HB3 . . . . . . . . . c19602_2mgt 1 . 18 . 9506 . 2 1 6 ARG HD2 H 10.439 -0.774 -5.081 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HD2 . . . . . . . . . c19602_2mgt 1 . 18 . 9507 . 2 1 6 ARG HD3 H 9.187 -0.430 -6.268 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HD3 . . . . . . . . . c19602_2mgt 1 . 18 . 9508 . 2 1 6 ARG HE H 11.118 -2.708 -6.449 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HE . . . . . . . . . c19602_2mgt 1 . 18 . 9509 . 2 1 6 ARG HG2 H 11.138 1.004 -6.564 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HG2 . . . . . . . . . c19602_2mgt 1 . 18 . 9510 . 2 1 6 ARG HG3 H 10.866 0.005 -7.981 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HG3 . . . . . . . . . c19602_2mgt 1 . 18 . 9511 . 2 1 6 ARG HH11 H 7.721 -1.631 -6.681 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HH11 . . . . . . . . . c19602_2mgt 1 . 18 . 9512 . 2 1 6 ARG HH12 H 7.123 -3.272 -6.734 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HH12 . . . . . . . . . c19602_2mgt 1 . 18 . 9513 . 2 1 6 ARG HH21 H 10.266 -4.776 -6.491 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HH21 . . . . . . . . . c19602_2mgt 1 . 18 . 9514 . 2 1 6 ARG HH22 H 8.539 -5.017 -6.620 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HH22 . . . . . . . . . c19602_2mgt 1 . 18 . 9515 . 2 1 6 ARG N N 13.412 0.666 -4.872 . . . 1.0 . . . . . . . . . . . . B . 5 ARG N . . . . . . . . . c19602_2mgt 1 . 18 . 9516 . 2 1 6 ARG NE N 10.207 -2.272 -6.469 . . . 1.0 . . . . . . . . . . . . B . 5 ARG NE . . . . . . . . . c19602_2mgt 1 . 18 . 9517 . 2 1 6 ARG NH1 N 7.897 -2.625 -6.673 . . . 1.0 . . . . . . . . . . . . B . 5 ARG NH1 . . . . . . . . . c19602_2mgt 1 . 18 . 9518 . 2 1 6 ARG NH2 N 9.332 -4.397 -6.552 . . . 1.0 . . . . . . . . . . . . B . 5 ARG NH2 . . . . . . . . . c19602_2mgt 1 . 18 . 9519 . 2 1 6 ARG O O 15.134 -1.707 -6.587 . . . 1.0 . . . . . . . . . . . . B . 5 ARG O . . . . . . . . . c19602_2mgt 1 . 18 . 9520 . 2 1 7 ARG C C 16.738 -3.443 -3.964 . . . 1.0 . . . . . . . . . . . . B . 6 ARG C . . . . . . . . . c19602_2mgt 1 . 18 . 9521 . 2 1 7 ARG CA C 16.621 -1.939 -4.169 . . . 1.0 . . . . . . . . . . . . B . 6 ARG CA . . . . . . . . . c19602_2mgt 1 . 18 . 9522 . 2 1 7 ARG CB C 17.215 -1.228 -2.943 . . . 1.0 . . . . . . . . . . . . B . 6 ARG CB . . . . . . . . . c19602_2mgt 1 . 18 . 9523 . 2 1 7 ARG CD C 18.341 0.710 -4.175 . . . 1.0 . . . . . . . . . . . . B . 6 ARG CD . . . . . . . . . c19602_2mgt 1 . 18 . 9524 . 2 1 7 ARG CG C 17.309 0.288 -3.117 . . . 1.0 . . . . . . . . . . . . B . 6 ARG CG . . . . . . . . . c19602_2mgt 1 . 18 . 9525 . 2 1 7 ARG CZ C 18.288 0.287 -6.664 . . . 1.0 . . . . . . . . . . . . B . 6 ARG CZ . . . . . . . . . c19602_2mgt 1 . 18 . 9526 . 2 1 7 ARG H H 14.796 -1.107 -3.532 . . . 1.0 . . . . . . . . . . . . B . 6 ARG H . . . . . . . . . c19602_2mgt 1 . 18 . 9527 . 2 1 7 ARG HA H 17.198 -1.685 -5.050 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HA . . . . . . . . . c19602_2mgt 1 . 18 . 9528 . 2 1 7 ARG HB2 H 16.587 -1.439 -2.076 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HB2 . . . . . . . . . c19602_2mgt 1 . 18 . 9529 . 2 1 7 ARG HB3 H 18.214 -1.616 -2.738 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HB3 . . . . . . . . . c19602_2mgt 1 . 18 . 9530 . 2 1 7 ARG HD2 H 18.693 1.712 -3.936 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HD2 . . . . . . . . . c19602_2mgt 1 . 18 . 9531 . 2 1 7 ARG HD3 H 19.193 0.033 -4.139 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HD3 . . . . . . . . . c19602_2mgt 1 . 18 . 9532 . 2 1 7 ARG HE H 16.848 1.188 -5.586 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HE . . . . . . . . . c19602_2mgt 1 . 18 . 9533 . 2 1 7 ARG HG2 H 16.321 0.676 -3.363 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HG2 . . . . . . . . . c19602_2mgt 1 . 18 . 9534 . 2 1 7 ARG HG3 H 17.593 0.720 -2.159 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HG3 . . . . . . . . . c19602_2mgt 1 . 18 . 9535 . 2 1 7 ARG HH11 H 20.052 -0.373 -5.883 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HH11 . . . . . . . . . c19602_2mgt 1 . 18 . 9536 . 2 1 7 ARG HH12 H 19.848 -0.617 -7.603 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HH12 . . . . . . . . . c19602_2mgt 1 . 18 . 9537 . 2 1 7 ARG HH21 H 16.679 0.829 -7.785 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HH21 . . . . . . . . . c19602_2mgt 1 . 18 . 9538 . 2 1 7 ARG HH22 H 17.972 0.042 -8.660 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HH22 . . . . . . . . . c19602_2mgt 1 . 18 . 9539 . 2 1 7 ARG N N 15.252 -1.478 -4.351 . . . 1.0 . . . . . . . . . . . . B . 6 ARG N . . . . . . . . . c19602_2mgt 1 . 18 . 9540 . 2 1 7 ARG NE N 17.757 0.752 -5.521 . . . 1.0 . . . . . . . . . . . . B . 6 ARG NE . . . . . . . . . c19602_2mgt 1 . 18 . 9541 . 2 1 7 ARG NH1 N 19.493 -0.278 -6.719 . . . 1.0 . . . . . . . . . . . . B . 6 ARG NH1 . . . . . . . . . c19602_2mgt 1 . 18 . 9542 . 2 1 7 ARG NH2 N 17.588 0.390 -7.793 . . . 1.0 . . . . . . . . . . . . B . 6 ARG NH2 . . . . . . . . . c19602_2mgt 1 . 18 . 9543 . 2 1 7 ARG O O 17.857 -3.946 -3.963 . . . 1.0 . . . . . . . . . . . . B . 6 ARG O . . . . . . . . . c19602_2mgt 1 . 18 . 9544 . 2 1 8 ASP C C 14.214 -6.082 -3.187 . . . 1.0 . . . . . . . . . . . . B . 7 ASP C . . . . . . . . . c19602_2mgt 1 . 18 . 9545 . 2 1 8 ASP CA C 15.617 -5.481 -3.153 . . . 1.0 . . . . . . . . . . . . B . 7 ASP CA . . . . . . . . . c19602_2mgt 1 . 18 . 9546 . 2 1 8 ASP CB C 16.122 -5.362 -1.710 . . . 1.0 . . . . . . . . . . . . B . 7 ASP CB . . . . . . . . . c19602_2mgt 1 . 18 . 9547 . 2 1 8 ASP CG C 16.291 -6.687 -0.992 . . . 1.0 . . . . . . . . . . . . B . 7 ASP CG . . . . . . . . . c19602_2mgt 1 . 18 . 9548 . 2 1 8 ASP H H 14.731 -3.676 -3.790 . . . 1.0 . . . . . . . . . . . . B . 7 ASP H . . . . . . . . . c19602_2mgt 1 . 18 . 9549 . 2 1 8 ASP HA H 16.293 -6.121 -3.723 . . . 1.0 . . . . . . . . . . . . B . 7 ASP HA . . . . . . . . . c19602_2mgt 1 . 18 . 9550 . 2 1 8 ASP HB2 H 17.092 -4.882 -1.715 . . . 1.0 . . . . . . . . . . . . B . 7 ASP HB2 . . . . . . . . . c19602_2mgt 1 . 18 . 9551 . 2 1 8 ASP HB3 H 15.424 -4.742 -1.144 . . . 1.0 . . . . . . . . . . . . B . 7 ASP HB3 . . . . . . . . . c19602_2mgt 1 . 18 . 9552 . 2 1 8 ASP N N 15.622 -4.149 -3.742 . . . 1.0 . . . . . . . . . . . . B . 7 ASP N . . . . . . . . . c19602_2mgt 1 . 18 . 9553 . 2 1 8 ASP O O 13.238 -5.359 -3.369 . . . 1.0 . . . . . . . . . . . . B . 7 ASP O . . . . . . . . . c19602_2mgt 1 . 18 . 9554 . 2 1 8 ASP OD1 O 16.837 -7.628 -1.619 . . . 1.0 . . . . . . . . . . . . B . 7 ASP OD1 . . . . . . . . . c19602_2mgt 1 . 18 . 9555 . 2 1 8 ASP OD2 O 15.894 -6.758 0.169 . . . 1.0 . . . . . . . . . . . . B . 7 ASP OD2 . . . . . . . . . c19602_2mgt 1 . 18 . 9556 . 2 1 9 SER C C 11.902 -7.474 -1.927 . . . 1.0 . . . . . . . . . . . . B . 8 SER C . . . . . . . . . c19602_2mgt 1 . 18 . 9557 . 2 1 9 SER CA C 12.825 -8.089 -2.974 . . . 1.0 . . . . . . . . . . . . B . 8 SER CA . . . . . . . . . c19602_2mgt 1 . 18 . 9558 . 2 1 9 SER CB C 12.982 -9.577 -2.666 . . . 1.0 . . . . . . . . . . . . B . 8 SER CB . . . . . . . . . c19602_2mgt 1 . 18 . 9559 . 2 1 9 SER H H 14.932 -7.945 -2.799 . . . 1.0 . . . . . . . . . . . . B . 8 SER H . . . . . . . . . c19602_2mgt 1 . 18 . 9560 . 2 1 9 SER HA H 12.400 -7.977 -3.966 . . . 1.0 . . . . . . . . . . . . B . 8 SER HA . . . . . . . . . c19602_2mgt 1 . 18 . 9561 . 2 1 9 SER HB2 H 13.449 -9.691 -1.693 . . . 1.0 . . . . . . . . . . . . B . 8 SER HB2 . . . . . . . . . c19602_2mgt 1 . 18 . 9562 . 2 1 9 SER HB3 H 11.993 -10.032 -2.642 . . . 1.0 . . . . . . . . . . . . B . 8 SER HB3 . . . . . . . . . c19602_2mgt 1 . 18 . 9563 . 2 1 9 SER HG H 13.502 -11.170 -3.630 . . . 1.0 . . . . . . . . . . . . B . 8 SER HG . . . . . . . . . c19602_2mgt 1 . 18 . 9564 . 2 1 9 SER N N 14.104 -7.399 -2.975 . . . 1.0 . . . . . . . . . . . . B . 8 SER N . . . . . . . . . c19602_2mgt 1 . 18 . 9565 . 2 1 9 SER O O 12.307 -7.311 -0.779 . . . 1.0 . . . . . . . . . . . . B . 8 SER O . . . . . . . . . c19602_2mgt 1 . 18 . 9566 . 2 1 9 SER OG O 13.759 -10.242 -3.627 . . . 1.0 . . . . . . . . . . . . B . 8 SER OG . . . . . . . . . c19602_2mgt 1 . 18 . 9567 . 2 1 10 GLY C C 8.326 -6.694 -2.262 . . . 1.0 . . . . . . . . . . . . B . 9 GLY C . . . . . . . . . c19602_2mgt 1 . 18 . 9568 . 2 1 10 GLY CA C 9.642 -6.577 -1.490 . . . 1.0 . . . . . . . . . . . . B . 9 GLY CA . . . . . . . . . c19602_2mgt 1 . 18 . 9569 . 2 1 10 GLY H H 10.406 -7.280 -3.293 . . . 1.0 . . . . . . . . . . . . B . 9 GLY H . . . . . . . . . c19602_2mgt 1 . 18 . 9570 . 2 1 10 GLY HA2 H 9.585 -7.103 -0.539 . . . 1.0 . . . . . . . . . . . . B . 9 GLY HA2 . . . . . . . . . c19602_2mgt 1 . 18 . 9571 . 2 1 10 GLY HA3 H 9.907 -5.540 -1.285 . . . 1.0 . . . . . . . . . . . . B . 9 GLY HA3 . . . . . . . . . c19602_2mgt 1 . 18 . 9572 . 2 1 10 GLY N N 10.673 -7.145 -2.327 . . . 1.0 . . . . . . . . . . . . B . 9 GLY N . . . . . . . . . c19602_2mgt 1 . 18 . 9573 . 2 1 10 GLY O O 7.974 -7.776 -2.721 . . . 1.0 . . . . . . . . . . . . B . 9 GLY O . . . . . . . . . c19602_2mgt 1 . 18 . 9574 . 2 1 11 TYR C C 6.381 -3.583 -1.928 . . . 1.0 . . . . . . . . . . . . B . 10 TYR C . . . . . . . . . c19602_2mgt 1 . 18 . 9575 . 2 1 11 TYR CA C 7.727 -4.296 -1.912 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CA . . . . . . . . . c19602_2mgt 1 . 18 . 9576 . 2 1 11 TYR CB C 8.743 -3.503 -2.753 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CB . . . . . . . . . c19602_2mgt 1 . 18 . 9577 . 2 1 11 TYR CD1 C 9.711 -2.252 -0.761 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CD1 . . . . . . . . . c19602_2mgt 1 . 18 . 9578 . 2 1 11 TYR CD2 C 11.206 -3.092 -2.481 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CD2 . . . . . . . . . c19602_2mgt 1 . 18 . 9579 . 2 1 11 TYR CE1 C 10.806 -1.752 -0.043 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CE1 . . . . . . . . . c19602_2mgt 1 . 18 . 9580 . 2 1 11 TYR CE2 C 12.308 -2.601 -1.770 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CE2 . . . . . . . . . c19602_2mgt 1 . 18 . 9581 . 2 1 11 TYR CG C 9.909 -2.939 -1.973 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CG . . . . . . . . . c19602_2mgt 1 . 18 . 9582 . 2 1 11 TYR CZ C 12.113 -1.925 -0.546 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CZ . . . . . . . . . c19602_2mgt 1 . 18 . 9583 . 2 1 11 TYR H H 6.816 -5.716 -3.121 . . . 1.0 . . . . . . . . . . . . B . 10 TYR H . . . . . . . . . c19602_2mgt 1 . 18 . 9584 . 2 1 11 TYR HA H 8.068 -4.375 -0.880 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HA . . . . . . . . . c19602_2mgt 1 . 18 . 9585 . 2 1 11 TYR HB2 H 9.137 -4.136 -3.546 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HB2 . . . . . . . . . c19602_2mgt 1 . 18 . 9586 . 2 1 11 TYR HB3 H 8.237 -2.684 -3.256 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HB3 . . . . . . . . . c19602_2mgt 1 . 18 . 9587 . 2 1 11 TYR HD1 H 8.721 -2.090 -0.382 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HD1 . . . . . . . . . c19602_2mgt 1 . 18 . 9588 . 2 1 11 TYR HD2 H 11.352 -3.595 -3.420 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HD2 . . . . . . . . . c19602_2mgt 1 . 18 . 9589 . 2 1 11 TYR HE1 H 10.642 -1.247 0.892 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HE1 . . . . . . . . . c19602_2mgt 1 . 18 . 9590 . 2 1 11 TYR HE2 H 13.302 -2.743 -2.160 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HE2 . . . . . . . . . c19602_2mgt 1 . 18 . 9591 . 2 1 11 TYR HH H 12.935 -1.029 0.976 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HH . . . . . . . . . c19602_2mgt 1 . 18 . 9592 . 2 1 11 TYR N N 7.565 -5.624 -2.462 . . . 1.0 . . . . . . . . . . . . B . 10 TYR N . . . . . . . . . c19602_2mgt 1 . 18 . 9593 . 2 1 11 TYR O O 5.483 -3.924 -2.694 . . . 1.0 . . . . . . . . . . . . B . 10 TYR O . . . . . . . . . c19602_2mgt 1 . 18 . 9594 . 2 1 11 TYR OH O 13.183 -1.458 0.153 . . . 1.0 . . . . . . . . . . . . B . 10 TYR OH . . . . . . . . . c19602_2mgt 1 . 18 . 9595 . 2 1 12 GLU C C 5.978 -0.171 -0.946 . . . 1.0 . . . . . . . . . . . . B . 11 GLU C . . . . . . . . . c19602_2mgt 1 . 18 . 9596 . 2 1 12 GLU CA C 5.298 -1.487 -1.319 . . . 1.0 . . . . . . . . . . . . B . 11 GLU CA . . . . . . . . . c19602_2mgt 1 . 18 . 9597 . 2 1 12 GLU CB C 4.061 -1.806 -0.479 . . . 1.0 . . . . . . . . . . . . B . 11 GLU CB . . . . . . . . . c19602_2mgt 1 . 18 . 9598 . 2 1 12 GLU CD C 1.914 -0.620 0.171 . . . 1.0 . . . . . . . . . . . . B . 11 GLU CD . . . . . . . . . c19602_2mgt 1 . 18 . 9599 . 2 1 12 GLU CG C 2.891 -0.940 -0.945 . . . 1.0 . . . . . . . . . . . . B . 11 GLU CG . . . . . . . . . c19602_2mgt 1 . 18 . 9600 . 2 1 12 GLU H H 7.012 -2.339 -0.463 . . . 1.0 . . . . . . . . . . . . B . 11 GLU H . . . . . . . . . c19602_2mgt 1 . 18 . 9601 . 2 1 12 GLU HA H 5.016 -1.458 -2.372 . . . 1.0 . . . . . . . . . . . . B . 11 GLU HA . . . . . . . . . c19602_2mgt 1 . 18 . 9602 . 2 1 12 GLU HB2 H 3.793 -2.852 -0.611 . . . 1.0 . . . . . . . . . . . . B . 11 GLU HB2 . . . . . . . . . c19602_2mgt 1 . 18 . 9603 . 2 1 12 GLU HB3 H 4.290 -1.639 0.574 . . . 1.0 . . . . . . . . . . . . B . 11 GLU HB3 . . . . . . . . . c19602_2mgt 1 . 18 . 9604 . 2 1 12 GLU HG2 H 3.274 0.009 -1.326 . . . 1.0 . . . . . . . . . . . . B . 11 GLU HG2 . . . . . . . . . c19602_2mgt 1 . 18 . 9605 . 2 1 12 GLU HG3 H 2.366 -1.450 -1.752 . . . 1.0 . . . . . . . . . . . . B . 11 GLU HG3 . . . . . . . . . c19602_2mgt 1 . 18 . 9606 . 2 1 12 GLU N N 6.285 -2.520 -1.136 . . . 1.0 . . . . . . . . . . . . B . 11 GLU N . . . . . . . . . c19602_2mgt 1 . 18 . 9607 . 2 1 12 GLU O O 5.721 0.388 0.119 . . . 1.0 . . . . . . . . . . . . B . 11 GLU O . . . . . . . . . c19602_2mgt 1 . 18 . 9608 . 2 1 12 GLU OE1 O 1.521 -1.545 0.916 . . . 1.0 . . . . . . . . . . . . B . 11 GLU OE1 . . . . . . . . . c19602_2mgt 1 . 18 . 9609 . 2 1 12 GLU OE2 O 1.572 0.564 0.290 . . . 1.0 . . . . . . . . . . . . B . 11 GLU OE2 . . . . . . . . . c19602_2mgt 1 . 18 . 9610 . 2 1 13 VAL C C 7.301 2.636 -1.118 . . . 1.0 . . . . . . . . . . . . B . 12 VAL C . . . . . . . . . c19602_2mgt 1 . 18 . 9611 . 2 1 13 VAL CA C 7.888 1.316 -1.613 . . . 1.0 . . . . . . . . . . . . B . 12 VAL CA . . . . . . . . . c19602_2mgt 1 . 18 . 9612 . 2 1 13 VAL CB C 8.740 1.499 -2.891 . . . 1.0 . . . . . . . . . . . . B . 12 VAL CB . . . . . . . . . c19602_2mgt 1 . 18 . 9613 . 2 1 13 VAL CG1 C 9.328 2.901 -3.088 . . . 1.0 . . . . . . . . . . . . B . 12 VAL CG1 . . . . . . . . . c19602_2mgt 1 . 18 . 9614 . 2 1 13 VAL CG2 C 9.920 0.524 -2.858 . . . 1.0 . . . . . . . . . . . . B . 12 VAL CG2 . . . . . . . . . c19602_2mgt 1 . 18 . 9615 . 2 1 13 VAL H H 7.016 -0.274 -2.667 . . . 1.0 . . . . . . . . . . . . B . 12 VAL H . . . . . . . . . c19602_2mgt 1 . 18 . 9616 . 2 1 13 VAL HA H 8.554 0.959 -0.839 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HA . . . . . . . . . c19602_2mgt 1 . 18 . 9617 . 2 1 13 VAL HB H 8.122 1.282 -3.759 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HB . . . . . . . . . c19602_2mgt 1 . 18 . 9618 . 2 1 13 VAL HG11 H 9.946 3.159 -2.229 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HG11 . . . . . . . . . c19602_2mgt 1 . 18 . 9619 . 2 1 13 VAL HG12 H 9.931 2.916 -3.992 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HG12 . . . . . . . . . c19602_2mgt 1 . 18 . 9620 . 2 1 13 VAL HG13 H 8.529 3.629 -3.200 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HG13 . . . . . . . . . c19602_2mgt 1 . 18 . 9621 . 2 1 13 VAL HG21 H 10.607 0.754 -3.669 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HG21 . . . . . . . . . c19602_2mgt 1 . 18 . 9622 . 2 1 13 VAL HG22 H 10.459 0.615 -1.914 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HG22 . . . . . . . . . c19602_2mgt 1 . 18 . 9623 . 2 1 13 VAL HG23 H 9.543 -0.487 -2.975 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HG23 . . . . . . . . . c19602_2mgt 1 . 18 . 9624 . 2 1 13 VAL N N 6.900 0.262 -1.820 . . . 1.0 . . . . . . . . . . . . B . 12 VAL N . . . . . . . . . c19602_2mgt 1 . 18 . 9625 . 2 1 13 VAL O O 8.040 3.421 -0.535 . . . 1.0 . . . . . . . . . . . . B . 12 VAL O . . . . . . . . . c19602_2mgt 1 . 18 . 9626 . 2 1 14 HIS C C 5.507 4.132 0.824 . . . 1.0 . . . . . . . . . . . . B . 13 HIS C . . . . . . . . . c19602_2mgt 1 . 18 . 9627 . 2 1 14 HIS CA C 5.383 4.066 -0.713 . . . 1.0 . . . . . . . . . . . . B . 13 HIS CA . . . . . . . . . c19602_2mgt 1 . 18 . 9628 . 2 1 14 HIS CB C 3.926 4.156 -1.175 . . . 1.0 . . . . . . . . . . . . B . 13 HIS CB . . . . . . . . . c19602_2mgt 1 . 18 . 9629 . 2 1 14 HIS CD2 C 3.394 3.720 -3.655 . . . 1.0 . . . . . . . . . . . . B . 13 HIS CD2 . . . . . . . . . c19602_2mgt 1 . 18 . 9630 . 2 1 14 HIS CE1 C 3.758 5.712 -4.479 . . . 1.0 . . . . . . . . . . . . B . 13 HIS CE1 . . . . . . . . . c19602_2mgt 1 . 18 . 9631 . 2 1 14 HIS CG C 3.790 4.531 -2.627 . . . 1.0 . . . . . . . . . . . . B . 13 HIS CG . . . . . . . . . c19602_2mgt 1 . 18 . 9632 . 2 1 14 HIS H H 5.413 2.215 -1.761 . . . 1.0 . . . . . . . . . . . . B . 13 HIS H . . . . . . . . . c19602_2mgt 1 . 18 . 9633 . 2 1 14 HIS HA H 5.936 4.914 -1.116 . . . 1.0 . . . . . . . . . . . . B . 13 HIS HA . . . . . . . . . c19602_2mgt 1 . 18 . 9634 . 2 1 14 HIS HB2 H 3.432 3.199 -1.001 . . . 1.0 . . . . . . . . . . . . B . 13 HIS HB2 . . . . . . . . . c19602_2mgt 1 . 18 . 9635 . 2 1 14 HIS HB3 H 3.414 4.919 -0.588 . . . 1.0 . . . . . . . . . . . . B . 13 HIS HB3 . . . . . . . . . c19602_2mgt 1 . 18 . 9636 . 2 1 14 HIS HD1 H 4.329 6.595 -2.660 . . . 1.0 . . . . . . . . . . . . B . 13 HIS HD1 . . . . . . . . . c19602_2mgt 1 . 18 . 9637 . 2 1 14 HIS HD2 H 3.132 2.677 -3.572 . . . 1.0 . . . . . . . . . . . . B . 13 HIS HD2 . . . . . . . . . c19602_2mgt 1 . 18 . 9638 . 2 1 14 HIS HE1 H 3.840 6.547 -5.159 . . . 1.0 . . . . . . . . . . . . B . 13 HIS HE1 . . . . . . . . . c19602_2mgt 1 . 18 . 9639 . 2 1 14 HIS N N 5.999 2.884 -1.283 . . . 1.0 . . . . . . . . . . . . B . 13 HIS N . . . . . . . . . c19602_2mgt 1 . 18 . 9640 . 2 1 14 HIS ND1 N 4.020 5.775 -3.164 . . . 1.0 . . . . . . . . . . . . B . 13 HIS ND1 . . . . . . . . . c19602_2mgt 1 . 18 . 9641 . 2 1 14 HIS NE2 N 3.368 4.477 -4.830 . . . 1.0 . . . . . . . . . . . . B . 13 HIS NE2 . . . . . . . . . c19602_2mgt 1 . 18 . 9642 . 2 1 14 HIS O O 5.416 5.228 1.362 . . . 1.0 . . . . . . . . . . . . B . 13 HIS O . . . . . . . . . c19602_2mgt 1 . 18 . 9643 . 2 1 15 HIS C C 7.585 3.172 3.254 . . . 1.0 . . . . . . . . . . . . B . 14 HIS C . . . . . . . . . c19602_2mgt 1 . 18 . 9644 . 2 1 15 HIS CA C 6.083 3.054 2.974 . . . 1.0 . . . . . . . . . . . . B . 14 HIS CA . . . . . . . . . c19602_2mgt 1 . 18 . 9645 . 2 1 15 HIS CB C 5.554 1.787 3.642 . . . 1.0 . . . . . . . . . . . . B . 14 HIS CB . . . . . . . . . c19602_2mgt 1 . 18 . 9646 . 2 1 15 HIS CD2 C 3.310 0.822 2.906 . . . 1.0 . . . . . . . . . . . . B . 14 HIS CD2 . . . . . . . . . c19602_2mgt 1 . 18 . 9647 . 2 1 15 HIS CE1 C 1.948 2.104 4.032 . . . 1.0 . . . . . . . . . . . . B . 14 HIS CE1 . . . . . . . . . c19602_2mgt 1 . 18 . 9648 . 2 1 15 HIS CG C 4.060 1.700 3.632 . . . 1.0 . . . . . . . . . . . . B . 14 HIS CG . . . . . . . . . c19602_2mgt 1 . 18 . 9649 . 2 1 15 HIS H H 5.835 2.138 1.062 . . . 1.0 . . . . . . . . . . . . B . 14 HIS H . . . . . . . . . c19602_2mgt 1 . 18 . 9650 . 2 1 15 HIS HA H 5.591 3.909 3.437 . . . 1.0 . . . . . . . . . . . . B . 14 HIS HA . . . . . . . . . c19602_2mgt 1 . 18 . 9651 . 2 1 15 HIS HB2 H 5.965 0.910 3.144 . . . 1.0 . . . . . . . . . . . . B . 14 HIS HB2 . . . . . . . . . c19602_2mgt 1 . 18 . 9652 . 2 1 15 HIS HB3 H 5.882 1.773 4.680 . . . 1.0 . . . . . . . . . . . . B . 14 HIS HB3 . . . . . . . . . c19602_2mgt 1 . 18 . 9653 . 2 1 15 HIS HD1 H 3.442 3.248 4.964 . . . 1.0 . . . . . . . . . . . . B . 14 HIS HD1 . . . . . . . . . c19602_2mgt 1 . 18 . 9654 . 2 1 15 HIS HD2 H 3.703 0.064 2.248 . . . 1.0 . . . . . . . . . . . . B . 14 HIS HD2 . . . . . . . . . c19602_2mgt 1 . 18 . 9655 . 2 1 15 HIS HE1 H 1.054 2.559 4.427 . . . 1.0 . . . . . . . . . . . . B . 14 HIS HE1 . . . . . . . . . c19602_2mgt 1 . 18 . 9656 . 2 1 15 HIS N N 5.769 3.027 1.540 . . . 1.0 . . . . . . . . . . . . B . 14 HIS N . . . . . . . . . c19602_2mgt 1 . 18 . 9657 . 2 1 15 HIS ND1 N 3.192 2.487 4.346 . . . 1.0 . . . . . . . . . . . . B . 14 HIS ND1 . . . . . . . . . c19602_2mgt 1 . 18 . 9658 . 2 1 15 HIS NE2 N 1.963 1.089 3.158 . . . 1.0 . . . . . . . . . . . . B . 14 HIS NE2 . . . . . . . . . c19602_2mgt 1 . 18 . 9659 . 2 1 15 HIS O O 7.967 3.737 4.273 . . . 1.0 . . . . . . . . . . . . B . 14 HIS O . . . . . . . . . c19602_2mgt 1 . 18 . 9660 . 2 1 16 GLN C C 10.345 4.196 2.254 . . . 1.0 . . . . . . . . . . . . B . 15 GLN C . . . . . . . . . c19602_2mgt 1 . 18 . 9661 . 2 1 16 GLN CA C 9.882 2.753 2.466 . . . 1.0 . . . . . . . . . . . . B . 15 GLN CA . . . . . . . . . c19602_2mgt 1 . 18 . 9662 . 2 1 16 GLN CB C 10.461 1.793 1.424 . . . 1.0 . . . . . . . . . . . . B . 15 GLN CB . . . . . . . . . c19602_2mgt 1 . 18 . 9663 . 2 1 16 GLN CD C 12.858 1.599 2.249 . . . 1.0 . . . . . . . . . . . . B . 15 GLN CD . . . . . . . . . c19602_2mgt 1 . 18 . 9664 . 2 1 16 GLN CG C 11.940 1.932 1.085 . . . 1.0 . . . . . . . . . . . . B . 15 GLN CG . . . . . . . . . c19602_2mgt 1 . 18 . 9665 . 2 1 16 GLN H H 8.082 2.176 1.557 . . . 1.0 . . . . . . . . . . . . B . 15 GLN H . . . . . . . . . c19602_2mgt 1 . 18 . 9666 . 2 1 16 GLN HA H 10.192 2.414 3.448 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HA . . . . . . . . . c19602_2mgt 1 . 18 . 9667 . 2 1 16 GLN HB2 H 10.287 0.782 1.775 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HB2 . . . . . . . . . c19602_2mgt 1 . 18 . 9668 . 2 1 16 GLN HB3 H 9.916 1.929 0.499 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HB3 . . . . . . . . . c19602_2mgt 1 . 18 . 9669 . 2 1 16 GLN HE21 H 12.923 3.532 2.873 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HE21 . . . . . . . . . c19602_2mgt 1 . 18 . 9670 . 2 1 16 GLN HE22 H 13.885 2.400 3.803 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HE22 . . . . . . . . . c19602_2mgt 1 . 18 . 9671 . 2 1 16 GLN HG2 H 12.158 1.241 0.271 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HG2 . . . . . . . . . c19602_2mgt 1 . 18 . 9672 . 2 1 16 GLN HG3 H 12.128 2.942 0.732 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HG3 . . . . . . . . . c19602_2mgt 1 . 18 . 9673 . 2 1 16 GLN N N 8.438 2.658 2.367 . . . 1.0 . . . . . . . . . . . . B . 15 GLN N . . . . . . . . . c19602_2mgt 1 . 18 . 9674 . 2 1 16 GLN NE2 N 13.259 2.594 3.034 . . . 1.0 . . . . . . . . . . . . B . 15 GLN NE2 . . . . . . . . . c19602_2mgt 1 . 18 . 9675 . 2 1 16 GLN O O 11.199 4.664 2.992 . . . 1.0 . . . . . . . . . . . . B . 15 GLN O . . . . . . . . . c19602_2mgt 1 . 18 . 9676 . 2 1 16 GLN OE1 O 13.217 0.445 2.438 . . . 1.0 . . . . . . . . . . . . B . 15 GLN OE1 . . . . . . . . . c19602_2mgt 1 . 18 . 9677 . 2 1 17 LYS C C 10.357 7.259 1.774 . . . 1.0 . . . . . . . . . . . . B . 16 LYS C . . . . . . . . . c19602_2mgt 1 . 18 . 9678 . 2 1 17 LYS CA C 10.178 6.163 0.710 . . . 1.0 . . . . . . . . . . . . B . 16 LYS CA . . . . . . . . . c19602_2mgt 1 . 18 . 9679 . 2 1 17 LYS CB C 9.130 6.556 -0.344 . . . 1.0 . . . . . . . . . . . . B . 16 LYS CB . . . . . . . . . c19602_2mgt 1 . 18 . 9680 . 2 1 17 LYS CD C 8.273 8.286 -1.948 . . . 1.0 . . . . . . . . . . . . B . 16 LYS CD . . . . . . . . . c19602_2mgt 1 . 18 . 9681 . 2 1 17 LYS CE C 8.482 9.684 -2.523 . . . 1.0 . . . . . . . . . . . . B . 16 LYS CE . . . . . . . . . c19602_2mgt 1 . 18 . 9682 . 2 1 17 LYS CG C 9.440 7.874 -1.056 . . . 1.0 . . . . . . . . . . . . B . 16 LYS CG . . . . . . . . . c19602_2mgt 1 . 18 . 9683 . 2 1 17 LYS H H 9.049 4.387 0.749 . . . 1.0 . . . . . . . . . . . . B . 16 LYS H . . . . . . . . . c19602_2mgt 1 . 18 . 9684 . 2 1 17 LYS HA H 11.131 6.014 0.208 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HA . . . . . . . . . c19602_2mgt 1 . 18 . 9685 . 2 1 17 LYS HB2 H 9.073 5.771 -1.099 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HB2 . . . . . . . . . c19602_2mgt 1 . 18 . 9686 . 2 1 17 LYS HB3 H 8.158 6.636 0.146 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HB3 . . . . . . . . . c19602_2mgt 1 . 18 . 9687 . 2 1 17 LYS HD2 H 8.147 7.565 -2.754 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HD2 . . . . . . . . . c19602_2mgt 1 . 18 . 9688 . 2 1 17 LYS HD3 H 7.370 8.303 -1.347 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HD3 . . . . . . . . . c19602_2mgt 1 . 18 . 9689 . 2 1 17 LYS HE2 H 7.541 10.030 -2.951 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HE2 . . . . . . . . . c19602_2mgt 1 . 18 . 9690 . 2 1 17 LYS HE3 H 8.775 10.366 -1.722 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HE3 . . . . . . . . . c19602_2mgt 1 . 18 . 9691 . 2 1 17 LYS HG2 H 9.597 8.659 -0.321 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HG2 . . . . . . . . . c19602_2mgt 1 . 18 . 9692 . 2 1 17 LYS HG3 H 10.337 7.762 -1.660 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HG3 . . . . . . . . . c19602_2mgt 1 . 18 . 9693 . 2 1 17 LYS HZ1 H 9.584 10.620 -3.965 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HZ1 . . . . . . . . . c19602_2mgt 1 . 18 . 9694 . 2 1 17 LYS HZ2 H 10.399 9.422 -3.183 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HZ2 . . . . . . . . . c19602_2mgt 1 . 18 . 9695 . 2 1 17 LYS HZ3 H 9.252 9.043 -4.299 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HZ3 . . . . . . . . . c19602_2mgt 1 . 18 . 9696 . 2 1 17 LYS N N 9.767 4.876 1.260 . . . 1.0 . . . . . . . . . . . . B . 16 LYS N . . . . . . . . . c19602_2mgt 1 . 18 . 9697 . 2 1 17 LYS NZ N 9.506 9.693 -3.569 . . . 1.0 . . . . . . . . . . . . B . 16 LYS NZ . . . . . . . . . c19602_2mgt 1 . 18 . 9698 . 2 1 17 LYS O O 9.546 7.413 2.681 . . . 1.0 . . . . . . . . . . . . B . 16 LYS O . . . . . . . . . c19602_2mgt 1 . 18 . 9699 . 2 1 18 NH2 HN1 H 11.555 8.806 2.315 . . . 1.0 . . . . . . . . . . . . B . 17 NH2 HN1 . . . . . . . . . c19602_2mgt 1 . 18 . 9700 . 2 1 18 NH2 HN2 H 12.063 7.930 0.886 . . . 1.0 . . . . . . . . . . . . B . 17 NH2 HN2 . . . . . . . . . c19602_2mgt 1 . 18 . 9701 . 2 1 18 NH2 N N 11.410 8.066 1.643 . . . 1.0 . . . . . . . . . . . . B . 17 NH2 N . . . . . . . . . c19602_2mgt 1 . 18 . 9702 . 3 2 1 ZN ZN Zn 0.629 -0.073 2.071 . . . 1.0 . . . . . . . . . . . . A . 101 ZN ZN . . . . . . . . . c19602_2mgt 1 . 19 . 9703 . 1 1 1 ACE C C -14.071 -7.868 2.283 . . . 1.0 . . . . . . . . . . . . A . 0 ACE C . . . . . . . . . c19602_2mgt 1 . 19 . 9704 . 1 1 1 ACE CH3 C -14.741 -9.209 2.555 . . . 1.0 . . . . . . . . . . . . A . 0 ACE CH3 . . . . . . . . . c19602_2mgt 1 . 19 . 9705 . 1 1 1 ACE H1 H -14.133 -10.013 2.139 . . . 1.0 . . . . . . . . . . . . A . 0 ACE H1 . . . . . . . . . c19602_2mgt 1 . 19 . 9706 . 1 1 1 ACE H2 H -14.852 -9.363 3.627 . . . 1.0 . . . . . . . . . . . . A . 0 ACE H2 . . . . . . . . . c19602_2mgt 1 . 19 . 9707 . 1 1 1 ACE H3 H -15.721 -9.228 2.082 . . . 1.0 . . . . . . . . . . . . A . 0 ACE H3 . . . . . . . . . c19602_2mgt 1 . 19 . 9708 . 1 1 1 ACE O O -13.751 -7.128 3.210 . . . 1.0 . . . . . . . . . . . . A . 0 ACE O . . . . . . . . . c19602_2mgt 1 . 19 . 9709 . 1 1 2 ASP C C -14.214 -5.136 0.702 . . . 1.0 . . . . . . . . . . . . A . 1 ASP C . . . . . . . . . c19602_2mgt 1 . 19 . 9710 . 1 1 2 ASP CA C -13.248 -6.307 0.566 . . . 1.0 . . . . . . . . . . . . A . 1 ASP CA . . . . . . . . . c19602_2mgt 1 . 19 . 9711 . 1 1 2 ASP CB C -12.863 -6.391 -0.918 . . . 1.0 . . . . . . . . . . . . A . 1 ASP CB . . . . . . . . . c19602_2mgt 1 . 19 . 9712 . 1 1 2 ASP CG C -11.523 -7.058 -1.192 . . . 1.0 . . . . . . . . . . . . A . 1 ASP CG . . . . . . . . . c19602_2mgt 1 . 19 . 9713 . 1 1 2 ASP H H -14.154 -8.202 0.286 . . . 1.0 . . . . . . . . . . . . A . 1 ASP H . . . . . . . . . c19602_2mgt 1 . 19 . 9714 . 1 1 2 ASP HA H -12.358 -6.100 1.160 . . . 1.0 . . . . . . . . . . . . A . 1 ASP HA . . . . . . . . . c19602_2mgt 1 . 19 . 9715 . 1 1 2 ASP HB2 H -13.639 -6.919 -1.470 . . . 1.0 . . . . . . . . . . . . A . 1 ASP HB2 . . . . . . . . . c19602_2mgt 1 . 19 . 9716 . 1 1 2 ASP HB3 H -12.807 -5.371 -1.302 . . . 1.0 . . . . . . . . . . . . A . 1 ASP HB3 . . . . . . . . . c19602_2mgt 1 . 19 . 9717 . 1 1 2 ASP N N -13.857 -7.555 1.003 . . . 1.0 . . . . . . . . . . . . A . 1 ASP N . . . . . . . . . c19602_2mgt 1 . 19 . 9718 . 1 1 2 ASP O O -13.752 -4.039 0.988 . . . 1.0 . . . . . . . . . . . . A . 1 ASP O . . . . . . . . . c19602_2mgt 1 . 19 . 9719 . 1 1 2 ASP OD1 O -11.304 -8.189 -0.730 . . . 1.0 . . . . . . . . . . . . A . 1 ASP OD1 . . . . . . . . . c19602_2mgt 1 . 19 . 9720 . 1 1 2 ASP OD2 O -10.721 -6.429 -1.911 . . . 1.0 . . . . . . . . . . . . A . 1 ASP OD2 . . . . . . . . . c19602_2mgt 1 . 19 . 9721 . 1 1 3 ALA C C -16.628 -3.256 1.177 . . . 1.0 . . . . . . . . . . . . A . 2 ALA C . . . . . . . . . c19602_2mgt 1 . 19 . 9722 . 1 1 3 ALA CA C -16.458 -4.300 0.082 . . . 1.0 . . . . . . . . . . . . A . 2 ALA CA . . . . . . . . . c19602_2mgt 1 . 19 . 9723 . 1 1 3 ALA CB C -17.799 -4.941 -0.271 . . . 1.0 . . . . . . . . . . . . A . 2 ALA CB . . . . . . . . . c19602_2mgt 1 . 19 . 9724 . 1 1 3 ALA H H -15.803 -6.304 0.248 . . . 1.0 . . . . . . . . . . . . A . 2 ALA H . . . . . . . . . c19602_2mgt 1 . 19 . 9725 . 1 1 3 ALA HA H -16.087 -3.784 -0.801 . . . 1.0 . . . . . . . . . . . . A . 2 ALA HA . . . . . . . . . c19602_2mgt 1 . 19 . 9726 . 1 1 3 ALA HB1 H -18.485 -4.171 -0.621 . . . 1.0 . . . . . . . . . . . . A . 2 ALA HB1 . . . . . . . . . c19602_2mgt 1 . 19 . 9727 . 1 1 3 ALA HB2 H -17.665 -5.684 -1.056 . . . 1.0 . . . . . . . . . . . . A . 2 ALA HB2 . . . . . . . . . c19602_2mgt 1 . 19 . 9728 . 1 1 3 ALA HB3 H -18.219 -5.418 0.611 . . . 1.0 . . . . . . . . . . . . A . 2 ALA HB3 . . . . . . . . . c19602_2mgt 1 . 19 . 9729 . 1 1 3 ALA N N -15.512 -5.355 0.436 . . . 1.0 . . . . . . . . . . . . A . 2 ALA N . . . . . . . . . c19602_2mgt 1 . 19 . 9730 . 1 1 3 ALA O O -16.666 -2.069 0.879 . . . 1.0 . . . . . . . . . . . . A . 2 ALA O . . . . . . . . . c19602_2mgt 1 . 19 . 9731 . 1 1 4 GLU C C -15.467 -1.871 3.701 . . . 1.0 . . . . . . . . . . . . A . 3 GLU C . . . . . . . . . c19602_2mgt 1 . 19 . 9732 . 1 1 4 GLU CA C -16.660 -2.822 3.609 . . . 1.0 . . . . . . . . . . . . A . 3 GLU CA . . . . . . . . . c19602_2mgt 1 . 19 . 9733 . 1 1 4 GLU CB C -16.735 -3.692 4.862 . . . 1.0 . . . . . . . . . . . . A . 3 GLU CB . . . . . . . . . c19602_2mgt 1 . 19 . 9734 . 1 1 4 GLU CD C -15.775 -5.668 6.093 . . . 1.0 . . . . . . . . . . . . A . 3 GLU CD . . . . . . . . . c19602_2mgt 1 . 19 . 9735 . 1 1 4 GLU CG C -15.604 -4.726 4.919 . . . 1.0 . . . . . . . . . . . . A . 3 GLU CG . . . . . . . . . c19602_2mgt 1 . 19 . 9736 . 1 1 4 GLU H H -16.598 -4.682 2.603 . . . 1.0 . . . . . . . . . . . . A . 3 GLU H . . . . . . . . . c19602_2mgt 1 . 19 . 9737 . 1 1 4 GLU HA H -17.556 -2.212 3.568 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HA . . . . . . . . . c19602_2mgt 1 . 19 . 9738 . 1 1 4 GLU HB2 H -16.675 -3.059 5.740 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HB2 . . . . . . . . . c19602_2mgt 1 . 19 . 9739 . 1 1 4 GLU HB3 H -17.703 -4.188 4.881 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HB3 . . . . . . . . . c19602_2mgt 1 . 19 . 9740 . 1 1 4 GLU HG2 H -15.588 -5.317 4.007 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HG2 . . . . . . . . . c19602_2mgt 1 . 19 . 9741 . 1 1 4 GLU HG3 H -14.650 -4.211 5.008 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HG3 . . . . . . . . . c19602_2mgt 1 . 19 . 9742 . 1 1 4 GLU N N -16.649 -3.687 2.437 . . . 1.0 . . . . . . . . . . . . A . 3 GLU N . . . . . . . . . c19602_2mgt 1 . 19 . 9743 . 1 1 4 GLU O O -15.589 -0.862 4.383 . . . 1.0 . . . . . . . . . . . . A . 3 GLU O . . . . . . . . . c19602_2mgt 1 . 19 . 9744 . 1 1 4 GLU OE1 O -16.757 -6.441 6.072 . . . 1.0 . . . . . . . . . . . . A . 3 GLU OE1 . . . . . . . . . c19602_2mgt 1 . 19 . 9745 . 1 1 4 GLU OE2 O -14.924 -5.639 6.994 . . . 1.0 . . . . . . . . . . . . A . 3 GLU OE2 . . . . . . . . . c19602_2mgt 1 . 19 . 9746 . 1 1 5 PHE C C -13.062 -0.533 1.662 . . . 1.0 . . . . . . . . . . . . A . 4 PHE C . . . . . . . . . c19602_2mgt 1 . 19 . 9747 . 1 1 5 PHE CA C -13.155 -1.327 2.964 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CA . . . . . . . . . c19602_2mgt 1 . 19 . 9748 . 1 1 5 PHE CB C -11.903 -2.196 3.095 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CB . . . . . . . . . c19602_2mgt 1 . 19 . 9749 . 1 1 5 PHE CD1 C -12.346 -2.806 5.515 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CD1 . . . . . . . . . c19602_2mgt 1 . 19 . 9750 . 1 1 5 PHE CD2 C -11.504 -4.514 3.997 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CD2 . . . . . . . . . c19602_2mgt 1 . 19 . 9751 . 1 1 5 PHE CE1 C -12.334 -3.736 6.567 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CE1 . . . . . . . . . c19602_2mgt 1 . 19 . 9752 . 1 1 5 PHE CE2 C -11.496 -5.444 5.047 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CE2 . . . . . . . . . c19602_2mgt 1 . 19 . 9753 . 1 1 5 PHE CG C -11.919 -3.193 4.232 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CG . . . . . . . . . c19602_2mgt 1 . 19 . 9754 . 1 1 5 PHE CZ C -11.903 -5.051 6.333 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CZ . . . . . . . . . c19602_2mgt 1 . 19 . 9755 . 1 1 5 PHE H H -14.305 -3.049 2.539 . . . 1.0 . . . . . . . . . . . . A . 4 PHE H . . . . . . . . . c19602_2mgt 1 . 19 . 9756 . 1 1 5 PHE HA H -13.171 -0.614 3.784 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HA . . . . . . . . . c19602_2mgt 1 . 19 . 9757 . 1 1 5 PHE HB2 H -11.767 -2.739 2.161 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HB2 . . . . . . . . . c19602_2mgt 1 . 19 . 9758 . 1 1 5 PHE HB3 H -11.041 -1.542 3.229 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HB3 . . . . . . . . . c19602_2mgt 1 . 19 . 9759 . 1 1 5 PHE HD1 H -12.686 -1.794 5.686 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HD1 . . . . . . . . . c19602_2mgt 1 . 19 . 9760 . 1 1 5 PHE HD2 H -11.201 -4.814 3.005 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HD2 . . . . . . . . . c19602_2mgt 1 . 19 . 9761 . 1 1 5 PHE HE1 H -12.663 -3.446 7.552 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HE1 . . . . . . . . . c19602_2mgt 1 . 19 . 9762 . 1 1 5 PHE HE2 H -11.186 -6.461 4.861 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HE2 . . . . . . . . . c19602_2mgt 1 . 19 . 9763 . 1 1 5 PHE HZ H -11.903 -5.767 7.141 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HZ . . . . . . . . . c19602_2mgt 1 . 19 . 9764 . 1 1 5 PHE N N -14.345 -2.170 3.033 . . . 1.0 . . . . . . . . . . . . A . 4 PHE N . . . . . . . . . c19602_2mgt 1 . 19 . 9765 . 1 1 5 PHE O O -12.326 0.447 1.622 . . . 1.0 . . . . . . . . . . . . A . 4 PHE O . . . . . . . . . c19602_2mgt 1 . 19 . 9766 . 1 1 6 ARG C C -14.651 1.152 -0.528 . . . 1.0 . . . . . . . . . . . . A . 5 ARG C . . . . . . . . . c19602_2mgt 1 . 19 . 9767 . 1 1 6 ARG CA C -13.897 -0.187 -0.653 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CA . . . . . . . . . c19602_2mgt 1 . 19 . 9768 . 1 1 6 ARG CB C -14.492 -1.117 -1.726 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CB . . . . . . . . . c19602_2mgt 1 . 19 . 9769 . 1 1 6 ARG CD C -12.142 -2.126 -2.174 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CD . . . . . . . . . c19602_2mgt 1 . 19 . 9770 . 1 1 6 ARG CG C -13.647 -2.371 -2.022 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CG . . . . . . . . . c19602_2mgt 1 . 19 . 9771 . 1 1 6 ARG CZ C -10.723 -0.955 -3.866 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CZ . . . . . . . . . c19602_2mgt 1 . 19 . 9772 . 1 1 6 ARG H H -14.401 -1.727 0.714 . . . 1.0 . . . . . . . . . . . . A . 5 ARG H . . . . . . . . . c19602_2mgt 1 . 19 . 9773 . 1 1 6 ARG HA H -12.884 0.075 -0.959 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HA . . . . . . . . . c19602_2mgt 1 . 19 . 9774 . 1 1 6 ARG HB2 H -15.484 -1.433 -1.410 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HB2 . . . . . . . . . c19602_2mgt 1 . 19 . 9775 . 1 1 6 ARG HB3 H -14.603 -0.564 -2.655 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HB3 . . . . . . . . . c19602_2mgt 1 . 19 . 9776 . 1 1 6 ARG HD2 H -11.735 -1.758 -1.233 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HD2 . . . . . . . . . c19602_2mgt 1 . 19 . 9777 . 1 1 6 ARG HD3 H -11.651 -3.068 -2.419 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HD3 . . . . . . . . . c19602_2mgt 1 . 19 . 9778 . 1 1 6 ARG HE H -12.662 -0.559 -3.488 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HE . . . . . . . . . c19602_2mgt 1 . 19 . 9779 . 1 1 6 ARG HG2 H -13.791 -3.088 -1.226 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HG2 . . . . . . . . . c19602_2mgt 1 . 19 . 9780 . 1 1 6 ARG HG3 H -14.017 -2.830 -2.935 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HG3 . . . . . . . . . c19602_2mgt 1 . 19 . 9781 . 1 1 6 ARG HH11 H -9.658 -2.341 -2.826 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH11 . . . . . . . . . c19602_2mgt 1 . 19 . 9782 . 1 1 6 ARG HH12 H -8.787 -1.522 -4.098 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH12 . . . . . . . . . c19602_2mgt 1 . 19 . 9783 . 1 1 6 ARG HH21 H -11.488 0.437 -5.132 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH21 . . . . . . . . . c19602_2mgt 1 . 19 . 9784 . 1 1 6 ARG HH22 H -9.810 0.027 -5.393 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH22 . . . . . . . . . c19602_2mgt 1 . 19 . 9785 . 1 1 6 ARG N N -13.818 -0.908 0.619 . . . 1.0 . . . . . . . . . . . . A . 5 ARG N . . . . . . . . . c19602_2mgt 1 . 19 . 9786 . 1 1 6 ARG NE N -11.880 -1.139 -3.222 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NE . . . . . . . . . c19602_2mgt 1 . 19 . 9787 . 1 1 6 ARG NH1 N -9.628 -1.641 -3.552 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NH1 . . . . . . . . . c19602_2mgt 1 . 19 . 9788 . 1 1 6 ARG NH2 N -10.659 -0.072 -4.857 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NH2 . . . . . . . . . c19602_2mgt 1 . 19 . 9789 . 1 1 6 ARG O O -15.146 1.682 -1.520 . . . 1.0 . . . . . . . . . . . . A . 5 ARG O . . . . . . . . . c19602_2mgt 1 . 19 . 9790 . 1 1 7 ARG C C -14.317 4.095 0.550 . . . 1.0 . . . . . . . . . . . . A . 6 ARG C . . . . . . . . . c19602_2mgt 1 . 19 . 9791 . 1 1 7 ARG CA C -15.270 3.005 1.018 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CA . . . . . . . . . c19602_2mgt 1 . 19 . 9792 . 1 1 7 ARG CB C -15.480 3.135 2.535 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CB . . . . . . . . . c19602_2mgt 1 . 19 . 9793 . 1 1 7 ARG CD C -17.624 1.697 2.533 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CD . . . . . . . . . c19602_2mgt 1 . 19 . 9794 . 1 1 7 ARG CG C -16.258 1.975 3.157 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CG . . . . . . . . . c19602_2mgt 1 . 19 . 9795 . 1 1 7 ARG CZ C -18.025 0.931 0.187 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CZ . . . . . . . . . c19602_2mgt 1 . 19 . 9796 . 1 1 7 ARG H H -14.300 1.205 1.457 . . . 1.0 . . . . . . . . . . . . A . 6 ARG H . . . . . . . . . c19602_2mgt 1 . 19 . 9797 . 1 1 7 ARG HA H -16.228 3.114 0.525 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HA . . . . . . . . . c19602_2mgt 1 . 19 . 9798 . 1 1 7 ARG HB2 H -14.504 3.170 3.023 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HB2 . . . . . . . . . c19602_2mgt 1 . 19 . 9799 . 1 1 7 ARG HB3 H -16.005 4.067 2.745 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HB3 . . . . . . . . . c19602_2mgt 1 . 19 . 9800 . 1 1 7 ARG HD2 H -18.259 1.226 3.275 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HD2 . . . . . . . . . c19602_2mgt 1 . 19 . 9801 . 1 1 7 ARG HD3 H -18.078 2.637 2.233 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HD3 . . . . . . . . . c19602_2mgt 1 . 19 . 9802 . 1 1 7 ARG HE H -17.134 -0.156 1.636 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HE . . . . . . . . . c19602_2mgt 1 . 19 . 9803 . 1 1 7 ARG HG2 H -15.640 1.091 3.060 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HG2 . . . . . . . . . c19602_2mgt 1 . 19 . 9804 . 1 1 7 ARG HG3 H -16.404 2.184 4.214 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HG3 . . . . . . . . . c19602_2mgt 1 . 19 . 9805 . 1 1 7 ARG HH11 H -18.687 2.833 0.469 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH11 . . . . . . . . . c19602_2mgt 1 . 19 . 9806 . 1 1 7 ARG HH12 H -18.956 2.171 -1.125 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH12 . . . . . . . . . c19602_2mgt 1 . 19 . 9807 . 1 1 7 ARG HH21 H -17.539 -0.944 -0.422 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH21 . . . . . . . . . c19602_2mgt 1 . 19 . 9808 . 1 1 7 ARG HH22 H -18.317 0.056 -1.623 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH22 . . . . . . . . . c19602_2mgt 1 . 19 . 9809 . 1 1 7 ARG N N -14.728 1.700 0.691 . . . 1.0 . . . . . . . . . . . . A . 6 ARG N . . . . . . . . . c19602_2mgt 1 . 19 . 9810 . 1 1 7 ARG NE N -17.540 0.747 1.421 . . . 1.0 . . . . . . . . . . . . A . 6 ARG NE . . . . . . . . . c19602_2mgt 1 . 19 . 9811 . 1 1 7 ARG NH1 N -18.588 2.076 -0.190 . . . 1.0 . . . . . . . . . . . . A . 6 ARG NH1 . . . . . . . . . c19602_2mgt 1 . 19 . 9812 . 1 1 7 ARG NH2 N -17.945 -0.060 -0.693 . . . 1.0 . . . . . . . . . . . . A . 6 ARG NH2 . . . . . . . . . c19602_2mgt 1 . 19 . 9813 . 1 1 7 ARG O O -13.127 3.854 0.387 . . . 1.0 . . . . . . . . . . . . A . 6 ARG O . . . . . . . . . c19602_2mgt 1 . 19 . 9814 . 1 1 8 ASP C C -13.264 6.988 1.347 . . . 1.0 . . . . . . . . . . . . A . 7 ASP C . . . . . . . . . c19602_2mgt 1 . 19 . 9815 . 1 1 8 ASP CA C -14.091 6.526 0.142 . . . 1.0 . . . . . . . . . . . . A . 7 ASP CA . . . . . . . . . c19602_2mgt 1 . 19 . 9816 . 1 1 8 ASP CB C -15.091 7.619 -0.261 . . . 1.0 . . . . . . . . . . . . A . 7 ASP CB . . . . . . . . . c19602_2mgt 1 . 19 . 9817 . 1 1 8 ASP CG C -16.043 8.066 0.852 . . . 1.0 . . . . . . . . . . . . A . 7 ASP CG . . . . . . . . . c19602_2mgt 1 . 19 . 9818 . 1 1 8 ASP H H -15.835 5.419 0.564 . . . 1.0 . . . . . . . . . . . . A . 7 ASP H . . . . . . . . . c19602_2mgt 1 . 19 . 9819 . 1 1 8 ASP HA H -13.415 6.346 -0.693 . . . 1.0 . . . . . . . . . . . . A . 7 ASP HA . . . . . . . . . c19602_2mgt 1 . 19 . 9820 . 1 1 8 ASP HB2 H -14.526 8.485 -0.594 . . . 1.0 . . . . . . . . . . . . A . 7 ASP HB2 . . . . . . . . . c19602_2mgt 1 . 19 . 9821 . 1 1 8 ASP HB3 H -15.684 7.256 -1.095 . . . 1.0 . . . . . . . . . . . . A . 7 ASP HB3 . . . . . . . . . c19602_2mgt 1 . 19 . 9822 . 1 1 8 ASP N N -14.845 5.306 0.399 . . . 1.0 . . . . . . . . . . . . A . 7 ASP N . . . . . . . . . c19602_2mgt 1 . 19 . 9823 . 1 1 8 ASP O O -12.284 7.699 1.170 . . . 1.0 . . . . . . . . . . . . A . 7 ASP O . . . . . . . . . c19602_2mgt 1 . 19 . 9824 . 1 1 8 ASP OD1 O -16.506 7.213 1.632 . . . 1.0 . . . . . . . . . . . . A . 7 ASP OD1 . . . . . . . . . c19602_2mgt 1 . 19 . 9825 . 1 1 8 ASP OD2 O -16.323 9.281 0.902 . . . 1.0 . . . . . . . . . . . . A . 7 ASP OD2 . . . . . . . . . c19602_2mgt 1 . 19 . 9826 . 1 1 9 SER C C -11.785 6.484 4.199 . . . 1.0 . . . . . . . . . . . . A . 8 SER C . . . . . . . . . c19602_2mgt 1 . 19 . 9827 . 1 1 9 SER CA C -13.137 7.115 3.821 . . . 1.0 . . . . . . . . . . . . A . 8 SER CA . . . . . . . . . c19602_2mgt 1 . 19 . 9828 . 1 1 9 SER CB C -14.197 6.914 4.912 . . . 1.0 . . . . . . . . . . . . A . 8 SER CB . . . . . . . . . c19602_2mgt 1 . 19 . 9829 . 1 1 9 SER H H -14.536 6.103 2.614 . . . 1.0 . . . . . . . . . . . . A . 8 SER H . . . . . . . . . c19602_2mgt 1 . 19 . 9830 . 1 1 9 SER HA H -12.984 8.186 3.710 . . . 1.0 . . . . . . . . . . . . A . 8 SER HA . . . . . . . . . c19602_2mgt 1 . 19 . 9831 . 1 1 9 SER HB2 H -14.423 5.853 5.011 . . . 1.0 . . . . . . . . . . . . A . 8 SER HB2 . . . . . . . . . c19602_2mgt 1 . 19 . 9832 . 1 1 9 SER HB3 H -13.815 7.292 5.859 . . . 1.0 . . . . . . . . . . . . A . 8 SER HB3 . . . . . . . . . c19602_2mgt 1 . 19 . 9833 . 1 1 9 SER HG H -16.075 7.335 5.194 . . . 1.0 . . . . . . . . . . . . A . 8 SER HG . . . . . . . . . c19602_2mgt 1 . 19 . 9834 . 1 1 9 SER N N -13.667 6.609 2.563 . . . 1.0 . . . . . . . . . . . . A . 8 SER N . . . . . . . . . c19602_2mgt 1 . 19 . 9835 . 1 1 9 SER O O -11.661 5.835 5.231 . . . 1.0 . . . . . . . . . . . . A . 8 SER O . . . . . . . . . c19602_2mgt 1 . 19 . 9836 . 1 1 9 SER OG O -15.379 7.615 4.591 . . . 1.0 . . . . . . . . . . . . A . 8 SER OG . . . . . . . . . c19602_2mgt 1 . 19 . 9837 . 1 1 10 GLY C C -8.516 6.913 2.584 . . . 1.0 . . . . . . . . . . . . A . 9 GLY C . . . . . . . . . c19602_2mgt 1 . 19 . 9838 . 1 1 10 GLY CA C -9.375 6.355 3.718 . . . 1.0 . . . . . . . . . . . . A . 9 GLY CA . . . . . . . . . c19602_2mgt 1 . 19 . 9839 . 1 1 10 GLY H H -10.873 7.148 2.499 . . . 1.0 . . . . . . . . . . . . A . 9 GLY H . . . . . . . . . c19602_2mgt 1 . 19 . 9840 . 1 1 10 GLY HA2 H -9.101 6.819 4.665 . . . 1.0 . . . . . . . . . . . . A . 9 GLY HA2 . . . . . . . . . c19602_2mgt 1 . 19 . 9841 . 1 1 10 GLY HA3 H -9.274 5.281 3.846 . . . 1.0 . . . . . . . . . . . . A . 9 GLY HA3 . . . . . . . . . c19602_2mgt 1 . 19 . 9842 . 1 1 10 GLY N N -10.746 6.676 3.384 . . . 1.0 . . . . . . . . . . . . A . 9 GLY N . . . . . . . . . c19602_2mgt 1 . 19 . 9843 . 1 1 10 GLY O O -8.620 8.099 2.292 . . . 1.0 . . . . . . . . . . . . A . 9 GLY O . . . . . . . . . c19602_2mgt 1 . 19 . 9844 . 1 1 11 TYR C C -6.297 4.200 1.301 . . . 1.0 . . . . . . . . . . . . A . 10 TYR C . . . . . . . . . c19602_2mgt 1 . 19 . 9845 . 1 1 11 TYR CA C -7.510 4.697 2.068 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CA . . . . . . . . . c19602_2mgt 1 . 19 . 9846 . 1 1 11 TYR CB C -8.733 3.935 1.548 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CB . . . . . . . . . c19602_2mgt 1 . 19 . 9847 . 1 1 11 TYR CD1 C -8.588 2.179 3.370 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CD1 . . . . . . . . . c19602_2mgt 1 . 19 . 9848 . 1 1 11 TYR CD2 C -10.758 3.104 2.762 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CD2 . . . . . . . . . c19602_2mgt 1 . 19 . 9849 . 1 1 11 TYR CE1 C -9.191 1.395 4.359 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CE1 . . . . . . . . . c19602_2mgt 1 . 19 . 9850 . 1 1 11 TYR CE2 C -11.370 2.314 3.740 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CE2 . . . . . . . . . c19602_2mgt 1 . 19 . 9851 . 1 1 11 TYR CG C -9.370 3.035 2.573 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CG . . . . . . . . . c19602_2mgt 1 . 19 . 9852 . 1 1 11 TYR CZ C -10.589 1.451 4.539 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CZ . . . . . . . . . c19602_2mgt 1 . 19 . 9853 . 1 1 11 TYR H H -7.273 6.496 1.068 . . . 1.0 . . . . . . . . . . . . A . 10 TYR H . . . . . . . . . c19602_2mgt 1 . 19 . 9854 . 1 1 11 TYR HA H -7.371 4.498 3.127 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HA . . . . . . . . . c19602_2mgt 1 . 19 . 9855 . 1 1 11 TYR HB2 H -9.480 4.647 1.210 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HB2 . . . . . . . . . c19602_2mgt 1 . 19 . 9856 . 1 1 11 TYR HB3 H -8.460 3.344 0.676 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HB3 . . . . . . . . . c19602_2mgt 1 . 19 . 9857 . 1 1 11 TYR HD1 H -7.522 2.130 3.248 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HD1 . . . . . . . . . c19602_2mgt 1 . 19 . 9858 . 1 1 11 TYR HD2 H -11.347 3.787 2.170 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HD2 . . . . . . . . . c19602_2mgt 1 . 19 . 9859 . 1 1 11 TYR HE1 H -8.581 0.777 4.996 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HE1 . . . . . . . . . c19602_2mgt 1 . 19 . 9860 . 1 1 11 TYR HE2 H -12.434 2.388 3.890 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HE2 . . . . . . . . . c19602_2mgt 1 . 19 . 9861 . 1 1 11 TYR HH H -12.125 0.845 5.565 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HH . . . . . . . . . c19602_2mgt 1 . 19 . 9862 . 1 1 11 TYR N N -7.697 6.118 1.894 . . . 1.0 . . . . . . . . . . . . A . 10 TYR N . . . . . . . . . c19602_2mgt 1 . 19 . 9863 . 1 1 11 TYR O O -6.029 4.660 0.193 . . . 1.0 . . . . . . . . . . . . A . 10 TYR O . . . . . . . . . c19602_2mgt 1 . 19 . 9864 . 1 1 11 TYR OH O -11.174 0.712 5.517 . . . 1.0 . . . . . . . . . . . . A . 10 TYR OH . . . . . . . . . c19602_2mgt 1 . 19 . 9865 . 1 1 12 GLU C C -5.450 0.765 1.599 . . . 1.0 . . . . . . . . . . . . A . 11 GLU C . . . . . . . . . c19602_2mgt 1 . 19 . 9866 . 1 1 12 GLU CA C -4.984 2.141 1.092 . . . 1.0 . . . . . . . . . . . . A . 11 GLU CA . . . . . . . . . c19602_2mgt 1 . 19 . 9867 . 1 1 12 GLU CB C -3.482 2.351 1.243 . . . 1.0 . . . . . . . . . . . . A . 11 GLU CB . . . . . . . . . c19602_2mgt 1 . 19 . 9868 . 1 1 12 GLU CD C -1.277 1.396 0.529 . . . 1.0 . . . . . . . . . . . . A . 11 GLU CD . . . . . . . . . c19602_2mgt 1 . 19 . 9869 . 1 1 12 GLU CG C -2.736 1.577 0.157 . . . 1.0 . . . . . . . . . . . . A . 11 GLU CG . . . . . . . . . c19602_2mgt 1 . 19 . 9870 . 1 1 12 GLU H H -5.911 2.907 2.803 . . . 1.0 . . . . . . . . . . . . A . 11 GLU H . . . . . . . . . c19602_2mgt 1 . 19 . 9871 . 1 1 12 GLU HA H -5.250 2.256 0.041 . . . 1.0 . . . . . . . . . . . . A . 11 GLU HA . . . . . . . . . c19602_2mgt 1 . 19 . 9872 . 1 1 12 GLU HB2 H -3.247 3.409 1.145 . . . 1.0 . . . . . . . . . . . . A . 11 GLU HB2 . . . . . . . . . c19602_2mgt 1 . 19 . 9873 . 1 1 12 GLU HB3 H -3.168 2.027 2.234 . . . 1.0 . . . . . . . . . . . . A . 11 GLU HB3 . . . . . . . . . c19602_2mgt 1 . 19 . 9874 . 1 1 12 GLU HG2 H -3.186 0.593 0.038 . . . 1.0 . . . . . . . . . . . . A . 11 GLU HG2 . . . . . . . . . c19602_2mgt 1 . 19 . 9875 . 1 1 12 GLU HG3 H -2.807 2.117 -0.785 . . . 1.0 . . . . . . . . . . . . A . 11 GLU HG3 . . . . . . . . . c19602_2mgt 1 . 19 . 9876 . 1 1 12 GLU N N -5.681 3.154 1.853 . . . 1.0 . . . . . . . . . . . . A . 11 GLU N . . . . . . . . . c19602_2mgt 1 . 19 . 9877 . 1 1 12 GLU O O -4.874 0.186 2.521 . . . 1.0 . . . . . . . . . . . . A . 11 GLU O . . . . . . . . . c19602_2mgt 1 . 19 . 9878 . 1 1 12 GLU OE1 O -0.674 2.345 1.055 . . . 1.0 . . . . . . . . . . . . A . 11 GLU OE1 . . . . . . . . . c19602_2mgt 1 . 19 . 9879 . 1 1 12 GLU OE2 O -0.775 0.274 0.308 . . . 1.0 . . . . . . . . . . . . A . 11 GLU OE2 . . . . . . . . . c19602_2mgt 1 . 19 . 9880 . 1 1 13 VAL C C -6.452 -2.197 1.465 . . . 1.0 . . . . . . . . . . . . A . 12 VAL C . . . . . . . . . c19602_2mgt 1 . 19 . 9881 . 1 1 13 VAL CA C -7.294 -0.920 1.393 . . . 1.0 . . . . . . . . . . . . A . 12 VAL CA . . . . . . . . . c19602_2mgt 1 . 19 . 9882 . 1 1 13 VAL CB C -8.499 -1.082 0.438 . . . 1.0 . . . . . . . . . . . . A . 12 VAL CB . . . . . . . . . c19602_2mgt 1 . 19 . 9883 . 1 1 13 VAL CG1 C -9.256 -2.406 0.634 . . . 1.0 . . . . . . . . . . . . A . 12 VAL CG1 . . . . . . . . . c19602_2mgt 1 . 19 . 9884 . 1 1 13 VAL CG2 C -9.487 0.064 0.686 . . . 1.0 . . . . . . . . . . . . A . 12 VAL CG2 . . . . . . . . . c19602_2mgt 1 . 19 . 9885 . 1 1 13 VAL H H -6.916 0.785 0.226 . . . 1.0 . . . . . . . . . . . . A . 12 VAL H . . . . . . . . . c19602_2mgt 1 . 19 . 9886 . 1 1 13 VAL HA H -7.687 -0.727 2.386 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HA . . . . . . . . . c19602_2mgt 1 . 19 . 9887 . 1 1 13 VAL HB H -8.154 -1.036 -0.595 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HB . . . . . . . . . c19602_2mgt 1 . 19 . 9888 . 1 1 13 VAL HG11 H -8.657 -3.236 0.270 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HG11 . . . . . . . . . c19602_2mgt 1 . 19 . 9889 . 1 1 13 VAL HG12 H -9.470 -2.557 1.690 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HG12 . . . . . . . . . c19602_2mgt 1 . 19 . 9890 . 1 1 13 VAL HG13 H -10.187 -2.400 0.073 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HG13 . . . . . . . . . c19602_2mgt 1 . 19 . 9891 . 1 1 13 VAL HG21 H -10.332 -0.038 0.006 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HG21 . . . . . . . . . c19602_2mgt 1 . 19 . 9892 . 1 1 13 VAL HG22 H -9.822 0.031 1.721 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HG22 . . . . . . . . . c19602_2mgt 1 . 19 . 9893 . 1 1 13 VAL HG23 H -9.012 1.022 0.493 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HG23 . . . . . . . . . c19602_2mgt 1 . 19 . 9894 . 1 1 13 VAL N N -6.530 0.261 0.994 . . . 1.0 . . . . . . . . . . . . A . 12 VAL N . . . . . . . . . c19602_2mgt 1 . 19 . 9895 . 1 1 13 VAL O O -6.847 -3.133 2.158 . . . 1.0 . . . . . . . . . . . . A . 12 VAL O . . . . . . . . . c19602_2mgt 1 . 19 . 9896 . 1 1 14 HIS C C -3.993 -3.765 2.222 . . . 1.0 . . . . . . . . . . . . A . 13 HIS C . . . . . . . . . c19602_2mgt 1 . 19 . 9897 . 1 1 14 HIS CA C -4.450 -3.429 0.801 . . . 1.0 . . . . . . . . . . . . A . 13 HIS CA . . . . . . . . . c19602_2mgt 1 . 19 . 9898 . 1 1 14 HIS CB C -3.245 -3.217 -0.122 . . . 1.0 . . . . . . . . . . . . A . 13 HIS CB . . . . . . . . . c19602_2mgt 1 . 19 . 9899 . 1 1 14 HIS CD2 C -2.364 -5.141 -1.585 . . . 1.0 . . . . . . . . . . . . A . 13 HIS CD2 . . . . . . . . . c19602_2mgt 1 . 19 . 9900 . 1 1 14 HIS CE1 C -1.415 -6.384 -0.050 . . . 1.0 . . . . . . . . . . . . A . 13 HIS CE1 . . . . . . . . . c19602_2mgt 1 . 19 . 9901 . 1 1 14 HIS CG C -2.483 -4.490 -0.388 . . . 1.0 . . . . . . . . . . . . A . 13 HIS CG . . . . . . . . . c19602_2mgt 1 . 19 . 9902 . 1 1 14 HIS H H -5.009 -1.459 0.232 . . . 1.0 . . . . . . . . . . . . A . 13 HIS H . . . . . . . . . c19602_2mgt 1 . 19 . 9903 . 1 1 14 HIS HA H -5.066 -4.244 0.425 . . . 1.0 . . . . . . . . . . . . A . 13 HIS HA . . . . . . . . . c19602_2mgt 1 . 19 . 9904 . 1 1 14 HIS HB2 H -3.592 -2.824 -1.073 . . . 1.0 . . . . . . . . . . . . A . 13 HIS HB2 . . . . . . . . . c19602_2mgt 1 . 19 . 9905 . 1 1 14 HIS HB3 H -2.571 -2.481 0.320 . . . 1.0 . . . . . . . . . . . . A . 13 HIS HB3 . . . . . . . . . c19602_2mgt 1 . 19 . 9906 . 1 1 14 HIS HD1 H -1.799 -5.073 1.539 . . . 1.0 . . . . . . . . . . . . A . 13 HIS HD1 . . . . . . . . . c19602_2mgt 1 . 19 . 9907 . 1 1 14 HIS HD2 H -2.760 -4.805 -2.531 . . . 1.0 . . . . . . . . . . . . A . 13 HIS HD2 . . . . . . . . . c19602_2mgt 1 . 19 . 9908 . 1 1 14 HIS HE1 H -0.898 -7.192 0.449 . . . 1.0 . . . . . . . . . . . . A . 13 HIS HE1 . . . . . . . . . c19602_2mgt 1 . 19 . 9909 . 1 1 14 HIS N N -5.292 -2.247 0.798 . . . 1.0 . . . . . . . . . . . . A . 13 HIS N . . . . . . . . . c19602_2mgt 1 . 19 . 9910 . 1 1 14 HIS ND1 N -1.862 -5.275 0.551 . . . 1.0 . . . . . . . . . . . . A . 13 HIS ND1 . . . . . . . . . c19602_2mgt 1 . 19 . 9911 . 1 1 14 HIS NE2 N -1.707 -6.353 -1.357 . . . 1.0 . . . . . . . . . . . . A . 13 HIS NE2 . . . . . . . . . c19602_2mgt 1 . 19 . 9912 . 1 1 14 HIS O O -3.986 -4.935 2.600 . . . 1.0 . . . . . . . . . . . . A . 13 HIS O . . . . . . . . . c19602_2mgt 1 . 19 . 9913 . 1 1 15 HIS C C -4.490 -3.236 5.290 . . . 1.0 . . . . . . . . . . . . A . 14 HIS C . . . . . . . . . c19602_2mgt 1 . 19 . 9914 . 1 1 15 HIS CA C -3.294 -2.911 4.412 . . . 1.0 . . . . . . . . . . . . A . 14 HIS CA . . . . . . . . . c19602_2mgt 1 . 19 . 9915 . 1 1 15 HIS CB C -2.614 -1.645 4.927 . . . 1.0 . . . . . . . . . . . . A . 14 HIS CB . . . . . . . . . c19602_2mgt 1 . 19 . 9916 . 1 1 15 HIS CD2 C -1.006 -0.219 3.550 . . . 1.0 . . . . . . . . . . . . A . 14 HIS CD2 . . . . . . . . . c19602_2mgt 1 . 19 . 9917 . 1 1 15 HIS CE1 C 0.591 -1.677 3.195 . . . 1.0 . . . . . . . . . . . . A . 14 HIS CE1 . . . . . . . . . c19602_2mgt 1 . 19 . 9918 . 1 1 15 HIS CG C -1.337 -1.371 4.195 . . . 1.0 . . . . . . . . . . . . A . 14 HIS CG . . . . . . . . . c19602_2mgt 1 . 19 . 9919 . 1 1 15 HIS H H -3.755 -1.793 2.661 . . . 1.0 . . . . . . . . . . . . A . 14 HIS H . . . . . . . . . c19602_2mgt 1 . 19 . 9920 . 1 1 15 HIS HA H -2.593 -3.742 4.486 . . . 1.0 . . . . . . . . . . . . A . 14 HIS HA . . . . . . . . . c19602_2mgt 1 . 19 . 9921 . 1 1 15 HIS HB2 H -3.289 -0.793 4.822 . . . 1.0 . . . . . . . . . . . . A . 14 HIS HB2 . . . . . . . . . c19602_2mgt 1 . 19 . 9922 . 1 1 15 HIS HB3 H -2.383 -1.769 5.983 . . . 1.0 . . . . . . . . . . . . A . 14 HIS HB3 . . . . . . . . . c19602_2mgt 1 . 19 . 9923 . 1 1 15 HIS HD1 H -0.312 -3.237 4.270 . . . 1.0 . . . . . . . . . . . . A . 14 HIS HD1 . . . . . . . . . c19602_2mgt 1 . 19 . 9924 . 1 1 15 HIS HD2 H -1.615 0.666 3.485 . . . 1.0 . . . . . . . . . . . . A . 14 HIS HD2 . . . . . . . . . c19602_2mgt 1 . 19 . 9925 . 1 1 15 HIS HE1 H 1.490 -2.145 2.827 . . . 1.0 . . . . . . . . . . . . A . 14 HIS HE1 . . . . . . . . . c19602_2mgt 1 . 19 . 9926 . 1 1 15 HIS N N -3.670 -2.736 3.017 . . . 1.0 . . . . . . . . . . . . A . 14 HIS N . . . . . . . . . c19602_2mgt 1 . 19 . 9927 . 1 1 15 HIS ND1 N -0.328 -2.273 3.963 . . . 1.0 . . . . . . . . . . . . A . 14 HIS ND1 . . . . . . . . . c19602_2mgt 1 . 19 . 9928 . 1 1 15 HIS NE2 N 0.231 -0.414 2.940 . . . 1.0 . . . . . . . . . . . . A . 14 HIS NE2 . . . . . . . . . c19602_2mgt 1 . 19 . 9929 . 1 1 15 HIS O O -4.299 -3.872 6.317 . . . 1.0 . . . . . . . . . . . . A . 14 HIS O . . . . . . . . . c19602_2mgt 1 . 19 . 9930 . 1 1 16 GLN C C -7.256 -4.561 5.661 . . . 1.0 . . . . . . . . . . . . A . 15 GLN C . . . . . . . . . c19602_2mgt 1 . 19 . 9931 . 1 1 16 GLN CA C -6.899 -3.079 5.673 . . . 1.0 . . . . . . . . . . . . A . 15 GLN CA . . . . . . . . . c19602_2mgt 1 . 19 . 9932 . 1 1 16 GLN CB C -8.018 -2.207 5.100 . . . 1.0 . . . . . . . . . . . . A . 15 GLN CB . . . . . . . . . c19602_2mgt 1 . 19 . 9933 . 1 1 16 GLN CD C -8.860 -1.135 7.284 . . . 1.0 . . . . . . . . . . . . A . 15 GLN CD . . . . . . . . . c19602_2mgt 1 . 19 . 9934 . 1 1 16 GLN CG C -9.184 -2.000 6.065 . . . 1.0 . . . . . . . . . . . . A . 15 GLN CG . . . . . . . . . c19602_2mgt 1 . 19 . 9935 . 1 1 16 GLN H H -5.820 -2.306 4.053 . . . 1.0 . . . . . . . . . . . . A . 15 GLN H . . . . . . . . . c19602_2mgt 1 . 19 . 9936 . 1 1 16 GLN HA H -6.699 -2.785 6.694 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HA . . . . . . . . . c19602_2mgt 1 . 19 . 9937 . 1 1 16 GLN HB2 H -7.613 -1.235 4.822 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HB2 . . . . . . . . . c19602_2mgt 1 . 19 . 9938 . 1 1 16 GLN HB3 H -8.403 -2.681 4.203 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HB3 . . . . . . . . . c19602_2mgt 1 . 19 . 9939 . 1 1 16 GLN HE21 H -10.821 -0.920 7.761 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HE21 . . . . . . . . . c19602_2mgt 1 . 19 . 9940 . 1 1 16 GLN HE22 H -9.686 -0.119 8.824 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HE22 . . . . . . . . . c19602_2mgt 1 . 19 . 9941 . 1 1 16 GLN HG2 H -9.970 -1.511 5.503 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HG2 . . . . . . . . . c19602_2mgt 1 . 19 . 9942 . 1 1 16 GLN HG3 H -9.555 -2.968 6.386 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HG3 . . . . . . . . . c19602_2mgt 1 . 19 . 9943 . 1 1 16 GLN N N -5.702 -2.826 4.908 . . . 1.0 . . . . . . . . . . . . A . 15 GLN N . . . . . . . . . c19602_2mgt 1 . 19 . 9944 . 1 1 16 GLN NE2 N -9.871 -0.697 8.018 . . . 1.0 . . . . . . . . . . . . A . 15 GLN NE2 . . . . . . . . . c19602_2mgt 1 . 19 . 9945 . 1 1 16 GLN O O -7.563 -5.107 6.712 . . . 1.0 . . . . . . . . . . . . A . 15 GLN O . . . . . . . . . c19602_2mgt 1 . 19 . 9946 . 1 1 16 GLN OE1 O -7.711 -0.842 7.580 . . . 1.0 . . . . . . . . . . . . A . 15 GLN OE1 . . . . . . . . . c19602_2mgt 1 . 19 . 9947 . 1 1 17 LYS C C -6.656 -7.582 5.041 . . . 1.0 . . . . . . . . . . . . A . 16 LYS C . . . . . . . . . c19602_2mgt 1 . 19 . 9948 . 1 1 17 LYS CA C -7.537 -6.601 4.265 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CA . . . . . . . . . c19602_2mgt 1 . 19 . 9949 . 1 1 17 LYS CB C -7.417 -6.892 2.767 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CB . . . . . . . . . c19602_2mgt 1 . 19 . 9950 . 1 1 17 LYS CD C -8.154 -6.183 0.455 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CD . . . . . . . . . c19602_2mgt 1 . 19 . 9951 . 1 1 17 LYS CE C -8.157 -7.616 -0.074 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CE . . . . . . . . . c19602_2mgt 1 . 19 . 9952 . 1 1 17 LYS CG C -8.480 -6.148 1.948 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CG . . . . . . . . . c19602_2mgt 1 . 19 . 9953 . 1 1 17 LYS H H -6.862 -4.680 3.688 . . . 1.0 . . . . . . . . . . . . A . 16 LYS H . . . . . . . . . c19602_2mgt 1 . 19 . 9954 . 1 1 17 LYS HA H -8.573 -6.734 4.574 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HA . . . . . . . . . c19602_2mgt 1 . 19 . 9955 . 1 1 17 LYS HB2 H -6.419 -6.604 2.432 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HB2 . . . . . . . . . c19602_2mgt 1 . 19 . 9956 . 1 1 17 LYS HB3 H -7.536 -7.963 2.605 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HB3 . . . . . . . . . c19602_2mgt 1 . 19 . 9957 . 1 1 17 LYS HD2 H -8.906 -5.600 -0.075 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HD2 . . . . . . . . . c19602_2mgt 1 . 19 . 9958 . 1 1 17 LYS HD3 H -7.176 -5.733 0.286 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HD3 . . . . . . . . . c19602_2mgt 1 . 19 . 9959 . 1 1 17 LYS HE2 H -7.321 -8.166 0.359 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HE2 . . . . . . . . . c19602_2mgt 1 . 19 . 9960 . 1 1 17 LYS HE3 H -9.087 -8.100 0.221 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HE3 . . . . . . . . . c19602_2mgt 1 . 19 . 9961 . 1 1 17 LYS HG2 H -9.456 -6.604 2.121 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HG2 . . . . . . . . . c19602_2mgt 1 . 19 . 9962 . 1 1 17 LYS HG3 H -8.535 -5.106 2.258 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HG3 . . . . . . . . . c19602_2mgt 1 . 19 . 9963 . 1 1 17 LYS HZ1 H -8.067 -8.594 -1.866 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HZ1 . . . . . . . . . c19602_2mgt 1 . 19 . 9964 . 1 1 17 LYS HZ2 H -8.827 -7.138 -1.943 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HZ2 . . . . . . . . . c19602_2mgt 1 . 19 . 9965 . 1 1 17 LYS HZ3 H -7.184 -7.207 -1.827 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HZ3 . . . . . . . . . c19602_2mgt 1 . 19 . 9966 . 1 1 17 LYS N N -7.160 -5.209 4.496 . . . 1.0 . . . . . . . . . . . . A . 16 LYS N . . . . . . . . . c19602_2mgt 1 . 19 . 9967 . 1 1 17 LYS NZ N -8.050 -7.639 -1.537 . . . 1.0 . . . . . . . . . . . . A . 16 LYS NZ . . . . . . . . . c19602_2mgt 1 . 19 . 9968 . 1 1 17 LYS O O -5.468 -7.351 5.218 . . . 1.0 . . . . . . . . . . . . A . 16 LYS O . . . . . . . . . c19602_2mgt 1 . 19 . 9969 . 1 1 18 NH2 HN1 H -6.659 -9.386 5.980 . . . 1.0 . . . . . . . . . . . . A . 17 NH2 HN1 . . . . . . . . . c19602_2mgt 1 . 19 . 9970 . 1 1 18 NH2 HN2 H -8.189 -8.897 5.286 . . . 1.0 . . . . . . . . . . . . A . 17 NH2 HN2 . . . . . . . . . c19602_2mgt 1 . 19 . 9971 . 1 1 18 NH2 N N -7.214 -8.713 5.472 . . . 1.0 . . . . . . . . . . . . A . 17 NH2 N . . . . . . . . . c19602_2mgt 1 . 19 . 9972 . 2 1 1 ACE C C 19.335 3.915 -2.605 . . . 1.0 . . . . . . . . . . . . B . 0 ACE C . . . . . . . . . c19602_2mgt 1 . 19 . 9973 . 2 1 1 ACE CH3 C 20.459 4.942 -2.584 . . . 1.0 . . . . . . . . . . . . B . 0 ACE CH3 . . . . . . . . . c19602_2mgt 1 . 19 . 9974 . 2 1 1 ACE H1 H 20.651 5.231 -1.553 . . . 1.0 . . . . . . . . . . . . B . 0 ACE H1 . . . . . . . . . c19602_2mgt 1 . 19 . 9975 . 2 1 1 ACE H2 H 21.361 4.509 -3.016 . . . 1.0 . . . . . . . . . . . . B . 0 ACE H2 . . . . . . . . . c19602_2mgt 1 . 19 . 9976 . 2 1 1 ACE H3 H 20.175 5.826 -3.152 . . . 1.0 . . . . . . . . . . . . B . 0 ACE H3 . . . . . . . . . c19602_2mgt 1 . 19 . 9977 . 2 1 1 ACE O O 19.601 2.725 -2.476 . . . 1.0 . . . . . . . . . . . . B . 0 ACE O . . . . . . . . . c19602_2mgt 1 . 19 . 9978 . 2 1 2 ASP C C 16.707 2.429 -3.572 . . . 1.0 . . . . . . . . . . . . B . 1 ASP C . . . . . . . . . c19602_2mgt 1 . 19 . 9979 . 2 1 2 ASP CA C 16.862 3.585 -2.588 . . . 1.0 . . . . . . . . . . . . B . 1 ASP CA . . . . . . . . . c19602_2mgt 1 . 19 . 9980 . 2 1 2 ASP CB C 15.662 4.511 -2.724 . . . 1.0 . . . . . . . . . . . . B . 1 ASP CB . . . . . . . . . c19602_2mgt 1 . 19 . 9981 . 2 1 2 ASP CG C 15.596 5.114 -4.117 . . . 1.0 . . . . . . . . . . . . B . 1 ASP CG . . . . . . . . . c19602_2mgt 1 . 19 . 9982 . 2 1 2 ASP H H 17.959 5.372 -2.892 . . . 1.0 . . . . . . . . . . . . B . 1 ASP H . . . . . . . . . c19602_2mgt 1 . 19 . 9983 . 2 1 2 ASP HA H 16.861 3.169 -1.582 . . . 1.0 . . . . . . . . . . . . B . 1 ASP HA . . . . . . . . . c19602_2mgt 1 . 19 . 9984 . 2 1 2 ASP HB2 H 14.744 3.954 -2.538 . . . 1.0 . . . . . . . . . . . . B . 1 ASP HB2 . . . . . . . . . c19602_2mgt 1 . 19 . 9985 . 2 1 2 ASP HB3 H 15.763 5.287 -1.980 . . . 1.0 . . . . . . . . . . . . B . 1 ASP HB3 . . . . . . . . . c19602_2mgt 1 . 19 . 9986 . 2 1 2 ASP N N 18.086 4.378 -2.756 . . . 1.0 . . . . . . . . . . . . B . 1 ASP N . . . . . . . . . c19602_2mgt 1 . 19 . 9987 . 2 1 2 ASP O O 15.771 1.648 -3.443 . . . 1.0 . . . . . . . . . . . . B . 1 ASP O . . . . . . . . . c19602_2mgt 1 . 19 . 9988 . 2 1 2 ASP OD1 O 15.245 4.367 -5.045 . . . 1.0 . . . . . . . . . . . . B . 1 ASP OD1 . . . . . . . . . c19602_2mgt 1 . 19 . 9989 . 2 1 2 ASP OD2 O 15.943 6.308 -4.250 . . . 1.0 . . . . . . . . . . . . B . 1 ASP OD2 . . . . . . . . . c19602_2mgt 1 . 19 . 9990 . 2 1 3 ALA C C 17.972 -0.089 -4.450 . . . 1.0 . . . . . . . . . . . . B . 2 ALA C . . . . . . . . . c19602_2mgt 1 . 19 . 9991 . 2 1 3 ALA CA C 17.957 1.172 -5.316 . . . 1.0 . . . . . . . . . . . . B . 2 ALA CA . . . . . . . . . c19602_2mgt 1 . 19 . 9992 . 2 1 3 ALA CB C 19.349 1.419 -5.892 . . . 1.0 . . . . . . . . . . . . B . 2 ALA CB . . . . . . . . . c19602_2mgt 1 . 19 . 9993 . 2 1 3 ALA H H 18.266 3.124 -4.590 . . . 1.0 . . . . . . . . . . . . B . 2 ALA H . . . . . . . . . c19602_2mgt 1 . 19 . 9994 . 2 1 3 ALA HA H 17.240 1.049 -6.127 . . . 1.0 . . . . . . . . . . . . B . 2 ALA HA . . . . . . . . . c19602_2mgt 1 . 19 . 9995 . 2 1 3 ALA HB1 H 19.319 2.252 -6.593 . . . 1.0 . . . . . . . . . . . . B . 2 ALA HB1 . . . . . . . . . c19602_2mgt 1 . 19 . 9996 . 2 1 3 ALA HB2 H 20.039 1.660 -5.085 . . . 1.0 . . . . . . . . . . . . B . 2 ALA HB2 . . . . . . . . . c19602_2mgt 1 . 19 . 9997 . 2 1 3 ALA HB3 H 19.693 0.521 -6.393 . . . 1.0 . . . . . . . . . . . . B . 2 ALA HB3 . . . . . . . . . c19602_2mgt 1 . 19 . 9998 . 2 1 3 ALA N N 17.622 2.348 -4.538 . . . 1.0 . . . . . . . . . . . . B . 2 ALA N . . . . . . . . . c19602_2mgt 1 . 19 . 9999 . 2 1 3 ALA O O 17.417 -1.103 -4.850 . . . 1.0 . . . . . . . . . . . . B . 2 ALA O . . . . . . . . . c19602_2mgt 1 . 19 . 10000 . 2 1 4 GLU C C 17.159 -1.520 -1.814 . . . 1.0 . . . . . . . . . . . . B . 3 GLU C . . . . . . . . . c19602_2mgt 1 . 19 . 10001 . 2 1 4 GLU CA C 18.554 -1.051 -2.236 . . . 1.0 . . . . . . . . . . . . B . 3 GLU CA . . . . . . . . . c19602_2mgt 1 . 19 . 10002 . 2 1 4 GLU CB C 19.322 -0.543 -1.015 . . . 1.0 . . . . . . . . . . . . B . 3 GLU CB . . . . . . . . . c19602_2mgt 1 . 19 . 10003 . 2 1 4 GLU CD C 19.349 1.273 0.731 . . . 1.0 . . . . . . . . . . . . B . 3 GLU CD . . . . . . . . . c19602_2mgt 1 . 19 . 10004 . 2 1 4 GLU CG C 18.501 0.511 -0.258 . . . 1.0 . . . . . . . . . . . . B . 3 GLU CG . . . . . . . . . c19602_2mgt 1 . 19 . 10005 . 2 1 4 GLU H H 18.960 0.882 -2.981 . . . 1.0 . . . . . . . . . . . . B . 3 GLU H . . . . . . . . . c19602_2mgt 1 . 19 . 10006 . 2 1 4 GLU HA H 19.084 -1.906 -2.645 . . . 1.0 . . . . . . . . . . . . B . 3 GLU HA . . . . . . . . . c19602_2mgt 1 . 19 . 10007 . 2 1 4 GLU HB2 H 19.531 -1.378 -0.347 . . . 1.0 . . . . . . . . . . . . B . 3 GLU HB2 . . . . . . . . . c19602_2mgt 1 . 19 . 10008 . 2 1 4 GLU HB3 H 20.269 -0.110 -1.339 . . . 1.0 . . . . . . . . . . . . B . 3 GLU HB3 . . . . . . . . . c19602_2mgt 1 . 19 . 10009 . 2 1 4 GLU HG2 H 18.058 1.208 -0.967 . . . 1.0 . . . . . . . . . . . . B . 3 GLU HG2 . . . . . . . . . c19602_2mgt 1 . 19 . 10010 . 2 1 4 GLU HG3 H 17.706 0.016 0.294 . . . 1.0 . . . . . . . . . . . . B . 3 GLU HG3 . . . . . . . . . c19602_2mgt 1 . 19 . 10011 . 2 1 4 GLU N N 18.542 0.001 -3.243 . . . 1.0 . . . . . . . . . . . . B . 3 GLU N . . . . . . . . . c19602_2mgt 1 . 19 . 10012 . 2 1 4 GLU O O 17.042 -2.629 -1.323 . . . 1.0 . . . . . . . . . . . . B . 3 GLU O . . . . . . . . . c19602_2mgt 1 . 19 . 10013 . 2 1 4 GLU OE1 O 20.164 0.655 1.408 . . . 1.0 . . . . . . . . . . . . B . 3 GLU OE1 . . . . . . . . . c19602_2mgt 1 . 19 . 10014 . 2 1 4 GLU OE2 O 19.181 2.522 0.778 . . . 1.0 . . . . . . . . . . . . B . 3 GLU OE2 . . . . . . . . . c19602_2mgt 1 . 19 . 10015 . 2 1 5 PHE C C 13.960 -1.404 -2.989 . . . 1.0 . . . . . . . . . . . . B . 4 PHE C . . . . . . . . . c19602_2mgt 1 . 19 . 10016 . 2 1 5 PHE CA C 14.731 -1.101 -1.715 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CA . . . . . . . . . c19602_2mgt 1 . 19 . 10017 . 2 1 5 PHE CB C 14.016 0.006 -0.949 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CB . . . . . . . . . c19602_2mgt 1 . 19 . 10018 . 2 1 5 PHE CD1 C 15.121 -0.388 1.289 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CD1 . . . . . . . . . c19602_2mgt 1 . 19 . 10019 . 2 1 5 PHE CD2 C 15.183 1.842 0.313 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CD2 . . . . . . . . . c19602_2mgt 1 . 19 . 10020 . 2 1 5 PHE CE1 C 15.813 0.088 2.414 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CE1 . . . . . . . . . c19602_2mgt 1 . 19 . 10021 . 2 1 5 PHE CE2 C 15.881 2.312 1.433 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CE2 . . . . . . . . . c19602_2mgt 1 . 19 . 10022 . 2 1 5 PHE CG C 14.786 0.498 0.250 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CG . . . . . . . . . c19602_2mgt 1 . 19 . 10023 . 2 1 5 PHE CZ C 16.174 1.443 2.496 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CZ . . . . . . . . . c19602_2mgt 1 . 19 . 10024 . 2 1 5 PHE H H 16.274 0.243 -2.281 . . . 1.0 . . . . . . . . . . . . B . 4 PHE H . . . . . . . . . c19602_2mgt 1 . 19 . 10025 . 2 1 5 PHE HA H 14.721 -2.005 -1.110 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HA . . . . . . . . . c19602_2mgt 1 . 19 . 10026 . 2 1 5 PHE HB2 H 13.832 0.840 -1.629 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HB2 . . . . . . . . . c19602_2mgt 1 . 19 . 10027 . 2 1 5 PHE HB3 H 13.049 -0.367 -0.611 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HB3 . . . . . . . . . c19602_2mgt 1 . 19 . 10028 . 2 1 5 PHE HD1 H 14.856 -1.432 1.217 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HD1 . . . . . . . . . c19602_2mgt 1 . 19 . 10029 . 2 1 5 PHE HD2 H 14.952 2.507 -0.504 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HD2 . . . . . . . . . c19602_2mgt 1 . 19 . 10030 . 2 1 5 PHE HE1 H 16.066 -0.587 3.217 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HE1 . . . . . . . . . c19602_2mgt 1 . 19 . 10031 . 2 1 5 PHE HE2 H 16.198 3.340 1.472 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HE2 . . . . . . . . . c19602_2mgt 1 . 19 . 10032 . 2 1 5 PHE HZ H 16.691 1.811 3.367 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HZ . . . . . . . . . c19602_2mgt 1 . 19 . 10033 . 2 1 5 PHE N N 16.112 -0.708 -1.974 . . . 1.0 . . . . . . . . . . . . B . 4 PHE N . . . . . . . . . c19602_2mgt 1 . 19 . 10034 . 2 1 5 PHE O O 12.898 -2.008 -2.898 . . . 1.0 . . . . . . . . . . . . B . 4 PHE O . . . . . . . . . c19602_2mgt 1 . 19 . 10035 . 2 1 6 ARG C C 14.161 -2.849 -5.835 . . . 1.0 . . . . . . . . . . . . B . 5 ARG C . . . . . . . . . c19602_2mgt 1 . 19 . 10036 . 2 1 6 ARG CA C 13.899 -1.382 -5.455 . . . 1.0 . . . . . . . . . . . . B . 5 ARG CA . . . . . . . . . c19602_2mgt 1 . 19 . 10037 . 2 1 6 ARG CB C 14.354 -0.377 -6.524 . . . 1.0 . . . . . . . . . . . . B . 5 ARG CB . . . . . . . . . c19602_2mgt 1 . 19 . 10038 . 2 1 6 ARG CD C 12.626 1.334 -5.572 . . . 1.0 . . . . . . . . . . . . B . 5 ARG CD . . . . . . . . . c19602_2mgt 1 . 19 . 10039 . 2 1 6 ARG CG C 13.980 1.094 -6.255 . . . 1.0 . . . . . . . . . . . . B . 5 ARG CG . . . . . . . . . c19602_2mgt 1 . 19 . 10040 . 2 1 6 ARG CZ C 10.245 1.102 -6.312 . . . 1.0 . . . . . . . . . . . . B . 5 ARG CZ . . . . . . . . . c19602_2mgt 1 . 19 . 10041 . 2 1 6 ARG H H 15.365 -0.541 -4.179 . . . 1.0 . . . . . . . . . . . . B . 5 ARG H . . . . . . . . . c19602_2mgt 1 . 19 . 10042 . 2 1 6 ARG HA H 12.821 -1.288 -5.357 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HA . . . . . . . . . c19602_2mgt 1 . 19 . 10043 . 2 1 6 ARG HB2 H 15.434 -0.452 -6.642 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HB2 . . . . . . . . . c19602_2mgt 1 . 19 . 10044 . 2 1 6 ARG HB3 H 13.891 -0.659 -7.467 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HB3 . . . . . . . . . c19602_2mgt 1 . 19 . 10045 . 2 1 6 ARG HD2 H 12.633 0.912 -4.566 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HD2 . . . . . . . . . c19602_2mgt 1 . 19 . 10046 . 2 1 6 ARG HD3 H 12.466 2.405 -5.486 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HD3 . . . . . . . . . c19602_2mgt 1 . 19 . 10047 . 2 1 6 ARG HE H 11.770 -0.069 -6.900 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HE . . . . . . . . . c19602_2mgt 1 . 19 . 10048 . 2 1 6 ARG HG2 H 14.753 1.548 -5.646 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HG2 . . . . . . . . . c19602_2mgt 1 . 19 . 10049 . 2 1 6 ARG HG3 H 13.981 1.622 -7.206 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HG3 . . . . . . . . . c19602_2mgt 1 . 19 . 10050 . 2 1 6 ARG HH11 H 10.488 2.735 -5.116 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HH11 . . . . . . . . . c19602_2mgt 1 . 19 . 10051 . 2 1 6 ARG HH12 H 8.850 2.421 -5.645 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HH12 . . . . . . . . . c19602_2mgt 1 . 19 . 10052 . 2 1 6 ARG HH21 H 9.672 -0.420 -7.529 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HH21 . . . . . . . . . c19602_2mgt 1 . 19 . 10053 . 2 1 6 ARG HH22 H 8.385 0.638 -6.996 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HH22 . . . . . . . . . c19602_2mgt 1 . 19 . 10054 . 2 1 6 ARG N N 14.486 -1.040 -4.167 . . . 1.0 . . . . . . . . . . . . B . 5 ARG N . . . . . . . . . c19602_2mgt 1 . 19 . 10055 . 2 1 6 ARG NE N 11.528 0.730 -6.332 . . . 1.0 . . . . . . . . . . . . B . 5 ARG NE . . . . . . . . . c19602_2mgt 1 . 19 . 10056 . 2 1 6 ARG NH1 N 9.828 2.172 -5.634 . . . 1.0 . . . . . . . . . . . . B . 5 ARG NH1 . . . . . . . . . c19602_2mgt 1 . 19 . 10057 . 2 1 6 ARG NH2 N 9.361 0.380 -6.998 . . . 1.0 . . . . . . . . . . . . B . 5 ARG NH2 . . . . . . . . . c19602_2mgt 1 . 19 . 10058 . 2 1 6 ARG O O 14.201 -3.195 -7.010 . . . 1.0 . . . . . . . . . . . . B . 5 ARG O . . . . . . . . . c19602_2mgt 1 . 19 . 10059 . 2 1 7 ARG C C 13.134 -5.799 -5.283 . . . 1.0 . . . . . . . . . . . . B . 6 ARG C . . . . . . . . . c19602_2mgt 1 . 19 . 10060 . 2 1 7 ARG CA C 14.474 -5.154 -4.953 . . . 1.0 . . . . . . . . . . . . B . 6 ARG CA . . . . . . . . . c19602_2mgt 1 . 19 . 10061 . 2 1 7 ARG CB C 15.004 -5.731 -3.633 . . . 1.0 . . . . . . . . . . . . B . 6 ARG CB . . . . . . . . . c19602_2mgt 1 . 19 . 10062 . 2 1 7 ARG CD C 17.488 -5.154 -4.075 . . . 1.0 . . . . . . . . . . . . B . 6 ARG CD . . . . . . . . . c19602_2mgt 1 . 19 . 10063 . 2 1 7 ARG CG C 16.287 -5.063 -3.130 . . . 1.0 . . . . . . . . . . . . B . 6 ARG CG . . . . . . . . . c19602_2mgt 1 . 19 . 10064 . 2 1 7 ARG CZ C 17.571 -4.047 -6.342 . . . 1.0 . . . . . . . . . . . . B . 6 ARG CZ . . . . . . . . . c19602_2mgt 1 . 19 . 10065 . 2 1 7 ARG H H 14.322 -3.356 -3.889 . . . 1.0 . . . . . . . . . . . . B . 6 ARG H . . . . . . . . . c19602_2mgt 1 . 19 . 10066 . 2 1 7 ARG HA H 15.185 -5.361 -5.744 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HA . . . . . . . . . c19602_2mgt 1 . 19 . 10067 . 2 1 7 ARG HB2 H 14.240 -5.592 -2.867 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HB2 . . . . . . . . . c19602_2mgt 1 . 19 . 10068 . 2 1 7 ARG HB3 H 15.181 -6.800 -3.748 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HB3 . . . . . . . . . c19602_2mgt 1 . 19 . 10069 . 2 1 7 ARG HD2 H 18.399 -5.159 -3.478 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HD2 . . . . . . . . . c19602_2mgt 1 . 19 . 10070 . 2 1 7 ARG HD3 H 17.431 -6.091 -4.616 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HD3 . . . . . . . . . c19602_2mgt 1 . 19 . 10071 . 2 1 7 ARG HE H 17.586 -3.097 -4.560 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HE . . . . . . . . . c19602_2mgt 1 . 19 . 10072 . 2 1 7 ARG HG2 H 16.059 -4.021 -2.948 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HG2 . . . . . . . . . c19602_2mgt 1 . 19 . 10073 . 2 1 7 ARG HG3 H 16.560 -5.523 -2.182 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HG3 . . . . . . . . . c19602_2mgt 1 . 19 . 10074 . 2 1 7 ARG HH11 H 17.510 -6.070 -6.531 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HH11 . . . . . . . . . c19602_2mgt 1 . 19 . 10075 . 2 1 7 ARG HH12 H 17.537 -5.174 -8.033 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HH12 . . . . . . . . . c19602_2mgt 1 . 19 . 10076 . 2 1 7 ARG HH21 H 17.661 -2.028 -6.556 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HH21 . . . . . . . . . c19602_2mgt 1 . 19 . 10077 . 2 1 7 ARG HH22 H 17.619 -2.936 -8.050 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HH22 . . . . . . . . . c19602_2mgt 1 . 19 . 10078 . 2 1 7 ARG N N 14.333 -3.716 -4.831 . . . 1.0 . . . . . . . . . . . . B . 6 ARG N . . . . . . . . . c19602_2mgt 1 . 19 . 10079 . 2 1 7 ARG NE N 17.558 -4.009 -4.998 . . . 1.0 . . . . . . . . . . . . B . 6 ARG NE . . . . . . . . . c19602_2mgt 1 . 19 . 10080 . 2 1 7 ARG NH1 N 17.553 -5.191 -7.023 . . . 1.0 . . . . . . . . . . . . B . 6 ARG NH1 . . . . . . . . . c19602_2mgt 1 . 19 . 10081 . 2 1 7 ARG NH2 N 17.598 -2.911 -7.040 . . . 1.0 . . . . . . . . . . . . B . 6 ARG NH2 . . . . . . . . . c19602_2mgt 1 . 19 . 10082 . 2 1 7 ARG O O 12.080 -5.278 -4.929 . . . 1.0 . . . . . . . . . . . . B . 6 ARG O . . . . . . . . . c19602_2mgt 1 . 19 . 10083 . 2 1 8 ASP C C 11.343 -8.319 -4.840 . . . 1.0 . . . . . . . . . . . . B . 7 ASP C . . . . . . . . . c19602_2mgt 1 . 19 . 10084 . 2 1 8 ASP CA C 11.989 -7.796 -6.142 . . . 1.0 . . . . . . . . . . . . B . 7 ASP CA . . . . . . . . . c19602_2mgt 1 . 19 . 10085 . 2 1 8 ASP CB C 12.424 -8.944 -7.054 . . . 1.0 . . . . . . . . . . . . B . 7 ASP CB . . . . . . . . . c19602_2mgt 1 . 19 . 10086 . 2 1 8 ASP CG C 11.227 -9.630 -7.685 . . . 1.0 . . . . . . . . . . . . B . 7 ASP CG . . . . . . . . . c19602_2mgt 1 . 19 . 10087 . 2 1 8 ASP H H 14.069 -7.378 -6.143 . . . 1.0 . . . . . . . . . . . . B . 7 ASP H . . . . . . . . . c19602_2mgt 1 . 19 . 10088 . 2 1 8 ASP HA H 11.258 -7.188 -6.675 . . . 1.0 . . . . . . . . . . . . B . 7 ASP HA . . . . . . . . . c19602_2mgt 1 . 19 . 10089 . 2 1 8 ASP HB2 H 13.064 -8.558 -7.847 . . . 1.0 . . . . . . . . . . . . B . 7 ASP HB2 . . . . . . . . . c19602_2mgt 1 . 19 . 10090 . 2 1 8 ASP HB3 H 12.997 -9.673 -6.487 . . . 1.0 . . . . . . . . . . . . B . 7 ASP HB3 . . . . . . . . . c19602_2mgt 1 . 19 . 10091 . 2 1 8 ASP N N 13.173 -6.981 -5.894 . . . 1.0 . . . . . . . . . . . . B . 7 ASP N . . . . . . . . . c19602_2mgt 1 . 19 . 10092 . 2 1 8 ASP O O 10.214 -8.801 -4.862 . . . 1.0 . . . . . . . . . . . . B . 7 ASP O . . . . . . . . . c19602_2mgt 1 . 19 . 10093 . 2 1 8 ASP OD1 O 10.683 -10.542 -7.040 . . . 1.0 . . . . . . . . . . . . B . 7 ASP OD1 . . . . . . . . . c19602_2mgt 1 . 19 . 10094 . 2 1 8 ASP OD2 O 10.863 -9.221 -8.806 . . . 1.0 . . . . . . . . . . . . B . 7 ASP OD2 . . . . . . . . . c19602_2mgt 1 . 19 . 10095 . 2 1 9 SER C C 10.484 -8.634 -1.749 . . . 1.0 . . . . . . . . . . . . B . 8 SER C . . . . . . . . . c19602_2mgt 1 . 19 . 10096 . 2 1 9 SER CA C 11.794 -8.947 -2.474 . . . 1.0 . . . . . . . . . . . . B . 8 SER CA . . . . . . . . . c19602_2mgt 1 . 19 . 10097 . 2 1 9 SER CB C 12.946 -8.671 -1.504 . . . 1.0 . . . . . . . . . . . . B . 8 SER CB . . . . . . . . . c19602_2mgt 1 . 19 . 10098 . 2 1 9 SER H H 12.981 -7.830 -3.788 . . . 1.0 . . . . . . . . . . . . B . 8 SER H . . . . . . . . . c19602_2mgt 1 . 19 . 10099 . 2 1 9 SER HA H 11.787 -10.003 -2.726 . . . 1.0 . . . . . . . . . . . . B . 8 SER HA . . . . . . . . . c19602_2mgt 1 . 19 . 10100 . 2 1 9 SER HB2 H 13.072 -7.595 -1.392 . . . 1.0 . . . . . . . . . . . . B . 8 SER HB2 . . . . . . . . . c19602_2mgt 1 . 19 . 10101 . 2 1 9 SER HB3 H 12.726 -9.107 -0.530 . . . 1.0 . . . . . . . . . . . . B . 8 SER HB3 . . . . . . . . . c19602_2mgt 1 . 19 . 10102 . 2 1 9 SER HG H 14.873 -8.885 -1.481 . . . 1.0 . . . . . . . . . . . . B . 8 SER HG . . . . . . . . . c19602_2mgt 1 . 19 . 10103 . 2 1 9 SER N N 12.057 -8.226 -3.711 . . . 1.0 . . . . . . . . . . . . B . 8 SER N . . . . . . . . . c19602_2mgt 1 . 19 . 10104 . 2 1 9 SER O O 10.133 -9.396 -0.850 . . . 1.0 . . . . . . . . . . . . B . 8 SER O . . . . . . . . . c19602_2mgt 1 . 19 . 10105 . 2 1 9 SER OG O 14.135 -9.241 -1.986 . . . 1.0 . . . . . . . . . . . . B . 8 SER OG . . . . . . . . . c19602_2mgt 1 . 19 . 10106 . 2 1 10 GLY C C 7.493 -6.941 -2.489 . . . 1.0 . . . . . . . . . . . . B . 9 GLY C . . . . . . . . . c19602_2mgt 1 . 19 . 10107 . 2 1 10 GLY CA C 8.563 -7.124 -1.419 . . . 1.0 . . . . . . . . . . . . B . 9 GLY CA . . . . . . . . . c19602_2mgt 1 . 19 . 10108 . 2 1 10 GLY H H 10.020 -7.015 -2.911 . . . 1.0 . . . . . . . . . . . . B . 9 GLY H . . . . . . . . . c19602_2mgt 1 . 19 . 10109 . 2 1 10 GLY HA2 H 8.225 -7.851 -0.684 . . . 1.0 . . . . . . . . . . . . B . 9 GLY HA2 . . . . . . . . . c19602_2mgt 1 . 19 . 10110 . 2 1 10 GLY HA3 H 8.777 -6.191 -0.903 . . . 1.0 . . . . . . . . . . . . B . 9 GLY HA3 . . . . . . . . . c19602_2mgt 1 . 19 . 10111 . 2 1 10 GLY N N 9.777 -7.548 -2.088 . . . 1.0 . . . . . . . . . . . . B . 9 GLY N . . . . . . . . . c19602_2mgt 1 . 19 . 10112 . 2 1 10 GLY O O 7.284 -7.841 -3.288 . . . 1.0 . . . . . . . . . . . . B . 9 GLY O . . . . . . . . . c19602_2mgt 1 . 19 . 10113 . 2 1 11 TYR C C 6.012 -3.539 -2.124 . . . 1.0 . . . . . . . . . . . . B . 10 TYR C . . . . . . . . . c19602_2mgt 1 . 19 . 10114 . 2 1 11 TYR CA C 7.126 -4.554 -1.940 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CA . . . . . . . . . c19602_2mgt 1 . 19 . 10115 . 2 1 11 TYR CB C 8.396 -3.971 -2.578 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CB . . . . . . . . . c19602_2mgt 1 . 19 . 10116 . 2 1 11 TYR CD1 C 9.343 -2.949 -0.463 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CD1 . . . . . . . . . c19602_2mgt 1 . 19 . 10117 . 2 1 11 TYR CD2 C 10.779 -4.298 -1.887 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CD2 . . . . . . . . . c19602_2mgt 1 . 19 . 10118 . 2 1 11 TYR CE1 C 10.413 -2.720 0.411 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CE1 . . . . . . . . . c19602_2mgt 1 . 19 . 10119 . 2 1 11 TYR CE2 C 11.860 -4.042 -1.039 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CE2 . . . . . . . . . c19602_2mgt 1 . 19 . 10120 . 2 1 11 TYR CG C 9.526 -3.737 -1.612 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CG . . . . . . . . . c19602_2mgt 1 . 19 . 10121 . 2 1 11 TYR CZ C 11.688 -3.248 0.114 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CZ . . . . . . . . . c19602_2mgt 1 . 19 . 10122 . 2 1 11 TYR H H 6.225 -5.704 -3.394 . . . 1.0 . . . . . . . . . . . . B . 10 TYR H . . . . . . . . . c19602_2mgt 1 . 19 . 10123 . 2 1 11 TYR HA H 7.272 -4.727 -0.873 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HA . . . . . . . . . c19602_2mgt 1 . 19 . 10124 . 2 1 11 TYR HB2 H 8.750 -4.624 -3.376 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HB2 . . . . . . . . . c19602_2mgt 1 . 19 . 10125 . 2 1 11 TYR HB3 H 8.157 -3.028 -3.065 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HB3 . . . . . . . . . c19602_2mgt 1 . 19 . 10126 . 2 1 11 TYR HD1 H 8.388 -2.503 -0.254 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HD1 . . . . . . . . . c19602_2mgt 1 . 19 . 10127 . 2 1 11 TYR HD2 H 10.913 -4.919 -2.756 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HD2 . . . . . . . . . c19602_2mgt 1 . 19 . 10128 . 2 1 11 TYR HE1 H 10.253 -2.139 1.300 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HE1 . . . . . . . . . c19602_2mgt 1 . 19 . 10129 . 2 1 11 TYR HE2 H 12.821 -4.449 -1.285 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HE2 . . . . . . . . . c19602_2mgt 1 . 19 . 10130 . 2 1 11 TYR HH H 12.517 -2.441 1.679 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HH . . . . . . . . . c19602_2mgt 1 . 19 . 10131 . 2 1 11 TYR N N 6.807 -5.804 -2.585 . . . 1.0 . . . . . . . . . . . . B . 10 TYR N . . . . . . . . . c19602_2mgt 1 . 19 . 10132 . 2 1 11 TYR O O 5.320 -3.512 -3.139 . . . 1.0 . . . . . . . . . . . . B . 10 TYR O . . . . . . . . . c19602_2mgt 1 . 19 . 10133 . 2 1 11 TYR OH O 12.745 -3.013 0.941 . . . 1.0 . . . . . . . . . . . . B . 10 TYR OH . . . . . . . . . c19602_2mgt 1 . 19 . 10134 . 2 1 12 GLU C C 6.568 -0.359 -0.722 . . . 1.0 . . . . . . . . . . . . B . 11 GLU C . . . . . . . . . c19602_2mgt 1 . 19 . 10135 . 2 1 12 GLU CA C 5.518 -1.265 -1.368 . . . 1.0 . . . . . . . . . . . . B . 11 GLU CA . . . . . . . . . c19602_2mgt 1 . 19 . 10136 . 2 1 12 GLU CB C 4.150 -1.152 -0.722 . . . 1.0 . . . . . . . . . . . . B . 11 GLU CB . . . . . . . . . c19602_2mgt 1 . 19 . 10137 . 2 1 12 GLU CD C 2.343 0.470 -0.074 . . . 1.0 . . . . . . . . . . . . B . 11 GLU CD . . . . . . . . . c19602_2mgt 1 . 19 . 10138 . 2 1 12 GLU CG C 3.558 0.241 -0.948 . . . 1.0 . . . . . . . . . . . . B . 11 GLU CG . . . . . . . . . c19602_2mgt 1 . 19 . 10139 . 2 1 12 GLU H H 6.532 -2.761 -0.345 . . . 1.0 . . . . . . . . . . . . B . 11 GLU H . . . . . . . . . c19602_2mgt 1 . 19 . 10140 . 2 1 12 GLU HA H 5.443 -1.054 -2.431 . . . 1.0 . . . . . . . . . . . . B . 11 GLU HA . . . . . . . . . c19602_2mgt 1 . 19 . 10141 . 2 1 12 GLU HB2 H 3.487 -1.902 -1.154 . . . 1.0 . . . . . . . . . . . . B . 11 GLU HB2 . . . . . . . . . c19602_2mgt 1 . 19 . 10142 . 2 1 12 GLU HB3 H 4.256 -1.355 0.343 . . . 1.0 . . . . . . . . . . . . B . 11 GLU HB3 . . . . . . . . . c19602_2mgt 1 . 19 . 10143 . 2 1 12 GLU HG2 H 4.294 1.004 -0.695 . . . 1.0 . . . . . . . . . . . . B . 11 GLU HG2 . . . . . . . . . c19602_2mgt 1 . 19 . 10144 . 2 1 12 GLU HG3 H 3.286 0.356 -1.996 . . . 1.0 . . . . . . . . . . . . B . 11 GLU HG3 . . . . . . . . . c19602_2mgt 1 . 19 . 10145 . 2 1 12 GLU N N 5.984 -2.610 -1.178 . . . 1.0 . . . . . . . . . . . . B . 11 GLU N . . . . . . . . . c19602_2mgt 1 . 19 . 10146 . 2 1 12 GLU O O 6.550 -0.127 0.487 . . . 1.0 . . . . . . . . . . . . B . 11 GLU O . . . . . . . . . c19602_2mgt 1 . 19 . 10147 . 2 1 12 GLU OE1 O 2.000 -0.391 0.741 . . . 1.0 . . . . . . . . . . . . B . 11 GLU OE1 . . . . . . . . . c19602_2mgt 1 . 19 . 10148 . 2 1 12 GLU OE2 O 1.774 1.581 -0.189 . . . 1.0 . . . . . . . . . . . . B . 11 GLU OE2 . . . . . . . . . c19602_2mgt 1 . 19 . 10149 . 2 1 13 VAL C C 8.392 2.174 -0.519 . . . 1.0 . . . . . . . . . . . . B . 12 VAL C . . . . . . . . . c19602_2mgt 1 . 19 . 10150 . 2 1 13 VAL CA C 8.716 0.806 -1.125 . . . 1.0 . . . . . . . . . . . . B . 12 VAL CA . . . . . . . . . c19602_2mgt 1 . 19 . 10151 . 2 1 13 VAL CB C 9.691 0.925 -2.311 . . . 1.0 . . . . . . . . . . . . B . 12 VAL CB . . . . . . . . . c19602_2mgt 1 . 19 . 10152 . 2 1 13 VAL CG1 C 10.883 1.830 -1.980 . . . 1.0 . . . . . . . . . . . . B . 12 VAL CG1 . . . . . . . . . c19602_2mgt 1 . 19 . 10153 . 2 1 13 VAL CG2 C 10.248 -0.453 -2.681 . . . 1.0 . . . . . . . . . . . . B . 12 VAL CG2 . . . . . . . . . c19602_2mgt 1 . 19 . 10154 . 2 1 13 VAL H H 7.438 -0.108 -2.529 . . . 1.0 . . . . . . . . . . . . B . 12 VAL H . . . . . . . . . c19602_2mgt 1 . 19 . 10155 . 2 1 13 VAL HA H 9.219 0.200 -0.383 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HA . . . . . . . . . c19602_2mgt 1 . 19 . 10156 . 2 1 13 VAL HB H 9.160 1.340 -3.167 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HB . . . . . . . . . c19602_2mgt 1 . 19 . 10157 . 2 1 13 VAL HG11 H 10.534 2.855 -1.878 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HG11 . . . . . . . . . c19602_2mgt 1 . 19 . 10158 . 2 1 13 VAL HG12 H 11.351 1.511 -1.048 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HG12 . . . . . . . . . c19602_2mgt 1 . 19 . 10159 . 2 1 13 VAL HG13 H 11.619 1.799 -2.780 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HG13 . . . . . . . . . c19602_2mgt 1 . 19 . 10160 . 2 1 13 VAL HG21 H 10.925 -0.348 -3.526 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HG21 . . . . . . . . . c19602_2mgt 1 . 19 . 10161 . 2 1 13 VAL HG22 H 10.782 -0.875 -1.831 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HG22 . . . . . . . . . c19602_2mgt 1 . 19 . 10162 . 2 1 13 VAL HG23 H 9.436 -1.114 -2.972 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HG23 . . . . . . . . . c19602_2mgt 1 . 19 . 10163 . 2 1 13 VAL N N 7.513 0.105 -1.546 . . . 1.0 . . . . . . . . . . . . B . 12 VAL N . . . . . . . . . c19602_2mgt 1 . 19 . 10164 . 2 1 13 VAL O O 9.075 2.590 0.417 . . . 1.0 . . . . . . . . . . . . B . 12 VAL O . . . . . . . . . c19602_2mgt 1 . 19 . 10165 . 2 1 14 HIS C C 6.793 4.608 0.650 . . . 1.0 . . . . . . . . . . . . B . 13 HIS C . . . . . . . . . c19602_2mgt 1 . 19 . 10166 . 2 1 14 HIS CA C 7.207 4.298 -0.785 . . . 1.0 . . . . . . . . . . . . B . 13 HIS CA . . . . . . . . . c19602_2mgt 1 . 19 . 10167 . 2 1 14 HIS CB C 6.220 4.935 -1.767 . . . 1.0 . . . . . . . . . . . . B . 13 HIS CB . . . . . . . . . c19602_2mgt 1 . 19 . 10168 . 2 1 14 HIS CD2 C 4.098 5.600 -0.480 . . . 1.0 . . . . . . . . . . . . B . 13 HIS CD2 . . . . . . . . . c19602_2mgt 1 . 19 . 10169 . 2 1 14 HIS CE1 C 2.668 4.190 -1.337 . . . 1.0 . . . . . . . . . . . . B . 13 HIS CE1 . . . . . . . . . c19602_2mgt 1 . 19 . 10170 . 2 1 14 HIS CG C 4.768 4.815 -1.381 . . . 1.0 . . . . . . . . . . . . B . 13 HIS CG . . . . . . . . . c19602_2mgt 1 . 19 . 10171 . 2 1 14 HIS H H 6.833 2.469 -1.797 . . . 1.0 . . . . . . . . . . . . B . 13 HIS H . . . . . . . . . c19602_2mgt 1 . 19 . 10172 . 2 1 14 HIS HA H 8.184 4.749 -0.952 . . . 1.0 . . . . . . . . . . . . B . 13 HIS HA . . . . . . . . . c19602_2mgt 1 . 19 . 10173 . 2 1 14 HIS HB2 H 6.454 5.997 -1.829 . . . 1.0 . . . . . . . . . . . . B . 13 HIS HB2 . . . . . . . . . c19602_2mgt 1 . 19 . 10174 . 2 1 14 HIS HB3 H 6.360 4.506 -2.759 . . . 1.0 . . . . . . . . . . . . B . 13 HIS HB3 . . . . . . . . . c19602_2mgt 1 . 19 . 10175 . 2 1 14 HIS HD1 H 4.035 3.243 -2.615 . . . 1.0 . . . . . . . . . . . . B . 13 HIS HD1 . . . . . . . . . c19602_2mgt 1 . 19 . 10176 . 2 1 14 HIS HD2 H 4.522 6.405 0.103 . . . 1.0 . . . . . . . . . . . . B . 13 HIS HD2 . . . . . . . . . c19602_2mgt 1 . 19 . 10177 . 2 1 14 HIS HE1 H 1.751 3.674 -1.568 . . . 1.0 . . . . . . . . . . . . B . 13 HIS HE1 . . . . . . . . . c19602_2mgt 1 . 19 . 10178 . 2 1 14 HIS N N 7.379 2.876 -1.051 . . . 1.0 . . . . . . . . . . . . B . 13 HIS N . . . . . . . . . c19602_2mgt 1 . 19 . 10179 . 2 1 14 HIS ND1 N 3.854 3.937 -1.903 . . . 1.0 . . . . . . . . . . . . B . 13 HIS ND1 . . . . . . . . . c19602_2mgt 1 . 19 . 10180 . 2 1 14 HIS NE2 N 2.769 5.182 -0.446 . . . 1.0 . . . . . . . . . . . . B . 13 HIS NE2 . . . . . . . . . c19602_2mgt 1 . 19 . 10181 . 2 1 14 HIS O O 6.999 5.735 1.082 . . . 1.0 . . . . . . . . . . . . B . 13 HIS O . . . . . . . . . c19602_2mgt 1 . 19 . 10182 . 2 1 15 HIS C C 6.277 2.303 3.408 . . . 1.0 . . . . . . . . . . . . B . 14 HIS C . . . . . . . . . c19602_2mgt 1 . 19 . 10183 . 2 1 15 HIS CA C 6.111 3.711 2.831 . . . 1.0 . . . . . . . . . . . . B . 14 HIS CA . . . . . . . . . c19602_2mgt 1 . 19 . 10184 . 2 1 15 HIS CB C 4.854 4.494 3.267 . . . 1.0 . . . . . . . . . . . . B . 14 HIS CB . . . . . . . . . c19602_2mgt 1 . 19 . 10185 . 2 1 15 HIS CD2 C 3.010 3.071 2.175 . . . 1.0 . . . . . . . . . . . . B . 14 HIS CD2 . . . . . . . . . c19602_2mgt 1 . 19 . 10186 . 2 1 15 HIS CE1 C 1.678 2.805 3.891 . . . 1.0 . . . . . . . . . . . . B . 14 HIS CE1 . . . . . . . . . c19602_2mgt 1 . 19 . 10187 . 2 1 15 HIS CG C 3.543 3.755 3.229 . . . 1.0 . . . . . . . . . . . . B . 14 HIS CG . . . . . . . . . c19602_2mgt 1 . 19 . 10188 . 2 1 15 HIS H H 6.071 2.739 0.947 . . . 1.0 . . . . . . . . . . . . B . 14 HIS H . . . . . . . . . c19602_2mgt 1 . 19 . 10189 . 2 1 15 HIS HA H 6.963 4.284 3.193 . . . 1.0 . . . . . . . . . . . . B . 14 HIS HA . . . . . . . . . c19602_2mgt 1 . 19 . 10190 . 2 1 15 HIS HB2 H 5.007 4.817 4.295 . . . 1.0 . . . . . . . . . . . . B . 14 HIS HB2 . . . . . . . . . c19602_2mgt 1 . 19 . 10191 . 2 1 15 HIS HB3 H 4.761 5.396 2.663 . . . 1.0 . . . . . . . . . . . . B . 14 HIS HB3 . . . . . . . . . c19602_2mgt 1 . 19 . 10192 . 2 1 15 HIS HD1 H 2.829 3.936 5.231 . . . 1.0 . . . . . . . . . . . . B . 14 HIS HD1 . . . . . . . . . c19602_2mgt 1 . 19 . 10193 . 2 1 15 HIS HD2 H 3.453 2.977 1.195 . . . 1.0 . . . . . . . . . . . . B . 14 HIS HD2 . . . . . . . . . c19602_2mgt 1 . 19 . 10194 . 2 1 15 HIS HE1 H 0.875 2.467 4.525 . . . 1.0 . . . . . . . . . . . . B . 14 HIS HE1 . . . . . . . . . c19602_2mgt 1 . 19 . 10195 . 2 1 15 HIS N N 6.242 3.636 1.383 . . . 1.0 . . . . . . . . . . . . B . 14 HIS N . . . . . . . . . c19602_2mgt 1 . 19 . 10196 . 2 1 15 HIS ND1 N 2.690 3.587 4.293 . . . 1.0 . . . . . . . . . . . . B . 14 HIS ND1 . . . . . . . . . c19602_2mgt 1 . 19 . 10197 . 2 1 15 HIS NE2 N 1.818 2.479 2.599 . . . 1.0 . . . . . . . . . . . . B . 14 HIS NE2 . . . . . . . . . c19602_2mgt 1 . 19 . 10198 . 2 1 15 HIS O O 5.430 1.804 4.145 . . . 1.0 . . . . . . . . . . . . B . 14 HIS O . . . . . . . . . c19602_2mgt 1 . 19 . 10199 . 2 1 16 GLN C C 7.865 0.222 4.990 . . . 1.0 . . . . . . . . . . . . B . 15 GLN C . . . . . . . . . c19602_2mgt 1 . 19 . 10200 . 2 1 16 GLN CA C 7.794 0.333 3.468 . . . 1.0 . . . . . . . . . . . . B . 15 GLN CA . . . . . . . . . c19602_2mgt 1 . 19 . 10201 . 2 1 16 GLN CB C 9.140 -0.043 2.832 . . . 1.0 . . . . . . . . . . . . B . 15 GLN CB . . . . . . . . . c19602_2mgt 1 . 19 . 10202 . 2 1 16 GLN CD C 11.627 0.445 2.577 . . . 1.0 . . . . . . . . . . . . B . 15 GLN CD . . . . . . . . . c19602_2mgt 1 . 19 . 10203 . 2 1 16 GLN CG C 10.299 0.905 3.180 . . . 1.0 . . . . . . . . . . . . B . 15 GLN CG . . . . . . . . . c19602_2mgt 1 . 19 . 10204 . 2 1 16 GLN H H 8.033 2.132 2.413 . . . 1.0 . . . . . . . . . . . . B . 15 GLN H . . . . . . . . . c19602_2mgt 1 . 19 . 10205 . 2 1 16 GLN HA H 7.048 -0.374 3.109 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HA . . . . . . . . . c19602_2mgt 1 . 19 . 10206 . 2 1 16 GLN HB2 H 9.406 -1.041 3.165 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HB2 . . . . . . . . . c19602_2mgt 1 . 19 . 10207 . 2 1 16 GLN HB3 H 9.017 -0.078 1.755 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HB3 . . . . . . . . . c19602_2mgt 1 . 19 . 10208 . 2 1 16 GLN HE21 H 12.124 2.340 2.050 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HE21 . . . . . . . . . c19602_2mgt 1 . 19 . 10209 . 2 1 16 GLN HE22 H 13.309 1.112 1.671 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HE22 . . . . . . . . . c19602_2mgt 1 . 19 . 10210 . 2 1 16 GLN HG2 H 10.071 1.903 2.809 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HG2 . . . . . . . . . c19602_2mgt 1 . 19 . 10211 . 2 1 16 GLN HG3 H 10.417 0.963 4.261 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HG3 . . . . . . . . . c19602_2mgt 1 . 19 . 10212 . 2 1 16 GLN N N 7.391 1.660 3.030 . . . 1.0 . . . . . . . . . . . . B . 15 GLN N . . . . . . . . . c19602_2mgt 1 . 19 . 10213 . 2 1 16 GLN NE2 N 12.414 1.373 2.055 . . . 1.0 . . . . . . . . . . . . B . 15 GLN NE2 . . . . . . . . . c19602_2mgt 1 . 19 . 10214 . 2 1 16 GLN O O 7.928 1.224 5.698 . . . 1.0 . . . . . . . . . . . . B . 15 GLN O . . . . . . . . . c19602_2mgt 1 . 19 . 10215 . 2 1 16 GLN OE1 O 11.960 -0.734 2.584 . . . 1.0 . . . . . . . . . . . . B . 15 GLN OE1 . . . . . . . . . c19602_2mgt 1 . 19 . 10216 . 2 1 17 LYS C C 9.418 -1.234 7.405 . . . 1.0 . . . . . . . . . . . . B . 16 LYS C . . . . . . . . . c19602_2mgt 1 . 19 . 10217 . 2 1 17 LYS CA C 7.977 -1.320 6.903 . . . 1.0 . . . . . . . . . . . . B . 16 LYS CA . . . . . . . . . c19602_2mgt 1 . 19 . 10218 . 2 1 17 LYS CB C 7.357 -2.695 7.172 . . . 1.0 . . . . . . . . . . . . B . 16 LYS CB . . . . . . . . . c19602_2mgt 1 . 19 . 10219 . 2 1 17 LYS CD C 5.129 -3.802 7.531 . . . 1.0 . . . . . . . . . . . . B . 16 LYS CD . . . . . . . . . c19602_2mgt 1 . 19 . 10220 . 2 1 17 LYS CE C 3.634 -3.556 7.382 . . . 1.0 . . . . . . . . . . . . B . 16 LYS CE . . . . . . . . . c19602_2mgt 1 . 19 . 10221 . 2 1 17 LYS CG C 5.849 -2.608 6.927 . . . 1.0 . . . . . . . . . . . . B . 16 LYS CG . . . . . . . . . c19602_2mgt 1 . 19 . 10222 . 2 1 17 LYS H H 7.852 -1.794 4.838 . . . 1.0 . . . . . . . . . . . . B . 16 LYS H . . . . . . . . . c19602_2mgt 1 . 19 . 10223 . 2 1 17 LYS HA H 7.403 -0.575 7.453 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HA . . . . . . . . . c19602_2mgt 1 . 19 . 10224 . 2 1 17 LYS HB2 H 7.803 -3.454 6.528 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HB2 . . . . . . . . . c19602_2mgt 1 . 19 . 10225 . 2 1 17 LYS HB3 H 7.536 -2.974 8.210 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HB3 . . . . . . . . . c19602_2mgt 1 . 19 . 10226 . 2 1 17 LYS HD2 H 5.424 -4.719 7.022 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HD2 . . . . . . . . . c19602_2mgt 1 . 19 . 10227 . 2 1 17 LYS HD3 H 5.377 -3.875 8.588 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HD3 . . . . . . . . . c19602_2mgt 1 . 19 . 10228 . 2 1 17 LYS HE2 H 3.387 -2.576 7.792 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HE2 . . . . . . . . . c19602_2mgt 1 . 19 . 10229 . 2 1 17 LYS HE3 H 3.362 -3.575 6.328 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HE3 . . . . . . . . . c19602_2mgt 1 . 19 . 10230 . 2 1 17 LYS HG2 H 5.462 -1.708 7.405 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HG2 . . . . . . . . . c19602_2mgt 1 . 19 . 10231 . 2 1 17 LYS HG3 H 5.644 -2.558 5.856 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HG3 . . . . . . . . . c19602_2mgt 1 . 19 . 10232 . 2 1 17 LYS HZ1 H 1.885 -4.402 7.997 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HZ1 . . . . . . . . . c19602_2mgt 1 . 19 . 10233 . 2 1 17 LYS HZ2 H 3.094 -5.491 7.729 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HZ2 . . . . . . . . . c19602_2mgt 1 . 19 . 10234 . 2 1 17 LYS HZ3 H 3.116 -4.549 9.078 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HZ3 . . . . . . . . . c19602_2mgt 1 . 19 . 10235 . 2 1 17 LYS N N 7.880 -1.016 5.483 . . . 1.0 . . . . . . . . . . . . B . 16 LYS N . . . . . . . . . c19602_2mgt 1 . 19 . 10236 . 2 1 17 LYS NZ N 2.875 -4.576 8.097 . . . 1.0 . . . . . . . . . . . . B . 16 LYS NZ . . . . . . . . . c19602_2mgt 1 . 19 . 10237 . 2 1 17 LYS O O 10.358 -1.154 6.618 . . . 1.0 . . . . . . . . . . . . B . 16 LYS O . . . . . . . . . c19602_2mgt 1 . 19 . 10238 . 2 1 18 NH2 HN1 H 10.530 -1.194 9.109 . . . 1.0 . . . . . . . . . . . . B . 17 NH2 HN1 . . . . . . . . . c19602_2mgt 1 . 19 . 10239 . 2 1 18 NH2 HN2 H 8.800 -1.297 9.341 . . . 1.0 . . . . . . . . . . . . B . 17 NH2 HN2 . . . . . . . . . c19602_2mgt 1 . 19 . 10240 . 2 1 18 NH2 N N 9.597 -1.238 8.725 . . . 1.0 . . . . . . . . . . . . B . 17 NH2 N . . . . . . . . . c19602_2mgt 1 . 19 . 10241 . 3 2 1 ZN ZN Zn 0.781 1.013 1.550 . . . 1.0 . . . . . . . . . . . . A . 101 ZN ZN . . . . . . . . . c19602_2mgt 1 . 20 . 10242 . 1 1 1 ACE C C -11.284 -6.383 -0.299 . . . 1.0 . . . . . . . . . . . . A . 0 ACE C . . . . . . . . . c19602_2mgt 1 . 20 . 10243 . 1 1 1 ACE CH3 C -10.002 -5.825 0.301 . . . 1.0 . . . . . . . . . . . . A . 0 ACE CH3 . . . . . . . . . c19602_2mgt 1 . 20 . 10244 . 1 1 1 ACE H1 H -10.238 -5.182 1.148 . . . 1.0 . . . . . . . . . . . . A . 0 ACE H1 . . . . . . . . . c19602_2mgt 1 . 20 . 10245 . 1 1 1 ACE H2 H -9.360 -6.638 0.635 . . . 1.0 . . . . . . . . . . . . A . 0 ACE H2 . . . . . . . . . c19602_2mgt 1 . 20 . 10246 . 1 1 1 ACE H3 H -9.480 -5.245 -0.456 . . . 1.0 . . . . . . . . . . . . A . 0 ACE H3 . . . . . . . . . c19602_2mgt 1 . 20 . 10247 . 1 1 1 ACE O O -11.379 -7.582 -0.543 . . . 1.0 . . . . . . . . . . . . A . 0 ACE O . . . . . . . . . c19602_2mgt 1 . 20 . 10248 . 1 1 2 ASP C C -14.409 -4.520 -1.191 . . . 1.0 . . . . . . . . . . . . A . 1 ASP C . . . . . . . . . c19602_2mgt 1 . 20 . 10249 . 1 1 2 ASP CA C -13.623 -5.819 -0.962 . . . 1.0 . . . . . . . . . . . . A . 1 ASP CA . . . . . . . . . c19602_2mgt 1 . 20 . 10250 . 1 1 2 ASP CB C -14.325 -6.725 0.062 . . . 1.0 . . . . . . . . . . . . A . 1 ASP CB . . . . . . . . . c19602_2mgt 1 . 20 . 10251 . 1 1 2 ASP CG C -15.624 -7.269 -0.506 . . . 1.0 . . . . . . . . . . . . A . 1 ASP CG . . . . . . . . . c19602_2mgt 1 . 20 . 10252 . 1 1 2 ASP H H -12.081 -4.529 -0.330 . . . 1.0 . . . . . . . . . . . . A . 1 ASP H . . . . . . . . . c19602_2mgt 1 . 20 . 10253 . 1 1 2 ASP HA H -13.567 -6.363 -1.900 . . . 1.0 . . . . . . . . . . . . A . 1 ASP HA . . . . . . . . . c19602_2mgt 1 . 20 . 10254 . 1 1 2 ASP HB2 H -13.705 -7.576 0.334 . . . 1.0 . . . . . . . . . . . . A . 1 ASP HB2 . . . . . . . . . c19602_2mgt 1 . 20 . 10255 . 1 1 2 ASP HB3 H -14.532 -6.152 0.965 . . . 1.0 . . . . . . . . . . . . A . 1 ASP HB3 . . . . . . . . . c19602_2mgt 1 . 20 . 10256 . 1 1 2 ASP N N -12.261 -5.502 -0.532 . . . 1.0 . . . . . . . . . . . . A . 1 ASP N . . . . . . . . . c19602_2mgt 1 . 20 . 10257 . 1 1 2 ASP O O -13.940 -3.454 -0.805 . . . 1.0 . . . . . . . . . . . . A . 1 ASP O . . . . . . . . . c19602_2mgt 1 . 20 . 10258 . 1 1 2 ASP OD1 O -15.602 -7.957 -1.536 . . . 1.0 . . . . . . . . . . . . A . 1 ASP OD1 . . . . . . . . . c19602_2mgt 1 . 20 . 10259 . 1 1 2 ASP OD2 O -16.665 -6.941 0.100 . . . 1.0 . . . . . . . . . . . . A . 1 ASP OD2 . . . . . . . . . c19602_2mgt 1 . 20 . 10260 . 1 1 3 ALA C C -16.749 -2.574 -0.921 . . . 1.0 . . . . . . . . . . . . A . 2 ALA C . . . . . . . . . c19602_2mgt 1 . 20 . 10261 . 1 1 3 ALA CA C -16.507 -3.507 -2.108 . . . 1.0 . . . . . . . . . . . . A . 2 ALA CA . . . . . . . . . c19602_2mgt 1 . 20 . 10262 . 1 1 3 ALA CB C -17.838 -4.088 -2.589 . . . 1.0 . . . . . . . . . . . . A . 2 ALA CB . . . . . . . . . c19602_2mgt 1 . 20 . 10263 . 1 1 3 ALA H H -15.911 -5.530 -2.094 . . . 1.0 . . . . . . . . . . . . A . 2 ALA H . . . . . . . . . c19602_2mgt 1 . 20 . 10264 . 1 1 3 ALA HA H -16.076 -2.921 -2.918 . . . 1.0 . . . . . . . . . . . . A . 2 ALA HA . . . . . . . . . c19602_2mgt 1 . 20 . 10265 . 1 1 3 ALA HB1 H -18.566 -3.290 -2.720 . . . 1.0 . . . . . . . . . . . . A . 2 ALA HB1 . . . . . . . . . c19602_2mgt 1 . 20 . 10266 . 1 1 3 ALA HB2 H -17.694 -4.596 -3.542 . . . 1.0 . . . . . . . . . . . . A . 2 ALA HB2 . . . . . . . . . c19602_2mgt 1 . 20 . 10267 . 1 1 3 ALA HB3 H -18.228 -4.792 -1.854 . . . 1.0 . . . . . . . . . . . . A . 2 ALA HB3 . . . . . . . . . c19602_2mgt 1 . 20 . 10268 . 1 1 3 ALA N N -15.605 -4.614 -1.796 . . . 1.0 . . . . . . . . . . . . A . 2 ALA N . . . . . . . . . c19602_2mgt 1 . 20 . 10269 . 1 1 3 ALA O O -16.617 -1.367 -1.075 . . . 1.0 . . . . . . . . . . . . A . 2 ALA O . . . . . . . . . c19602_2mgt 1 . 20 . 10270 . 1 1 4 GLU C C -16.006 -1.660 2.030 . . . 1.0 . . . . . . . . . . . . A . 3 GLU C . . . . . . . . . c19602_2mgt 1 . 20 . 10271 . 1 1 4 GLU CA C -17.262 -2.348 1.487 . . . 1.0 . . . . . . . . . . . . A . 3 GLU CA . . . . . . . . . c19602_2mgt 1 . 20 . 10272 . 1 1 4 GLU CB C -17.888 -3.254 2.547 . . . 1.0 . . . . . . . . . . . . A . 3 GLU CB . . . . . . . . . c19602_2mgt 1 . 20 . 10273 . 1 1 4 GLU CD C -17.603 -5.394 3.836 . . . 1.0 . . . . . . . . . . . . A . 3 GLU CD . . . . . . . . . c19602_2mgt 1 . 20 . 10274 . 1 1 4 GLU CG C -16.937 -4.397 2.915 . . . 1.0 . . . . . . . . . . . . A . 3 GLU CG . . . . . . . . . c19602_2mgt 1 . 20 . 10275 . 1 1 4 GLU H H -17.122 -4.123 0.326 . . . 1.0 . . . . . . . . . . . . A . 3 GLU H . . . . . . . . . c19602_2mgt 1 . 20 . 10276 . 1 1 4 GLU HA H -17.968 -1.554 1.271 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HA . . . . . . . . . c19602_2mgt 1 . 20 . 10277 . 1 1 4 GLU HB2 H -18.109 -2.668 3.438 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HB2 . . . . . . . . . c19602_2mgt 1 . 20 . 10278 . 1 1 4 GLU HB3 H -18.824 -3.652 2.157 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HB3 . . . . . . . . . c19602_2mgt 1 . 20 . 10279 . 1 1 4 GLU HG2 H -16.604 -4.922 2.022 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HG2 . . . . . . . . . c19602_2mgt 1 . 20 . 10280 . 1 1 4 GLU HG3 H -16.067 -3.980 3.417 . . . 1.0 . . . . . . . . . . . . A . 3 GLU HG3 . . . . . . . . . c19602_2mgt 1 . 20 . 10281 . 1 1 4 GLU N N -17.048 -3.118 0.261 . . . 1.0 . . . . . . . . . . . . A . 3 GLU N . . . . . . . . . c19602_2mgt 1 . 20 . 10282 . 1 1 4 GLU O O -16.103 -0.915 2.996 . . . 1.0 . . . . . . . . . . . . A . 3 GLU O . . . . . . . . . c19602_2mgt 1 . 20 . 10283 . 1 1 4 GLU OE1 O -18.551 -6.066 3.375 . . . 1.0 . . . . . . . . . . . . A . 3 GLU OE1 . . . . . . . . . c19602_2mgt 1 . 20 . 10284 . 1 1 4 GLU OE2 O -17.169 -5.488 4.990 . . . 1.0 . . . . . . . . . . . . A . 3 GLU OE2 . . . . . . . . . c19602_2mgt 1 . 20 . 10285 . 1 1 5 PHE C C -13.181 -0.293 0.523 . . . 1.0 . . . . . . . . . . . . A . 4 PHE C . . . . . . . . . c19602_2mgt 1 . 20 . 10286 . 1 1 5 PHE CA C -13.607 -1.170 1.692 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CA . . . . . . . . . c19602_2mgt 1 . 20 . 10287 . 1 1 5 PHE CB C -12.508 -2.160 2.070 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CB . . . . . . . . . c19602_2mgt 1 . 20 . 10288 . 1 1 5 PHE CD1 C -13.440 -2.643 4.367 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CD1 . . . . . . . . . c19602_2mgt 1 . 20 . 10289 . 1 1 5 PHE CD2 C -13.027 -4.501 2.855 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CD2 . . . . . . . . . c19602_2mgt 1 . 20 . 10290 . 1 1 5 PHE CE1 C -13.977 -3.535 5.305 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CE1 . . . . . . . . . c19602_2mgt 1 . 20 . 10291 . 1 1 5 PHE CE2 C -13.555 -5.395 3.797 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CE2 . . . . . . . . . c19602_2mgt 1 . 20 . 10292 . 1 1 5 PHE CG C -12.962 -3.128 3.138 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CG . . . . . . . . . c19602_2mgt 1 . 20 . 10293 . 1 1 5 PHE CZ C -14.024 -4.911 5.029 . . . 1.0 . . . . . . . . . . . . A . 4 PHE CZ . . . . . . . . . c19602_2mgt 1 . 20 . 10294 . 1 1 5 PHE H H -14.822 -2.592 0.697 . . . 1.0 . . . . . . . . . . . . A . 4 PHE H . . . . . . . . . c19602_2mgt 1 . 20 . 10295 . 1 1 5 PHE HA H -13.760 -0.506 2.532 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HA . . . . . . . . . c19602_2mgt 1 . 20 . 10296 . 1 1 5 PHE HB2 H -12.207 -2.711 1.179 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HB2 . . . . . . . . . c19602_2mgt 1 . 20 . 10297 . 1 1 5 PHE HB3 H -11.647 -1.603 2.439 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HB3 . . . . . . . . . c19602_2mgt 1 . 20 . 10298 . 1 1 5 PHE HD1 H -13.431 -1.584 4.575 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HD1 . . . . . . . . . c19602_2mgt 1 . 20 . 10299 . 1 1 5 PHE HD2 H -12.700 -4.863 1.899 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HD2 . . . . . . . . . c19602_2mgt 1 . 20 . 10300 . 1 1 5 PHE HE1 H -14.361 -3.155 6.234 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HE1 . . . . . . . . . c19602_2mgt 1 . 20 . 10301 . 1 1 5 PHE HE2 H -13.625 -6.445 3.559 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HE2 . . . . . . . . . c19602_2mgt 1 . 20 . 10302 . 1 1 5 PHE HZ H -14.441 -5.591 5.753 . . . 1.0 . . . . . . . . . . . . A . 4 PHE HZ . . . . . . . . . c19602_2mgt 1 . 20 . 10303 . 1 1 5 PHE N N -14.843 -1.892 1.421 . . . 1.0 . . . . . . . . . . . . A . 4 PHE N . . . . . . . . . c19602_2mgt 1 . 20 . 10304 . 1 1 5 PHE O O -12.398 0.621 0.742 . . . 1.0 . . . . . . . . . . . . A . 4 PHE O . . . . . . . . . c19602_2mgt 1 . 20 . 10305 . 1 1 6 ARG C C -14.282 1.708 -1.685 . . . 1.0 . . . . . . . . . . . . A . 5 ARG C . . . . . . . . . c19602_2mgt 1 . 20 . 10306 . 1 1 6 ARG CA C -13.511 0.380 -1.834 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CA . . . . . . . . . c19602_2mgt 1 . 20 . 10307 . 1 1 6 ARG CB C -13.894 -0.366 -3.123 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CB . . . . . . . . . c19602_2mgt 1 . 20 . 10308 . 1 1 6 ARG CD C -11.715 -1.812 -2.949 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CD . . . . . . . . . c19602_2mgt 1 . 20 . 10309 . 1 1 6 ARG CG C -13.160 -1.681 -3.443 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CG . . . . . . . . . c19602_2mgt 1 . 20 . 10310 . 1 1 6 ARG CZ C -9.515 -0.983 -3.826 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CZ . . . . . . . . . c19602_2mgt 1 . 20 . 10311 . 1 1 6 ARG H H -14.376 -1.255 -0.804 . . . 1.0 . . . . . . . . . . . . A . 5 ARG H . . . . . . . . . c19602_2mgt 1 . 20 . 10312 . 1 1 6 ARG HA H -12.450 0.627 -1.884 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HA . . . . . . . . . c19602_2mgt 1 . 20 . 10313 . 1 1 6 ARG HB2 H -14.960 -0.584 -3.067 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HB2 . . . . . . . . . c19602_2mgt 1 . 20 . 10314 . 1 1 6 ARG HB3 H -13.737 0.305 -3.964 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HB3 . . . . . . . . . c19602_2mgt 1 . 20 . 10315 . 1 1 6 ARG HD2 H -11.687 -1.671 -1.872 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HD2 . . . . . . . . . c19602_2mgt 1 . 20 . 10316 . 1 1 6 ARG HD3 H -11.369 -2.820 -3.161 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HD3 . . . . . . . . . c19602_2mgt 1 . 20 . 10317 . 1 1 6 ARG HE H -11.245 0.047 -3.842 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HE . . . . . . . . . c19602_2mgt 1 . 20 . 10318 . 1 1 6 ARG HG2 H -13.732 -2.502 -3.027 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HG2 . . . . . . . . . c19602_2mgt 1 . 20 . 10319 . 1 1 6 ARG HG3 H -13.171 -1.822 -4.521 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HG3 . . . . . . . . . c19602_2mgt 1 . 20 . 10320 . 1 1 6 ARG HH11 H -9.365 -2.909 -3.176 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH11 . . . . . . . . . c19602_2mgt 1 . 20 . 10321 . 1 1 6 ARG HH12 H -7.874 -2.178 -3.725 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH12 . . . . . . . . . c19602_2mgt 1 . 20 . 10322 . 1 1 6 ARG HH21 H -9.292 0.926 -4.504 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH21 . . . . . . . . . c19602_2mgt 1 . 20 . 10323 . 1 1 6 ARG HH22 H -7.838 -0.049 -4.496 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH22 . . . . . . . . . c19602_2mgt 1 . 20 . 10324 . 1 1 6 ARG N N -13.729 -0.489 -0.682 . . . 1.0 . . . . . . . . . . . . A . 5 ARG N . . . . . . . . . c19602_2mgt 1 . 20 . 10325 . 1 1 6 ARG NE N -10.826 -0.836 -3.588 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NE . . . . . . . . . c19602_2mgt 1 . 20 . 10326 . 1 1 6 ARG NH1 N -8.867 -2.117 -3.554 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NH1 . . . . . . . . . c19602_2mgt 1 . 20 . 10327 . 1 1 6 ARG NH2 N -8.833 0.040 -4.344 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NH2 . . . . . . . . . c19602_2mgt 1 . 20 . 10328 . 1 1 6 ARG O O -14.810 2.234 -2.657 . . . 1.0 . . . . . . . . . . . . A . 5 ARG O . . . . . . . . . c19602_2mgt 1 . 20 . 10329 . 1 1 7 ARG C C -14.219 4.691 -0.352 . . . 1.0 . . . . . . . . . . . . A . 6 ARG C . . . . . . . . . c19602_2mgt 1 . 20 . 10330 . 1 1 7 ARG CA C -15.076 3.452 -0.093 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CA . . . . . . . . . c19602_2mgt 1 . 20 . 10331 . 1 1 7 ARG CB C -15.476 3.380 1.384 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CB . . . . . . . . . c19602_2mgt 1 . 20 . 10332 . 1 1 7 ARG CD C -17.693 2.114 1.027 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CD . . . . . . . . . c19602_2mgt 1 . 20 . 10333 . 1 1 7 ARG CG C -16.346 2.175 1.756 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CG . . . . . . . . . c19602_2mgt 1 . 20 . 10334 . 1 1 7 ARG CZ C -17.882 1.710 -1.451 . . . 1.0 . . . . . . . . . . . . A . 6 ARG CZ . . . . . . . . . c19602_2mgt 1 . 20 . 10335 . 1 1 7 ARG H H -13.960 1.730 0.306 . . . 1.0 . . . . . . . . . . . . A . 6 ARG H . . . . . . . . . c19602_2mgt 1 . 20 . 10336 . 1 1 7 ARG HA H -15.974 3.525 -0.691 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HA . . . . . . . . . c19602_2mgt 1 . 20 . 10337 . 1 1 7 ARG HB2 H -14.571 3.348 1.990 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HB2 . . . . . . . . . c19602_2mgt 1 . 20 . 10338 . 1 1 7 ARG HB3 H -16.023 4.283 1.643 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HB3 . . . . . . . . . c19602_2mgt 1 . 20 . 10339 . 1 1 7 ARG HD2 H -18.412 1.636 1.687 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HD2 . . . . . . . . . c19602_2mgt 1 . 20 . 10340 . 1 1 7 ARG HD3 H -18.052 3.119 0.824 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HD3 . . . . . . . . . c19602_2mgt 1 . 20 . 10341 . 1 1 7 ARG HE H -17.339 0.346 -0.073 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HE . . . . . . . . . c19602_2mgt 1 . 20 . 10342 . 1 1 7 ARG HG2 H -15.790 1.258 1.572 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HG2 . . . . . . . . . c19602_2mgt 1 . 20 . 10343 . 1 1 7 ARG HG3 H -16.543 2.239 2.825 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HG3 . . . . . . . . . c19602_2mgt 1 . 20 . 10344 . 1 1 7 ARG HH11 H -18.341 3.651 -1.031 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH11 . . . . . . . . . c19602_2mgt 1 . 20 . 10345 . 1 1 7 ARG HH12 H -18.415 3.209 -2.721 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH12 . . . . . . . . . c19602_2mgt 1 . 20 . 10346 . 1 1 7 ARG HH21 H -17.460 -0.115 -2.241 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH21 . . . . . . . . . c19602_2mgt 1 . 20 . 10347 . 1 1 7 ARG HH22 H -17.946 1.107 -3.387 . . . 1.0 . . . . . . . . . . . . A . 6 ARG HH22 . . . . . . . . . c19602_2mgt 1 . 20 . 10348 . 1 1 7 ARG N N -14.384 2.232 -0.458 . . . 1.0 . . . . . . . . . . . . A . 6 ARG N . . . . . . . . . c19602_2mgt 1 . 20 . 10349 . 1 1 7 ARG NE N -17.618 1.309 -0.198 . . . 1.0 . . . . . . . . . . . . A . 6 ARG NE . . . . . . . . . c19602_2mgt 1 . 20 . 10350 . 1 1 7 ARG NH1 N -18.257 2.954 -1.757 . . . 1.0 . . . . . . . . . . . . A . 6 ARG NH1 . . . . . . . . . c19602_2mgt 1 . 20 . 10351 . 1 1 7 ARG NH2 N -17.753 0.830 -2.438 . . . 1.0 . . . . . . . . . . . . A . 6 ARG NH2 . . . . . . . . . c19602_2mgt 1 . 20 . 10352 . 1 1 7 ARG O O -13.006 4.605 -0.539 . . . 1.0 . . . . . . . . . . . . A . 6 ARG O . . . . . . . . . c19602_2mgt 1 . 20 . 10353 . 1 1 8 ASP C C -13.367 7.667 0.484 . . . 1.0 . . . . . . . . . . . . A . 7 ASP C . . . . . . . . . c19602_2mgt 1 . 20 . 10354 . 1 1 8 ASP CA C -14.238 7.127 -0.658 . . . 1.0 . . . . . . . . . . . . A . 7 ASP CA . . . . . . . . . c19602_2mgt 1 . 20 . 10355 . 1 1 8 ASP CB C -15.322 8.128 -1.063 . . . 1.0 . . . . . . . . . . . . A . 7 ASP CB . . . . . . . . . c19602_2mgt 1 . 20 . 10356 . 1 1 8 ASP CG C -16.188 8.611 0.088 . . . 1.0 . . . . . . . . . . . . A . 7 ASP CG . . . . . . . . . c19602_2mgt 1 . 20 . 10357 . 1 1 8 ASP H H -15.855 5.865 -0.135 . . . 1.0 . . . . . . . . . . . . A . 7 ASP H . . . . . . . . . c19602_2mgt 1 . 20 . 10358 . 1 1 8 ASP HA H -13.599 6.969 -1.525 . . . 1.0 . . . . . . . . . . . . A . 7 ASP HA . . . . . . . . . c19602_2mgt 1 . 20 . 10359 . 1 1 8 ASP HB2 H -14.838 8.983 -1.521 . . . 1.0 . . . . . . . . . . . . A . 7 ASP HB2 . . . . . . . . . c19602_2mgt 1 . 20 . 10360 . 1 1 8 ASP HB3 H -15.979 7.673 -1.798 . . . 1.0 . . . . . . . . . . . . A . 7 ASP HB3 . . . . . . . . . c19602_2mgt 1 . 20 . 10361 . 1 1 8 ASP N N -14.866 5.858 -0.333 . . . 1.0 . . . . . . . . . . . . A . 7 ASP N . . . . . . . . . c19602_2mgt 1 . 20 . 10362 . 1 1 8 ASP O O -12.408 8.381 0.226 . . . 1.0 . . . . . . . . . . . . A . 7 ASP O . . . . . . . . . c19602_2mgt 1 . 20 . 10363 . 1 1 8 ASP OD1 O -15.698 9.472 0.853 . . . 1.0 . . . . . . . . . . . . A . 7 ASP OD1 . . . . . . . . . c19602_2mgt 1 . 20 . 10364 . 1 1 8 ASP OD2 O -17.335 8.157 0.186 . . . 1.0 . . . . . . . . . . . . A . 7 ASP OD2 . . . . . . . . . c19602_2mgt 1 . 20 . 10365 . 1 1 9 SER C C -11.757 7.146 3.280 . . . 1.0 . . . . . . . . . . . . A . 8 SER C . . . . . . . . . c19602_2mgt 1 . 20 . 10366 . 1 1 9 SER CA C -13.017 7.932 2.900 . . . 1.0 . . . . . . . . . . . . A . 8 SER CA . . . . . . . . . c19602_2mgt 1 . 20 . 10367 . 1 1 9 SER CB C -13.984 8.060 4.081 . . . 1.0 . . . . . . . . . . . . A . 8 SER CB . . . . . . . . . c19602_2mgt 1 . 20 . 10368 . 1 1 9 SER H H -14.541 6.846 1.901 . . . 1.0 . . . . . . . . . . . . A . 8 SER H . . . . . . . . . c19602_2mgt 1 . 20 . 10369 . 1 1 9 SER HA H -12.714 8.942 2.632 . . . 1.0 . . . . . . . . . . . . A . 8 SER HA . . . . . . . . . c19602_2mgt 1 . 20 . 10370 . 1 1 9 SER HB2 H -14.294 7.072 4.420 . . . 1.0 . . . . . . . . . . . . A . 8 SER HB2 . . . . . . . . . c19602_2mgt 1 . 20 . 10371 . 1 1 9 SER HB3 H -13.465 8.573 4.887 . . . 1.0 . . . . . . . . . . . . A . 8 SER HB3 . . . . . . . . . c19602_2mgt 1 . 20 . 10372 . 1 1 9 SER HG H -15.725 8.233 3.253 . . . 1.0 . . . . . . . . . . . . A . 8 SER HG . . . . . . . . . c19602_2mgt 1 . 20 . 10373 . 1 1 9 SER N N -13.688 7.355 1.742 . . . 1.0 . . . . . . . . . . . . A . 8 SER N . . . . . . . . . c19602_2mgt 1 . 20 . 10374 . 1 1 9 SER O O -11.681 6.582 4.368 . . . 1.0 . . . . . . . . . . . . A . 8 SER O . . . . . . . . . c19602_2mgt 1 . 20 . 10375 . 1 1 9 SER OG O -15.124 8.811 3.736 . . . 1.0 . . . . . . . . . . . . A . 8 SER OG . . . . . . . . . c19602_2mgt 1 . 20 . 10376 . 1 1 10 GLY C C -8.495 6.948 1.596 . . . 1.0 . . . . . . . . . . . . A . 9 GLY C . . . . . . . . . c19602_2mgt 1 . 20 . 10377 . 1 1 10 GLY CA C -9.451 6.542 2.712 . . . 1.0 . . . . . . . . . . . . A . 9 GLY CA . . . . . . . . . c19602_2mgt 1 . 20 . 10378 . 1 1 10 GLY H H -10.827 7.542 1.497 . . . 1.0 . . . . . . . . . . . . A . 9 GLY H . . . . . . . . . c19602_2mgt 1 . 20 . 10379 . 1 1 10 GLY HA2 H -9.086 6.913 3.666 . . . 1.0 . . . . . . . . . . . . A . 9 GLY HA2 . . . . . . . . . c19602_2mgt 1 . 20 . 10380 . 1 1 10 GLY HA3 H -9.558 5.465 2.812 . . . 1.0 . . . . . . . . . . . . A . 9 GLY HA3 . . . . . . . . . c19602_2mgt 1 . 20 . 10381 . 1 1 10 GLY N N -10.747 7.110 2.407 . . . 1.0 . . . . . . . . . . . . A . 9 GLY N . . . . . . . . . c19602_2mgt 1 . 20 . 10382 . 1 1 10 GLY O O -8.446 8.123 1.247 . . . 1.0 . . . . . . . . . . . . A . 9 GLY O . . . . . . . . . c19602_2mgt 1 . 20 . 10383 . 1 1 11 TYR C C -6.424 4.004 0.655 . . . 1.0 . . . . . . . . . . . . A . 10 TYR C . . . . . . . . . c19602_2mgt 1 . 20 . 10384 . 1 1 11 TYR CA C -7.658 4.616 1.308 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CA . . . . . . . . . c19602_2mgt 1 . 20 . 10385 . 1 1 11 TYR CB C -8.915 3.912 0.779 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CB . . . . . . . . . c19602_2mgt 1 . 20 . 10386 . 1 1 11 TYR CD1 C -8.869 2.161 2.611 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CD1 . . . . . . . . . c19602_2mgt 1 . 20 . 10387 . 1 1 11 TYR CD2 C -10.990 3.168 1.990 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CD2 . . . . . . . . . c19602_2mgt 1 . 20 . 10388 . 1 1 11 TYR CE1 C -9.514 1.334 3.537 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CE1 . . . . . . . . . c19602_2mgt 1 . 20 . 10389 . 1 1 11 TYR CE2 C -11.645 2.346 2.915 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CE2 . . . . . . . . . c19602_2mgt 1 . 20 . 10390 . 1 1 11 TYR CG C -9.604 3.056 1.815 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CG . . . . . . . . . c19602_2mgt 1 . 20 . 10391 . 1 1 11 TYR CZ C -10.916 1.392 3.661 . . . 1.0 . . . . . . . . . . . . A . 10 TYR CZ . . . . . . . . . c19602_2mgt 1 . 20 . 10392 . 1 1 11 TYR H H -7.253 6.302 0.169 . . . 1.0 . . . . . . . . . . . . A . 10 TYR H . . . . . . . . . c19602_2mgt 1 . 20 . 10393 . 1 1 11 TYR HA H -7.592 4.494 2.388 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HA . . . . . . . . . c19602_2mgt 1 . 20 . 10394 . 1 1 11 TYR HB2 H -9.629 4.648 0.404 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HB2 . . . . . . . . . c19602_2mgt 1 . 20 . 10395 . 1 1 11 TYR HB3 H -8.650 3.293 -0.075 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HB3 . . . . . . . . . c19602_2mgt 1 . 20 . 10396 . 1 1 11 TYR HD1 H -7.807 2.074 2.493 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HD1 . . . . . . . . . c19602_2mgt 1 . 20 . 10397 . 1 1 11 TYR HD2 H -11.551 3.883 1.410 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HD2 . . . . . . . . . c19602_2mgt 1 . 20 . 10398 . 1 1 11 TYR HE1 H -8.934 0.656 4.141 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HE1 . . . . . . . . . c19602_2mgt 1 . 20 . 10399 . 1 1 11 TYR HE2 H -12.709 2.440 3.040 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HE2 . . . . . . . . . c19602_2mgt 1 . 20 . 10400 . 1 1 11 TYR HH H -12.508 0.700 4.533 . . . 1.0 . . . . . . . . . . . . A . 10 TYR HH . . . . . . . . . c19602_2mgt 1 . 20 . 10401 . 1 1 11 TYR N N -7.733 6.028 1.005 . . . 1.0 . . . . . . . . . . . . A . 10 TYR N . . . . . . . . . c19602_2mgt 1 . 20 . 10402 . 1 1 11 TYR O O -6.109 4.332 -0.481 . . . 1.0 . . . . . . . . . . . . A . 10 TYR O . . . . . . . . . c19602_2mgt 1 . 20 . 10403 . 1 1 11 TYR OH O -11.557 0.565 4.530 . . . 1.0 . . . . . . . . . . . . A . 10 TYR OH . . . . . . . . . c19602_2mgt 1 . 20 . 10404 . 1 1 12 GLU C C -5.490 0.678 1.255 . . . 1.0 . . . . . . . . . . . . A . 11 GLU C . . . . . . . . . c19602_2mgt 1 . 20 . 10405 . 1 1 12 GLU CA C -4.956 2.025 0.739 . . . 1.0 . . . . . . . . . . . . A . 11 GLU CA . . . . . . . . . c19602_2mgt 1 . 20 . 10406 . 1 1 12 GLU CB C -3.489 2.301 1.081 . . . 1.0 . . . . . . . . . . . . A . 11 GLU CB . . . . . . . . . c19602_2mgt 1 . 20 . 10407 . 1 1 12 GLU CD C -1.254 1.191 0.661 . . . 1.0 . . . . . . . . . . . . A . 11 GLU CD . . . . . . . . . c19602_2mgt 1 . 20 . 10408 . 1 1 12 GLU CG C -2.574 1.626 0.056 . . . 1.0 . . . . . . . . . . . . A . 11 GLU CG . . . . . . . . . c19602_2mgt 1 . 20 . 10409 . 1 1 12 GLU H H -6.082 2.869 2.283 . . . 1.0 . . . . . . . . . . . . A . 11 GLU H . . . . . . . . . c19602_2mgt 1 . 20 . 10410 . 1 1 12 GLU HA H -5.068 2.064 -0.343 . . . 1.0 . . . . . . . . . . . . A . 11 GLU HA . . . . . . . . . c19602_2mgt 1 . 20 . 10411 . 1 1 12 GLU HB2 H -3.294 3.374 1.069 . . . 1.0 . . . . . . . . . . . . A . 11 GLU HB2 . . . . . . . . . c19602_2mgt 1 . 20 . 10412 . 1 1 12 GLU HB3 H -3.279 1.941 2.083 . . . 1.0 . . . . . . . . . . . . A . 11 GLU HB3 . . . . . . . . . c19602_2mgt 1 . 20 . 10413 . 1 1 12 GLU HG2 H -3.068 0.742 -0.347 . . . 1.0 . . . . . . . . . . . . A . 11 GLU HG2 . . . . . . . . . c19602_2mgt 1 . 20 . 10414 . 1 1 12 GLU HG3 H -2.383 2.314 -0.764 . . . 1.0 . . . . . . . . . . . . A . 11 GLU HG3 . . . . . . . . . c19602_2mgt 1 . 20 . 10415 . 1 1 12 GLU N N -5.797 3.044 1.332 . . . 1.0 . . . . . . . . . . . . A . 11 GLU N . . . . . . . . . c19602_2mgt 1 . 20 . 10416 . 1 1 12 GLU O O -4.984 0.110 2.224 . . . 1.0 . . . . . . . . . . . . A . 11 GLU O . . . . . . . . . c19602_2mgt 1 . 20 . 10417 . 1 1 12 GLU OE1 O -0.602 2.013 1.339 . . . 1.0 . . . . . . . . . . . . A . 11 GLU OE1 . . . . . . . . . c19602_2mgt 1 . 20 . 10418 . 1 1 12 GLU OE2 O -0.904 0.017 0.500 . . . 1.0 . . . . . . . . . . . . A . 11 GLU OE2 . . . . . . . . . c19602_2mgt 1 . 20 . 10419 . 1 1 13 VAL C C -6.978 -2.032 1.614 . . . 1.0 . . . . . . . . . . . . A . 12 VAL C . . . . . . . . . c19602_2mgt 1 . 20 . 10420 . 1 1 13 VAL CA C -7.568 -0.742 1.090 . . . 1.0 . . . . . . . . . . . . A . 12 VAL CA . . . . . . . . . c19602_2mgt 1 . 20 . 10421 . 1 1 13 VAL CB C -8.583 -1.027 -0.040 . . . 1.0 . . . . . . . . . . . . A . 12 VAL CB . . . . . . . . . c19602_2mgt 1 . 20 . 10422 . 1 1 13 VAL CG1 C -9.337 -2.357 0.129 . . . 1.0 . . . . . . . . . . . . A . 12 VAL CG1 . . . . . . . . . c19602_2mgt 1 . 20 . 10423 . 1 1 13 VAL CG2 C -9.610 0.103 -0.046 . . . 1.0 . . . . . . . . . . . . A . 12 VAL CG2 . . . . . . . . . c19602_2mgt 1 . 20 . 10424 . 1 1 13 VAL H H -6.882 0.768 -0.179 . . . 1.0 . . . . . . . . . . . . A . 12 VAL H . . . . . . . . . c19602_2mgt 1 . 20 . 10425 . 1 1 13 VAL HA H -8.115 -0.312 1.922 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HA . . . . . . . . . c19602_2mgt 1 . 20 . 10426 . 1 1 13 VAL HB H -8.067 -1.051 -1.001 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HB . . . . . . . . . c19602_2mgt 1 . 20 . 10427 . 1 1 13 VAL HG11 H -10.117 -2.454 -0.620 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HG11 . . . . . . . . . c19602_2mgt 1 . 20 . 10428 . 1 1 13 VAL HG12 H -8.644 -3.186 -0.002 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HG12 . . . . . . . . . c19602_2mgt 1 . 20 . 10429 . 1 1 13 VAL HG13 H -9.782 -2.410 1.122 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HG13 . . . . . . . . . c19602_2mgt 1 . 20 . 10430 . 1 1 13 VAL HG21 H -10.065 0.150 0.940 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HG21 . . . . . . . . . c19602_2mgt 1 . 20 . 10431 . 1 1 13 VAL HG22 H -9.125 1.049 -0.264 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HG22 . . . . . . . . . c19602_2mgt 1 . 20 . 10432 . 1 1 13 VAL HG23 H -10.368 -0.085 -0.803 . . . 1.0 . . . . . . . . . . . . A . 12 VAL HG23 . . . . . . . . . c19602_2mgt 1 . 20 . 10433 . 1 1 13 VAL N N -6.590 0.240 0.627 . . . 1.0 . . . . . . . . . . . . A . 12 VAL N . . . . . . . . . c19602_2mgt 1 . 20 . 10434 . 1 1 13 VAL O O -7.518 -2.572 2.572 . . . 1.0 . . . . . . . . . . . . A . 12 VAL O . . . . . . . . . c19602_2mgt 1 . 20 . 10435 . 1 1 14 HIS C C -4.907 -3.960 2.747 . . . 1.0 . . . . . . . . . . . . A . 13 HIS C . . . . . . . . . c19602_2mgt 1 . 20 . 10436 . 1 1 14 HIS CA C -5.457 -3.883 1.315 . . . 1.0 . . . . . . . . . . . . A . 13 HIS CA . . . . . . . . . c19602_2mgt 1 . 20 . 10437 . 1 1 14 HIS CB C -4.436 -4.308 0.269 . . . 1.0 . . . . . . . . . . . . A . 13 HIS CB . . . . . . . . . c19602_2mgt 1 . 20 . 10438 . 1 1 14 HIS CD2 C -4.652 -6.853 0.194 . . . 1.0 . . . . . . . . . . . . A . 13 HIS CD2 . . . . . . . . . c19602_2mgt 1 . 20 . 10439 . 1 1 14 HIS CE1 C -2.692 -7.441 0.972 . . . 1.0 . . . . . . . . . . . . A . 13 HIS CE1 . . . . . . . . . c19602_2mgt 1 . 20 . 10440 . 1 1 14 HIS CG C -3.947 -5.715 0.460 . . . 1.0 . . . . . . . . . . . . A . 13 HIS CG . . . . . . . . . c19602_2mgt 1 . 20 . 10441 . 1 1 14 HIS H H -5.501 -2.053 0.218 . . . 1.0 . . . . . . . . . . . . A . 13 HIS H . . . . . . . . . c19602_2mgt 1 . 20 . 10442 . 1 1 14 HIS HA H -6.316 -4.550 1.247 . . . 1.0 . . . . . . . . . . . . A . 13 HIS HA . . . . . . . . . c19602_2mgt 1 . 20 . 10443 . 1 1 14 HIS HB2 H -4.887 -4.235 -0.719 . . . 1.0 . . . . . . . . . . . . A . 13 HIS HB2 . . . . . . . . . c19602_2mgt 1 . 20 . 10444 . 1 1 14 HIS HB3 H -3.598 -3.619 0.301 . . . 1.0 . . . . . . . . . . . . A . 13 HIS HB3 . . . . . . . . . c19602_2mgt 1 . 20 . 10445 . 1 1 14 HIS HD1 H -1.981 -5.484 1.248 . . . 1.0 . . . . . . . . . . . . A . 13 HIS HD1 . . . . . . . . . c19602_2mgt 1 . 20 . 10446 . 1 1 14 HIS HD2 H -5.660 -6.897 -0.189 . . . 1.0 . . . . . . . . . . . . A . 13 HIS HD2 . . . . . . . . . c19602_2mgt 1 . 20 . 10447 . 1 1 14 HIS HE1 H -1.850 -8.032 1.303 . . . 1.0 . . . . . . . . . . . . A . 13 HIS HE1 . . . . . . . . . c19602_2mgt 1 . 20 . 10448 . 1 1 14 HIS N N -5.925 -2.552 0.988 . . . 1.0 . . . . . . . . . . . . A . 13 HIS N . . . . . . . . . c19602_2mgt 1 . 20 . 10449 . 1 1 14 HIS ND1 N -2.727 -6.101 0.960 . . . 1.0 . . . . . . . . . . . . A . 13 HIS ND1 . . . . . . . . . c19602_2mgt 1 . 20 . 10450 . 1 1 14 HIS NE2 N -3.843 -7.946 0.508 . . . 1.0 . . . . . . . . . . . . A . 13 HIS NE2 . . . . . . . . . c19602_2mgt 1 . 20 . 10451 . 1 1 14 HIS O O -4.998 -5.023 3.356 . . . 1.0 . . . . . . . . . . . . A . 13 HIS O . . . . . . . . . c19602_2mgt 1 . 20 . 10452 . 1 1 15 HIS C C -5.132 -2.799 5.720 . . . 1.0 . . . . . . . . . . . . A . 14 HIS C . . . . . . . . . c19602_2mgt 1 . 20 . 10453 . 1 1 15 HIS CA C -3.986 -2.768 4.707 . . . 1.0 . . . . . . . . . . . . A . 14 HIS CA . . . . . . . . . c19602_2mgt 1 . 20 . 10454 . 1 1 15 HIS CB C -3.159 -1.503 4.944 . . . 1.0 . . . . . . . . . . . . A . 14 HIS CB . . . . . . . . . c19602_2mgt 1 . 20 . 10455 . 1 1 15 HIS CD2 C -1.331 -0.479 3.498 . . . 1.0 . . . . . . . . . . . . A . 14 HIS CD2 . . . . . . . . . c19602_2mgt 1 . 20 . 10456 . 1 1 15 HIS CE1 C 0.158 -2.088 3.533 . . . 1.0 . . . . . . . . . . . . A . 14 HIS CE1 . . . . . . . . . c19602_2mgt 1 . 20 . 10457 . 1 1 15 HIS CG C -1.841 -1.505 4.231 . . . 1.0 . . . . . . . . . . . . A . 14 HIS CG . . . . . . . . . c19602_2mgt 1 . 20 . 10458 . 1 1 15 HIS H H -4.449 -1.975 2.787 . . . 1.0 . . . . . . . . . . . . A . 14 HIS H . . . . . . . . . c19602_2mgt 1 . 20 . 10459 . 1 1 15 HIS HA H -3.353 -3.631 4.907 . . . 1.0 . . . . . . . . . . . . A . 14 HIS HA . . . . . . . . . c19602_2mgt 1 . 20 . 10460 . 1 1 15 HIS HB2 H -3.743 -0.635 4.639 . . . 1.0 . . . . . . . . . . . . A . 14 HIS HB2 . . . . . . . . . c19602_2mgt 1 . 20 . 10461 . 1 1 15 HIS HB3 H -2.945 -1.403 6.009 . . . 1.0 . . . . . . . . . . . . A . 14 HIS HB3 . . . . . . . . . c19602_2mgt 1 . 20 . 10462 . 1 1 15 HIS HD1 H -0.963 -3.381 4.743 . . . 1.0 . . . . . . . . . . . . A . 14 HIS HD1 . . . . . . . . . c19602_2mgt 1 . 20 . 10463 . 1 1 15 HIS HD2 H -1.821 0.464 3.309 . . . 1.0 . . . . . . . . . . . . A . 14 HIS HD2 . . . . . . . . . c19602_2mgt 1 . 20 . 10464 . 1 1 15 HIS HE1 H 1.063 -2.653 3.373 . . . 1.0 . . . . . . . . . . . . A . 14 HIS HE1 . . . . . . . . . c19602_2mgt 1 . 20 . 10465 . 1 1 15 HIS N N -4.430 -2.838 3.316 . . . 1.0 . . . . . . . . . . . . A . 14 HIS N . . . . . . . . . c19602_2mgt 1 . 20 . 10466 . 1 1 15 HIS ND1 N -0.895 -2.503 4.250 . . . 1.0 . . . . . . . . . . . . A . 14 HIS ND1 . . . . . . . . . c19602_2mgt 1 . 20 . 10467 . 1 1 15 HIS NE2 N -0.059 -0.857 3.063 . . . 1.0 . . . . . . . . . . . . A . 14 HIS NE2 . . . . . . . . . c19602_2mgt 1 . 20 . 10468 . 1 1 15 HIS O O -4.849 -2.955 6.903 . . . 1.0 . . . . . . . . . . . . A . 14 HIS O . . . . . . . . . c19602_2mgt 1 . 20 . 10469 . 1 1 16 GLN C C -7.635 -4.061 6.927 . . . 1.0 . . . . . . . . . . . . A . 15 GLN C . . . . . . . . . c19602_2mgt 1 . 20 . 10470 . 1 1 16 GLN CA C -7.539 -2.721 6.205 . . . 1.0 . . . . . . . . . . . . A . 15 GLN CA . . . . . . . . . c19602_2mgt 1 . 20 . 10471 . 1 1 16 GLN CB C -8.832 -2.348 5.477 . . . 1.0 . . . . . . . . . . . . A . 15 GLN CB . . . . . . . . . c19602_2mgt 1 . 20 . 10472 . 1 1 16 GLN CD C -10.329 -4.445 5.530 . . . 1.0 . . . . . . . . . . . . A . 15 GLN CD . . . . . . . . . c19602_2mgt 1 . 20 . 10473 . 1 1 16 GLN CG C -9.540 -3.454 4.680 . . . 1.0 . . . . . . . . . . . . A . 15 GLN CG . . . . . . . . . c19602_2mgt 1 . 20 . 10474 . 1 1 16 GLN H H -6.590 -2.514 4.323 . . . 1.0 . . . . . . . . . . . . A . 15 GLN H . . . . . . . . . c19602_2mgt 1 . 20 . 10475 . 1 1 16 GLN HA H -7.381 -1.957 6.955 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HA . . . . . . . . . c19602_2mgt 1 . 20 . 10476 . 1 1 16 GLN HB2 H -9.510 -1.970 6.229 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HB2 . . . . . . . . . c19602_2mgt 1 . 20 . 10477 . 1 1 16 GLN HB3 H -8.607 -1.530 4.800 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HB3 . . . . . . . . . c19602_2mgt 1 . 20 . 10478 . 1 1 16 GLN HE21 H -11.189 -2.994 6.668 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HE21 . . . . . . . . . c19602_2mgt 1 . 20 . 10479 . 1 1 16 GLN HE22 H -11.683 -4.630 7.031 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HE22 . . . . . . . . . c19602_2mgt 1 . 20 . 10480 . 1 1 16 GLN HG2 H -10.235 -2.980 3.989 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HG2 . . . . . . . . . c19602_2mgt 1 . 20 . 10481 . 1 1 16 GLN HG3 H -8.807 -4.015 4.101 . . . 1.0 . . . . . . . . . . . . A . 15 GLN HG3 . . . . . . . . . c19602_2mgt 1 . 20 . 10482 . 1 1 16 GLN N N -6.399 -2.667 5.300 . . . 1.0 . . . . . . . . . . . . A . 15 GLN N . . . . . . . . . c19602_2mgt 1 . 20 . 10483 . 1 1 16 GLN NE2 N -11.117 -3.987 6.499 . . . 1.0 . . . . . . . . . . . . A . 15 GLN NE2 . . . . . . . . . c19602_2mgt 1 . 20 . 10484 . 1 1 16 GLN O O -8.077 -4.099 8.065 . . . 1.0 . . . . . . . . . . . . A . 15 GLN O . . . . . . . . . c19602_2mgt 1 . 20 . 10485 . 1 1 16 GLN OE1 O -10.216 -5.641 5.314 . . . 1.0 . . . . . . . . . . . . A . 15 GLN OE1 . . . . . . . . . c19602_2mgt 1 . 20 . 10486 . 1 1 17 LYS C C -6.040 -6.475 8.059 . . . 1.0 . . . . . . . . . . . . A . 16 LYS C . . . . . . . . . c19602_2mgt 1 . 20 . 10487 . 1 1 17 LYS CA C -7.017 -6.458 6.878 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CA . . . . . . . . . c19602_2mgt 1 . 20 . 10488 . 1 1 17 LYS CB C -6.525 -7.441 5.815 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CB . . . . . . . . . c19602_2mgt 1 . 20 . 10489 . 1 1 17 LYS CD C -7.185 -8.830 3.799 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CD . . . . . . . . . c19602_2mgt 1 . 20 . 10490 . 1 1 17 LYS CE C -5.841 -8.597 3.107 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CE . . . . . . . . . c19602_2mgt 1 . 20 . 10491 . 1 1 17 LYS CG C -7.554 -7.649 4.697 . . . 1.0 . . . . . . . . . . . . A . 16 LYS CG . . . . . . . . . c19602_2mgt 1 . 20 . 10492 . 1 1 17 LYS H H -6.907 -5.005 5.319 . . . 1.0 . . . . . . . . . . . . A . 16 LYS H . . . . . . . . . c19602_2mgt 1 . 20 . 10493 . 1 1 17 LYS HA H -7.986 -6.795 7.242 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HA . . . . . . . . . c19602_2mgt 1 . 20 . 10494 . 1 1 17 LYS HB2 H -5.593 -7.066 5.392 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HB2 . . . . . . . . . c19602_2mgt 1 . 20 . 10495 . 1 1 17 LYS HB3 H -6.332 -8.402 6.294 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HB3 . . . . . . . . . c19602_2mgt 1 . 20 . 10496 . 1 1 17 LYS HD2 H -7.134 -9.742 4.395 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HD2 . . . . . . . . . c19602_2mgt 1 . 20 . 10497 . 1 1 17 LYS HD3 H -7.966 -8.949 3.050 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HD3 . . . . . . . . . c19602_2mgt 1 . 20 . 10498 . 1 1 17 LYS HE2 H -5.863 -7.645 2.577 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HE2 . . . . . . . . . c19602_2mgt 1 . 20 . 10499 . 1 1 17 LYS HE3 H -5.053 -8.564 3.855 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HE3 . . . . . . . . . c19602_2mgt 1 . 20 . 10500 . 1 1 17 LYS HG2 H -8.525 -7.854 5.145 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HG2 . . . . . . . . . c19602_2mgt 1 . 20 . 10501 . 1 1 17 LYS HG3 H -7.629 -6.745 4.091 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HG3 . . . . . . . . . c19602_2mgt 1 . 20 . 10502 . 1 1 17 LYS HZ1 H -4.652 -9.508 1.717 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HZ1 . . . . . . . . . c19602_2mgt 1 . 20 . 10503 . 1 1 17 LYS HZ2 H -5.520 -10.562 2.635 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HZ2 . . . . . . . . . c19602_2mgt 1 . 20 . 10504 . 1 1 17 LYS HZ3 H -6.261 -9.702 1.443 . . . 1.0 . . . . . . . . . . . . A . 16 LYS HZ3 . . . . . . . . . c19602_2mgt 1 . 20 . 10505 . 1 1 17 LYS N N -7.170 -5.134 6.284 . . . 1.0 . . . . . . . . . . . . A . 16 LYS N . . . . . . . . . c19602_2mgt 1 . 20 . 10506 . 1 1 17 LYS NZ N -5.546 -9.674 2.158 . . . 1.0 . . . . . . . . . . . . A . 16 LYS NZ . . . . . . . . . c19602_2mgt 1 . 20 . 10507 . 1 1 17 LYS O O -6.166 -7.325 8.928 . . . 1.0 . . . . . . . . . . . . A . 16 LYS O . . . . . . . . . c19602_2mgt 1 . 20 . 10508 . 1 1 18 NH2 HN1 H -5.004 -4.846 7.423 . . . 1.0 . . . . . . . . . . . . A . 17 NH2 HN1 . . . . . . . . . c19602_2mgt 1 . 20 . 10509 . 1 1 18 NH2 HN2 H -4.447 -5.561 8.921 . . . 1.0 . . . . . . . . . . . . A . 17 NH2 HN2 . . . . . . . . . c19602_2mgt 1 . 20 . 10510 . 1 1 18 NH2 N N -5.077 -5.559 8.132 . . . 1.0 . . . . . . . . . . . . A . 17 NH2 N . . . . . . . . . c19602_2mgt 1 . 20 . 10511 . 2 1 1 ACE C C 12.877 8.314 -2.625 . . . 1.0 . . . . . . . . . . . . B . 0 ACE C . . . . . . . . . c19602_2mgt 1 . 20 . 10512 . 2 1 1 ACE CH3 C 12.303 8.346 -1.221 . . . 1.0 . . . . . . . . . . . . B . 0 ACE CH3 . . . . . . . . . c19602_2mgt 1 . 20 . 10513 . 2 1 1 ACE H1 H 13.085 8.586 -0.502 . . . 1.0 . . . . . . . . . . . . B . 0 ACE H1 . . . . . . . . . c19602_2mgt 1 . 20 . 10514 . 2 1 1 ACE H2 H 11.530 9.111 -1.164 . . . 1.0 . . . . . . . . . . . . B . 0 ACE H2 . . . . . . . . . c19602_2mgt 1 . 20 . 10515 . 2 1 1 ACE H3 H 11.864 7.378 -0.992 . . . 1.0 . . . . . . . . . . . . B . 0 ACE H3 . . . . . . . . . c19602_2mgt 1 . 20 . 10516 . 2 1 1 ACE O O 12.199 8.734 -3.550 . . . 1.0 . . . . . . . . . . . . B . 0 ACE O . . . . . . . . . c19602_2mgt 1 . 20 . 10517 . 2 1 2 ASP C C 14.826 6.559 -4.812 . . . 1.0 . . . . . . . . . . . . B . 1 ASP C . . . . . . . . . c19602_2mgt 1 . 20 . 10518 . 2 1 2 ASP CA C 14.843 7.899 -4.062 . . . 1.0 . . . . . . . . . . . . B . 1 ASP CA . . . . . . . . . c19602_2mgt 1 . 20 . 10519 . 2 1 2 ASP CB C 16.275 8.377 -3.797 . . . 1.0 . . . . . . . . . . . . B . 1 ASP CB . . . . . . . . . c19602_2mgt 1 . 20 . 10520 . 2 1 2 ASP CG C 16.721 9.331 -4.898 . . . 1.0 . . . . . . . . . . . . B . 1 ASP CG . . . . . . . . . c19602_2mgt 1 . 20 . 10521 . 2 1 2 ASP H H 14.613 7.482 -1.992 . . . 1.0 . . . . . . . . . . . . B . 1 ASP H . . . . . . . . . c19602_2mgt 1 . 20 . 10522 . 2 1 2 ASP HA H 14.362 8.641 -4.702 . . . 1.0 . . . . . . . . . . . . B . 1 ASP HA . . . . . . . . . c19602_2mgt 1 . 20 . 10523 . 2 1 2 ASP HB2 H 16.314 8.919 -2.850 . . . 1.0 . . . . . . . . . . . . B . 1 ASP HB2 . . . . . . . . . c19602_2mgt 1 . 20 . 10524 . 2 1 2 ASP HB3 H 16.953 7.526 -3.726 . . . 1.0 . . . . . . . . . . . . B . 1 ASP HB3 . . . . . . . . . c19602_2mgt 1 . 20 . 10525 . 2 1 2 ASP N N 14.116 7.842 -2.793 . . . 1.0 . . . . . . . . . . . . B . 1 ASP N . . . . . . . . . c19602_2mgt 1 . 20 . 10526 . 2 1 2 ASP O O 14.441 5.533 -4.257 . . . 1.0 . . . . . . . . . . . . B . 1 ASP O . . . . . . . . . c19602_2mgt 1 . 20 . 10527 . 2 1 2 ASP OD1 O 17.167 8.862 -5.962 . . . 1.0 . . . . . . . . . . . . B . 1 ASP OD1 . . . . . . . . . c19602_2mgt 1 . 20 . 10528 . 2 1 2 ASP OD2 O 16.581 10.544 -4.683 . . . 1.0 . . . . . . . . . . . . B . 1 ASP OD2 . . . . . . . . . c19602_2mgt 1 . 20 . 10529 . 2 1 3 ALA C C 15.833 4.165 -6.431 . . . 1.0 . . . . . . . . . . . . B . 2 ALA C . . . . . . . . . c19602_2mgt 1 . 20 . 10530 . 2 1 3 ALA CA C 15.218 5.441 -6.992 . . . 1.0 . . . . . . . . . . . . B . 2 ALA CA . . . . . . . . . c19602_2mgt 1 . 20 . 10531 . 2 1 3 ALA CB C 15.958 5.792 -8.281 . . . 1.0 . . . . . . . . . . . . B . 2 ALA CB . . . . . . . . . c19602_2mgt 1 . 20 . 10532 . 2 1 3 ALA H H 15.619 7.445 -6.456 . . . 1.0 . . . . . . . . . . . . B . 2 ALA H . . . . . . . . . c19602_2mgt 1 . 20 . 10533 . 2 1 3 ALA HA H 14.176 5.251 -7.223 . . . 1.0 . . . . . . . . . . . . B . 2 ALA HA . . . . . . . . . c19602_2mgt 1 . 20 . 10534 . 2 1 3 ALA HB1 H 16.938 6.198 -8.038 . . . 1.0 . . . . . . . . . . . . B . 2 ALA HB1 . . . . . . . . . c19602_2mgt 1 . 20 . 10535 . 2 1 3 ALA HB2 H 16.085 4.895 -8.888 . . . 1.0 . . . . . . . . . . . . B . 2 ALA HB2 . . . . . . . . . c19602_2mgt 1 . 20 . 10536 . 2 1 3 ALA HB3 H 15.388 6.523 -8.843 . . . 1.0 . . . . . . . . . . . . B . 2 ALA HB3 . . . . . . . . . c19602_2mgt 1 . 20 . 10537 . 2 1 3 ALA N N 15.272 6.575 -6.077 . . . 1.0 . . . . . . . . . . . . B . 2 ALA N . . . . . . . . . c19602_2mgt 1 . 20 . 10538 . 2 1 3 ALA O O 15.246 3.100 -6.580 . . . 1.0 . . . . . . . . . . . . B . 2 ALA O . . . . . . . . . c19602_2mgt 1 . 20 . 10539 . 2 1 4 GLU C C 17.143 2.087 -4.599 . . . 1.0 . . . . . . . . . . . . B . 3 GLU C . . . . . . . . . c19602_2mgt 1 . 20 . 10540 . 2 1 4 GLU CA C 17.846 3.133 -5.455 . . . 1.0 . . . . . . . . . . . . B . 3 GLU CA . . . . . . . . . c19602_2mgt 1 . 20 . 10541 . 2 1 4 GLU CB C 19.132 3.630 -4.791 . . . 1.0 . . . . . . . . . . . . B . 3 GLU CB . . . . . . . . . c19602_2mgt 1 . 20 . 10542 . 2 1 4 GLU CD C 19.976 5.372 -3.214 . . . 1.0 . . . . . . . . . . . . B . 3 GLU CD . . . . . . . . . c19602_2mgt 1 . 20 . 10543 . 2 1 4 GLU CG C 18.852 4.401 -3.497 . . . 1.0 . . . . . . . . . . . . B . 3 GLU CG . . . . . . . . . c19602_2mgt 1 . 20 . 10544 . 2 1 4 GLU H H 17.407 5.188 -5.693 . . . 1.0 . . . . . . . . . . . . B . 3 GLU H . . . . . . . . . c19602_2mgt 1 . 20 . 10545 . 2 1 4 GLU HA H 18.115 2.648 -6.386 . . . 1.0 . . . . . . . . . . . . B . 3 GLU HA . . . . . . . . . c19602_2mgt 1 . 20 . 10546 . 2 1 4 GLU HB2 H 19.787 2.785 -4.573 . . . 1.0 . . . . . . . . . . . . B . 3 GLU HB2 . . . . . . . . . c19602_2mgt 1 . 20 . 10547 . 2 1 4 GLU HB3 H 19.653 4.277 -5.497 . . . 1.0 . . . . . . . . . . . . B . 3 GLU HB3 . . . . . . . . . c19602_2mgt 1 . 20 . 10548 . 2 1 4 GLU HG2 H 17.932 4.980 -3.592 . . . 1.0 . . . . . . . . . . . . B . 3 GLU HG2 . . . . . . . . . c19602_2mgt 1 . 20 . 10549 . 2 1 4 GLU HG3 H 18.744 3.707 -2.665 . . . 1.0 . . . . . . . . . . . . B . 3 GLU HG3 . . . . . . . . . c19602_2mgt 1 . 20 . 10550 . 2 1 4 GLU N N 17.007 4.269 -5.808 . . . 1.0 . . . . . . . . . . . . B . 3 GLU N . . . . . . . . . c19602_2mgt 1 . 20 . 10551 . 2 1 4 GLU O O 17.390 0.905 -4.819 . . . 1.0 . . . . . . . . . . . . B . 3 GLU O . . . . . . . . . c19602_2mgt 1 . 20 . 10552 . 2 1 4 GLU OE1 O 21.045 4.917 -2.772 . . . 1.0 . . . . . . . . . . . . B . 3 GLU OE1 . . . . . . . . . c19602_2mgt 1 . 20 . 10553 . 2 1 4 GLU OE2 O 19.764 6.568 -3.448 . . . 1.0 . . . . . . . . . . . . B . 3 GLU OE2 . . . . . . . . . c19602_2mgt 1 . 20 . 10554 . 2 1 5 PHE C C 13.970 1.532 -3.330 . . . 1.0 . . . . . . . . . . . . B . 4 PHE C . . . . . . . . . c19602_2mgt 1 . 20 . 10555 . 2 1 5 PHE CA C 15.440 1.576 -2.897 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CA . . . . . . . . . c19602_2mgt 1 . 20 . 10556 . 2 1 5 PHE CB C 15.624 1.871 -1.412 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CB . . . . . . . . . c19602_2mgt 1 . 20 . 10557 . 2 1 5 PHE CD1 C 15.596 4.365 -1.040 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CD1 . . . . . . . . . c19602_2mgt 1 . 20 . 10558 . 2 1 5 PHE CD2 C 13.682 3.035 -0.319 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CD2 . . . . . . . . . c19602_2mgt 1 . 20 . 10559 . 2 1 5 PHE CE1 C 14.979 5.518 -0.533 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CE1 . . . . . . . . . c19602_2mgt 1 . 20 . 10560 . 2 1 5 PHE CE2 C 13.070 4.186 0.200 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CE2 . . . . . . . . . c19602_2mgt 1 . 20 . 10561 . 2 1 5 PHE CG C 14.949 3.124 -0.919 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CG . . . . . . . . . c19602_2mgt 1 . 20 . 10562 . 2 1 5 PHE CZ C 13.724 5.424 0.093 . . . 1.0 . . . . . . . . . . . . B . 4 PHE CZ . . . . . . . . . c19602_2mgt 1 . 20 . 10563 . 2 1 5 PHE H H 16.087 3.480 -3.565 . . . 1.0 . . . . . . . . . . . . B . 4 PHE H . . . . . . . . . c19602_2mgt 1 . 20 . 10564 . 2 1 5 PHE HA H 15.818 0.571 -3.048 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HA . . . . . . . . . c19602_2mgt 1 . 20 . 10565 . 2 1 5 PHE HB2 H 15.226 1.031 -0.845 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HB2 . . . . . . . . . c19602_2mgt 1 . 20 . 10566 . 2 1 5 PHE HB3 H 16.690 1.931 -1.196 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HB3 . . . . . . . . . c19602_2mgt 1 . 20 . 10567 . 2 1 5 PHE HD1 H 16.560 4.424 -1.521 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HD1 . . . . . . . . . c19602_2mgt 1 . 20 . 10568 . 2 1 5 PHE HD2 H 13.187 2.079 -0.265 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HD2 . . . . . . . . . c19602_2mgt 1 . 20 . 10569 . 2 1 5 PHE HE1 H 15.470 6.474 -0.625 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HE1 . . . . . . . . . c19602_2mgt 1 . 20 . 10570 . 2 1 5 PHE HE2 H 12.097 4.121 0.663 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HE2 . . . . . . . . . c19602_2mgt 1 . 20 . 10571 . 2 1 5 PHE HZ H 13.256 6.310 0.485 . . . 1.0 . . . . . . . . . . . . B . 4 PHE HZ . . . . . . . . . c19602_2mgt 1 . 20 . 10572 . 2 1 5 PHE N N 16.247 2.493 -3.690 . . . 1.0 . . . . . . . . . . . . B . 4 PHE N . . . . . . . . . c19602_2mgt 1 . 20 . 10573 . 2 1 5 PHE O O 13.247 0.667 -2.840 . . . 1.0 . . . . . . . . . . . . B . 4 PHE O . . . . . . . . . c19602_2mgt 1 . 20 . 10574 . 2 1 6 ARG C C 12.532 1.048 -6.041 . . . 1.0 . . . . . . . . . . . . B . 5 ARG C . . . . . . . . . c19602_2mgt 1 . 20 . 10575 . 2 1 6 ARG CA C 12.344 2.225 -5.078 . . . 1.0 . . . . . . . . . . . . B . 5 ARG CA . . . . . . . . . c19602_2mgt 1 . 20 . 10576 . 2 1 6 ARG CB C 12.018 3.543 -5.796 . . . 1.0 . . . . . . . . . . . . B . 5 ARG CB . . . . . . . . . c19602_2mgt 1 . 20 . 10577 . 2 1 6 ARG CD C 9.473 3.348 -5.476 . . . 1.0 . . . . . . . . . . . . B . 5 ARG CD . . . . . . . . . c19602_2mgt 1 . 20 . 10578 . 2 1 6 ARG CG C 10.638 3.525 -6.461 . . . 1.0 . . . . . . . . . . . . B . 5 ARG CG . . . . . . . . . c19602_2mgt 1 . 20 . 10579 . 2 1 6 ARG CZ C 8.888 5.652 -4.733 . . . 1.0 . . . . . . . . . . . . B . 5 ARG CZ . . . . . . . . . c19602_2mgt 1 . 20 . 10580 . 2 1 6 ARG H H 14.207 3.070 -4.643 . . . 1.0 . . . . . . . . . . . . B . 5 ARG H . . . . . . . . . c19602_2mgt 1 . 20 . 10581 . 2 1 6 ARG HA H 11.522 2.006 -4.409 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HA . . . . . . . . . c19602_2mgt 1 . 20 . 10582 . 2 1 6 ARG HB2 H 12.062 4.365 -5.087 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HB2 . . . . . . . . . c19602_2mgt 1 . 20 . 10583 . 2 1 6 ARG HB3 H 12.760 3.735 -6.564 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HB3 . . . . . . . . . c19602_2mgt 1 . 20 . 10584 . 2 1 6 ARG HD2 H 8.543 3.320 -6.036 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HD2 . . . . . . . . . c19602_2mgt 1 . 20 . 10585 . 2 1 6 ARG HD3 H 9.563 2.404 -4.937 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HD3 . . . . . . . . . c19602_2mgt 1 . 20 . 10586 . 2 1 6 ARG HE H 9.750 4.224 -3.574 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HE . . . . . . . . . c19602_2mgt 1 . 20 . 10587 . 2 1 6 ARG HG2 H 10.510 4.459 -7.005 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HG2 . . . . . . . . . c19602_2mgt 1 . 20 . 10588 . 2 1 6 ARG HG3 H 10.615 2.714 -7.184 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HG3 . . . . . . . . . c19602_2mgt 1 . 20 . 10589 . 2 1 6 ARG HH11 H 8.469 5.337 -6.698 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HH11 . . . . . . . . . c19602_2mgt 1 . 20 . 10590 . 2 1 6 ARG HH12 H 8.055 6.922 -6.089 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HH12 . . . . . . . . . c19602_2mgt 1 . 20 . 10591 . 2 1 6 ARG HH21 H 9.088 6.295 -2.815 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HH21 . . . . . . . . . c19602_2mgt 1 . 20 . 10592 . 2 1 6 ARG HH22 H 8.437 7.465 -3.937 . . . 1.0 . . . . . . . . . . . . B . 5 ARG HH22 . . . . . . . . . c19602_2mgt 1 . 20 . 10593 . 2 1 6 ARG N N 13.560 2.378 -4.294 . . . 1.0 . . . . . . . . . . . . B . 5 ARG N . . . . . . . . . c19602_2mgt 1 . 20 . 10594 . 2 1 6 ARG NE N 9.397 4.433 -4.497 . . . 1.0 . . . . . . . . . . . . B . 5 ARG NE . . . . . . . . . c19602_2mgt 1 . 20 . 10595 . 2 1 6 ARG NH1 N 8.450 6.004 -5.940 . . . 1.0 . . . . . . . . . . . . B . 5 ARG NH1 . . . . . . . . . c19602_2mgt 1 . 20 . 10596 . 2 1 6 ARG NH2 N 8.801 6.542 -3.751 . . . 1.0 . . . . . . . . . . . . B . 5 ARG NH2 . . . . . . . . . c19602_2mgt 1 . 20 . 10597 . 2 1 6 ARG O O 12.867 1.229 -7.210 . . . 1.0 . . . . . . . . . . . . B . 5 ARG O . . . . . . . . . c19602_2mgt 1 . 20 . 10598 . 2 1 7 ARG C C 11.488 -2.337 -6.226 . . . 1.0 . . . . . . . . . . . . B . 6 ARG C . . . . . . . . . c19602_2mgt 1 . 20 . 10599 . 2 1 7 ARG CA C 12.709 -1.425 -6.138 . . . 1.0 . . . . . . . . . . . . B . 6 ARG CA . . . . . . . . . c19602_2mgt 1 . 20 . 10600 . 2 1 7 ARG CB C 13.801 -2.097 -5.303 . . . 1.0 . . . . . . . . . . . . B . 6 ARG CB . . . . . . . . . c19602_2mgt 1 . 20 . 10601 . 2 1 7 ARG CD C 15.828 -1.229 -6.637 . . . 1.0 . . . . . . . . . . . . B . 6 ARG CD . . . . . . . . . c19602_2mgt 1 . 20 . 10602 . 2 1 7 ARG CG C 15.132 -1.338 -5.276 . . . 1.0 . . . . . . . . . . . . B . 6 ARG CG . . . . . . . . . c19602_2mgt 1 . 20 . 10603 . 2 1 7 ARG CZ C 15.827 0.397 -8.533 . . . 1.0 . . . . . . . . . . . . B . 6 ARG CZ . . . . . . . . . c19602_2mgt 1 . 20 . 10604 . 2 1 7 ARG H H 12.142 -0.221 -4.530 . . . 1.0 . . . . . . . . . . . . B . 6 ARG H . . . . . . . . . c19602_2mgt 1 . 20 . 10605 . 2 1 7 ARG HA H 13.086 -1.243 -7.139 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HA . . . . . . . . . c19602_2mgt 1 . 20 . 10606 . 2 1 7 ARG HB2 H 13.445 -2.177 -4.278 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HB2 . . . . . . . . . c19602_2mgt 1 . 20 . 10607 . 2 1 7 ARG HB3 H 13.973 -3.101 -5.682 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HB3 . . . . . . . . . c19602_2mgt 1 . 20 . 10608 . 2 1 7 ARG HD2 H 16.894 -1.402 -6.495 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HD2 . . . . . . . . . c19602_2mgt 1 . 20 . 10609 . 2 1 7 ARG HD3 H 15.436 -1.992 -7.306 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HD3 . . . . . . . . . c19602_2mgt 1 . 20 . 10610 . 2 1 7 ARG HE H 15.450 0.861 -6.603 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HE . . . . . . . . . c19602_2mgt 1 . 20 . 10611 . 2 1 7 ARG HG2 H 14.955 -0.344 -4.882 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HG2 . . . . . . . . . c19602_2mgt 1 . 20 . 10612 . 2 1 7 ARG HG3 H 15.804 -1.851 -4.591 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HG3 . . . . . . . . . c19602_2mgt 1 . 20 . 10613 . 2 1 7 ARG HH11 H 16.313 -1.483 -9.134 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HH11 . . . . . . . . . c19602_2mgt 1 . 20 . 10614 . 2 1 7 ARG HH12 H 16.263 -0.277 -10.401 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HH12 . . . . . . . . . c19602_2mgt 1 . 20 . 10615 . 2 1 7 ARG HH21 H 15.360 2.362 -8.311 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HH21 . . . . . . . . . c19602_2mgt 1 . 20 . 10616 . 2 1 7 ARG HH22 H 15.774 1.866 -9.934 . . . 1.0 . . . . . . . . . . . . B . 6 ARG HH22 . . . . . . . . . c19602_2mgt 1 . 20 . 10617 . 2 1 7 ARG N N 12.370 -0.164 -5.508 . . . 1.0 . . . . . . . . . . . . B . 6 ARG N . . . . . . . . . c19602_2mgt 1 . 20 . 10618 . 2 1 7 ARG NE N 15.666 0.102 -7.236 . . . 1.0 . . . . . . . . . . . . B . 6 ARG NE . . . . . . . . . c19602_2mgt 1 . 20 . 10619 . 2 1 7 ARG NH1 N 16.167 -0.528 -9.427 . . . 1.0 . . . . . . . . . . . . B . 6 ARG NH1 . . . . . . . . . c19602_2mgt 1 . 20 . 10620 . 2 1 7 ARG NH2 N 15.648 1.644 -8.959 . . . 1.0 . . . . . . . . . . . . B . 6 ARG NH2 . . . . . . . . . c19602_2mgt 1 . 20 . 10621 . 2 1 7 ARG O O 10.528 -2.202 -5.466 . . . 1.0 . . . . . . . . . . . . B . 6 ARG O . . . . . . . . . c19602_2mgt 1 . 20 . 10622 . 2 1 8 ASP C C 10.404 -5.391 -6.484 . . . 1.0 . . . . . . . . . . . . B . 7 ASP C . . . . . . . . . c19602_2mgt 1 . 20 . 10623 . 2 1 8 ASP CA C 10.453 -4.201 -7.444 . . . 1.0 . . . . . . . . . . . . B . 7 ASP CA . . . . . . . . . c19602_2mgt 1 . 20 . 10624 . 2 1 8 ASP CB C 10.624 -4.704 -8.877 . . . 1.0 . . . . . . . . . . . . B . 7 ASP CB . . . . . . . . . c19602_2mgt 1 . 20 . 10625 . 2 1 8 ASP CG C 9.437 -5.561 -9.276 . . . 1.0 . . . . . . . . . . . . B . 7 ASP CG . . . . . . . . . c19602_2mgt 1 . 20 . 10626 . 2 1 8 ASP H H 12.372 -3.363 -7.735 . . . 1.0 . . . . . . . . . . . . B . 7 ASP H . . . . . . . . . c19602_2mgt 1 . 20 . 10627 . 2 1 8 ASP HA H 9.509 -3.659 -7.377 . . . 1.0 . . . . . . . . . . . . B . 7 ASP HA . . . . . . . . . c19602_2mgt 1 . 20 . 10628 . 2 1 8 ASP HB2 H 10.706 -3.859 -9.561 . . . 1.0 . . . . . . . . . . . . B . 7 ASP HB2 . . . . . . . . . c19602_2mgt 1 . 20 . 10629 . 2 1 8 ASP HB3 H 11.535 -5.302 -8.944 . . . 1.0 . . . . . . . . . . . . B . 7 ASP HB3 . . . . . . . . . c19602_2mgt 1 . 20 . 10630 . 2 1 8 ASP N N 11.546 -3.291 -7.158 . . . 1.0 . . . . . . . . . . . . B . 7 ASP N . . . . . . . . . c19602_2mgt 1 . 20 . 10631 . 2 1 8 ASP O O 9.318 -5.904 -6.235 . . . 1.0 . . . . . . . . . . . . B . 7 ASP O . . . . . . . . . c19602_2mgt 1 . 20 . 10632 . 2 1 8 ASP OD1 O 8.422 -4.962 -9.703 . . . 1.0 . . . . . . . . . . . . B . 7 ASP OD1 . . . . . . . . . c19602_2mgt 1 . 20 . 10633 . 2 1 8 ASP OD2 O 9.517 -6.784 -9.110 . . . 1.0 . . . . . . . . . . . . B . 7 ASP OD2 . . . . . . . . . c19602_2mgt 1 . 20 . 10634 . 2 1 9 SER C C 11.222 -7.060 -3.841 . . . 1.0 . . . . . . . . . . . . B . 8 SER C . . . . . . . . . c19602_2mgt 1 . 20 . 10635 . 2 1 9 SER CA C 11.685 -7.133 -5.300 . . . 1.0 . . . . . . . . . . . . B . 8 SER CA . . . . . . . . . c19602_2mgt 1 . 20 . 10636 . 2 1 9 SER CB C 13.124 -7.651 -5.419 . . . 1.0 . . . . . . . . . . . . B . 8 SER CB . . . . . . . . . c19602_2mgt 1 . 20 . 10637 . 2 1 9 SER H H 12.414 -5.403 -6.254 . . . 1.0 . . . . . . . . . . . . B . 8 SER H . . . . . . . . . c19602_2mgt 1 . 20 . 10638 . 2 1 9 SER HA H 11.043 -7.836 -5.823 . . . 1.0 . . . . . . . . . . . . B . 8 SER HA . . . . . . . . . c19602_2mgt 1 . 20 . 10639 . 2 1 9 SER HB2 H 13.808 -6.972 -4.913 . . . 1.0 . . . . . . . . . . . . B . 8 SER HB2 . . . . . . . . . c19602_2mgt 1 . 20 . 10640 . 2 1 9 SER HB3 H 13.192 -8.638 -4.960 . . . 1.0 . . . . . . . . . . . . B . 8 SER HB3 . . . . . . . . . c19602_2mgt 1 . 20 . 10641 . 2 1 9 SER HG H 13.714 -6.878 -7.100 . . . 1.0 . . . . . . . . . . . . B . 8 SER HG . . . . . . . . . c19602_2mgt 1 . 20 . 10642 . 2 1 9 SER N N 11.556 -5.853 -5.981 . . . 1.0 . . . . . . . . . . . . B . 8 SER N . . . . . . . . . c19602_2mgt 1 . 20 . 10643 . 2 1 9 SER O O 12.035 -7.030 -2.924 . . . 1.0 . . . . . . . . . . . . B . 8 SER O . . . . . . . . . c19602_2mgt 1 . 20 . 10644 . 2 1 9 SER OG O 13.503 -7.757 -6.769 . . . 1.0 . . . . . . . . . . . . B . 8 SER OG . . . . . . . . . c19602_2mgt 1 . 20 . 10645 . 2 1 10 GLY C C 7.783 -7.208 -2.529 . . . 1.0 . . . . . . . . . . . . B . 9 GLY C . . . . . . . . . c19602_2mgt 1 . 20 . 10646 . 2 1 10 GLY CA C 9.285 -7.066 -2.310 . . . 1.0 . . . . . . . . . . . . B . 9 GLY CA . . . . . . . . . c19602_2mgt 1 . 20 . 10647 . 2 1 10 GLY H H 9.276 -7.005 -4.411 . . . 1.0 . . . . . . . . . . . . B . 9 GLY H . . . . . . . . . c19602_2mgt 1 . 20 . 10648 . 2 1 10 GLY HA2 H 9.661 -7.922 -1.756 . . . 1.0 . . . . . . . . . . . . B . 9 GLY HA2 . . . . . . . . . c19602_2mgt 1 . 20 . 10649 . 2 1 10 GLY HA3 H 9.547 -6.171 -1.749 . . . 1.0 . . . . . . . . . . . . B . 9 GLY HA3 . . . . . . . . . c19602_2mgt 1 . 20 . 10650 . 2 1 10 GLY N N 9.905 -7.041 -3.621 . . . 1.0 . . . . . . . . . . . . B . 9 GLY N . . . . . . . . . c19602_2mgt 1 . 20 . 10651 . 2 1 10 GLY O O 7.348 -8.298 -2.872 . . . 1.0 . . . . . . . . . . . . B . 9 GLY O . . . . . . . . . c19602_2mgt 1 . 20 . 10652 . 2 1 11 TYR C C 5.977 -4.058 -1.634 . . . 1.0 . . . . . . . . . . . . B . 10 TYR C . . . . . . . . . c19602_2mgt 1 . 20 . 10653 . 2 1 11 TYR CA C 7.259 -4.862 -1.835 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CA . . . . . . . . . c19602_2mgt 1 . 20 . 10654 . 2 1 11 TYR CB C 8.188 -4.052 -2.758 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CB . . . . . . . . . c19602_2mgt 1 . 20 . 10655 . 2 1 11 TYR CD1 C 9.426 -3.002 -0.806 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CD1 . . . . . . . . . c19602_2mgt 1 . 20 . 10656 . 2 1 11 TYR CD2 C 10.687 -3.756 -2.740 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CD2 . . . . . . . . . c19602_2mgt 1 . 20 . 10657 . 2 1 11 TYR CE1 C 10.607 -2.583 -0.187 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CE1 . . . . . . . . . c19602_2mgt 1 . 20 . 10658 . 2 1 11 TYR CE2 C 11.874 -3.338 -2.128 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CE2 . . . . . . . . . c19602_2mgt 1 . 20 . 10659 . 2 1 11 TYR CG C 9.457 -3.580 -2.088 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CG . . . . . . . . . c19602_2mgt 1 . 20 . 10660 . 2 1 11 TYR CZ C 11.845 -2.731 -0.855 . . . 1.0 . . . . . . . . . . . . B . 10 TYR CZ . . . . . . . . . c19602_2mgt 1 . 20 . 10661 . 2 1 11 TYR H H 6.036 -6.244 -2.772 . . . 1.0 . . . . . . . . . . . . B . 10 TYR H . . . . . . . . . c19602_2mgt 1 . 20 . 10662 . 2 1 11 TYR HA H 7.741 -5.022 -0.873 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HA . . . . . . . . . c19602_2mgt 1 . 20 . 10663 . 2 1 11 TYR HB2 H 8.451 -4.635 -3.638 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HB2 . . . . . . . . . c19602_2mgt 1 . 20 . 10664 . 2 1 11 TYR HB3 H 7.655 -3.182 -3.135 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HB3 . . . . . . . . . c19602_2mgt 1 . 20 . 10665 . 2 1 11 TYR HD1 H 8.502 -2.883 -0.273 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HD1 . . . . . . . . . c19602_2mgt 1 . 20 . 10666 . 2 1 11 TYR HD2 H 10.718 -4.220 -3.713 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HD2 . . . . . . . . . c19602_2mgt 1 . 20 . 10667 . 2 1 11 TYR HE1 H 10.543 -2.169 0.802 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HE1 . . . . . . . . . c19602_2mgt 1 . 20 . 10668 . 2 1 11 TYR HE2 H 12.809 -3.501 -2.628 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HE2 . . . . . . . . . c19602_2mgt 1 . 20 . 10669 . 2 1 11 TYR HH H 12.873 -1.922 0.584 . . . 1.0 . . . . . . . . . . . . B . 10 TYR HH . . . . . . . . . c19602_2mgt 1 . 20 . 10670 . 2 1 11 TYR N N 6.960 -6.164 -2.389 . . . 1.0 . . . . . . . . . . . . B . 10 TYR N . . . . . . . . . c19602_2mgt 1 . 20 . 10671 . 2 1 11 TYR O O 5.013 -4.189 -2.384 . . . 1.0 . . . . . . . . . . . . B . 10 TYR O . . . . . . . . . c19602_2mgt 1 . 20 . 10672 . 2 1 11 TYR OH O 13.010 -2.332 -0.275 . . . 1.0 . . . . . . . . . . . . B . 10 TYR OH . . . . . . . . . c19602_2mgt 1 . 20 . 10673 . 2 1 12 GLU C C 6.508 -0.741 -0.413 . . . 1.0 . . . . . . . . . . . . B . 11 GLU C . . . . . . . . . c19602_2mgt 1 . 20 . 10674 . 2 1 12 GLU CA C 5.519 -1.779 -0.955 . . . 1.0 . . . . . . . . . . . . B . 11 GLU CA . . . . . . . . . c19602_2mgt 1 . 20 . 10675 . 2 1 12 GLU CB C 4.163 -1.674 -0.286 . . . 1.0 . . . . . . . . . . . . B . 11 GLU CB . . . . . . . . . c19602_2mgt 1 . 20 . 10676 . 2 1 12 GLU CD C 2.289 -0.030 0.162 . . . 1.0 . . . . . . . . . . . . B . 11 GLU CD . . . . . . . . . c19602_2mgt 1 . 20 . 10677 . 2 1 12 GLU CG C 3.484 -0.368 -0.707 . . . 1.0 . . . . . . . . . . . . B . 11 GLU CG . . . . . . . . . c19602_2mgt 1 . 20 . 10678 . 2 1 12 GLU H H 6.777 -3.152 -0.017 . . . 1.0 . . . . . . . . . . . . B . 11 GLU H . . . . . . . . . c19602_2mgt 1 . 20 . 10679 . 2 1 12 GLU HA H 5.388 -1.649 -2.027 . . . 1.0 . . . . . . . . . . . . B . 11 GLU HA . . . . . . . . . c19602_2mgt 1 . 20 . 10680 . 2 1 12 GLU HB2 H 3.557 -2.522 -0.594 . . . 1.0 . . . . . . . . . . . . B . 11 GLU HB2 . . . . . . . . . c19602_2mgt 1 . 20 . 10681 . 2 1 12 GLU HB3 H 4.297 -1.718 0.797 . . . 1.0 . . . . . . . . . . . . B . 11 GLU HB3 . . . . . . . . . c19602_2mgt 1 . 20 . 10682 . 2 1 12 GLU HG2 H 4.190 0.459 -0.631 . . . 1.0 . . . . . . . . . . . . B . 11 GLU HG2 . . . . . . . . . c19602_2mgt 1 . 20 . 10683 . 2 1 12 GLU HG3 H 3.164 -0.440 -1.746 . . . 1.0 . . . . . . . . . . . . B . 11 GLU HG3 . . . . . . . . . c19602_2mgt 1 . 20 . 10684 . 2 1 12 GLU N N 6.057 -3.096 -0.718 . . . 1.0 . . . . . . . . . . . . B . 11 GLU N . . . . . . . . . c19602_2mgt 1 . 20 . 10685 . 2 1 12 GLU O O 6.499 -0.427 0.775 . . . 1.0 . . . . . . . . . . . . B . 11 GLU O . . . . . . . . . c19602_2mgt 1 . 20 . 10686 . 2 1 12 GLU OE1 O 1.918 -0.854 1.029 . . . 1.0 . . . . . . . . . . . . B . 11 GLU OE1 . . . . . . . . . c19602_2mgt 1 . 20 . 10687 . 2 1 12 GLU OE2 O 1.775 1.085 0.020 . . . 1.0 . . . . . . . . . . . . B . 11 GLU OE2 . . . . . . . . . c19602_2mgt 1 . 20 . 10688 . 2 1 13 VAL C C 8.050 1.890 -0.138 . . . 1.0 . . . . . . . . . . . . B . 12 VAL C . . . . . . . . . c19602_2mgt 1 . 20 . 10689 . 2 1 13 VAL CA C 8.497 0.634 -0.892 . . . 1.0 . . . . . . . . . . . . B . 12 VAL CA . . . . . . . . . c19602_2mgt 1 . 20 . 10690 . 2 1 13 VAL CB C 9.345 1.053 -2.107 . . . 1.0 . . . . . . . . . . . . B . 12 VAL CB . . . . . . . . . c19602_2mgt 1 . 20 . 10691 . 2 1 13 VAL CG1 C 10.648 1.699 -1.604 . . . 1.0 . . . . . . . . . . . . B . 12 VAL CG1 . . . . . . . . . c19602_2mgt 1 . 20 . 10692 . 2 1 13 VAL CG2 C 9.740 -0.125 -3.008 . . . 1.0 . . . . . . . . . . . . B . 12 VAL CG2 . . . . . . . . . c19602_2mgt 1 . 20 . 10693 . 2 1 13 VAL H H 7.284 -0.438 -2.259 . . . 1.0 . . . . . . . . . . . . B . 12 VAL H . . . . . . . . . c19602_2mgt 1 . 20 . 10694 . 2 1 13 VAL HA H 9.123 0.027 -0.253 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HA . . . . . . . . . c19602_2mgt 1 . 20 . 10695 . 2 1 13 VAL HB H 8.781 1.775 -2.701 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HB . . . . . . . . . c19602_2mgt 1 . 20 . 10696 . 2 1 13 VAL HG11 H 11.200 2.125 -2.430 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HG11 . . . . . . . . . c19602_2mgt 1 . 20 . 10697 . 2 1 13 VAL HG12 H 10.468 2.519 -0.924 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HG12 . . . . . . . . . c19602_2mgt 1 . 20 . 10698 . 2 1 13 VAL HG13 H 11.254 0.959 -1.082 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HG13 . . . . . . . . . c19602_2mgt 1 . 20 . 10699 . 2 1 13 VAL HG21 H 10.377 -0.816 -2.462 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HG21 . . . . . . . . . c19602_2mgt 1 . 20 . 10700 . 2 1 13 VAL HG22 H 8.862 -0.652 -3.373 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HG22 . . . . . . . . . c19602_2mgt 1 . 20 . 10701 . 2 1 13 VAL HG23 H 10.284 0.253 -3.868 . . . 1.0 . . . . . . . . . . . . B . 12 VAL HG23 . . . . . . . . . c19602_2mgt 1 . 20 . 10702 . 2 1 13 VAL N N 7.363 -0.197 -1.284 . . . 1.0 . . . . . . . . . . . . B . 12 VAL N . . . . . . . . . c19602_2mgt 1 . 20 . 10703 . 2 1 13 VAL O O 8.766 2.374 0.734 . . . 1.0 . . . . . . . . . . . . B . 12 VAL O . . . . . . . . . c19602_2mgt 1 . 20 . 10704 . 2 1 14 HIS C C 6.335 3.955 1.426 . . . 1.0 . . . . . . . . . . . . B . 13 HIS C . . . . . . . . . c19602_2mgt 1 . 20 . 10705 . 2 1 14 HIS CA C 6.458 3.755 -0.088 . . . 1.0 . . . . . . . . . . . . B . 13 HIS CA . . . . . . . . . c19602_2mgt 1 . 20 . 10706 . 2 1 14 HIS CB C 5.143 4.081 -0.795 . . . 1.0 . . . . . . . . . . . . B . 13 HIS CB . . . . . . . . . c19602_2mgt 1 . 20 . 10707 . 2 1 14 HIS CD2 C 5.125 2.888 -3.066 . . . 1.0 . . . . . . . . . . . . B . 13 HIS CD2 . . . . . . . . . c19602_2mgt 1 . 20 . 10708 . 2 1 14 HIS CE1 C 5.741 4.538 -4.368 . . . 1.0 . . . . . . . . . . . . B . 13 HIS CE1 . . . . . . . . . c19602_2mgt 1 . 20 . 10709 . 2 1 14 HIS CG C 5.267 4.005 -2.291 . . . 1.0 . . . . . . . . . . . . B . 13 HIS CG . . . . . . . . . c19602_2mgt 1 . 20 . 10710 . 2 1 14 HIS H H 6.314 1.951 -1.175 . . . 1.0 . . . . . . . . . . . . B . 13 HIS H . . . . . . . . . c19602_2mgt 1 . 20 . 10711 . 2 1 14 HIS HA H 7.227 4.435 -0.454 . . . 1.0 . . . . . . . . . . . . B . 13 HIS HA . . . . . . . . . c19602_2mgt 1 . 20 . 10712 . 2 1 14 HIS HB2 H 4.378 3.382 -0.458 . . . 1.0 . . . . . . . . . . . . B . 13 HIS HB2 . . . . . . . . . c19602_2mgt 1 . 20 . 10713 . 2 1 14 HIS HB3 H 4.834 5.090 -0.528 . . . 1.0 . . . . . . . . . . . . B . 13 HIS HB3 . . . . . . . . . c19602_2mgt 1 . 20 . 10714 . 2 1 14 HIS HD1 H 5.859 5.976 -2.845 . . . 1.0 . . . . . . . . . . . . B . 13 HIS HD1 . . . . . . . . . c19602_2mgt 1 . 20 . 10715 . 2 1 14 HIS HD2 H 4.849 1.902 -2.718 . . . 1.0 . . . . . . . . . . . . B . 13 HIS HD2 . . . . . . . . . c19602_2mgt 1 . 20 . 10716 . 2 1 14 HIS HE1 H 6.014 5.114 -5.240 . . . 1.0 . . . . . . . . . . . . B . 13 HIS HE1 . . . . . . . . . c19602_2mgt 1 . 20 . 10717 . 2 1 14 HIS N N 6.871 2.418 -0.475 . . . 1.0 . . . . . . . . . . . . B . 13 HIS N . . . . . . . . . c19602_2mgt 1 . 20 . 10718 . 2 1 14 HIS ND1 N 5.656 5.027 -3.123 . . . 1.0 . . . . . . . . . . . . B . 13 HIS ND1 . . . . . . . . . c19602_2mgt 1 . 20 . 10719 . 2 1 14 HIS NE2 N 5.443 3.233 -4.379 . . . 1.0 . . . . . . . . . . . . B . 13 HIS NE2 . . . . . . . . . c19602_2mgt 1 . 20 . 10720 . 2 1 14 HIS O O 6.297 5.098 1.866 . . . 1.0 . . . . . . . . . . . . B . 13 HIS O . . . . . . . . . c19602_2mgt 1 . 20 . 10721 . 2 1 15 HIS C C 7.620 2.896 4.385 . . . 1.0 . . . . . . . . . . . . B . 14 HIS C . . . . . . . . . c19602_2mgt 1 . 20 . 10722 . 2 1 15 HIS CA C 6.259 3.001 3.685 . . . 1.0 . . . . . . . . . . . . B . 14 HIS CA . . . . . . . . . c19602_2mgt 1 . 20 . 10723 . 2 1 15 HIS CB C 5.289 1.968 4.255 . . . 1.0 . . . . . . . . . . . . B . 14 HIS CB . . . . . . . . . c19602_2mgt 1 . 20 . 10724 . 2 1 15 HIS CD2 C 3.066 1.246 3.224 . . . 1.0 . . . . . . . . . . . . B . 14 HIS CD2 . . . . . . . . . c19602_2mgt 1 . 20 . 10725 . 2 1 15 HIS CE1 C 1.963 3.133 3.296 . . . 1.0 . . . . . . . . . . . . B . 14 HIS CE1 . . . . . . . . . c19602_2mgt 1 . 20 . 10726 . 2 1 15 HIS CG C 3.876 2.181 3.797 . . . 1.0 . . . . . . . . . . . . B . 14 HIS CG . . . . . . . . . c19602_2mgt 1 . 20 . 10727 . 2 1 15 HIS H H 6.349 1.959 1.823 . . . 1.0 . . . . . . . . . . . . B . 14 HIS H . . . . . . . . . c19602_2mgt 1 . 20 . 10728 . 2 1 15 HIS HA H 5.855 3.982 3.935 . . . 1.0 . . . . . . . . . . . . B . 14 HIS HA . . . . . . . . . c19602_2mgt 1 . 20 . 10729 . 2 1 15 HIS HB2 H 5.626 0.965 3.985 . . . 1.0 . . . . . . . . . . . . B . 14 HIS HB2 . . . . . . . . . c19602_2mgt 1 . 20 . 10730 . 2 1 15 HIS HB3 H 5.288 2.049 5.340 . . . 1.0 . . . . . . . . . . . . B . 14 HIS HB3 . . . . . . . . . c19602_2mgt 1 . 20 . 10731 . 2 1 15 HIS HD1 H 3.509 4.251 4.168 . . . 1.0 . . . . . . . . . . . . B . 14 HIS HD1 . . . . . . . . . c19602_2mgt 1 . 20 . 10732 . 2 1 15 HIS HD2 H 3.341 0.220 3.029 . . . 1.0 . . . . . . . . . . . . B . 14 HIS HD2 . . . . . . . . . c19602_2mgt 1 . 20 . 10733 . 2 1 15 HIS HE1 H 1.199 3.880 3.157 . . . 1.0 . . . . . . . . . . . . B . 14 HIS HE1 . . . . . . . . . c19602_2mgt 1 . 20 . 10734 . 2 1 15 HIS N N 6.308 2.884 2.233 . . . 1.0 . . . . . . . . . . . . B . 14 HIS N . . . . . . . . . c19602_2mgt 1 . 20 . 10735 . 2 1 15 HIS ND1 N 3.167 3.358 3.841 . . . 1.0 . . . . . . . . . . . . B . 14 HIS ND1 . . . . . . . . . c19602_2mgt 1 . 20 . 10736 . 2 1 15 HIS NE2 N 1.847 1.855 2.916 . . . 1.0 . . . . . . . . . . . . B . 14 HIS NE2 . . . . . . . . . c19602_2mgt 1 . 20 . 10737 . 2 1 15 HIS O O 7.661 3.184 5.574 . . . 1.0 . . . . . . . . . . . . B . 14 HIS O . . . . . . . . . c19602_2mgt 1 . 20 . 10738 . 2 1 16 GLN C C 10.888 3.683 4.089 . . . 1.0 . . . . . . . . . . . . B . 15 GLN C . . . . . . . . . c19602_2mgt 1 . 20 . 10739 . 2 1 16 GLN CA C 10.040 2.435 4.347 . . . 1.0 . . . . . . . . . . . . B . 15 GLN CA . . . . . . . . . c19602_2mgt 1 . 20 . 10740 . 2 1 16 GLN CB C 10.790 1.178 3.895 . . . 1.0 . . . . . . . . . . . . B . 15 GLN CB . . . . . . . . . c19602_2mgt 1 . 20 . 10741 . 2 1 16 GLN CD C 12.341 0.248 2.162 . . . 1.0 . . . . . . . . . . . . B . 15 GLN CD . . . . . . . . . c19602_2mgt 1 . 20 . 10742 . 2 1 16 GLN CG C 11.146 1.151 2.405 . . . 1.0 . . . . . . . . . . . . B . 15 GLN CG . . . . . . . . . c19602_2mgt 1 . 20 . 10743 . 2 1 16 GLN H H 8.663 2.272 2.747 . . . 1.0 . . . . . . . . . . . . B . 15 GLN H . . . . . . . . . c19602_2mgt 1 . 20 . 10744 . 2 1 16 GLN HA H 9.906 2.344 5.421 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HA . . . . . . . . . c19602_2mgt 1 . 20 . 10745 . 2 1 16 GLN HB2 H 11.706 1.111 4.481 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HB2 . . . . . . . . . c19602_2mgt 1 . 20 . 10746 . 2 1 16 GLN HB3 H 10.192 0.300 4.124 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HB3 . . . . . . . . . c19602_2mgt 1 . 20 . 10747 . 2 1 16 GLN HE21 H 13.655 1.789 2.310 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HE21 . . . . . . . . . c19602_2mgt 1 . 20 . 10748 . 2 1 16 GLN HE22 H 14.353 0.219 1.995 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HE22 . . . . . . . . . c19602_2mgt 1 . 20 . 10749 . 2 1 16 GLN HG2 H 10.298 0.765 1.844 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HG2 . . . . . . . . . c19602_2mgt 1 . 20 . 10750 . 2 1 16 GLN HG3 H 11.387 2.149 2.040 . . . 1.0 . . . . . . . . . . . . B . 15 GLN HG3 . . . . . . . . . c19602_2mgt 1 . 20 . 10751 . 2 1 16 GLN N N 8.720 2.509 3.723 . . . 1.0 . . . . . . . . . . . . B . 15 GLN N . . . . . . . . . c19602_2mgt 1 . 20 . 10752 . 2 1 16 GLN NE2 N 13.546 0.798 2.158 . . . 1.0 . . . . . . . . . . . . B . 15 GLN NE2 . . . . . . . . . c19602_2mgt 1 . 20 . 10753 . 2 1 16 GLN O O 10.605 4.455 3.179 . . . 1.0 . . . . . . . . . . . . B . 15 GLN O . . . . . . . . . c19602_2mgt 1 . 20 . 10754 . 2 1 16 GLN OE1 O 12.193 -0.953 2.010 . . . 1.0 . . . . . . . . . . . . B . 15 GLN OE1 . . . . . . . . . c19602_2mgt 1 . 20 . 10755 . 2 1 17 LYS C C 13.979 4.517 3.629 . . . 1.0 . . . . . . . . . . . . B . 16 LYS C . . . . . . . . . c19602_2mgt 1 . 20 . 10756 . 2 1 17 LYS CA C 12.992 4.854 4.744 . . . 1.0 . . . . . . . . . . . . B . 16 LYS CA . . . . . . . . . c19602_2mgt 1 . 20 . 10757 . 2 1 17 LYS CB C 13.757 4.999 6.067 . . . 1.0 . . . . . . . . . . . . B . 16 LYS CB . . . . . . . . . c19602_2mgt 1 . 20 . 10758 . 2 1 17 LYS CD C 13.625 5.746 8.489 . . . 1.0 . . . . . . . . . . . . B . 16 LYS CD . . . . . . . . . c19602_2mgt 1 . 20 . 10759 . 2 1 17 LYS CE C 14.527 6.972 8.363 . . . 1.0 . . . . . . . . . . . . B . 16 LYS CE . . . . . . . . . c19602_2mgt 1 . 20 . 10760 . 2 1 17 LYS CG C 12.845 5.481 7.202 . . . 1.0 . . . . . . . . . . . . B . 16 LYS CG . . . . . . . . . c19602_2mgt 1 . 20 . 10761 . 2 1 17 LYS H H 12.143 3.101 5.549 . . . 1.0 . . . . . . . . . . . . B . 16 LYS H . . . . . . . . . c19602_2mgt 1 . 20 . 10762 . 2 1 17 LYS HA H 12.516 5.808 4.516 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HA . . . . . . . . . c19602_2mgt 1 . 20 . 10763 . 2 1 17 LYS HB2 H 14.206 4.042 6.339 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HB2 . . . . . . . . . c19602_2mgt 1 . 20 . 10764 . 2 1 17 LYS HB3 H 14.562 5.721 5.922 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HB3 . . . . . . . . . c19602_2mgt 1 . 20 . 10765 . 2 1 17 LYS HD2 H 12.908 5.910 9.292 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HD2 . . . . . . . . . c19602_2mgt 1 . 20 . 10766 . 2 1 17 LYS HD3 H 14.237 4.877 8.734 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HD3 . . . . . . . . . c19602_2mgt 1 . 20 . 10767 . 2 1 17 LYS HE2 H 15.295 6.781 7.612 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HE2 . . . . . . . . . c19602_2mgt 1 . 20 . 10768 . 2 1 17 LYS HE3 H 13.934 7.834 8.059 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HE3 . . . . . . . . . c19602_2mgt 1 . 20 . 10769 . 2 1 17 LYS HG2 H 12.337 6.395 6.903 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HG2 . . . . . . . . . c19602_2mgt 1 . 20 . 10770 . 2 1 17 LYS HG3 H 12.086 4.730 7.408 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HG3 . . . . . . . . . c19602_2mgt 1 . 20 . 10771 . 2 1 17 LYS HZ1 H 15.714 6.454 9.935 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HZ1 . . . . . . . . . c19602_2mgt 1 . 20 . 10772 . 2 1 17 LYS HZ2 H 15.798 8.049 9.551 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HZ2 . . . . . . . . . c19602_2mgt 1 . 20 . 10773 . 2 1 17 LYS HZ3 H 14.480 7.456 10.351 . . . 1.0 . . . . . . . . . . . . B . 16 LYS HZ3 . . . . . . . . . c19602_2mgt 1 . 20 . 10774 . 2 1 17 LYS N N 11.970 3.819 4.862 . . . 1.0 . . . . . . . . . . . . B . 16 LYS N . . . . . . . . . c19602_2mgt 1 . 20 . 10775 . 2 1 17 LYS NZ N 15.174 7.261 9.647 . . . 1.0 . . . . . . . . . . . . B . 16 LYS NZ . . . . . . . . . c19602_2mgt 1 . 20 . 10776 . 2 1 17 LYS O O 14.170 3.362 3.267 . . . 1.0 . . . . . . . . . . . . B . 16 LYS O . . . . . . . . . c19602_2mgt 1 . 20 . 10777 . 2 1 18 NH2 HN1 H 15.348 5.351 2.392 . . . 1.0 . . . . . . . . . . . . B . 17 NH2 HN1 . . . . . . . . . c19602_2mgt 1 . 20 . 10778 . 2 1 18 NH2 HN2 H 14.518 6.467 3.455 . . . 1.0 . . . . . . . . . . . . B . 17 NH2 HN2 . . . . . . . . . c19602_2mgt 1 . 20 . 10779 . 2 1 18 NH2 N N 14.654 5.530 3.105 . . . 1.0 . . . . . . . . . . . . B . 17 NH2 N . . . . . . . . . c19602_2mgt 1 . 20 . 10780 . 3 2 1 ZN ZN Zn 0.711 0.555 1.767 . . . 1.0 . . . . . . . . . . . . A . 101 ZN ZN . . . . . . . . . c19602_2mgt 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 c19602_2mgt _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 2mgt.mr . . 'MR format' 1 comment 'Not applicable' 'Not applicable' 0 c19602_2mgt 1 1 2mgt.mr . . XPLOR/CNS 2 distance NOE simple 358 c19602_2mgt 1 1 2mgt.mr . . XPLOR/CNS 3 distance 'general distance' simple 6 c19602_2mgt 1 1 2mgt.mr . . XPLOR/CNS 4 'dihedral angle' 'Not applicable' 'Not applicable' 20 c19602_2mgt 1 1 2mgt.mr . . 'MR format' 5 'nomenclature mapping' 'Not applicable' 'Not applicable' 0 c19602_2mgt 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 c19602_2mgt _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 . . . . c19602_2mgt 1 stop_ loop_ _Gen_dist_constraint.ID _Gen_dist_constraint.Member_ID _Gen_dist_constraint.Member_logic_code _Gen_dist_constraint.Assembly_atom_ID_1 _Gen_dist_constraint.Entity_assembly_ID_1 _Gen_dist_constraint.Entity_ID_1 _Gen_dist_constraint.Comp_index_ID_1 _Gen_dist_constraint.Seq_ID_1 _Gen_dist_constraint.Comp_ID_1 _Gen_dist_constraint.Atom_ID_1 _Gen_dist_constraint.Atom_type_1 _Gen_dist_constraint.Atom_isotope_number_1 _Gen_dist_constraint.Resonance_ID_1 _Gen_dist_constraint.Assembly_atom_ID_2 _Gen_dist_constraint.Entity_assembly_ID_2 _Gen_dist_constraint.Entity_ID_2 _Gen_dist_constraint.Comp_index_ID_2 _Gen_dist_constraint.Seq_ID_2 _Gen_dist_constraint.Comp_ID_2 _Gen_dist_constraint.Atom_ID_2 _Gen_dist_constraint.Atom_type_2 _Gen_dist_constraint.Atom_isotope_number_2 _Gen_dist_constraint.Resonance_ID_2 _Gen_dist_constraint.Intensity_val _Gen_dist_constraint.Intensity_lower_val_err _Gen_dist_constraint.Intensity_upper_val_err _Gen_dist_constraint.Distance_val _Gen_dist_constraint.Distance_lower_bound_val _Gen_dist_constraint.Distance_upper_bound_val _Gen_dist_constraint.Contribution_fractional_val _Gen_dist_constraint.Spectral_peak_ID _Gen_dist_constraint.Spectral_peak_list_ID _Gen_dist_constraint.PDB_record_ID_1 _Gen_dist_constraint.PDB_model_num_1 _Gen_dist_constraint.PDB_strand_ID_1 _Gen_dist_constraint.PDB_ins_code_1 _Gen_dist_constraint.PDB_residue_no_1 _Gen_dist_constraint.PDB_residue_name_1 _Gen_dist_constraint.PDB_atom_name_1 _Gen_dist_constraint.PDB_record_ID_2 _Gen_dist_constraint.PDB_model_num_2 _Gen_dist_constraint.PDB_strand_ID_2 _Gen_dist_constraint.PDB_ins_code_2 _Gen_dist_constraint.PDB_residue_no_2 _Gen_dist_constraint.PDB_residue_name_2 _Gen_dist_constraint.PDB_atom_name_2 _Gen_dist_constraint.Auth_entity_assembly_ID_1 _Gen_dist_constraint.Auth_asym_ID_1 _Gen_dist_constraint.Auth_chain_ID_1 _Gen_dist_constraint.Auth_seq_ID_1 _Gen_dist_constraint.Auth_comp_ID_1 _Gen_dist_constraint.Auth_atom_ID_1 _Gen_dist_constraint.Auth_alt_ID_1 _Gen_dist_constraint.Auth_atom_name_1 _Gen_dist_constraint.Auth_entity_assembly_ID_2 _Gen_dist_constraint.Auth_asym_ID_2 _Gen_dist_constraint.Auth_chain_ID_2 _Gen_dist_constraint.Auth_seq_ID_2 _Gen_dist_constraint.Auth_comp_ID_2 _Gen_dist_constraint.Auth_atom_ID_2 _Gen_dist_constraint.Auth_alt_ID_2 _Gen_dist_constraint.Auth_atom_name_2 _Gen_dist_constraint.Entry_ID _Gen_dist_constraint.Gen_dist_constraint_list_ID 1 1 OR . 1 1 13 13 VAL HA H . . . 1 1 6 6 ARG HD2 H . . . . . 5.0 0.0 5.0 . . . . . A . 12 VAL HA . . A . 5 ARG HD2 . A . 12 . HA . . . A . 5 . HD* . . c19602_2mgt 1 1 2 OR . 1 1 6 6 ARG HD3 H . . . 1 1 13 13 VAL HA H . . . . . 5.0 0.0 5.0 . . . . . A . 5 ARG HD3 . . A . 12 VAL HA . A . 5 . HD* . . . A . 12 . HA . . c19602_2mgt 1 2 1 . . 1 1 13 13 VAL HA H . . . 1 1 5 5 PHE QD H . . . . . 5.5 0.0 5.5 . . . . . A . 12 VAL HA . . A . 4 PHE QD . A . 12 . HA . . . A . 4 . HD* . . c19602_2mgt 1 3 1 . . 1 1 11 11 TYR QD H . . . 1 1 16 16 GLN HB2 H . . . . . 5.5 0.0 5.5 . . . . . A . 10 TYR QD . . A . 15 GLN HB2 . A . 10 . HD* . . . A . 15 . HB1 . . c19602_2mgt 1 4 1 OR . 1 1 11 11 TYR QD H . . . 1 1 16 16 GLN HG2 H . . . . . 5.5 0.0 5.5 . . . . . A . 10 TYR QD . . A . 15 GLN HG2 . A . 10 . HD* . . . A . 15 . HG* . . c19602_2mgt 1 4 2 OR . 1 1 11 11 TYR QD H . . . 1 1 16 16 GLN HG3 H . . . . . 5.5 0.0 5.5 . . . . . A . 10 TYR QD . . A . 15 GLN HG3 . A . 10 . HD* . . . A . 15 . HG* . . c19602_2mgt 1 5 1 . . 1 1 13 13 VAL HA H . . . 1 1 11 11 TYR HB2 H . . . . . 5.5 0.0 5.5 . . . . . A . 12 VAL HA . . A . 10 TYR HB2 . A . 12 . HA . . . A . 10 . HB2 . . c19602_2mgt 1 6 1 . . 1 1 13 13 VAL HA H . . . 1 1 11 11 TYR HB2 H . . . . . 4.5 0.0 4.5 . . . . . A . 12 VAL HA . . A . 10 TYR HB2 . A . 12 . HA . . . A . 10 . HB1 . . c19602_2mgt 1 7 1 . . 1 1 5 5 PHE H H . . . 1 1 2 2 ASP HB2 H . . . . . 4.5 0.0 4.5 . . . . . A . 4 PHE H . . A . 1 ASP HB2 . A . 4 . H . . . A . 1 . HB1 . . c19602_2mgt 1 8 1 . . 1 1 5 5 PHE QD H . . . 1 1 2 2 ASP HB2 H . . . . . 4.5 0.0 4.5 . . . . . A . 4 PHE QD . . A . 1 ASP HB2 . A . 4 . HD* . . . A . 1 . HB1 . . c19602_2mgt 1 9 1 . . 1 1 5 5 PHE H H . . . 1 1 3 3 ALA MB H . . . . . 4.5 0.0 4.5 . . . . . A . 4 PHE H . . A . 2 ALA MB . A . 4 . H . . . A . 2 . HB* . . c19602_2mgt 1 10 1 OR . 1 1 3 3 ALA MB H . . . 1 1 7 7 ARG HD2 H . . . . . 5.5 0.0 5.5 . . . . . A . 2 ALA MB . . A . 6 ARG HD2 . A . 2 . HB* . . . A . 6 . HD* . . c19602_2mgt 1 10 2 OR . 1 1 3 3 ALA MB H . . . 1 1 7 7 ARG HD3 H . . . . . 5.5 0.0 5.5 . . . . . A . 2 ALA MB . . A . 6 ARG HD3 . A . 2 . HB* . . . A . 6 . HD* . . c19602_2mgt 1 11 1 . . 1 1 4 4 GLU HG2 H . . . 1 1 7 7 ARG HE H . . . . . 5.5 0.0 5.5 . . . . . A . 3 GLU HG2 . . A . 6 ARG HE . A . 3 . HG2 . . . A . 6 . HE . . c19602_2mgt 1 12 1 . . 1 1 4 4 GLU HG2 H . . . 1 1 7 7 ARG HE H . . . . . 6.0 0.0 6.0 . . . . . A . 3 GLU HG2 . . A . 6 ARG HE . A . 3 . HG1 . . . A . 6 . HE . . c19602_2mgt 1 13 1 . . 1 1 7 7 ARG HE H . . . 1 1 5 5 PHE HA H . . . . . 4.5 0.0 4.5 . . . . . A . 6 ARG HE . . A . 4 PHE HA . A . 6 . HE . . . A . 4 . HA . . c19602_2mgt 1 14 1 . . 1 1 5 5 PHE QD H . . . 1 1 7 7 ARG H H . . . . . 5.0 0.0 5.0 . . . . . A . 4 PHE QD . . A . 6 ARG H . A . 4 . HD* . . . A . 6 . H . . c19602_2mgt 1 15 1 . . 1 1 5 5 PHE QD H . . . 1 1 7 7 ARG HG2 H . . . . . 5.0 0.0 5.0 . . . . . A . 4 PHE QD . . A . 6 ARG HG2 . A . 4 . HD* . . . A . 6 . HG2 . . c19602_2mgt 1 16 1 . . 1 1 5 5 PHE HA H . . . 1 1 7 7 ARG HG2 H . . . . . 5.5 0.0 5.5 . . . . . A . 4 PHE HA . . A . 6 ARG HG2 . A . 4 . HA . . . A . 6 . HG2 . . c19602_2mgt 1 17 1 . . 1 1 5 5 PHE QD H . . . 1 1 7 7 ARG HB2 H . . . . . 6.0 0.0 6.0 . . . . . A . 4 PHE QD . . A . 6 ARG HB2 . A . 4 . HD* . . . A . 6 . HB2 . . c19602_2mgt 1 18 1 . . 1 1 7 7 ARG HB2 H . . . 1 1 11 11 TYR QE H . . . . . 4.5 0.0 4.5 . . . . . A . 6 ARG HB2 . . A . 10 TYR QE . A . 6 . HB2 . . . A . 10 . HE* . . c19602_2mgt 1 19 1 . . 1 1 7 7 ARG HG2 H . . . 1 1 11 11 TYR QE H . . . . . 4.5 0.0 4.5 . . . . . A . 6 ARG HG2 . . A . 10 TYR QE . A . 6 . HG2 . . . A . 10 . HE* . . c19602_2mgt 1 20 1 . . 1 1 11 11 TYR QD H . . . 1 1 9 9 SER HA H . . . . . 6.0 0.0 6.0 . . . . . A . 10 TYR QD . . A . 8 SER HA . A . 10 . HD* . . . A . 8 . HA . . c19602_2mgt 1 21 1 OR . 1 1 14 14 HIS H H . . . 1 1 12 12 GLU HG2 H . . . . . 5.0 0.0 5.0 . . . . . A . 13 HIS H . . A . 11 GLU HG2 . A . 13 . H . . . A . 11 . HG* . . c19602_2mgt 1 21 2 OR . 1 1 12 12 GLU HG3 H . . . 1 1 14 14 HIS H H . . . . . 5.0 0.0 5.0 . . . . . A . 11 GLU HG3 . . A . 13 HIS H . A . 11 . HG* . . . A . 13 . H . . c19602_2mgt 1 22 1 . . 1 1 14 14 HIS H H . . . 1 1 12 12 GLU HA H . . . . . 4.0 0.0 4.0 . . . . . A . 13 HIS H . . A . 11 GLU HA . A . 13 . H . . . A . 11 . HA . . c19602_2mgt 1 23 1 OR . 1 1 11 11 TYR QE H . . . 1 1 10 10 GLY HA2 H . . . . . 3.5 0.0 3.5 . . . . . A . 10 TYR QE . . A . 9 GLY HA2 . A . 10 . HE* . . . A . 9 . HA* . . c19602_2mgt 1 23 2 OR . 1 1 11 11 TYR QE H . . . 1 1 10 10 GLY HA3 H . . . . . 3.5 0.0 3.5 . . . . . A . 10 TYR QE . . A . 9 GLY HA3 . A . 10 . HE* . . . A . 9 . HA* . . c19602_2mgt 1 24 1 . . 1 1 11 11 TYR QD H . . . 1 1 13 13 VAL MG1 H . . . . . 4.5 0.0 4.5 . . . . . A . 10 TYR QD . . A . 12 VAL MG1 . A . 10 . HD* . . . A . 12 . HG1* . . c19602_2mgt 1 25 1 . . 1 1 11 11 TYR QD H . . . 1 1 13 13 VAL MG2 H . . . . . 5.5 0.0 5.5 . . . . . A . 10 TYR QD . . A . 12 VAL MG2 . A . 10 . HD* . . . A . 12 . HG2* . . c19602_2mgt 1 26 1 . . 1 1 11 11 TYR QE H . . . 1 1 13 13 VAL MG1 H . . . . . 4.5 0.0 4.5 . . . . . A . 10 TYR QE . . A . 12 VAL MG1 . A . 10 . HE* . . . A . 12 . HG1* . . c19602_2mgt 1 27 1 . . 1 1 11 11 TYR QE H . . . 1 1 13 13 VAL MG2 H . . . . . 4.5 0.0 4.5 . . . . . A . 10 TYR QE . . A . 12 VAL MG2 . A . 10 . HE* . . . A . 12 . HG2* . . c19602_2mgt 1 28 1 . . 1 1 13 13 VAL H H . . . 1 1 15 15 HIS H H . . . . . 4.5 0.0 4.5 . . . . . A . 12 VAL H . . A . 14 HIS H . A . 12 . H . . . A . 14 . H . . c19602_2mgt 1 29 1 . . 1 1 2 2 ASP HB2 H . . . 1 1 3 3 ALA H H . . . . . 4.5 0.0 4.5 . . . . . A . 1 ASP HB2 . . A . 2 ALA H . A . 1 . HB2 . . . A . 2 . H . . c19602_2mgt 1 30 1 . . 1 1 3 3 ALA H H . . . 1 1 2 2 ASP HA H . . . . . 3.5 0.0 3.5 . . . . . A . 2 ALA H . . A . 1 ASP HA . A . 2 . H . . . A . 1 . HA . . c19602_2mgt 1 31 1 . . 1 1 2 2 ASP HB2 H . . . 1 1 3 3 ALA H H . . . . . 3.5 0.0 3.5 . . . . . A . 1 ASP HB2 . . A . 2 ALA H . A . 1 . HB1 . . . A . 2 . H . . c19602_2mgt 1 32 1 . . 1 1 3 3 ALA MB H . . . 1 1 2 2 ASP HA H . . . . . 5.5 0.0 5.5 . . . . . A . 2 ALA MB . . A . 1 ASP HA . A . 2 . HB* . . . A . 1 . HA . . c19602_2mgt 1 33 1 . . 1 1 3 3 ALA MB H . . . 1 1 2 2 ASP HB2 H . . . . . 5.5 0.0 5.5 . . . . . A . 2 ALA MB . . A . 1 ASP HB2 . A . 2 . HB* . . . A . 1 . HB1 . . c19602_2mgt 1 34 1 . . 1 1 3 3 ALA MB H . . . 1 1 4 4 GLU HG2 H . . . . . 5.5 0.0 5.5 . . . . . A . 2 ALA MB . . A . 3 GLU HG2 . A . 2 . HB* . . . A . 3 . HG1 . . c19602_2mgt 1 35 1 . . 1 1 3 3 ALA HA H . . . 1 1 4 4 GLU H H . . . . . 3.5 0.0 3.5 . . . . . A . 2 ALA HA . . A . 3 GLU H . A . 2 . HA . . . A . 3 . H . . c19602_2mgt 1 36 1 . . 1 1 3 3 ALA MB H . . . 1 1 4 4 GLU HG2 H . . . . . 4.0 0.0 4.0 . . . . . A . 2 ALA MB . . A . 3 GLU HG2 . A . 2 . HB* . . . A . 3 . HG2 . . c19602_2mgt 1 37 1 . . 1 1 3 3 ALA MB H . . . 1 1 4 4 GLU H H . . . . . 3.5 0.0 3.5 . . . . . A . 2 ALA MB . . A . 3 GLU H . A . 2 . HB* . . . A . 3 . H . . c19602_2mgt 1 38 1 . . 1 1 5 5 PHE QD H . . . 1 1 4 4 GLU HG2 H . . . . . 4.5 0.0 4.5 . . . . . A . 4 PHE QD . . A . 3 GLU HG2 . A . 4 . HD* . . . A . 3 . HG1 . . c19602_2mgt 1 39 1 . . 1 1 5 5 PHE H H . . . 1 1 4 4 GLU HA H . . . . . 3.5 0.0 3.5 . . . . . A . 4 PHE H . . A . 3 GLU HA . A . 4 . H . . . A . 3 . HA . . c19602_2mgt 1 40 1 . . 1 1 5 5 PHE QD H . . . 1 1 4 4 GLU HA H . . . . . 5.0 0.0 5.0 . . . . . A . 4 PHE QD . . A . 3 GLU HA . A . 4 . HD* . . . A . 3 . HA . . c19602_2mgt 1 41 1 . . 1 1 5 5 PHE H H . . . 1 1 4 4 GLU HG2 H . . . . . 5.5 0.0 5.5 . . . . . A . 4 PHE H . . A . 3 GLU HG2 . A . 4 . H . . . A . 3 . HG2 . . c19602_2mgt 1 42 1 OR . 1 1 5 5 PHE H H . . . 1 1 4 4 GLU HB2 H . . . . . 3.5 0.0 3.5 . . . . . A . 4 PHE H . . A . 3 GLU HB2 . A . 4 . H . . . A . 3 . HB* . . c19602_2mgt 1 42 2 OR . 1 1 5 5 PHE H H . . . 1 1 4 4 GLU HB3 H . . . . . 3.5 0.0 3.5 . . . . . A . 4 PHE H . . A . 3 GLU HB3 . A . 4 . H . . . A . 3 . HB* . . c19602_2mgt 1 43 1 OR . 1 1 5 5 PHE QD H . . . 1 1 4 4 GLU HB2 H . . . . . 4.5 0.0 4.5 . . . . . A . 4 PHE QD . . A . 3 GLU HB2 . A . 4 . HD* . . . A . 3 . HB* . . c19602_2mgt 1 43 2 OR . 1 1 5 5 PHE QD H . . . 1 1 4 4 GLU HB3 H . . . . . 4.5 0.0 4.5 . . . . . A . 4 PHE QD . . A . 3 GLU HB3 . A . 4 . HD* . . . A . 3 . HB* . . c19602_2mgt 1 44 1 . . 1 1 5 5 PHE QD H . . . 1 1 4 4 GLU HG2 H . . . . . 5.5 0.0 5.5 . . . . . A . 4 PHE QD . . A . 3 GLU HG2 . A . 4 . HD* . . . A . 3 . HG2 . . c19602_2mgt 1 45 1 . . 1 1 5 5 PHE HA H . . . 1 1 4 4 GLU HA H . . . . . 5.5 0.0 5.5 . . . . . A . 4 PHE HA . . A . 3 GLU HA . A . 4 . HA . . . A . 3 . HA . . c19602_2mgt 1 46 1 . . 1 1 5 5 PHE H H . . . 1 1 4 4 GLU HG2 H . . . . . 3.5 0.0 3.5 . . . . . A . 4 PHE H . . A . 3 GLU HG2 . A . 4 . H . . . A . 3 . HG1 . . c19602_2mgt 1 47 1 . . 1 1 4 4 GLU H H . . . 1 1 5 5 PHE QE H . . . . . 5.5 0.0 5.5 . . . . . A . 3 GLU H . . A . 4 PHE QE . A . 3 . H . . . A . 4 . HE* . . c19602_2mgt 1 48 1 . . 1 1 5 5 PHE QD H . . . 1 1 4 4 GLU H H . . . . . 5.5 0.0 5.5 . . . . . A . 4 PHE QD . . A . 3 GLU H . A . 4 . HD* . . . A . 3 . H . . c19602_2mgt 1 49 1 . . 1 1 5 5 PHE H H . . . 1 1 4 4 GLU H H . . . . . 3.5 0.0 3.5 . . . . . A . 4 PHE H . . A . 3 GLU H . A . 4 . H . . . A . 3 . H . . c19602_2mgt 1 50 1 . . 1 1 5 5 PHE HA H . . . 1 1 6 6 ARG H H . . . . . 3.5 0.0 3.5 . . . . . A . 4 PHE HA . . A . 5 ARG H . A . 4 . HA . . . A . 5 . H . . c19602_2mgt 1 51 1 . . 1 1 5 5 PHE HA H . . . 1 1 6 6 ARG HB2 H . . . . . 5.5 0.0 5.5 . . . . . A . 4 PHE HA . . A . 5 ARG HB2 . A . 4 . HA . . . A . 5 . HB2 . . c19602_2mgt 1 52 1 . . 1 1 7 7 ARG H H . . . 1 1 6 6 ARG HA H . . . . . 3.5 0.0 3.5 . . . . . A . 6 ARG H . . A . 5 ARG HA . A . 6 . H . . . A . 5 . HA . . c19602_2mgt 1 53 1 . . 1 1 7 7 ARG HA H . . . 1 1 8 8 ASP H H . . . . . 3.5 0.0 3.5 . . . . . A . 6 ARG HA . . A . 7 ASP H . A . 6 . HA . . . A . 7 . H . . c19602_2mgt 1 54 1 . . 1 1 7 7 ARG HA H . . . 1 1 8 8 ASP HA H . . . . . 5.5 0.0 5.5 . . . . . A . 6 ARG HA . . A . 7 ASP HA . A . 6 . HA . . . A . 7 . HA . . c19602_2mgt 1 55 1 . . 1 1 8 8 ASP HA H . . . 1 1 9 9 SER H H . . . . . 3.5 0.0 3.5 . . . . . A . 7 ASP HA . . A . 8 SER H . A . 7 . HA . . . A . 8 . H . . c19602_2mgt 1 56 1 OR . 1 1 9 9 SER H H . . . 1 1 8 8 ASP HB2 H . . . . . 3.5 0.0 3.5 . . . . . A . 8 SER H . . A . 7 ASP HB2 . A . 8 . H . . . A . 7 . HB* . . c19602_2mgt 1 56 2 OR . 1 1 9 9 SER H H . . . 1 1 8 8 ASP HB3 H . . . . . 3.5 0.0 3.5 . . . . . A . 8 SER H . . A . 7 ASP HB3 . A . 8 . H . . . A . 7 . HB* . . c19602_2mgt 1 57 1 . . 1 1 9 9 SER HA H . . . 1 1 10 10 GLY H H . . . . . 4.5 0.0 4.5 . . . . . A . 8 SER HA . . A . 9 GLY H . A . 8 . HA . . . A . 9 . H . . c19602_2mgt 1 58 1 OR . 1 1 11 11 TYR H H . . . 1 1 10 10 GLY HA2 H . . . . . 3.5 0.0 3.5 . . . . . A . 10 TYR H . . A . 9 GLY HA2 . A . 10 . H . . . A . 9 . HA* . . c19602_2mgt 1 58 2 OR . 1 1 10 10 GLY HA3 H . . . 1 1 11 11 TYR H H . . . . . 3.5 0.0 3.5 . . . . . A . 9 GLY HA3 . . A . 10 TYR H . A . 9 . HA* . . . A . 10 . H . . c19602_2mgt 1 59 1 . . 1 1 10 10 GLY H H . . . 1 1 11 11 TYR H H . . . . . 4.0 0.0 4.0 . . . . . A . 9 GLY H . . A . 10 TYR H . A . 9 . H . . . A . 10 . H . . c19602_2mgt 1 60 1 . . 1 1 11 11 TYR HB2 H . . . 1 1 12 12 GLU H H . . . . . 3.5 0.0 3.5 . . . . . A . 10 TYR HB2 . . A . 11 GLU H . A . 10 . HB1 . . . A . 11 . H . . c19602_2mgt 1 61 1 . . 1 1 11 11 TYR HB2 H . . . 1 1 12 12 GLU H H . . . . . 4.5 0.0 4.5 . . . . . A . 10 TYR HB2 . . A . 11 GLU H . A . 10 . HB2 . . . A . 11 . H . . c19602_2mgt 1 62 1 . . 1 1 11 11 TYR QD H . . . 1 1 12 12 GLU H H . . . . . 4.5 0.0 4.5 . . . . . A . 10 TYR QD . . A . 11 GLU H . A . 10 . HD* . . . A . 11 . H . . c19602_2mgt 1 63 1 . . 1 1 11 11 TYR QE H . . . 1 1 12 12 GLU H H . . . . . 4.0 0.0 4.0 . . . . . A . 10 TYR QE . . A . 11 GLU H . A . 10 . HE* . . . A . 11 . H . . c19602_2mgt 1 64 1 . . 1 1 11 11 TYR H H . . . 1 1 12 12 GLU H H . . . . . 4.5 0.0 4.5 . . . . . A . 10 TYR H . . A . 11 GLU H . A . 10 . H . . . A . 11 . H . . c19602_2mgt 1 65 1 . . 1 1 12 12 GLU H H . . . 1 1 11 11 TYR HA H . . . . . 2.5 0.0 2.5 . . . . . A . 11 GLU H . . A . 10 TYR HA . A . 11 . H . . . A . 10 . HA . . c19602_2mgt 1 66 1 . . 1 1 11 11 TYR H H . . . 1 1 12 12 GLU HB2 H . . . . . 6.0 0.0 6.0 . . . . . A . 10 TYR H . . A . 11 GLU HB2 . A . 10 . H . . . A . 11 . HB1 . . c19602_2mgt 1 67 1 . . 1 1 12 12 GLU HA H . . . 1 1 11 11 TYR H H . . . . . 4.5 0.0 4.5 . . . . . A . 11 GLU HA . . A . 10 TYR H . A . 11 . HA . . . A . 10 . H . . c19602_2mgt 1 68 1 . . 1 1 11 11 TYR QD H . . . 1 1 12 12 GLU HB2 H . . . . . 5.5 0.0 5.5 . . . . . A . 10 TYR QD . . A . 11 GLU HB2 . A . 10 . HD* . . . A . 11 . HB2 . . c19602_2mgt 1 69 1 . . 1 1 11 11 TYR QD H . . . 1 1 12 12 GLU HB2 H . . . . . 4.5 0.0 4.5 . . . . . A . 10 TYR QD . . A . 11 GLU HB2 . A . 10 . HD* . . . A . 11 . HB1 . . c19602_2mgt 1 70 1 . . 1 1 11 11 TYR H H . . . 1 1 12 12 GLU HB2 H . . . . . 5.5 0.0 5.5 . . . . . A . 10 TYR H . . A . 11 GLU HB2 . A . 10 . H . . . A . 11 . HB2 . . c19602_2mgt 1 71 1 . . 1 1 11 11 TYR QE H . . . 1 1 12 12 GLU HB2 H . . . . . 6.0 0.0 6.0 . . . . . A . 10 TYR QE . . A . 11 GLU HB2 . A . 10 . HE* . . . A . 11 . HB1 . . c19602_2mgt 1 72 1 . . 1 1 12 12 GLU HA H . . . 1 1 13 13 VAL H H . . . . . 3.5 0.0 3.5 . . . . . A . 11 GLU HA . . A . 12 VAL H . A . 11 . HA . . . A . 12 . H . . c19602_2mgt 1 73 1 . . 1 1 13 13 VAL HA H . . . 1 1 14 14 HIS H H . . . . . 3.5 0.0 3.5 . . . . . A . 12 VAL HA . . A . 13 HIS H . A . 12 . HA . . . A . 13 . H . . c19602_2mgt 1 74 1 . . 1 1 14 14 HIS H H . . . 1 1 13 13 VAL HB H . . . . . 3.5 0.0 3.5 . . . . . A . 13 HIS H . . A . 12 VAL HB . A . 13 . H . . . A . 12 . HB . . c19602_2mgt 1 75 1 . . 1 1 13 13 VAL MG2 H . . . 1 1 14 14 HIS HA H . . . . . 5.5 0.0 5.5 . . . . . A . 12 VAL MG2 . . A . 13 HIS HA . A . 12 . HG2* . . . A . 13 . HA . . c19602_2mgt 1 76 1 . . 1 1 13 13 VAL MG1 H . . . 1 1 14 14 HIS HA H . . . . . 5.0 0.0 5.0 . . . . . A . 12 VAL MG1 . . A . 13 HIS HA . A . 12 . HG1* . . . A . 13 . HA . . c19602_2mgt 1 77 1 . . 1 1 13 13 VAL HA H . . . 1 1 14 14 HIS HA H . . . . . 4.5 0.0 4.5 . . . . . A . 12 VAL HA . . A . 13 HIS HA . A . 12 . HA . . . A . 13 . HA . . c19602_2mgt 1 78 1 . . 1 1 15 15 HIS HA H . . . 1 1 16 16 GLN H H . . . . . 3.5 0.0 3.5 . . . . . A . 14 HIS HA . . A . 15 GLN H . A . 14 . HA . . . A . 15 . H . . c19602_2mgt 1 79 1 . . 1 1 15 15 HIS H H . . . 1 1 16 16 GLN H H . . . . . 3.5 0.0 3.5 . . . . . A . 14 HIS H . . A . 15 GLN H . A . 14 . H . . . A . 15 . H . . c19602_2mgt 1 80 1 . . 1 1 16 16 GLN HA H . . . 1 1 17 17 LYS H H . . . . . 4.5 0.0 4.5 . . . . . A . 15 GLN HA . . A . 16 LYS H . A . 15 . HA . . . A . 16 . H . . c19602_2mgt 1 81 1 . . 1 1 17 17 LYS H H . . . 1 1 16 16 GLN HB2 H . . . . . 3.5 0.0 3.5 . . . . . A . 16 LYS H . . A . 15 GLN HB2 . A . 16 . H . . . A . 15 . HB1 . . c19602_2mgt 1 82 1 . . 1 1 17 17 LYS H H . . . 1 1 16 16 GLN HB2 H . . . . . 3.5 0.0 3.5 . . . . . A . 16 LYS H . . A . 15 GLN HB2 . A . 16 . H . . . A . 15 . HB2 . . c19602_2mgt 1 83 1 OR . 1 1 16 16 GLN HG3 H . . . 1 1 17 17 LYS HG2 H . . . . . 6.0 0.0 6.0 . . . . . A . 15 GLN HG3 . . A . 16 LYS HG2 . A . 15 . HG* . . . A . 16 . HG1 . . c19602_2mgt 1 83 2 OR . 1 1 17 17 LYS HG2 H . . . 1 1 16 16 GLN HG2 H . . . . . 6.0 0.0 6.0 . . . . . A . 16 LYS HG2 . . A . 15 GLN HG2 . A . 16 . HG1 . . . A . 15 . HG* . . c19602_2mgt 1 84 1 . . 1 1 2 2 ASP HB2 H . . . 1 1 2 2 ASP HA H . . . . . 3.5 0.0 3.5 . . . . . A . 1 ASP HB2 . . A . 1 ASP HA . A . 1 . HB1 . . . A . 1 . HA . . c19602_2mgt 1 85 1 OR . 1 1 4 4 GLU HA H . . . 1 1 4 4 GLU HB2 H . . . . . 3.5 0.0 3.5 . . . . . A . 3 GLU HA . . A . 3 GLU HB2 . A . 3 . HA . . . A . 3 . HB* . . c19602_2mgt 1 85 2 OR . 1 1 4 4 GLU HA H . . . 1 1 4 4 GLU HB3 H . . . . . 3.5 0.0 3.5 . . . . . A . 3 GLU HA . . A . 3 GLU HB3 . A . 3 . HA . . . A . 3 . HB* . . c19602_2mgt 1 86 1 OR . 1 1 5 5 PHE HA H . . . 1 1 5 5 PHE HB2 H . . . . . 3.5 0.0 3.5 . . . . . A . 4 PHE HA . . A . 4 PHE HB2 . A . 4 . HA . . . A . 4 . HB* . . c19602_2mgt 1 86 2 OR . 1 1 5 5 PHE HA H . . . 1 1 5 5 PHE HB3 H . . . . . 3.5 0.0 3.5 . . . . . A . 4 PHE HA . . A . 4 PHE HB3 . A . 4 . HA . . . A . 4 . HB* . . c19602_2mgt 1 87 1 . . 1 1 6 6 ARG HB2 H . . . 1 1 6 6 ARG HA H . . . . . 3.0 0.0 3.0 . . . . . A . 5 ARG HB2 . . A . 5 ARG HA . A . 5 . HB2 . . . A . 5 . HA . . c19602_2mgt 1 88 1 . . 1 1 7 7 ARG HB2 H . . . 1 1 7 7 ARG HA H . . . . . 3.0 0.0 3.0 . . . . . A . 6 ARG HB2 . . A . 6 ARG HA . A . 6 . HB2 . . . A . 6 . HA . . c19602_2mgt 1 89 1 . . 1 1 9 9 SER HA H . . . 1 1 9 9 SER HB2 H . . . . . 3.5 0.0 3.5 . . . . . A . 8 SER HA . . A . 8 SER HB2 . A . 8 . HA . . . A . 8 . HB1 . . c19602_2mgt 1 90 1 . . 1 1 9 9 SER HA H . . . 1 1 9 9 SER HB2 H . . . . . 3.5 0.0 3.5 . . . . . A . 8 SER HA . . A . 8 SER HB2 . A . 8 . HA . . . A . 8 . HB2 . . c19602_2mgt 1 91 1 . . 1 1 11 11 TYR HB2 H . . . 1 1 11 11 TYR HA H . . . . . 4.5 0.0 4.5 . . . . . A . 10 TYR HB2 . . A . 10 TYR HA . A . 10 . HB2 . . . A . 10 . HA . . c19602_2mgt 1 92 1 . . 1 1 11 11 TYR HB2 H . . . 1 1 11 11 TYR HA H . . . . . 3.5 0.0 3.5 . . . . . A . 10 TYR HB2 . . A . 10 TYR HA . A . 10 . HB1 . . . A . 10 . HA . . c19602_2mgt 1 93 1 . . 1 1 16 16 GLN HA H . . . 1 1 16 16 GLN HB2 H . . . . . 4.5 0.0 4.5 . . . . . A . 15 GLN HA . . A . 15 GLN HB2 . A . 15 . HA . . . A . 15 . HB2 . . c19602_2mgt 1 94 1 . . 1 1 16 16 GLN HA H . . . 1 1 16 16 GLN HB2 H . . . . . 2.5 0.0 2.5 . . . . . A . 15 GLN HA . . A . 15 GLN HB2 . A . 15 . HA . . . A . 15 . HB1 . . c19602_2mgt 1 95 1 . . 1 1 2 2 ASP HB2 H . . . 1 1 2 2 ASP H H . . . . . 3.5 0.0 3.5 . . . . . A . 1 ASP HB2 . . A . 1 ASP H . A . 1 . HB2 . . . A . 1 . H . . c19602_2mgt 1 96 1 . . 1 1 2 2 ASP HA H . . . 1 1 2 2 ASP H H . . . . . 3.5 0.0 3.5 . . . . . A . 1 ASP HA . . A . 1 ASP H . A . 1 . HA . . . A . 1 . H . . c19602_2mgt 1 97 1 . . 1 1 2 2 ASP HB2 H . . . 1 1 2 2 ASP H H . . . . . 3.5 0.0 3.5 . . . . . A . 1 ASP HB2 . . A . 1 ASP H . A . 1 . HB1 . . . A . 1 . H . . c19602_2mgt 1 98 1 . . 1 1 3 3 ALA H H . . . 1 1 3 3 ALA HA H . . . . . 3.5 0.0 3.5 . . . . . A . 2 ALA H . . A . 2 ALA HA . A . 2 . H . . . A . 2 . HA . . c19602_2mgt 1 99 1 . . 1 1 3 3 ALA MB H . . . 1 1 3 3 ALA H H . . . . . 3.5 0.0 3.5 . . . . . A . 2 ALA MB . . A . 2 ALA H . A . 2 . HB* . . . A . 2 . H . . c19602_2mgt 1 100 1 . . 1 1 4 4 GLU HG2 H . . . 1 1 4 4 GLU HA H . . . . . 4.5 0.0 4.5 . . . . . A . 3 GLU HG2 . . A . 3 GLU HA . A . 3 . HG1 . . . A . 3 . HA . . c19602_2mgt 1 101 1 . . 1 1 4 4 GLU HG2 H . . . 1 1 4 4 GLU H H . . . . . 4.5 0.0 4.5 . . . . . A . 3 GLU HG2 . . A . 3 GLU H . A . 3 . HG2 . . . A . 3 . H . . c19602_2mgt 1 102 1 . . 1 1 4 4 GLU HG2 H . . . 1 1 4 4 GLU HA H . . . . . 4.5 0.0 4.5 . . . . . A . 3 GLU HG2 . . A . 3 GLU HA . A . 3 . HG2 . . . A . 3 . HA . . c19602_2mgt 1 103 1 OR . 1 1 4 4 GLU H H . . . 1 1 4 4 GLU HB2 H . . . . . 3.5 0.0 3.5 . . . . . A . 3 GLU H . . A . 3 GLU HB2 . A . 3 . H . . . A . 3 . HB* . . c19602_2mgt 1 103 2 OR . 1 1 4 4 GLU H H . . . 1 1 4 4 GLU HB3 H . . . . . 3.5 0.0 3.5 . . . . . A . 3 GLU H . . A . 3 GLU HB3 . A . 3 . H . . . A . 3 . HB* . . c19602_2mgt 1 104 1 . . 1 1 4 4 GLU HG2 H . . . 1 1 4 4 GLU H H . . . . . 4.5 0.0 4.5 . . . . . A . 3 GLU HG2 . . A . 3 GLU H . A . 3 . HG1 . . . A . 3 . H . . c19602_2mgt 1 105 1 . . 1 1 4 4 GLU H H . . . 1 1 4 4 GLU HA H . . . . . 3.5 0.0 3.5 . . . . . A . 3 GLU H . . A . 3 GLU HA . A . 3 . H . . . A . 3 . HA . . c19602_2mgt 1 106 1 OR . 1 1 5 5 PHE H H . . . 1 1 5 5 PHE HB2 H . . . . . 2.5 0.0 2.5 . . . . . A . 4 PHE H . . A . 4 PHE HB2 . A . 4 . H . . . A . 4 . HB* . . c19602_2mgt 1 106 2 OR . 1 1 5 5 PHE H H . . . 1 1 5 5 PHE HB3 H . . . . . 2.5 0.0 2.5 . . . . . A . 4 PHE H . . A . 4 PHE HB3 . A . 4 . H . . . A . 4 . HB* . . c19602_2mgt 1 107 1 . . 1 1 5 5 PHE H H . . . 1 1 5 5 PHE QE H . . . . . 4.5 0.0 4.5 . . . . . A . 4 PHE H . . A . 4 PHE QE . A . 4 . H . . . A . 4 . HE* . . c19602_2mgt 1 108 1 . . 1 1 5 5 PHE QD H . . . 1 1 5 5 PHE H H . . . . . 3.5 0.0 3.5 . . . . . A . 4 PHE QD . . A . 4 PHE H . A . 4 . HD* . . . A . 4 . H . . c19602_2mgt 1 109 1 . . 1 1 5 5 PHE QD H . . . 1 1 5 5 PHE HA H . . . . . 3.5 0.0 3.5 . . . . . A . 4 PHE QD . . A . 4 PHE HA . A . 4 . HD* . . . A . 4 . HA . . c19602_2mgt 1 110 1 . . 1 1 5 5 PHE H H . . . 1 1 5 5 PHE HA H . . . . . 3.5 0.0 3.5 . . . . . A . 4 PHE H . . A . 4 PHE HA . A . 4 . H . . . A . 4 . HA . . c19602_2mgt 1 111 1 OR . 1 1 5 5 PHE QD H . . . 1 1 5 5 PHE HB2 H . . . . . 2.5 0.0 2.5 . . . . . A . 4 PHE QD . . A . 4 PHE HB2 . A . 4 . HD* . . . A . 4 . HB* . . c19602_2mgt 1 111 2 OR . 1 1 5 5 PHE QD H . . . 1 1 5 5 PHE HB3 H . . . . . 2.5 0.0 2.5 . . . . . A . 4 PHE QD . . A . 4 PHE HB3 . A . 4 . HD* . . . A . 4 . HB* . . c19602_2mgt 1 112 1 . . 1 1 6 6 ARG HG2 H . . . 1 1 6 6 ARG HE H . . . . . 4.5 0.0 4.5 . . . . . A . 5 ARG HG2 . . A . 5 ARG HE . A . 5 . HG2 . . . A . 5 . HE . . c19602_2mgt 1 113 1 . . 1 1 6 6 ARG HG2 H . . . 1 1 6 6 ARG HE H . . . . . 4.5 0.0 4.5 . . . . . A . 5 ARG HG2 . . A . 5 ARG HE . A . 5 . HG1 . . . A . 5 . HE . . c19602_2mgt 1 114 1 . . 1 1 6 6 ARG H H . . . 1 1 6 6 ARG HB2 H . . . . . 3.5 0.0 3.5 . . . . . A . 5 ARG H . . A . 5 ARG HB2 . A . 5 . H . . . A . 5 . HB1 . . c19602_2mgt 1 115 1 . . 1 1 6 6 ARG HA H . . . 1 1 6 6 ARG HE H . . . . . 2.5 0.0 2.5 . . . . . A . 5 ARG HA . . A . 5 ARG HE . A . 5 . HA . . . A . 5 . HE . . c19602_2mgt 1 116 1 . . 1 1 6 6 ARG HB2 H . . . 1 1 6 6 ARG HE H . . . . . 5.5 0.0 5.5 . . . . . A . 5 ARG HB2 . . A . 5 ARG HE . A . 5 . HB2 . . . A . 5 . HE . . c19602_2mgt 1 117 1 . . 1 1 6 6 ARG H H . . . 1 1 6 6 ARG HG2 H . . . . . 4.0 0.0 4.0 . . . . . A . 5 ARG H . . A . 5 ARG HG2 . A . 5 . H . . . A . 5 . HG1 . . c19602_2mgt 1 118 1 OR . 1 1 6 6 ARG HA H . . . 1 1 6 6 ARG HD2 H . . . . . 3.5 0.0 3.5 . . . . . A . 5 ARG HA . . A . 5 ARG HD2 . A . 5 . HA . . . A . 5 . HD* . . c19602_2mgt 1 118 2 OR . 1 1 6 6 ARG HD3 H . . . 1 1 6 6 ARG HA H . . . . . 3.5 0.0 3.5 . . . . . A . 5 ARG HD3 . . A . 5 ARG HA . A . 5 . HD* . . . A . 5 . HA . . c19602_2mgt 1 119 1 . . 1 1 6 6 ARG HA H . . . 1 1 6 6 ARG HG2 H . . . . . 6.0 0.0 6.0 . . . . . A . 5 ARG HA . . A . 5 ARG HG2 . A . 5 . HA . . . A . 5 . HG2 . . c19602_2mgt 1 120 1 . . 1 1 6 6 ARG H H . . . 1 1 6 6 ARG HG2 H . . . . . 4.5 0.0 4.5 . . . . . A . 5 ARG H . . A . 5 ARG HG2 . A . 5 . H . . . A . 5 . HG2 . . c19602_2mgt 1 121 1 . . 1 1 6 6 ARG H H . . . 1 1 6 6 ARG HB2 H . . . . . 3.5 0.0 3.5 . . . . . A . 5 ARG H . . A . 5 ARG HB2 . A . 5 . H . . . A . 5 . HB2 . . c19602_2mgt 1 122 1 . . 1 1 6 6 ARG H H . . . 1 1 6 6 ARG HA H . . . . . 3.5 0.0 3.5 . . . . . A . 5 ARG H . . A . 5 ARG HA . A . 5 . H . . . A . 5 . HA . . c19602_2mgt 1 123 1 . . 1 1 6 6 ARG HB2 H . . . 1 1 6 6 ARG HE H . . . . . 5.5 0.0 5.5 . . . . . A . 5 ARG HB2 . . A . 5 ARG HE . A . 5 . HB1 . . . A . 5 . HE . . c19602_2mgt 1 124 1 . . 1 1 7 7 ARG HE H . . . 1 1 7 7 ARG HA H . . . . . 3.5 0.0 3.5 . . . . . A . 6 ARG HE . . A . 6 ARG HA . A . 6 . HE . . . A . 6 . HA . . c19602_2mgt 1 125 1 . . 1 1 7 7 ARG HE H . . . 1 1 7 7 ARG HG2 H . . . . . 3.5 0.0 3.5 . . . . . A . 6 ARG HE . . A . 6 ARG HG2 . A . 6 . HE . . . A . 6 . HG2 . . c19602_2mgt 1 126 1 . . 1 1 7 7 ARG H H . . . 1 1 7 7 ARG HA H . . . . . 3.0 0.0 3.0 . . . . . A . 6 ARG H . . A . 6 ARG HA . A . 6 . H . . . A . 6 . HA . . c19602_2mgt 1 127 1 OR . 1 1 7 7 ARG HB2 H . . . 1 1 7 7 ARG HD2 H . . . . . 3.5 0.0 3.5 . . . . . A . 6 ARG HB2 . . A . 6 ARG HD2 . A . 6 . HB2 . . . A . 6 . HD* . . c19602_2mgt 1 127 2 OR . 1 1 7 7 ARG HD3 H . . . 1 1 7 7 ARG HB2 H . . . . . 3.5 0.0 3.5 . . . . . A . 6 ARG HD3 . . A . 6 ARG HB2 . A . 6 . HD* . . . A . 6 . HB2 . . c19602_2mgt 1 128 1 . . 1 1 7 7 ARG H H . . . 1 1 7 7 ARG HG2 H . . . . . 2.5 0.0 2.5 . . . . . A . 6 ARG H . . A . 6 ARG HG2 . A . 6 . H . . . A . 6 . HG2 . . c19602_2mgt 1 129 1 . . 1 1 7 7 ARG H H . . . 1 1 7 7 ARG HB2 H . . . . . 3.5 0.0 3.5 . . . . . A . 6 ARG H . . A . 6 ARG HB2 . A . 6 . H . . . A . 6 . HB2 . . c19602_2mgt 1 130 1 OR . 1 1 7 7 ARG HD3 H . . . 1 1 7 7 ARG HB2 H . . . . . 2.5 0.0 2.5 . . . . . A . 6 ARG HD3 . . A . 6 ARG HB2 . A . 6 . HD* . . . A . 6 . HB1 . . c19602_2mgt 1 130 2 OR . 1 1 7 7 ARG HB2 H . . . 1 1 7 7 ARG HD2 H . . . . . 2.5 0.0 2.5 . . . . . A . 6 ARG HB2 . . A . 6 ARG HD2 . A . 6 . HB1 . . . A . 6 . HD* . . c19602_2mgt 1 131 1 . . 1 1 7 7 ARG HG2 H . . . 1 1 7 7 ARG HA H . . . . . 3.0 0.0 3.0 . . . . . A . 6 ARG HG2 . . A . 6 ARG HA . A . 6 . HG2 . . . A . 6 . HA . . c19602_2mgt 1 132 1 OR . 1 1 7 7 ARG HG2 H . . . 1 1 7 7 ARG HD2 H . . . . . 2.5 0.0 2.5 . . . . . A . 6 ARG HG2 . . A . 6 ARG HD2 . A . 6 . HG2 . . . A . 6 . HD* . . c19602_2mgt 1 132 2 OR . 1 1 7 7 ARG HD3 H . . . 1 1 7 7 ARG HG2 H . . . . . 2.5 0.0 2.5 . . . . . A . 6 ARG HD3 . . A . 6 ARG HG2 . A . 6 . HD* . . . A . 6 . HG2 . . c19602_2mgt 1 133 1 . . 1 1 7 7 ARG H H . . . 1 1 7 7 ARG HB2 H . . . . . 5.5 0.0 5.5 . . . . . A . 6 ARG H . . A . 6 ARG HB2 . A . 6 . H . . . A . 6 . HB1 . . c19602_2mgt 1 134 1 . . 1 1 7 7 ARG HE H . . . 1 1 7 7 ARG HG2 H . . . . . 6.0 0.0 6.0 . . . . . A . 6 ARG HE . . A . 6 ARG HG2 . A . 6 . HE . . . A . 6 . HG1 . . c19602_2mgt 1 135 1 . . 1 1 7 7 ARG HE H . . . 1 1 7 7 ARG HB2 H . . . . . 4.5 0.0 4.5 . . . . . A . 6 ARG HE . . A . 6 ARG HB2 . A . 6 . HE . . . A . 6 . HB2 . . c19602_2mgt 1 136 1 . . 1 1 7 7 ARG H H . . . 1 1 7 7 ARG HG2 H . . . . . 5.5 0.0 5.5 . . . . . A . 6 ARG H . . A . 6 ARG HG2 . A . 6 . H . . . A . 6 . HG1 . . c19602_2mgt 1 137 1 . . 1 1 7 7 ARG HE H . . . 1 1 7 7 ARG HB2 H . . . . . 4.5 0.0 4.5 . . . . . A . 6 ARG HE . . A . 6 ARG HB2 . A . 6 . HE . . . A . 6 . HB1 . . c19602_2mgt 1 138 1 . . 1 1 8 8 ASP H H . . . 1 1 8 8 ASP HA H . . . . . 3.5 0.0 3.5 . . . . . A . 7 ASP H . . A . 7 ASP HA . A . 7 . H . . . A . 7 . HA . . c19602_2mgt 1 139 1 . . 1 1 9 9 SER H H . . . 1 1 9 9 SER HB2 H . . . . . 3.5 0.0 3.5 . . . . . A . 8 SER H . . A . 8 SER HB2 . A . 8 . H . . . A . 8 . HB1 . . c19602_2mgt 1 140 1 . . 1 1 9 9 SER H H . . . 1 1 9 9 SER HB2 H . . . . . 2.5 0.0 2.5 . . . . . A . 8 SER H . . A . 8 SER HB2 . A . 8 . H . . . A . 8 . HB2 . . c19602_2mgt 1 141 1 . . 1 1 9 9 SER HA H . . . 1 1 9 9 SER H H . . . . . 3.0 0.0 3.0 . . . . . A . 8 SER HA . . A . 8 SER H . A . 8 . HA . . . A . 8 . H . . c19602_2mgt 1 142 1 OR . 1 1 10 10 GLY H H . . . 1 1 10 10 GLY HA2 H . . . . . 3.5 0.0 3.5 . . . . . A . 9 GLY H . . A . 9 GLY HA2 . A . 9 . H . . . A . 9 . HA* . . c19602_2mgt 1 142 2 OR . 1 1 10 10 GLY HA3 H . . . 1 1 10 10 GLY H H . . . . . 3.5 0.0 3.5 . . . . . A . 9 GLY HA3 . . A . 9 GLY H . A . 9 . HA* . . . A . 9 . H . . c19602_2mgt 1 143 1 . . 1 1 11 11 TYR HB2 H . . . 1 1 11 11 TYR QE H . . . . . 4.5 0.0 4.5 . . . . . A . 10 TYR HB2 . . A . 10 TYR QE . A . 10 . HB1 . . . A . 10 . HE* . . c19602_2mgt 1 144 1 . . 1 1 11 11 TYR HB2 H . . . 1 1 11 11 TYR QE H . . . . . 6.0 0.0 6.0 . . . . . A . 10 TYR HB2 . . A . 10 TYR QE . A . 10 . HB2 . . . A . 10 . HE* . . c19602_2mgt 1 145 1 . . 1 1 11 11 TYR H H . . . 1 1 11 11 TYR HA H . . . . . 3.0 0.0 3.0 . . . . . A . 10 TYR H . . A . 10 TYR HA . A . 10 . H . . . A . 10 . HA . . c19602_2mgt 1 146 1 . . 1 1 11 11 TYR HB2 H . . . 1 1 11 11 TYR H H . . . . . 3.5 0.0 3.5 . . . . . A . 10 TYR HB2 . . A . 10 TYR H . A . 10 . HB1 . . . A . 10 . H . . c19602_2mgt 1 147 1 . . 1 1 11 11 TYR HB2 H . . . 1 1 11 11 TYR H H . . . . . 3.0 0.0 3.0 . . . . . A . 10 TYR HB2 . . A . 10 TYR H . A . 10 . HB2 . . . A . 10 . H . . c19602_2mgt 1 148 1 . . 1 1 11 11 TYR QD H . . . 1 1 11 11 TYR H H . . . . . 4.5 0.0 4.5 . . . . . A . 10 TYR QD . . A . 10 TYR H . A . 10 . HD* . . . A . 10 . H . . c19602_2mgt 1 149 1 OR . 1 1 12 12 GLU H H . . . 1 1 12 12 GLU HG2 H . . . . . 4.0 0.0 4.0 . . . . . A . 11 GLU H . . A . 11 GLU HG2 . A . 11 . H . . . A . 11 . HG* . . c19602_2mgt 1 149 2 OR . 1 1 12 12 GLU HG3 H . . . 1 1 12 12 GLU H H . . . . . 4.0 0.0 4.0 . . . . . A . 11 GLU HG3 . . A . 11 GLU H . A . 11 . HG* . . . A . 11 . H . . c19602_2mgt 1 150 1 . . 1 1 12 12 GLU HA H . . . 1 1 12 12 GLU H H . . . . . 3.5 0.0 3.5 . . . . . A . 11 GLU HA . . A . 11 GLU H . A . 11 . HA . . . A . 11 . H . . c19602_2mgt 1 151 1 . . 1 1 12 12 GLU H H . . . 1 1 12 12 GLU HB2 H . . . . . 3.0 0.0 3.0 . . . . . A . 11 GLU H . . A . 11 GLU HB2 . A . 11 . H . . . A . 11 . HB2 . . c19602_2mgt 1 152 1 . . 1 1 12 12 GLU H H . . . 1 1 12 12 GLU HB2 H . . . . . 3.5 0.0 3.5 . . . . . A . 11 GLU H . . A . 11 GLU HB2 . A . 11 . H . . . A . 11 . HB1 . . c19602_2mgt 1 153 1 . . 1 1 13 13 VAL HA H . . . 1 1 13 13 VAL MG1 H . . . . . 2.5 0.0 2.5 . . . . . A . 12 VAL HA . . A . 12 VAL MG1 . A . 12 . HA . . . A . 12 . HG1* . . c19602_2mgt 1 154 1 . . 1 1 13 13 VAL HA H . . . 1 1 13 13 VAL MG2 H . . . . . 3.5 0.0 3.5 . . . . . A . 12 VAL HA . . A . 12 VAL MG2 . A . 12 . HA . . . A . 12 . HG2* . . c19602_2mgt 1 155 1 . . 1 1 13 13 VAL HA H . . . 1 1 13 13 VAL H H . . . . . 2.5 0.0 2.5 . . . . . A . 12 VAL HA . . A . 12 VAL H . A . 12 . HA . . . A . 12 . H . . c19602_2mgt 1 156 1 . . 1 1 13 13 VAL HA H . . . 1 1 13 13 VAL MG1 H . . . . . 2.5 0.0 2.5 . . . . . A . 12 VAL HA . . A . 12 VAL MG1 . A . 12 . HA . . . A . 12 . HG1* . . c19602_2mgt 1 157 1 OR . 1 1 14 14 HIS HD2 H . . . 1 1 14 14 HIS HB3 H . . . . . 4.5 0.0 4.5 . . . . . A . 13 HIS HD2 . . A . 13 HIS HB3 . A . 13 . HD2 . . . A . 13 . HB* . . c19602_2mgt 1 157 2 OR . 1 1 14 14 HIS HB2 H . . . 1 1 14 14 HIS HD2 H . . . . . 4.5 0.0 4.5 . . . . . A . 13 HIS HB2 . . A . 13 HIS HD2 . A . 13 . HB* . . . A . 13 . HD2 . . c19602_2mgt 1 158 1 OR . 1 1 14 14 HIS H H . . . 1 1 14 14 HIS HB3 H . . . . . 3.5 0.0 3.5 . . . . . A . 13 HIS H . . A . 13 HIS HB3 . A . 13 . H . . . A . 13 . HB* . . c19602_2mgt 1 158 2 OR . 1 1 14 14 HIS H H . . . 1 1 14 14 HIS HB2 H . . . . . 3.5 0.0 3.5 . . . . . A . 13 HIS H . . A . 13 HIS HB2 . A . 13 . H . . . A . 13 . HB* . . c19602_2mgt 1 159 1 . . 1 1 14 14 HIS H H . . . 1 1 14 14 HIS HB2 H . . . . . 3.5 0.0 3.5 . . . . . A . 13 HIS H . . A . 13 HIS HB2 . A . 13 . H . . . A . 13 . HB2 . . c19602_2mgt 1 160 1 . . 1 1 14 14 HIS H H . . . 1 1 14 14 HIS HA H . . . . . 3.5 0.0 3.5 . . . . . A . 13 HIS H . . A . 13 HIS HA . A . 13 . H . . . A . 13 . HA . . c19602_2mgt 1 161 1 . . 1 1 15 15 HIS HD2 H . . . 1 1 15 15 HIS HB2 H . . . . . 3.5 0.0 3.5 . . . . . A . 14 HIS HD2 . . A . 14 HIS HB2 . A . 14 . HD2 . . . A . 14 . HB1 . . c19602_2mgt 1 162 1 . . 1 1 15 15 HIS HD2 H . . . 1 1 15 15 HIS HB2 H . . . . . 4.5 0.0 4.5 . . . . . A . 14 HIS HD2 . . A . 14 HIS HB2 . A . 14 . HD2 . . . A . 14 . HB2 . . c19602_2mgt 1 163 1 . . 1 1 15 15 HIS H H . . . 1 1 15 15 HIS HB2 H . . . . . 5.5 0.0 5.5 . . . . . A . 14 HIS H . . A . 14 HIS HB2 . A . 14 . H . . . A . 14 . HB1 . . c19602_2mgt 1 164 1 . . 1 1 15 15 HIS H H . . . 1 1 15 15 HIS HB2 H . . . . . 4.5 0.0 4.5 . . . . . A . 14 HIS H . . A . 14 HIS HB2 . A . 14 . H . . . A . 14 . HB2 . . c19602_2mgt 1 165 1 . . 1 1 15 15 HIS H H . . . 1 1 15 15 HIS HA H . . . . . 3.5 0.0 3.5 . . . . . A . 14 HIS H . . A . 14 HIS HA . A . 14 . H . . . A . 14 . HA . . c19602_2mgt 1 166 1 OR . 1 1 16 16 GLN H H . . . 1 1 16 16 GLN HG2 H . . . . . 3.5 0.0 3.5 . . . . . A . 15 GLN H . . A . 15 GLN HG2 . A . 15 . H . . . A . 15 . HG* . . c19602_2mgt 1 166 2 OR . 1 1 16 16 GLN HG3 H . . . 1 1 16 16 GLN H H . . . . . 3.5 0.0 3.5 . . . . . A . 15 GLN HG3 . . A . 15 GLN H . A . 15 . HG* . . . A . 15 . H . . c19602_2mgt 1 167 1 . . 1 1 16 16 GLN H H . . . 1 1 16 16 GLN HB2 H . . . . . 3.5 0.0 3.5 . . . . . A . 15 GLN H . . A . 15 GLN HB2 . A . 15 . H . . . A . 15 . HB1 . . c19602_2mgt 1 168 1 . . 1 1 16 16 GLN H H . . . 1 1 16 16 GLN HB2 H . . . . . 3.5 0.0 3.5 . . . . . A . 15 GLN H . . A . 15 GLN HB2 . A . 15 . H . . . A . 15 . HB2 . . c19602_2mgt 1 169 1 . . 1 1 16 16 GLN H H . . . 1 1 16 16 GLN HA H . . . . . 3.0 0.0 3.0 . . . . . A . 15 GLN H . . A . 15 GLN HA . A . 15 . H . . . A . 15 . HA . . c19602_2mgt 1 170 1 OR . 1 1 16 16 GLN HA H . . . 1 1 16 16 GLN HG2 H . . . . . 4.5 0.0 4.5 . . . . . A . 15 GLN HA . . A . 15 GLN HG2 . A . 15 . HA . . . A . 15 . HG* . . c19602_2mgt 1 170 2 OR . 1 1 16 16 GLN HG3 H . . . 1 1 16 16 GLN HA H . . . . . 4.5 0.0 4.5 . . . . . A . 15 GLN HG3 . . A . 15 GLN HA . A . 15 . HG* . . . A . 15 . HA . . c19602_2mgt 1 171 1 OR . 1 1 16 16 GLN HE21 H . . . 1 1 16 16 GLN HG2 H . . . . . 3.5 0.0 3.5 . . . . . A . 15 GLN HE21 . . A . 15 GLN HG2 . A . 15 . HE21 . . . A . 15 . HG* . . c19602_2mgt 1 171 2 OR . 1 1 16 16 GLN HG3 H . . . 1 1 16 16 GLN HE21 H . . . . . 3.5 0.0 3.5 . . . . . A . 15 GLN HG3 . . A . 15 GLN HE21 . A . 15 . HG* . . . A . 15 . HE21 . . c19602_2mgt 1 172 1 OR . 1 1 17 17 LYS HB2 H . . . 1 1 17 17 LYS HE2 H . . . . . 5.5 0.0 5.5 . . . . . A . 16 LYS HB2 . . A . 16 LYS HE2 . A . 16 . HB2 . . . A . 16 . HE* . . c19602_2mgt 1 172 2 OR . 1 1 17 17 LYS HB2 H . . . 1 1 17 17 LYS HE3 H . . . . . 5.5 0.0 5.5 . . . . . A . 16 LYS HB2 . . A . 16 LYS HE3 . A . 16 . HB2 . . . A . 16 . HE* . . c19602_2mgt 1 173 1 OR . 1 1 17 17 LYS HB2 H . . . 1 1 17 17 LYS HE3 H . . . . . 5.5 0.0 5.5 . . . . . A . 16 LYS HB2 . . A . 16 LYS HE3 . A . 16 . HB1 . . . A . 16 . HE* . . c19602_2mgt 1 173 2 OR . 1 1 17 17 LYS HB2 H . . . 1 1 17 17 LYS HE2 H . . . . . 5.5 0.0 5.5 . . . . . A . 16 LYS HB2 . . A . 16 LYS HE2 . A . 16 . HB1 . . . A . 16 . HE* . . c19602_2mgt 1 174 1 OR . 1 1 17 17 LYS HG2 H . . . 1 1 17 17 LYS HE2 H . . . . . 4.5 0.0 4.5 . . . . . A . 16 LYS HG2 . . A . 16 LYS HE2 . A . 16 . HG2 . . . A . 16 . HE* . . c19602_2mgt 1 174 2 OR . 1 1 17 17 LYS HE3 H . . . 1 1 17 17 LYS HG2 H . . . . . 4.5 0.0 4.5 . . . . . A . 16 LYS HE3 . . A . 16 LYS HG2 . A . 16 . HE* . . . A . 16 . HG2 . . c19602_2mgt 1 175 1 OR . 1 1 17 17 LYS HE3 H . . . 1 1 17 17 LYS HG2 H . . . . . 4.5 0.0 4.5 . . . . . A . 16 LYS HE3 . . A . 16 LYS HG2 . A . 16 . HE* . . . A . 16 . HG1 . . c19602_2mgt 1 175 2 OR . 1 1 17 17 LYS HG2 H . . . 1 1 17 17 LYS HE2 H . . . . . 4.5 0.0 4.5 . . . . . A . 16 LYS HG2 . . A . 16 LYS HE2 . A . 16 . HG1 . . . A . 16 . HE* . . c19602_2mgt 1 176 1 OR . 1 1 17 17 LYS HD3 H . . . 1 1 17 17 LYS HE2 H . . . . . 3.5 0.0 3.5 . . . . . A . 16 LYS HD3 . . A . 16 LYS HE2 . A . 16 . HD* . . . A . 16 . HE* . . c19602_2mgt 1 176 2 OR . 1 1 17 17 LYS HD2 H . . . 1 1 17 17 LYS HE2 H . . . . . 3.5 0.0 3.5 . . . . . A . 16 LYS HD2 . . A . 16 LYS HE2 . A . 16 . HD* . . . A . 16 . HE* . . c19602_2mgt 1 176 3 OR . 1 1 17 17 LYS HE3 H . . . 1 1 17 17 LYS HD2 H . . . . . 3.5 0.0 3.5 . . . . . A . 16 LYS HE3 . . A . 16 LYS HD2 . A . 16 . HE* . . . A . 16 . HD* . . c19602_2mgt 1 176 4 OR . 1 1 17 17 LYS HE3 H . . . 1 1 17 17 LYS HD3 H . . . . . 3.5 0.0 3.5 . . . . . A . 16 LYS HE3 . . A . 16 LYS HD3 . A . 16 . HE* . . . A . 16 . HD* . . c19602_2mgt 1 177 1 . . 1 1 17 17 LYS H H . . . 1 1 17 17 LYS HB2 H . . . . . 4.5 0.0 4.5 . . . . . A . 16 LYS H . . A . 16 LYS HB2 . A . 16 . H . . . A . 16 . HB1 . . c19602_2mgt 1 178 1 . . 1 1 17 17 LYS H H . . . 1 1 17 17 LYS HB2 H . . . . . 4.5 0.0 4.5 . . . . . A . 16 LYS H . . A . 16 LYS HB2 . A . 16 . H . . . A . 16 . HB2 . . c19602_2mgt 1 179 1 . . 1 1 17 17 LYS H H . . . 1 1 17 17 LYS HA H . . . . . 3.5 0.0 3.5 . . . . . A . 16 LYS H . . A . 16 LYS HA . A . 16 . H . . . A . 16 . HA . . c19602_2mgt 1 180 1 OR . 2 1 13 13 VAL HA H . . . 2 1 6 6 ARG HD2 H . . . . . 5.0 0.0 5.0 . . . . . B . 12 VAL HA . . B . 5 ARG HD2 . B . 12 . HA . . . B . 5 . HD* . . c19602_2mgt 1 180 2 OR . 2 1 6 6 ARG HD3 H . . . 2 1 13 13 VAL HA H . . . . . 5.0 0.0 5.0 . . . . . B . 5 ARG HD3 . . B . 12 VAL HA . B . 5 . HD* . . . B . 12 . HA . . c19602_2mgt 1 181 1 . . 2 1 13 13 VAL HA H . . . 2 1 5 5 PHE QD H . . . . . 5.5 0.0 5.5 . . . . . B . 12 VAL HA . . B . 4 PHE QD . B . 12 . HA . . . B . 4 . HD* . . c19602_2mgt 1 182 1 . . 2 1 11 11 TYR QD H . . . 2 1 16 16 GLN HB2 H . . . . . 5.5 0.0 5.5 . . . . . B . 10 TYR QD . . B . 15 GLN HB2 . B . 10 . HD* . . . B . 15 . HB1 . . c19602_2mgt 1 183 1 OR . 2 1 11 11 TYR QD H . . . 2 1 16 16 GLN HG2 H . . . . . 5.5 0.0 5.5 . . . . . B . 10 TYR QD . . B . 15 GLN HG2 . B . 10 . HD* . . . B . 15 . HG* . . c19602_2mgt 1 183 2 OR . 2 1 11 11 TYR QD H . . . 2 1 16 16 GLN HG3 H . . . . . 5.5 0.0 5.5 . . . . . B . 10 TYR QD . . B . 15 GLN HG3 . B . 10 . HD* . . . B . 15 . HG* . . c19602_2mgt 1 184 1 . . 2 1 13 13 VAL HA H . . . 2 1 11 11 TYR HB2 H . . . . . 5.5 0.0 5.5 . . . . . B . 12 VAL HA . . B . 10 TYR HB2 . B . 12 . HA . . . B . 10 . HB2 . . c19602_2mgt 1 185 1 . . 2 1 13 13 VAL HA H . . . 2 1 11 11 TYR HB2 H . . . . . 4.5 0.0 4.5 . . . . . B . 12 VAL HA . . B . 10 TYR HB2 . B . 12 . HA . . . B . 10 . HB1 . . c19602_2mgt 1 186 1 . . 2 1 5 5 PHE H H . . . 2 1 2 2 ASP HB2 H . . . . . 4.5 0.0 4.5 . . . . . B . 4 PHE H . . B . 1 ASP HB2 . B . 4 . H . . . B . 1 . HB1 . . c19602_2mgt 1 187 1 . . 2 1 5 5 PHE QD H . . . 2 1 2 2 ASP HB2 H . . . . . 4.5 0.0 4.5 . . . . . B . 4 PHE QD . . B . 1 ASP HB2 . B . 4 . HD* . . . B . 1 . HB1 . . c19602_2mgt 1 188 1 . . 2 1 5 5 PHE H H . . . 2 1 3 3 ALA MB H . . . . . 4.5 0.0 4.5 . . . . . B . 4 PHE H . . B . 2 ALA MB . B . 4 . H . . . B . 2 . HB* . . c19602_2mgt 1 189 1 OR . 2 1 3 3 ALA MB H . . . 2 1 7 7 ARG HD2 H . . . . . 5.5 0.0 5.5 . . . . . B . 2 ALA MB . . B . 6 ARG HD2 . B . 2 . HB* . . . B . 6 . HD* . . c19602_2mgt 1 189 2 OR . 2 1 3 3 ALA MB H . . . 2 1 7 7 ARG HD3 H . . . . . 5.5 0.0 5.5 . . . . . B . 2 ALA MB . . B . 6 ARG HD3 . B . 2 . HB* . . . B . 6 . HD* . . c19602_2mgt 1 190 1 . . 2 1 4 4 GLU HG2 H . . . 2 1 7 7 ARG HE H . . . . . 5.5 0.0 5.5 . . . . . B . 3 GLU HG2 . . B . 6 ARG HE . B . 3 . HG2 . . . B . 6 . HE . . c19602_2mgt 1 191 1 . . 2 1 4 4 GLU HG2 H . . . 2 1 7 7 ARG HE H . . . . . 6.0 0.0 6.0 . . . . . B . 3 GLU HG2 . . B . 6 ARG HE . B . 3 . HG1 . . . B . 6 . HE . . c19602_2mgt 1 192 1 . . 2 1 7 7 ARG HE H . . . 2 1 5 5 PHE HA H . . . . . 4.5 0.0 4.5 . . . . . B . 6 ARG HE . . B . 4 PHE HA . B . 6 . HE . . . B . 4 . HA . . c19602_2mgt 1 193 1 . . 2 1 5 5 PHE QD H . . . 2 1 7 7 ARG H H . . . . . 5.0 0.0 5.0 . . . . . B . 4 PHE QD . . B . 6 ARG H . B . 4 . HD* . . . B . 6 . H . . c19602_2mgt 1 194 1 . . 2 1 5 5 PHE QD H . . . 2 1 7 7 ARG HG2 H . . . . . 5.0 0.0 5.0 . . . . . B . 4 PHE QD . . B . 6 ARG HG2 . B . 4 . HD* . . . B . 6 . HG2 . . c19602_2mgt 1 195 1 . . 2 1 5 5 PHE HA H . . . 2 1 7 7 ARG HG2 H . . . . . 5.5 0.0 5.5 . . . . . B . 4 PHE HA . . B . 6 ARG HG2 . B . 4 . HA . . . B . 6 . HG2 . . c19602_2mgt 1 196 1 . . 2 1 5 5 PHE QD H . . . 2 1 7 7 ARG HB2 H . . . . . 6.0 0.0 6.0 . . . . . B . 4 PHE QD . . B . 6 ARG HB2 . B . 4 . HD* . . . B . 6 . HB2 . . c19602_2mgt 1 197 1 . . 2 1 7 7 ARG HB2 H . . . 2 1 11 11 TYR QE H . . . . . 4.5 0.0 4.5 . . . . . B . 6 ARG HB2 . . B . 10 TYR QE . B . 6 . HB2 . . . B . 10 . HE* . . c19602_2mgt 1 198 1 . . 2 1 7 7 ARG HG2 H . . . 2 1 11 11 TYR QE H . . . . . 4.5 0.0 4.5 . . . . . B . 6 ARG HG2 . . B . 10 TYR QE . B . 6 . HG2 . . . B . 10 . HE* . . c19602_2mgt 1 199 1 . . 2 1 11 11 TYR QD H . . . 2 1 9 9 SER HA H . . . . . 6.0 0.0 6.0 . . . . . B . 10 TYR QD . . B . 8 SER HA . B . 10 . HD* . . . B . 8 . HA . . c19602_2mgt 1 200 1 OR . 2 1 14 14 HIS H H . . . 2 1 12 12 GLU HG2 H . . . . . 5.0 0.0 5.0 . . . . . B . 13 HIS H . . B . 11 GLU HG2 . B . 13 . H . . . B . 11 . HG* . . c19602_2mgt 1 200 2 OR . 2 1 12 12 GLU HG3 H . . . 2 1 14 14 HIS H H . . . . . 5.0 0.0 5.0 . . . . . B . 11 GLU HG3 . . B . 13 HIS H . B . 11 . HG* . . . B . 13 . H . . c19602_2mgt 1 201 1 . . 2 1 14 14 HIS H H . . . 2 1 12 12 GLU HA H . . . . . 4.0 0.0 4.0 . . . . . B . 13 HIS H . . B . 11 GLU HA . B . 13 . H . . . B . 11 . HA . . c19602_2mgt 1 202 1 OR . 2 1 11 11 TYR QE H . . . 2 1 10 10 GLY HA2 H . . . . . 3.5 0.0 3.5 . . . . . B . 10 TYR QE . . B . 9 GLY HA2 . B . 10 . HE* . . . B . 9 . HA* . . c19602_2mgt 1 202 2 OR . 2 1 11 11 TYR QE H . . . 2 1 10 10 GLY HA3 H . . . . . 3.5 0.0 3.5 . . . . . B . 10 TYR QE . . B . 9 GLY HA3 . B . 10 . HE* . . . B . 9 . HA* . . c19602_2mgt 1 203 1 . . 2 1 11 11 TYR QD H . . . 2 1 13 13 VAL MG1 H . . . . . 4.5 0.0 4.5 . . . . . B . 10 TYR QD . . B . 12 VAL MG1 . B . 10 . HD* . . . B . 12 . HG1* . . c19602_2mgt 1 204 1 . . 2 1 11 11 TYR QD H . . . 2 1 13 13 VAL MG2 H . . . . . 5.5 0.0 5.5 . . . . . B . 10 TYR QD . . B . 12 VAL MG2 . B . 10 . HD* . . . B . 12 . HG2* . . c19602_2mgt 1 205 1 . . 2 1 11 11 TYR QE H . . . 2 1 13 13 VAL MG1 H . . . . . 4.5 0.0 4.5 . . . . . B . 10 TYR QE . . B . 12 VAL MG1 . B . 10 . HE* . . . B . 12 . HG1* . . c19602_2mgt 1 206 1 . . 2 1 11 11 TYR QE H . . . 2 1 13 13 VAL MG2 H . . . . . 4.5 0.0 4.5 . . . . . B . 10 TYR QE . . B . 12 VAL MG2 . B . 10 . HE* . . . B . 12 . HG2* . . c19602_2mgt 1 207 1 . . 2 1 13 13 VAL H H . . . 2 1 15 15 HIS H H . . . . . 4.5 0.0 4.5 . . . . . B . 12 VAL H . . B . 14 HIS H . B . 12 . H . . . B . 14 . H . . c19602_2mgt 1 208 1 . . 2 1 2 2 ASP HB2 H . . . 2 1 3 3 ALA H H . . . . . 4.5 0.0 4.5 . . . . . B . 1 ASP HB2 . . B . 2 ALA H . B . 1 . HB2 . . . B . 2 . H . . c19602_2mgt 1 209 1 . . 2 1 3 3 ALA H H . . . 2 1 2 2 ASP HA H . . . . . 3.5 0.0 3.5 . . . . . B . 2 ALA H . . B . 1 ASP HA . B . 2 . H . . . B . 1 . HA . . c19602_2mgt 1 210 1 . . 2 1 2 2 ASP HB2 H . . . 2 1 3 3 ALA H H . . . . . 3.5 0.0 3.5 . . . . . B . 1 ASP HB2 . . B . 2 ALA H . B . 1 . HB1 . . . B . 2 . H . . c19602_2mgt 1 211 1 . . 2 1 3 3 ALA MB H . . . 2 1 2 2 ASP HA H . . . . . 5.5 0.0 5.5 . . . . . B . 2 ALA MB . . B . 1 ASP HA . B . 2 . HB* . . . B . 1 . HA . . c19602_2mgt 1 212 1 . . 2 1 3 3 ALA MB H . . . 2 1 2 2 ASP HB2 H . . . . . 5.5 0.0 5.5 . . . . . B . 2 ALA MB . . B . 1 ASP HB2 . B . 2 . HB* . . . B . 1 . HB1 . . c19602_2mgt 1 213 1 . . 2 1 3 3 ALA MB H . . . 2 1 4 4 GLU HG2 H . . . . . 5.5 0.0 5.5 . . . . . B . 2 ALA MB . . B . 3 GLU HG2 . B . 2 . HB* . . . B . 3 . HG1 . . c19602_2mgt 1 214 1 . . 2 1 3 3 ALA HA H . . . 2 1 4 4 GLU H H . . . . . 3.5 0.0 3.5 . . . . . B . 2 ALA HA . . B . 3 GLU H . B . 2 . HA . . . B . 3 . H . . c19602_2mgt 1 215 1 . . 2 1 3 3 ALA MB H . . . 2 1 4 4 GLU HG2 H . . . . . 4.0 0.0 4.0 . . . . . B . 2 ALA MB . . B . 3 GLU HG2 . B . 2 . HB* . . . B . 3 . HG2 . . c19602_2mgt 1 216 1 . . 2 1 3 3 ALA MB H . . . 2 1 4 4 GLU H H . . . . . 3.5 0.0 3.5 . . . . . B . 2 ALA MB . . B . 3 GLU H . B . 2 . HB* . . . B . 3 . H . . c19602_2mgt 1 217 1 . . 2 1 5 5 PHE QD H . . . 2 1 4 4 GLU HG2 H . . . . . 4.5 0.0 4.5 . . . . . B . 4 PHE QD . . B . 3 GLU HG2 . B . 4 . HD* . . . B . 3 . HG1 . . c19602_2mgt 1 218 1 . . 2 1 5 5 PHE H H . . . 2 1 4 4 GLU HA H . . . . . 3.5 0.0 3.5 . . . . . B . 4 PHE H . . B . 3 GLU HA . B . 4 . H . . . B . 3 . HA . . c19602_2mgt 1 219 1 . . 2 1 5 5 PHE QD H . . . 2 1 4 4 GLU HA H . . . . . 5.0 0.0 5.0 . . . . . B . 4 PHE QD . . B . 3 GLU HA . B . 4 . HD* . . . B . 3 . HA . . c19602_2mgt 1 220 1 . . 2 1 5 5 PHE H H . . . 2 1 4 4 GLU HG2 H . . . . . 5.5 0.0 5.5 . . . . . B . 4 PHE H . . B . 3 GLU HG2 . B . 4 . H . . . B . 3 . HG2 . . c19602_2mgt 1 221 1 OR . 2 1 5 5 PHE H H . . . 2 1 4 4 GLU HB2 H . . . . . 3.5 0.0 3.5 . . . . . B . 4 PHE H . . B . 3 GLU HB2 . B . 4 . H . . . B . 3 . HB* . . c19602_2mgt 1 221 2 OR . 2 1 5 5 PHE H H . . . 2 1 4 4 GLU HB3 H . . . . . 3.5 0.0 3.5 . . . . . B . 4 PHE H . . B . 3 GLU HB3 . B . 4 . H . . . B . 3 . HB* . . c19602_2mgt 1 222 1 OR . 2 1 5 5 PHE QD H . . . 2 1 4 4 GLU HB2 H . . . . . 4.5 0.0 4.5 . . . . . B . 4 PHE QD . . B . 3 GLU HB2 . B . 4 . HD* . . . B . 3 . HB* . . c19602_2mgt 1 222 2 OR . 2 1 5 5 PHE QD H . . . 2 1 4 4 GLU HB3 H . . . . . 4.5 0.0 4.5 . . . . . B . 4 PHE QD . . B . 3 GLU HB3 . B . 4 . HD* . . . B . 3 . HB* . . c19602_2mgt 1 223 1 . . 2 1 5 5 PHE QD H . . . 2 1 4 4 GLU HG2 H . . . . . 5.5 0.0 5.5 . . . . . B . 4 PHE QD . . B . 3 GLU HG2 . B . 4 . HD* . . . B . 3 . HG2 . . c19602_2mgt 1 224 1 . . 2 1 5 5 PHE HA H . . . 2 1 4 4 GLU HA H . . . . . 5.5 0.0 5.5 . . . . . B . 4 PHE HA . . B . 3 GLU HA . B . 4 . HA . . . B . 3 . HA . . c19602_2mgt 1 225 1 . . 2 1 5 5 PHE H H . . . 2 1 4 4 GLU HG2 H . . . . . 3.5 0.0 3.5 . . . . . B . 4 PHE H . . B . 3 GLU HG2 . B . 4 . H . . . B . 3 . HG1 . . c19602_2mgt 1 226 1 . . 2 1 4 4 GLU H H . . . 2 1 5 5 PHE QE H . . . . . 5.5 0.0 5.5 . . . . . B . 3 GLU H . . B . 4 PHE QE . B . 3 . H . . . B . 4 . HE* . . c19602_2mgt 1 227 1 . . 2 1 5 5 PHE QD H . . . 2 1 4 4 GLU H H . . . . . 5.5 0.0 5.5 . . . . . B . 4 PHE QD . . B . 3 GLU H . B . 4 . HD* . . . B . 3 . H . . c19602_2mgt 1 228 1 . . 2 1 5 5 PHE H H . . . 2 1 4 4 GLU H H . . . . . 3.5 0.0 3.5 . . . . . B . 4 PHE H . . B . 3 GLU H . B . 4 . H . . . B . 3 . H . . c19602_2mgt 1 229 1 . . 2 1 5 5 PHE HA H . . . 2 1 6 6 ARG H H . . . . . 3.5 0.0 3.5 . . . . . B . 4 PHE HA . . B . 5 ARG H . B . 4 . HA . . . B . 5 . H . . c19602_2mgt 1 230 1 . . 2 1 5 5 PHE HA H . . . 2 1 6 6 ARG HB2 H . . . . . 5.5 0.0 5.5 . . . . . B . 4 PHE HA . . B . 5 ARG HB2 . B . 4 . HA . . . B . 5 . HB2 . . c19602_2mgt 1 231 1 . . 2 1 7 7 ARG H H . . . 2 1 6 6 ARG HA H . . . . . 3.5 0.0 3.5 . . . . . B . 6 ARG H . . B . 5 ARG HA . B . 6 . H . . . B . 5 . HA . . c19602_2mgt 1 232 1 . . 2 1 7 7 ARG HA H . . . 2 1 8 8 ASP H H . . . . . 3.5 0.0 3.5 . . . . . B . 6 ARG HA . . B . 7 ASP H . B . 6 . HA . . . B . 7 . H . . c19602_2mgt 1 233 1 . . 2 1 7 7 ARG HA H . . . 2 1 8 8 ASP HA H . . . . . 5.5 0.0 5.5 . . . . . B . 6 ARG HA . . B . 7 ASP HA . B . 6 . HA . . . B . 7 . HA . . c19602_2mgt 1 234 1 . . 2 1 8 8 ASP HA H . . . 2 1 9 9 SER H H . . . . . 3.5 0.0 3.5 . . . . . B . 7 ASP HA . . B . 8 SER H . B . 7 . HA . . . B . 8 . H . . c19602_2mgt 1 235 1 OR . 2 1 9 9 SER H H . . . 2 1 8 8 ASP HB2 H . . . . . 3.5 0.0 3.5 . . . . . B . 8 SER H . . B . 7 ASP HB2 . B . 8 . H . . . B . 7 . HB* . . c19602_2mgt 1 235 2 OR . 2 1 9 9 SER H H . . . 2 1 8 8 ASP HB3 H . . . . . 3.5 0.0 3.5 . . . . . B . 8 SER H . . B . 7 ASP HB3 . B . 8 . H . . . B . 7 . HB* . . c19602_2mgt 1 236 1 . . 2 1 9 9 SER HA H . . . 2 1 10 10 GLY H H . . . . . 4.5 0.0 4.5 . . . . . B . 8 SER HA . . B . 9 GLY H . B . 8 . HA . . . B . 9 . H . . c19602_2mgt 1 237 1 OR . 2 1 11 11 TYR H H . . . 2 1 10 10 GLY HA2 H . . . . . 3.5 0.0 3.5 . . . . . B . 10 TYR H . . B . 9 GLY HA2 . B . 10 . H . . . B . 9 . HA* . . c19602_2mgt 1 237 2 OR . 2 1 10 10 GLY HA3 H . . . 2 1 11 11 TYR H H . . . . . 3.5 0.0 3.5 . . . . . B . 9 GLY HA3 . . B . 10 TYR H . B . 9 . HA* . . . B . 10 . H . . c19602_2mgt 1 238 1 . . 2 1 10 10 GLY H H . . . 2 1 11 11 TYR H H . . . . . 4.0 0.0 4.0 . . . . . B . 9 GLY H . . B . 10 TYR H . B . 9 . H . . . B . 10 . H . . c19602_2mgt 1 239 1 . . 2 1 11 11 TYR HB2 H . . . 2 1 12 12 GLU H H . . . . . 3.5 0.0 3.5 . . . . . B . 10 TYR HB2 . . B . 11 GLU H . B . 10 . HB1 . . . B . 11 . H . . c19602_2mgt 1 240 1 . . 2 1 11 11 TYR HB2 H . . . 2 1 12 12 GLU H H . . . . . 4.5 0.0 4.5 . . . . . B . 10 TYR HB2 . . B . 11 GLU H . B . 10 . HB2 . . . B . 11 . H . . c19602_2mgt 1 241 1 . . 2 1 11 11 TYR QD H . . . 2 1 12 12 GLU H H . . . . . 4.5 0.0 4.5 . . . . . B . 10 TYR QD . . B . 11 GLU H . B . 10 . HD* . . . B . 11 . H . . c19602_2mgt 1 242 1 . . 2 1 11 11 TYR QE H . . . 2 1 12 12 GLU H H . . . . . 4.0 0.0 4.0 . . . . . B . 10 TYR QE . . B . 11 GLU H . B . 10 . HE* . . . B . 11 . H . . c19602_2mgt 1 243 1 . . 2 1 11 11 TYR H H . . . 2 1 12 12 GLU H H . . . . . 4.5 0.0 4.5 . . . . . B . 10 TYR H . . B . 11 GLU H . B . 10 . H . . . B . 11 . H . . c19602_2mgt 1 244 1 . . 2 1 12 12 GLU H H . . . 2 1 11 11 TYR HA H . . . . . 2.5 0.0 2.5 . . . . . B . 11 GLU H . . B . 10 TYR HA . B . 11 . H . . . B . 10 . HA . . c19602_2mgt 1 245 1 . . 2 1 11 11 TYR H H . . . 2 1 12 12 GLU HB2 H . . . . . 6.0 0.0 6.0 . . . . . B . 10 TYR H . . B . 11 GLU HB2 . B . 10 . H . . . B . 11 . HB1 . . c19602_2mgt 1 246 1 . . 2 1 12 12 GLU HA H . . . 2 1 11 11 TYR H H . . . . . 4.5 0.0 4.5 . . . . . B . 11 GLU HA . . B . 10 TYR H . B . 11 . HA . . . B . 10 . H . . c19602_2mgt 1 247 1 . . 2 1 11 11 TYR QD H . . . 2 1 12 12 GLU HB2 H . . . . . 5.5 0.0 5.5 . . . . . B . 10 TYR QD . . B . 11 GLU HB2 . B . 10 . HD* . . . B . 11 . HB2 . . c19602_2mgt 1 248 1 . . 2 1 11 11 TYR QD H . . . 2 1 12 12 GLU HB2 H . . . . . 4.5 0.0 4.5 . . . . . B . 10 TYR QD . . B . 11 GLU HB2 . B . 10 . HD* . . . B . 11 . HB1 . . c19602_2mgt 1 249 1 . . 2 1 11 11 TYR H H . . . 2 1 12 12 GLU HB2 H . . . . . 5.5 0.0 5.5 . . . . . B . 10 TYR H . . B . 11 GLU HB2 . B . 10 . H . . . B . 11 . HB2 . . c19602_2mgt 1 250 1 . . 2 1 11 11 TYR QE H . . . 2 1 12 12 GLU HB2 H . . . . . 6.0 0.0 6.0 . . . . . B . 10 TYR QE . . B . 11 GLU HB2 . B . 10 . HE* . . . B . 11 . HB1 . . c19602_2mgt 1 251 1 . . 2 1 12 12 GLU HA H . . . 2 1 13 13 VAL H H . . . . . 3.5 0.0 3.5 . . . . . B . 11 GLU HA . . B . 12 VAL H . B . 11 . HA . . . B . 12 . H . . c19602_2mgt 1 252 1 . . 2 1 13 13 VAL HA H . . . 2 1 14 14 HIS H H . . . . . 3.5 0.0 3.5 . . . . . B . 12 VAL HA . . B . 13 HIS H . B . 12 . HA . . . B . 13 . H . . c19602_2mgt 1 253 1 . . 2 1 14 14 HIS H H . . . 2 1 13 13 VAL HB H . . . . . 3.5 0.0 3.5 . . . . . B . 13 HIS H . . B . 12 VAL HB . B . 13 . H . . . B . 12 . HB . . c19602_2mgt 1 254 1 . . 2 1 13 13 VAL MG2 H . . . 2 1 14 14 HIS HA H . . . . . 5.5 0.0 5.5 . . . . . B . 12 VAL MG2 . . B . 13 HIS HA . B . 12 . HG2* . . . B . 13 . HA . . c19602_2mgt 1 255 1 . . 2 1 13 13 VAL MG1 H . . . 2 1 14 14 HIS HA H . . . . . 5.0 0.0 5.0 . . . . . B . 12 VAL MG1 . . B . 13 HIS HA . B . 12 . HG1* . . . B . 13 . HA . . c19602_2mgt 1 256 1 . . 2 1 13 13 VAL HA H . . . 2 1 14 14 HIS HA H . . . . . 4.5 0.0 4.5 . . . . . B . 12 VAL HA . . B . 13 HIS HA . B . 12 . HA . . . B . 13 . HA . . c19602_2mgt 1 257 1 . . 2 1 15 15 HIS HA H . . . 2 1 16 16 GLN H H . . . . . 3.5 0.0 3.5 . . . . . B . 14 HIS HA . . B . 15 GLN H . B . 14 . HA . . . B . 15 . H . . c19602_2mgt 1 258 1 . . 2 1 15 15 HIS H H . . . 2 1 16 16 GLN H H . . . . . 3.5 0.0 3.5 . . . . . B . 14 HIS H . . B . 15 GLN H . B . 14 . H . . . B . 15 . H . . c19602_2mgt 1 259 1 . . 2 1 16 16 GLN HA H . . . 2 1 17 17 LYS H H . . . . . 4.5 0.0 4.5 . . . . . B . 15 GLN HA . . B . 16 LYS H . B . 15 . HA . . . B . 16 . H . . c19602_2mgt 1 260 1 . . 2 1 17 17 LYS H H . . . 2 1 16 16 GLN HB2 H . . . . . 3.5 0.0 3.5 . . . . . B . 16 LYS H . . B . 15 GLN HB2 . B . 16 . H . . . B . 15 . HB1 . . c19602_2mgt 1 261 1 . . 2 1 17 17 LYS H H . . . 2 1 16 16 GLN HB2 H . . . . . 3.5 0.0 3.5 . . . . . B . 16 LYS H . . B . 15 GLN HB2 . B . 16 . H . . . B . 15 . HB2 . . c19602_2mgt 1 262 1 OR . 2 1 16 16 GLN HG3 H . . . 2 1 17 17 LYS HG2 H . . . . . 6.0 0.0 6.0 . . . . . B . 15 GLN HG3 . . B . 16 LYS HG2 . B . 15 . HG* . . . B . 16 . HG1 . . c19602_2mgt 1 262 2 OR . 2 1 17 17 LYS HG2 H . . . 2 1 16 16 GLN HG2 H . . . . . 6.0 0.0 6.0 . . . . . B . 16 LYS HG2 . . B . 15 GLN HG2 . B . 16 . HG1 . . . B . 15 . HG* . . c19602_2mgt 1 263 1 . . 2 1 2 2 ASP HB2 H . . . 2 1 2 2 ASP HA H . . . . . 3.5 0.0 3.5 . . . . . B . 1 ASP HB2 . . B . 1 ASP HA . B . 1 . HB1 . . . B . 1 . HA . . c19602_2mgt 1 264 1 OR . 2 1 4 4 GLU HA H . . . 2 1 4 4 GLU HB2 H . . . . . 3.5 0.0 3.5 . . . . . B . 3 GLU HA . . B . 3 GLU HB2 . B . 3 . HA . . . B . 3 . HB* . . c19602_2mgt 1 264 2 OR . 2 1 4 4 GLU HA H . . . 2 1 4 4 GLU HB3 H . . . . . 3.5 0.0 3.5 . . . . . B . 3 GLU HA . . B . 3 GLU HB3 . B . 3 . HA . . . B . 3 . HB* . . c19602_2mgt 1 265 1 OR . 2 1 5 5 PHE HA H . . . 2 1 5 5 PHE HB2 H . . . . . 3.5 0.0 3.5 . . . . . B . 4 PHE HA . . B . 4 PHE HB2 . B . 4 . HA . . . B . 4 . HB* . . c19602_2mgt 1 265 2 OR . 2 1 5 5 PHE HA H . . . 2 1 5 5 PHE HB3 H . . . . . 3.5 0.0 3.5 . . . . . B . 4 PHE HA . . B . 4 PHE HB3 . B . 4 . HA . . . B . 4 . HB* . . c19602_2mgt 1 266 1 . . 2 1 6 6 ARG HB2 H . . . 2 1 6 6 ARG HA H . . . . . 3.0 0.0 3.0 . . . . . B . 5 ARG HB2 . . B . 5 ARG HA . B . 5 . HB2 . . . B . 5 . HA . . c19602_2mgt 1 267 1 . . 2 1 7 7 ARG HB2 H . . . 2 1 7 7 ARG HA H . . . . . 3.0 0.0 3.0 . . . . . B . 6 ARG HB2 . . B . 6 ARG HA . B . 6 . HB2 . . . B . 6 . HA . . c19602_2mgt 1 268 1 . . 2 1 9 9 SER HA H . . . 2 1 9 9 SER HB2 H . . . . . 3.5 0.0 3.5 . . . . . B . 8 SER HA . . B . 8 SER HB2 . B . 8 . HA . . . B . 8 . HB1 . . c19602_2mgt 1 269 1 . . 2 1 9 9 SER HA H . . . 2 1 9 9 SER HB2 H . . . . . 3.5 0.0 3.5 . . . . . B . 8 SER HA . . B . 8 SER HB2 . B . 8 . HA . . . B . 8 . HB2 . . c19602_2mgt 1 270 1 . . 2 1 11 11 TYR HB2 H . . . 2 1 11 11 TYR HA H . . . . . 4.5 0.0 4.5 . . . . . B . 10 TYR HB2 . . B . 10 TYR HA . B . 10 . HB2 . . . B . 10 . HA . . c19602_2mgt 1 271 1 . . 2 1 11 11 TYR HB2 H . . . 2 1 11 11 TYR HA H . . . . . 3.5 0.0 3.5 . . . . . B . 10 TYR HB2 . . B . 10 TYR HA . B . 10 . HB1 . . . B . 10 . HA . . c19602_2mgt 1 272 1 . . 2 1 16 16 GLN HA H . . . 2 1 16 16 GLN HB2 H . . . . . 4.5 0.0 4.5 . . . . . B . 15 GLN HA . . B . 15 GLN HB2 . B . 15 . HA . . . B . 15 . HB2 . . c19602_2mgt 1 273 1 . . 2 1 16 16 GLN HA H . . . 2 1 16 16 GLN HB2 H . . . . . 2.5 0.0 2.5 . . . . . B . 15 GLN HA . . B . 15 GLN HB2 . B . 15 . HA . . . B . 15 . HB1 . . c19602_2mgt 1 274 1 . . 2 1 2 2 ASP HB2 H . . . 2 1 2 2 ASP H H . . . . . 3.5 0.0 3.5 . . . . . B . 1 ASP HB2 . . B . 1 ASP H . B . 1 . HB2 . . . B . 1 . H . . c19602_2mgt 1 275 1 . . 2 1 2 2 ASP HA H . . . 2 1 2 2 ASP H H . . . . . 3.5 0.0 3.5 . . . . . B . 1 ASP HA . . B . 1 ASP H . B . 1 . HA . . . B . 1 . H . . c19602_2mgt 1 276 1 . . 2 1 2 2 ASP HB2 H . . . 2 1 2 2 ASP H H . . . . . 3.5 0.0 3.5 . . . . . B . 1 ASP HB2 . . B . 1 ASP H . B . 1 . HB1 . . . B . 1 . H . . c19602_2mgt 1 277 1 . . 2 1 3 3 ALA H H . . . 2 1 3 3 ALA HA H . . . . . 3.5 0.0 3.5 . . . . . B . 2 ALA H . . B . 2 ALA HA . B . 2 . H . . . B . 2 . HA . . c19602_2mgt 1 278 1 . . 2 1 3 3 ALA MB H . . . 2 1 3 3 ALA H H . . . . . 3.5 0.0 3.5 . . . . . B . 2 ALA MB . . B . 2 ALA H . B . 2 . HB* . . . B . 2 . H . . c19602_2mgt 1 279 1 . . 2 1 4 4 GLU HG2 H . . . 2 1 4 4 GLU HA H . . . . . 4.5 0.0 4.5 . . . . . B . 3 GLU HG2 . . B . 3 GLU HA . B . 3 . HG1 . . . B . 3 . HA . . c19602_2mgt 1 280 1 . . 2 1 4 4 GLU HG2 H . . . 2 1 4 4 GLU H H . . . . . 4.5 0.0 4.5 . . . . . B . 3 GLU HG2 . . B . 3 GLU H . B . 3 . HG2 . . . B . 3 . H . . c19602_2mgt 1 281 1 . . 2 1 4 4 GLU HG2 H . . . 2 1 4 4 GLU HA H . . . . . 4.5 0.0 4.5 . . . . . B . 3 GLU HG2 . . B . 3 GLU HA . B . 3 . HG2 . . . B . 3 . HA . . c19602_2mgt 1 282 1 OR . 2 1 4 4 GLU H H . . . 2 1 4 4 GLU HB2 H . . . . . 3.5 0.0 3.5 . . . . . B . 3 GLU H . . B . 3 GLU HB2 . B . 3 . H . . . B . 3 . HB* . . c19602_2mgt 1 282 2 OR . 2 1 4 4 GLU H H . . . 2 1 4 4 GLU HB3 H . . . . . 3.5 0.0 3.5 . . . . . B . 3 GLU H . . B . 3 GLU HB3 . B . 3 . H . . . B . 3 . HB* . . c19602_2mgt 1 283 1 . . 2 1 4 4 GLU HG2 H . . . 2 1 4 4 GLU H H . . . . . 4.5 0.0 4.5 . . . . . B . 3 GLU HG2 . . B . 3 GLU H . B . 3 . HG1 . . . B . 3 . H . . c19602_2mgt 1 284 1 . . 2 1 4 4 GLU H H . . . 2 1 4 4 GLU HA H . . . . . 3.5 0.0 3.5 . . . . . B . 3 GLU H . . B . 3 GLU HA . B . 3 . H . . . B . 3 . HA . . c19602_2mgt 1 285 1 OR . 2 1 5 5 PHE H H . . . 2 1 5 5 PHE HB2 H . . . . . 2.5 0.0 2.5 . . . . . B . 4 PHE H . . B . 4 PHE HB2 . B . 4 . H . . . B . 4 . HB* . . c19602_2mgt 1 285 2 OR . 2 1 5 5 PHE H H . . . 2 1 5 5 PHE HB3 H . . . . . 2.5 0.0 2.5 . . . . . B . 4 PHE H . . B . 4 PHE HB3 . B . 4 . H . . . B . 4 . HB* . . c19602_2mgt 1 286 1 . . 2 1 5 5 PHE H H . . . 2 1 5 5 PHE QE H . . . . . 4.5 0.0 4.5 . . . . . B . 4 PHE H . . B . 4 PHE QE . B . 4 . H . . . B . 4 . HE* . . c19602_2mgt 1 287 1 . . 2 1 5 5 PHE QD H . . . 2 1 5 5 PHE H H . . . . . 3.5 0.0 3.5 . . . . . B . 4 PHE QD . . B . 4 PHE H . B . 4 . HD* . . . B . 4 . H . . c19602_2mgt 1 288 1 . . 2 1 5 5 PHE QD H . . . 2 1 5 5 PHE HA H . . . . . 3.5 0.0 3.5 . . . . . B . 4 PHE QD . . B . 4 PHE HA . B . 4 . HD* . . . B . 4 . HA . . c19602_2mgt 1 289 1 . . 2 1 5 5 PHE H H . . . 2 1 5 5 PHE HA H . . . . . 3.5 0.0 3.5 . . . . . B . 4 PHE H . . B . 4 PHE HA . B . 4 . H . . . B . 4 . HA . . c19602_2mgt 1 290 1 OR . 2 1 5 5 PHE QD H . . . 2 1 5 5 PHE HB2 H . . . . . 2.5 0.0 2.5 . . . . . B . 4 PHE QD . . B . 4 PHE HB2 . B . 4 . HD* . . . B . 4 . HB* . . c19602_2mgt 1 290 2 OR . 2 1 5 5 PHE QD H . . . 2 1 5 5 PHE HB3 H . . . . . 2.5 0.0 2.5 . . . . . B . 4 PHE QD . . B . 4 PHE HB3 . B . 4 . HD* . . . B . 4 . HB* . . c19602_2mgt 1 291 1 . . 2 1 6 6 ARG HG2 H . . . 2 1 6 6 ARG HE H . . . . . 4.5 0.0 4.5 . . . . . B . 5 ARG HG2 . . B . 5 ARG HE . B . 5 . HG2 . . . B . 5 . HE . . c19602_2mgt 1 292 1 . . 2 1 6 6 ARG HG2 H . . . 2 1 6 6 ARG HE H . . . . . 4.5 0.0 4.5 . . . . . B . 5 ARG HG2 . . B . 5 ARG HE . B . 5 . HG1 . . . B . 5 . HE . . c19602_2mgt 1 293 1 . . 2 1 6 6 ARG H H . . . 2 1 6 6 ARG HB2 H . . . . . 3.5 0.0 3.5 . . . . . B . 5 ARG H . . B . 5 ARG HB2 . B . 5 . H . . . B . 5 . HB1 . . c19602_2mgt 1 294 1 . . 2 1 6 6 ARG HA H . . . 2 1 6 6 ARG HE H . . . . . 2.5 0.0 2.5 . . . . . B . 5 ARG HA . . B . 5 ARG HE . B . 5 . HA . . . B . 5 . HE . . c19602_2mgt 1 295 1 . . 2 1 6 6 ARG HB2 H . . . 2 1 6 6 ARG HE H . . . . . 5.5 0.0 5.5 . . . . . B . 5 ARG HB2 . . B . 5 ARG HE . B . 5 . HB2 . . . B . 5 . HE . . c19602_2mgt 1 296 1 . . 2 1 6 6 ARG H H . . . 2 1 6 6 ARG HG2 H . . . . . 4.0 0.0 4.0 . . . . . B . 5 ARG H . . B . 5 ARG HG2 . B . 5 . H . . . B . 5 . HG1 . . c19602_2mgt 1 297 1 OR . 2 1 6 6 ARG HA H . . . 2 1 6 6 ARG HD2 H . . . . . 3.5 0.0 3.5 . . . . . B . 5 ARG HA . . B . 5 ARG HD2 . B . 5 . HA . . . B . 5 . HD* . . c19602_2mgt 1 297 2 OR . 2 1 6 6 ARG HD3 H . . . 2 1 6 6 ARG HA H . . . . . 3.5 0.0 3.5 . . . . . B . 5 ARG HD3 . . B . 5 ARG HA . B . 5 . HD* . . . B . 5 . HA . . c19602_2mgt 1 298 1 . . 2 1 6 6 ARG HA H . . . 2 1 6 6 ARG HG2 H . . . . . 6.0 0.0 6.0 . . . . . B . 5 ARG HA . . B . 5 ARG HG2 . B . 5 . HA . . . B . 5 . HG2 . . c19602_2mgt 1 299 1 . . 2 1 6 6 ARG H H . . . 2 1 6 6 ARG HG2 H . . . . . 4.5 0.0 4.5 . . . . . B . 5 ARG H . . B . 5 ARG HG2 . B . 5 . H . . . B . 5 . HG2 . . c19602_2mgt 1 300 1 . . 2 1 6 6 ARG H H . . . 2 1 6 6 ARG HB2 H . . . . . 3.5 0.0 3.5 . . . . . B . 5 ARG H . . B . 5 ARG HB2 . B . 5 . H . . . B . 5 . HB2 . . c19602_2mgt 1 301 1 . . 2 1 6 6 ARG H H . . . 2 1 6 6 ARG HA H . . . . . 3.5 0.0 3.5 . . . . . B . 5 ARG H . . B . 5 ARG HA . B . 5 . H . . . B . 5 . HA . . c19602_2mgt 1 302 1 . . 2 1 6 6 ARG HB2 H . . . 2 1 6 6 ARG HE H . . . . . 5.5 0.0 5.5 . . . . . B . 5 ARG HB2 . . B . 5 ARG HE . B . 5 . HB1 . . . B . 5 . HE . . c19602_2mgt 1 303 1 . . 2 1 7 7 ARG HE H . . . 2 1 7 7 ARG HA H . . . . . 3.5 0.0 3.5 . . . . . B . 6 ARG HE . . B . 6 ARG HA . B . 6 . HE . . . B . 6 . HA . . c19602_2mgt 1 304 1 . . 2 1 7 7 ARG HE H . . . 2 1 7 7 ARG HG2 H . . . . . 3.5 0.0 3.5 . . . . . B . 6 ARG HE . . B . 6 ARG HG2 . B . 6 . HE . . . B . 6 . HG2 . . c19602_2mgt 1 305 1 . . 2 1 7 7 ARG H H . . . 2 1 7 7 ARG HA H . . . . . 3.0 0.0 3.0 . . . . . B . 6 ARG H . . B . 6 ARG HA . B . 6 . H . . . B . 6 . HA . . c19602_2mgt 1 306 1 OR . 2 1 7 7 ARG HB2 H . . . 2 1 7 7 ARG HD2 H . . . . . 3.5 0.0 3.5 . . . . . B . 6 ARG HB2 . . B . 6 ARG HD2 . B . 6 . HB2 . . . B . 6 . HD* . . c19602_2mgt 1 306 2 OR . 2 1 7 7 ARG HD3 H . . . 2 1 7 7 ARG HB2 H . . . . . 3.5 0.0 3.5 . . . . . B . 6 ARG HD3 . . B . 6 ARG HB2 . B . 6 . HD* . . . B . 6 . HB2 . . c19602_2mgt 1 307 1 . . 2 1 7 7 ARG H H . . . 2 1 7 7 ARG HG2 H . . . . . 2.5 0.0 2.5 . . . . . B . 6 ARG H . . B . 6 ARG HG2 . B . 6 . H . . . B . 6 . HG2 . . c19602_2mgt 1 308 1 . . 2 1 7 7 ARG H H . . . 2 1 7 7 ARG HB2 H . . . . . 3.5 0.0 3.5 . . . . . B . 6 ARG H . . B . 6 ARG HB2 . B . 6 . H . . . B . 6 . HB2 . . c19602_2mgt 1 309 1 OR . 2 1 7 7 ARG HD3 H . . . 2 1 7 7 ARG HB2 H . . . . . 2.5 0.0 2.5 . . . . . B . 6 ARG HD3 . . B . 6 ARG HB2 . B . 6 . HD* . . . B . 6 . HB1 . . c19602_2mgt 1 309 2 OR . 2 1 7 7 ARG HB2 H . . . 2 1 7 7 ARG HD2 H . . . . . 2.5 0.0 2.5 . . . . . B . 6 ARG HB2 . . B . 6 ARG HD2 . B . 6 . HB1 . . . B . 6 . HD* . . c19602_2mgt 1 310 1 . . 2 1 7 7 ARG HG2 H . . . 2 1 7 7 ARG HA H . . . . . 3.0 0.0 3.0 . . . . . B . 6 ARG HG2 . . B . 6 ARG HA . B . 6 . HG2 . . . B . 6 . HA . . c19602_2mgt 1 311 1 OR . 2 1 7 7 ARG HG2 H . . . 2 1 7 7 ARG HD2 H . . . . . 2.5 0.0 2.5 . . . . . B . 6 ARG HG2 . . B . 6 ARG HD2 . B . 6 . HG2 . . . B . 6 . HD* . . c19602_2mgt 1 311 2 OR . 2 1 7 7 ARG HD3 H . . . 2 1 7 7 ARG HG2 H . . . . . 2.5 0.0 2.5 . . . . . B . 6 ARG HD3 . . B . 6 ARG HG2 . B . 6 . HD* . . . B . 6 . HG2 . . c19602_2mgt 1 312 1 . . 2 1 7 7 ARG H H . . . 2 1 7 7 ARG HB2 H . . . . . 5.5 0.0 5.5 . . . . . B . 6 ARG H . . B . 6 ARG HB2 . B . 6 . H . . . B . 6 . HB1 . . c19602_2mgt 1 313 1 . . 2 1 7 7 ARG HE H . . . 2 1 7 7 ARG HG2 H . . . . . 6.0 0.0 6.0 . . . . . B . 6 ARG HE . . B . 6 ARG HG2 . B . 6 . HE . . . B . 6 . HG1 . . c19602_2mgt 1 314 1 . . 2 1 7 7 ARG HE H . . . 2 1 7 7 ARG HB2 H . . . . . 4.5 0.0 4.5 . . . . . B . 6 ARG HE . . B . 6 ARG HB2 . B . 6 . HE . . . B . 6 . HB2 . . c19602_2mgt 1 315 1 . . 2 1 7 7 ARG H H . . . 2 1 7 7 ARG HG2 H . . . . . 5.5 0.0 5.5 . . . . . B . 6 ARG H . . B . 6 ARG HG2 . B . 6 . H . . . B . 6 . HG1 . . c19602_2mgt 1 316 1 . . 2 1 7 7 ARG HE H . . . 2 1 7 7 ARG HB2 H . . . . . 4.5 0.0 4.5 . . . . . B . 6 ARG HE . . B . 6 ARG HB2 . B . 6 . HE . . . B . 6 . HB1 . . c19602_2mgt 1 317 1 . . 2 1 8 8 ASP H H . . . 2 1 8 8 ASP HA H . . . . . 3.5 0.0 3.5 . . . . . B . 7 ASP H . . B . 7 ASP HA . B . 7 . H . . . B . 7 . HA . . c19602_2mgt 1 318 1 . . 2 1 9 9 SER H H . . . 2 1 9 9 SER HB2 H . . . . . 3.5 0.0 3.5 . . . . . B . 8 SER H . . B . 8 SER HB2 . B . 8 . H . . . B . 8 . HB1 . . c19602_2mgt 1 319 1 . . 2 1 9 9 SER H H . . . 2 1 9 9 SER HB2 H . . . . . 2.5 0.0 2.5 . . . . . B . 8 SER H . . B . 8 SER HB2 . B . 8 . H . . . B . 8 . HB2 . . c19602_2mgt 1 320 1 . . 2 1 9 9 SER HA H . . . 2 1 9 9 SER H H . . . . . 3.0 0.0 3.0 . . . . . B . 8 SER HA . . B . 8 SER H . B . 8 . HA . . . B . 8 . H . . c19602_2mgt 1 321 1 OR . 2 1 10 10 GLY H H . . . 2 1 10 10 GLY HA2 H . . . . . 3.5 0.0 3.5 . . . . . B . 9 GLY H . . B . 9 GLY HA2 . B . 9 . H . . . B . 9 . HA* . . c19602_2mgt 1 321 2 OR . 2 1 10 10 GLY HA3 H . . . 2 1 10 10 GLY H H . . . . . 3.5 0.0 3.5 . . . . . B . 9 GLY HA3 . . B . 9 GLY H . B . 9 . HA* . . . B . 9 . H . . c19602_2mgt 1 322 1 . . 2 1 11 11 TYR HB2 H . . . 2 1 11 11 TYR QE H . . . . . 4.5 0.0 4.5 . . . . . B . 10 TYR HB2 . . B . 10 TYR QE . B . 10 . HB1 . . . B . 10 . HE* . . c19602_2mgt 1 323 1 . . 2 1 11 11 TYR HB2 H . . . 2 1 11 11 TYR QE H . . . . . 6.0 0.0 6.0 . . . . . B . 10 TYR HB2 . . B . 10 TYR QE . B . 10 . HB2 . . . B . 10 . HE* . . c19602_2mgt 1 324 1 . . 2 1 11 11 TYR H H . . . 2 1 11 11 TYR HA H . . . . . 3.0 0.0 3.0 . . . . . B . 10 TYR H . . B . 10 TYR HA . B . 10 . H . . . B . 10 . HA . . c19602_2mgt 1 325 1 . . 2 1 11 11 TYR HB2 H . . . 2 1 11 11 TYR H H . . . . . 3.5 0.0 3.5 . . . . . B . 10 TYR HB2 . . B . 10 TYR H . B . 10 . HB1 . . . B . 10 . H . . c19602_2mgt 1 326 1 . . 2 1 11 11 TYR HB2 H . . . 2 1 11 11 TYR H H . . . . . 3.0 0.0 3.0 . . . . . B . 10 TYR HB2 . . B . 10 TYR H . B . 10 . HB2 . . . B . 10 . H . . c19602_2mgt 1 327 1 . . 2 1 11 11 TYR QD H . . . 2 1 11 11 TYR H H . . . . . 4.5 0.0 4.5 . . . . . B . 10 TYR QD . . B . 10 TYR H . B . 10 . HD* . . . B . 10 . H . . c19602_2mgt 1 328 1 OR . 2 1 12 12 GLU H H . . . 2 1 12 12 GLU HG2 H . . . . . 4.0 0.0 4.0 . . . . . B . 11 GLU H . . B . 11 GLU HG2 . B . 11 . H . . . B . 11 . HG* . . c19602_2mgt 1 328 2 OR . 2 1 12 12 GLU HG3 H . . . 2 1 12 12 GLU H H . . . . . 4.0 0.0 4.0 . . . . . B . 11 GLU HG3 . . B . 11 GLU H . B . 11 . HG* . . . B . 11 . H . . c19602_2mgt 1 329 1 . . 2 1 12 12 GLU HA H . . . 2 1 12 12 GLU H H . . . . . 3.5 0.0 3.5 . . . . . B . 11 GLU HA . . B . 11 GLU H . B . 11 . HA . . . B . 11 . H . . c19602_2mgt 1 330 1 . . 2 1 12 12 GLU H H . . . 2 1 12 12 GLU HB2 H . . . . . 3.0 0.0 3.0 . . . . . B . 11 GLU H . . B . 11 GLU HB2 . B . 11 . H . . . B . 11 . HB2 . . c19602_2mgt 1 331 1 . . 2 1 12 12 GLU H H . . . 2 1 12 12 GLU HB2 H . . . . . 3.5 0.0 3.5 . . . . . B . 11 GLU H . . B . 11 GLU HB2 . B . 11 . H . . . B . 11 . HB1 . . c19602_2mgt 1 332 1 . . 2 1 13 13 VAL HA H . . . 2 1 13 13 VAL MG1 H . . . . . 2.5 0.0 2.5 . . . . . B . 12 VAL HA . . B . 12 VAL MG1 . B . 12 . HA . . . B . 12 . HG1* . . c19602_2mgt 1 333 1 . . 2 1 13 13 VAL HA H . . . 2 1 13 13 VAL MG2 H . . . . . 3.5 0.0 3.5 . . . . . B . 12 VAL HA . . B . 12 VAL MG2 . B . 12 . HA . . . B . 12 . HG2* . . c19602_2mgt 1 334 1 . . 2 1 13 13 VAL HA H . . . 2 1 13 13 VAL H H . . . . . 2.5 0.0 2.5 . . . . . B . 12 VAL HA . . B . 12 VAL H . B . 12 . HA . . . B . 12 . H . . c19602_2mgt 1 335 1 . . 2 1 13 13 VAL HA H . . . 2 1 13 13 VAL MG1 H . . . . . 2.5 0.0 2.5 . . . . . B . 12 VAL HA . . B . 12 VAL MG1 . B . 12 . HA . . . B . 12 . HG1* . . c19602_2mgt 1 336 1 OR . 2 1 14 14 HIS HD2 H . . . 2 1 14 14 HIS HB3 H . . . . . 4.5 0.0 4.5 . . . . . B . 13 HIS HD2 . . B . 13 HIS HB3 . B . 13 . HD2 . . . B . 13 . HB* . . c19602_2mgt 1 336 2 OR . 2 1 14 14 HIS HB2 H . . . 2 1 14 14 HIS HD2 H . . . . . 4.5 0.0 4.5 . . . . . B . 13 HIS HB2 . . B . 13 HIS HD2 . B . 13 . HB* . . . B . 13 . HD2 . . c19602_2mgt 1 337 1 OR . 2 1 14 14 HIS H H . . . 2 1 14 14 HIS HB3 H . . . . . 3.5 0.0 3.5 . . . . . B . 13 HIS H . . B . 13 HIS HB3 . B . 13 . H . . . B . 13 . HB* . . c19602_2mgt 1 337 2 OR . 2 1 14 14 HIS H H . . . 2 1 14 14 HIS HB2 H . . . . . 3.5 0.0 3.5 . . . . . B . 13 HIS H . . B . 13 HIS HB2 . B . 13 . H . . . B . 13 . HB* . . c19602_2mgt 1 338 1 . . 2 1 14 14 HIS H H . . . 2 1 14 14 HIS HB2 H . . . . . 3.5 0.0 3.5 . . . . . B . 13 HIS H . . B . 13 HIS HB2 . B . 13 . H . . . B . 13 . HB2 . . c19602_2mgt 1 339 1 . . 2 1 14 14 HIS H H . . . 2 1 14 14 HIS HA H . . . . . 3.5 0.0 3.5 . . . . . B . 13 HIS H . . B . 13 HIS HA . B . 13 . H . . . B . 13 . HA . . c19602_2mgt 1 340 1 . . 2 1 15 15 HIS HD2 H . . . 2 1 15 15 HIS HB2 H . . . . . 3.5 0.0 3.5 . . . . . B . 14 HIS HD2 . . B . 14 HIS HB2 . B . 14 . HD2 . . . B . 14 . HB1 . . c19602_2mgt 1 341 1 . . 2 1 15 15 HIS HD2 H . . . 2 1 15 15 HIS HB2 H . . . . . 4.5 0.0 4.5 . . . . . B . 14 HIS HD2 . . B . 14 HIS HB2 . B . 14 . HD2 . . . B . 14 . HB2 . . c19602_2mgt 1 342 1 . . 2 1 15 15 HIS H H . . . 2 1 15 15 HIS HB2 H . . . . . 5.5 0.0 5.5 . . . . . B . 14 HIS H . . B . 14 HIS HB2 . B . 14 . H . . . B . 14 . HB1 . . c19602_2mgt 1 343 1 . . 2 1 15 15 HIS H H . . . 2 1 15 15 HIS HB2 H . . . . . 4.5 0.0 4.5 . . . . . B . 14 HIS H . . B . 14 HIS HB2 . B . 14 . H . . . B . 14 . HB2 . . c19602_2mgt 1 344 1 . . 2 1 15 15 HIS H H . . . 2 1 15 15 HIS HA H . . . . . 3.5 0.0 3.5 . . . . . B . 14 HIS H . . B . 14 HIS HA . B . 14 . H . . . B . 14 . HA . . c19602_2mgt 1 345 1 OR . 2 1 16 16 GLN H H . . . 2 1 16 16 GLN HG2 H . . . . . 3.5 0.0 3.5 . . . . . B . 15 GLN H . . B . 15 GLN HG2 . B . 15 . H . . . B . 15 . HG* . . c19602_2mgt 1 345 2 OR . 2 1 16 16 GLN HG3 H . . . 2 1 16 16 GLN H H . . . . . 3.5 0.0 3.5 . . . . . B . 15 GLN HG3 . . B . 15 GLN H . B . 15 . HG* . . . B . 15 . H . . c19602_2mgt 1 346 1 . . 2 1 16 16 GLN H H . . . 2 1 16 16 GLN HB2 H . . . . . 3.5 0.0 3.5 . . . . . B . 15 GLN H . . B . 15 GLN HB2 . B . 15 . H . . . B . 15 . HB1 . . c19602_2mgt 1 347 1 . . 2 1 16 16 GLN H H . . . 2 1 16 16 GLN HB2 H . . . . . 3.5 0.0 3.5 . . . . . B . 15 GLN H . . B . 15 GLN HB2 . B . 15 . H . . . B . 15 . HB2 . . c19602_2mgt 1 348 1 . . 2 1 16 16 GLN H H . . . 2 1 16 16 GLN HA H . . . . . 3.0 0.0 3.0 . . . . . B . 15 GLN H . . B . 15 GLN HA . B . 15 . H . . . B . 15 . HA . . c19602_2mgt 1 349 1 OR . 2 1 16 16 GLN HA H . . . 2 1 16 16 GLN HG2 H . . . . . 4.5 0.0 4.5 . . . . . B . 15 GLN HA . . B . 15 GLN HG2 . B . 15 . HA . . . B . 15 . HG* . . c19602_2mgt 1 349 2 OR . 2 1 16 16 GLN HG3 H . . . 2 1 16 16 GLN HA H . . . . . 4.5 0.0 4.5 . . . . . B . 15 GLN HG3 . . B . 15 GLN HA . B . 15 . HG* . . . B . 15 . HA . . c19602_2mgt 1 350 1 OR . 2 1 16 16 GLN HE21 H . . . 2 1 16 16 GLN HG2 H . . . . . 3.5 0.0 3.5 . . . . . B . 15 GLN HE21 . . B . 15 GLN HG2 . B . 15 . HE21 . . . B . 15 . HG* . . c19602_2mgt 1 350 2 OR . 2 1 16 16 GLN HG3 H . . . 2 1 16 16 GLN HE21 H . . . . . 3.5 0.0 3.5 . . . . . B . 15 GLN HG3 . . B . 15 GLN HE21 . B . 15 . HG* . . . B . 15 . HE21 . . c19602_2mgt 1 351 1 OR . 2 1 17 17 LYS HB2 H . . . 2 1 17 17 LYS HE2 H . . . . . 5.5 0.0 5.5 . . . . . B . 16 LYS HB2 . . B . 16 LYS HE2 . B . 16 . HB2 . . . B . 16 . HE* . . c19602_2mgt 1 351 2 OR . 2 1 17 17 LYS HB2 H . . . 2 1 17 17 LYS HE3 H . . . . . 5.5 0.0 5.5 . . . . . B . 16 LYS HB2 . . B . 16 LYS HE3 . B . 16 . HB2 . . . B . 16 . HE* . . c19602_2mgt 1 352 1 OR . 2 1 17 17 LYS HB2 H . . . 2 1 17 17 LYS HE3 H . . . . . 5.5 0.0 5.5 . . . . . B . 16 LYS HB2 . . B . 16 LYS HE3 . B . 16 . HB1 . . . B . 16 . HE* . . c19602_2mgt 1 352 2 OR . 2 1 17 17 LYS HB2 H . . . 2 1 17 17 LYS HE2 H . . . . . 5.5 0.0 5.5 . . . . . B . 16 LYS HB2 . . B . 16 LYS HE2 . B . 16 . HB1 . . . B . 16 . HE* . . c19602_2mgt 1 353 1 OR . 2 1 17 17 LYS HG2 H . . . 2 1 17 17 LYS HE2 H . . . . . 4.5 0.0 4.5 . . . . . B . 16 LYS HG2 . . B . 16 LYS HE2 . B . 16 . HG2 . . . B . 16 . HE* . . c19602_2mgt 1 353 2 OR . 2 1 17 17 LYS HE3 H . . . 2 1 17 17 LYS HG2 H . . . . . 4.5 0.0 4.5 . . . . . B . 16 LYS HE3 . . B . 16 LYS HG2 . B . 16 . HE* . . . B . 16 . HG2 . . c19602_2mgt 1 354 1 OR . 2 1 17 17 LYS HE3 H . . . 2 1 17 17 LYS HG2 H . . . . . 4.5 0.0 4.5 . . . . . B . 16 LYS HE3 . . B . 16 LYS HG2 . B . 16 . HE* . . . B . 16 . HG1 . . c19602_2mgt 1 354 2 OR . 2 1 17 17 LYS HG2 H . . . 2 1 17 17 LYS HE2 H . . . . . 4.5 0.0 4.5 . . . . . B . 16 LYS HG2 . . B . 16 LYS HE2 . B . 16 . HG1 . . . B . 16 . HE* . . c19602_2mgt 1 355 1 OR . 2 1 17 17 LYS HD3 H . . . 2 1 17 17 LYS HE2 H . . . . . 3.5 0.0 3.5 . . . . . B . 16 LYS HD3 . . B . 16 LYS HE2 . B . 16 . HD* . . . B . 16 . HE* . . c19602_2mgt 1 355 2 OR . 2 1 17 17 LYS HD2 H . . . 2 1 17 17 LYS HE2 H . . . . . 3.5 0.0 3.5 . . . . . B . 16 LYS HD2 . . B . 16 LYS HE2 . B . 16 . HD* . . . B . 16 . HE* . . c19602_2mgt 1 355 3 OR . 2 1 17 17 LYS HE3 H . . . 2 1 17 17 LYS HD2 H . . . . . 3.5 0.0 3.5 . . . . . B . 16 LYS HE3 . . B . 16 LYS HD2 . B . 16 . HE* . . . B . 16 . HD* . . c19602_2mgt 1 355 4 OR . 2 1 17 17 LYS HE3 H . . . 2 1 17 17 LYS HD3 H . . . . . 3.5 0.0 3.5 . . . . . B . 16 LYS HE3 . . B . 16 LYS HD3 . B . 16 . HE* . . . B . 16 . HD* . . c19602_2mgt 1 356 1 . . 2 1 17 17 LYS H H . . . 2 1 17 17 LYS HB2 H . . . . . 4.5 0.0 4.5 . . . . . B . 16 LYS H . . B . 16 LYS HB2 . B . 16 . H . . . B . 16 . HB1 . . c19602_2mgt 1 357 1 . . 2 1 17 17 LYS H H . . . 2 1 17 17 LYS HB2 H . . . . . 4.5 0.0 4.5 . . . . . B . 16 LYS H . . B . 16 LYS HB2 . B . 16 . H . . . B . 16 . HB2 . . c19602_2mgt 1 358 1 . . 2 1 17 17 LYS H H . . . 2 1 17 17 LYS HA H . . . . . 3.5 0.0 3.5 . . . . . B . 16 LYS H . . B . 16 LYS HA . B . 16 . H . . . B . 16 . HA . . c19602_2mgt 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 'Long range NOEs chain A' 1 1 1 25 c19602_2mgt 1 2 '269 AbH6R_' 2 101 2 118 c19602_2mgt 1 3 '188 AbH6R_' 3 101 3 115 c19602_2mgt 1 4 '230 AbH6R_' 4 101 4 115 c19602_2mgt 1 5 ; 175 AbH6R_ Medium-range NOEs chain A ; 5 101 7 27 c19602_2mgt 1 6 '267 AbH6R_' 8 101 8 115 c19602_2mgt 1 7 '268 AbH6R_' 9 101 9 115 c19602_2mgt 1 8 '123 AbH6R_' 10 101 10 114 c19602_2mgt 1 9 '139 AbH6R_' 11 101 11 114 c19602_2mgt 1 10 '79 AbH6R_' 12 101 12 114 c19602_2mgt 1 11 '262 AbH6R_' 13 101 13 114 c19602_2mgt 1 12 '160 AbH6R_' 14 101 14 114 c19602_2mgt 1 13 '162 AbH6R_' 15 101 15 114 c19602_2mgt 1 14 '185 AbH6R_' 16 101 16 114 c19602_2mgt 1 15 '108 AbH6R_' 17 101 17 114 c19602_2mgt 1 16 '168 AbH6R_' 18 101 18 114 c19602_2mgt 1 17 '212 AbH6R_' 19 101 19 114 c19602_2mgt 1 18 '170 AbH6R_' 20 101 20 114 c19602_2mgt 1 19 '228 AbH6R_' 21 101 21 114 c19602_2mgt 1 20 '178 AbH6R_' 22 101 22 114 c19602_2mgt 1 21 '183 AbH6R_' 23 101 23 114 c19602_2mgt 1 22 '138 AbH6R_' 24 101 24 114 c19602_2mgt 1 23 '19 AbH6R_' 25 101 25 114 c19602_2mgt 1 24 '181 AbH6R_' 26 101 26 114 c19602_2mgt 1 25 '242 AbH6R_' 27 101 27 114 c19602_2mgt 1 26 '241 AbH6R_' 28 101 28 114 c19602_2mgt 1 27 '240 AbH6R_' 29 101 29 114 c19602_2mgt 1 28 '239 AbH6R_' 30 101 30 114 c19602_2mgt 1 29 ; 21 AbH6R_ Sequential NOEs chain A ; 31 101 33 26 c19602_2mgt 1 30 '124 AbH6R_' 34 101 34 114 c19602_2mgt 1 31 '17 AbH6R_' 35 101 35 114 c19602_2mgt 1 32 '125 AbH6R_' 36 101 36 114 c19602_2mgt 1 33 '211 AbH6R_' 37 101 37 114 c19602_2mgt 1 34 '258 AbH6R_' 38 101 38 114 c19602_2mgt 1 35 '265 AbH6R_' 39 101 39 114 c19602_2mgt 1 36 '18 AbH6R_' 40 101 40 114 c19602_2mgt 1 37 '266 AbH6R_' 41 101 41 114 c19602_2mgt 1 38 '80 AbH6R_' 42 101 42 114 c19602_2mgt 1 39 '159 AbH6R_' 43 101 43 114 c19602_2mgt 1 40 '19 AbH6R_' 44 101 44 114 c19602_2mgt 1 41 '186 AbH6R_' 45 101 45 114 c19602_2mgt 1 42 '64 AbH6R_' 46 101 46 114 c19602_2mgt 1 43 '47 AbH6R_' 47 101 47 114 c19602_2mgt 1 44 '156 AbH6R_' 48 101 48 114 c19602_2mgt 1 45 '158 AbH6R_' 49 101 49 114 c19602_2mgt 1 46 '246 AbH6R_' 50 101 50 114 c19602_2mgt 1 47 '63 AbH6R_' 51 101 51 114 c19602_2mgt 1 48 '140 AbH6R_' 52 101 52 114 c19602_2mgt 1 49 '107 AbH6R_' 53 101 53 114 c19602_2mgt 1 50 '238 AbH6R_' 54 101 54 114 c19602_2mgt 1 51 '20 AbH6R_' 55 101 55 114 c19602_2mgt 1 52 '213 AbH6R_' 56 101 56 114 c19602_2mgt 1 53 '23 AbH6R_' 57 101 57 114 c19602_2mgt 1 54 '25 AbH6R_' 58 101 58 114 c19602_2mgt 1 55 '247 AbH6R_' 59 101 59 114 c19602_2mgt 1 56 '26 AbH6R_' 60 101 60 114 c19602_2mgt 1 57 '75 AbH6R_' 61 101 61 114 c19602_2mgt 1 58 '27 AbH6R_' 62 101 62 114 c19602_2mgt 1 59 '28 AbH6R_' 63 101 63 114 c19602_2mgt 1 60 '119 AbH6R_' 64 101 64 114 c19602_2mgt 1 61 '114 AbH6R_' 65 101 65 114 c19602_2mgt 1 62 '113 AbH6R_' 66 101 66 114 c19602_2mgt 1 63 '99 AbH6R_' 67 101 67 114 c19602_2mgt 1 64 '66 AbH6R_' 68 101 68 114 c19602_2mgt 1 65 '235 AbH6R_' 69 101 69 114 c19602_2mgt 1 66 '130 AbH6R_' 70 101 70 114 c19602_2mgt 1 67 '131 AbH6R_' 71 101 71 118 c19602_2mgt 1 68 '128 AbH6R_' 72 101 72 114 c19602_2mgt 1 69 '227 AbH6R_' 73 101 73 114 c19602_2mgt 1 70 '226 AbH6R_' 74 101 74 114 c19602_2mgt 1 71 '76 AbH6R_' 75 101 75 114 c19602_2mgt 1 72 '176 AbH6R_' 76 101 76 114 c19602_2mgt 1 73 '31 AbH6R_' 77 101 77 114 c19602_2mgt 1 74 '32 AbH6R_' 78 101 78 114 c19602_2mgt 1 75 '137 AbH6R_' 79 101 79 114 c19602_2mgt 1 76 '122 AbH6R_' 80 101 80 114 c19602_2mgt 1 77 '123 AbH6R_' 81 101 81 114 c19602_2mgt 1 78 '121 AbH6R_' 82 101 82 114 c19602_2mgt 1 79 '132 AbH6R_' 83 101 83 114 c19602_2mgt 1 80 '236 AbH6R_' 84 101 84 114 c19602_2mgt 1 81 '41 AbH6R_' 85 101 85 114 c19602_2mgt 1 82 '83 AbH6R_' 86 101 86 114 c19602_2mgt 1 83 '47 AbH6R_' 87 101 87 114 c19602_2mgt 1 84 ; 260 AbH6R_ Intra-residue NOEs chain A ; 88 101 90 28 c19602_2mgt 1 85 '216 AbH6R_' 91 101 91 114 c19602_2mgt 1 86 '194 AbH6R_' 92 101 92 114 c19602_2mgt 1 87 '217 AbH6R_' 93 101 93 114 c19602_2mgt 1 88 '199 AbH6R_' 94 101 94 114 c19602_2mgt 1 89 '202 AbH6R_' 95 101 95 118 c19602_2mgt 1 90 '245 AbH6R_' 96 101 96 114 c19602_2mgt 1 91 '244 AbH6R_' 97 101 97 114 c19602_2mgt 1 92 '218 AbH6R_' 98 101 98 114 c19602_2mgt 1 93 '124 AbH6R_' 99 101 99 114 c19602_2mgt 1 94 '99 AbH6R_' 100 101 100 114 c19602_2mgt 1 95 '100 AbH6R_' 101 101 101 114 c19602_2mgt 1 96 '111 AbH6R_' 102 101 102 114 c19602_2mgt 1 97 '33 AbH6R_' 103 101 103 114 c19602_2mgt 1 98 '112 AbH6R_' 104 101 104 114 c19602_2mgt 1 99 '15 AbH6R_' 105 101 105 114 c19602_2mgt 1 100 '78 AbH6R_' 106 101 106 114 c19602_2mgt 1 101 '193 AbH6R_' 107 101 107 114 c19602_2mgt 1 102 '68 AbH6R_' 108 101 108 114 c19602_2mgt 1 103 '192 AbH6R_' 109 101 109 114 c19602_2mgt 1 104 '67 AbH6R_' 110 101 110 114 c19602_2mgt 1 105 '69 AbH6R_' 111 101 111 114 c19602_2mgt 1 106 '5 AbH6R_' 112 101 112 114 c19602_2mgt 1 107 '62 AbH6R_' 113 101 113 114 c19602_2mgt 1 108 '106 AbH6R_' 114 101 114 114 c19602_2mgt 1 109 '105 AbH6R_' 115 101 115 114 c19602_2mgt 1 110 '184 AbH6R_' 116 101 116 114 c19602_2mgt 1 111 '8 AbH6R_' 117 101 117 114 c19602_2mgt 1 112 '135 AbH6R_' 118 101 118 114 c19602_2mgt 1 113 '152 AbH6R_' 119 101 119 114 c19602_2mgt 1 114 '153 AbH6R_' 120 101 120 114 c19602_2mgt 1 115 '66 AbH6R_' 121 101 121 114 c19602_2mgt 1 116 '21 AbH6R_' 122 101 122 114 c19602_2mgt 1 117 '154 AbH6R_' 123 101 123 114 c19602_2mgt 1 118 '82 AbH6R_' 124 101 124 114 c19602_2mgt 1 119 '215 AbH6R_' 125 101 125 114 c19602_2mgt 1 120 '201 AbH6R_' 126 101 126 114 c19602_2mgt 1 121 '81 AbH6R_' 127 101 127 114 c19602_2mgt 1 122 '77 AbH6R_' 128 101 128 114 c19602_2mgt 1 123 '6 AbH6R_' 129 101 129 114 c19602_2mgt 1 124 '155 AbH6R_' 130 101 130 114 c19602_2mgt 1 125 '22 AbH6R_' 131 101 131 114 c19602_2mgt 1 126 '167 AbH6R_' 132 101 132 114 c19602_2mgt 1 127 '17 AbH6R_' 133 101 133 114 c19602_2mgt 1 128 '263 AbH6R_' 134 101 134 117 c19602_2mgt 1 129 '87 AbH6R_' 135 101 135 114 c19602_2mgt 1 130 '86 AbH6R_' 136 101 136 114 c19602_2mgt 1 131 '264 AbH6R_' 137 101 137 114 c19602_2mgt 1 132 '200 AbH6R_' 138 101 138 114 c19602_2mgt 1 133 '261 AbH6R_' 139 101 139 114 c19602_2mgt 1 134 '85 AbH6R_' 140 101 140 114 c19602_2mgt 1 135 '166 AbH6R_' 141 101 141 114 c19602_2mgt 1 136 '165 AbH6R_' 142 101 142 114 c19602_2mgt 1 137 '94 AbH6R_' 143 101 143 114 c19602_2mgt 1 138 '164 AbH6R_' 144 101 144 114 c19602_2mgt 1 139 '24 AbH6R_' 145 101 145 114 c19602_2mgt 1 140 '16 AbH6R_' 146 101 146 114 c19602_2mgt 1 141 '10 AbH6R_' 147 101 147 114 c19602_2mgt 1 142 '8 AbH6R_' 148 101 148 114 c19602_2mgt 1 143 '11 AbH6R_' 149 101 149 114 c19602_2mgt 1 144 '145 AbH6R_' 150 101 150 118 c19602_2mgt 1 145 '144 AbH6R_' 151 101 151 114 c19602_2mgt 1 146 '68 AbH6R_' 152 101 152 114 c19602_2mgt 1 147 '69 AbH6R_' 153 101 153 114 c19602_2mgt 1 148 '67 AbH6R_' 154 101 154 114 c19602_2mgt 1 149 '63 AbH6R_' 155 101 155 114 c19602_2mgt 1 150 '70 AbH6R_' 156 101 156 114 c19602_2mgt 1 151 '30 AbH6R_' 157 101 157 114 c19602_2mgt 1 152 '84 AbH6R_' 158 101 158 114 c19602_2mgt 1 153 '73 AbH6R_' 159 101 159 114 c19602_2mgt 1 154 '26 AbH6R_' 160 101 160 114 c19602_2mgt 1 155 '254 AbH6R_' 161 101 161 114 c19602_2mgt 1 156 '115 AbH6R_' 162 101 162 114 c19602_2mgt 1 157 '40 AbH6R_' 163 101 163 114 c19602_2mgt 1 158 '138 AbH6R_' 164 101 164 114 c19602_2mgt 1 159 '118 AbH6R_' 165 101 165 114 c19602_2mgt 1 160 '7 AbH6R_' 166 101 166 114 c19602_2mgt 1 161 '34 AbH6R_' 167 101 167 114 c19602_2mgt 1 162 '137 AbH6R_' 168 101 168 114 c19602_2mgt 1 163 '136 AbH6R_' 169 101 169 114 c19602_2mgt 1 164 '117 AbH6R_' 170 101 170 114 c19602_2mgt 1 165 '116 AbH6R_' 171 101 171 114 c19602_2mgt 1 166 '35 AbH6R_' 172 101 172 114 c19602_2mgt 1 167 '39 AbH6R_' 173 101 173 114 c19602_2mgt 1 168 '38 AbH6R_' 174 101 174 114 c19602_2mgt 1 169 '37 AbH6R_' 175 101 175 114 c19602_2mgt 1 170 '36 AbH6R_' 176 101 176 114 c19602_2mgt 1 171 '191 AbH6R_' 177 101 177 114 c19602_2mgt 1 172 '173 AbH6R_' 178 101 178 114 c19602_2mgt 1 173 '252 AbH6R_' 179 101 179 114 c19602_2mgt 1 174 '251 AbH6R_' 180 101 180 114 c19602_2mgt 1 175 '250 AbH6R_' 181 101 181 114 c19602_2mgt 1 176 '249 AbH6R_' 182 101 182 114 c19602_2mgt 1 177 '248 AbH6R_' 183 101 183 114 c19602_2mgt 1 178 '75 AbH6R_' 184 101 184 114 c19602_2mgt 1 179 '74 AbH6R_' 185 101 185 114 c19602_2mgt 1 180 ; 11 AbH6R_ Long range NOEs chain B ; 186 101 189 26 c19602_2mgt 1 181 '269 AbH6R_' 190 101 190 118 c19602_2mgt 1 182 '188 AbH6R_' 191 101 191 115 c19602_2mgt 1 183 '230 AbH6R_' 192 101 192 115 c19602_2mgt 1 184 ; 175 AbH6R_ Medium-range NOEs chain B ; 193 101 195 28 c19602_2mgt 1 185 '267 AbH6R_' 196 101 196 115 c19602_2mgt 1 186 '268 AbH6R_' 197 101 197 115 c19602_2mgt 1 187 '123 AbH6R_' 198 101 198 114 c19602_2mgt 1 188 '139 AbH6R_' 199 101 199 114 c19602_2mgt 1 189 '79 AbH6R_' 200 101 200 114 c19602_2mgt 1 190 '262 AbH6R_' 201 101 201 114 c19602_2mgt 1 191 '160 AbH6R_' 202 101 202 114 c19602_2mgt 1 192 '162 AbH6R_' 203 101 203 114 c19602_2mgt 1 193 '185 AbH6R_' 204 101 204 114 c19602_2mgt 1 194 '108 AbH6R_' 205 101 205 114 c19602_2mgt 1 195 '168 AbH6R_' 206 101 206 114 c19602_2mgt 1 196 '212 AbH6R_' 207 101 207 114 c19602_2mgt 1 197 '170 AbH6R_' 208 101 208 114 c19602_2mgt 1 198 '228 AbH6R_' 209 101 209 114 c19602_2mgt 1 199 '178 AbH6R_' 210 101 210 114 c19602_2mgt 1 200 '183 AbH6R_' 211 101 211 114 c19602_2mgt 1 201 '138 AbH6R_' 212 101 212 114 c19602_2mgt 1 202 '19 AbH6R_' 213 101 213 114 c19602_2mgt 1 203 '181 AbH6R_' 214 101 214 114 c19602_2mgt 1 204 '242 AbH6R_' 215 101 215 114 c19602_2mgt 1 205 '241 AbH6R_' 216 101 216 114 c19602_2mgt 1 206 '240 AbH6R_' 217 101 217 114 c19602_2mgt 1 207 '239 AbH6R_' 218 101 218 114 c19602_2mgt 1 208 ; 21 AbH6R_ Sequential NOEs chain B ; 219 101 221 26 c19602_2mgt 1 209 '124 AbH6R_' 222 101 222 114 c19602_2mgt 1 210 '17 AbH6R_' 223 101 223 114 c19602_2mgt 1 211 '125 AbH6R_' 224 101 224 114 c19602_2mgt 1 212 '211 AbH6R_' 225 101 225 114 c19602_2mgt 1 213 '258 AbH6R_' 226 101 226 114 c19602_2mgt 1 214 '265 AbH6R_' 227 101 227 114 c19602_2mgt 1 215 '18 AbH6R_' 228 101 228 114 c19602_2mgt 1 216 '266 AbH6R_' 229 101 229 114 c19602_2mgt 1 217 '80 AbH6R_' 230 101 230 114 c19602_2mgt 1 218 '159 AbH6R_' 231 101 231 114 c19602_2mgt 1 219 '19 AbH6R_' 232 101 232 114 c19602_2mgt 1 220 '186 AbH6R_' 233 101 233 114 c19602_2mgt 1 221 '64 AbH6R_' 234 101 234 114 c19602_2mgt 1 222 '47 AbH6R_' 235 101 235 114 c19602_2mgt 1 223 '156 AbH6R_' 236 101 236 114 c19602_2mgt 1 224 '158 AbH6R_' 237 101 237 114 c19602_2mgt 1 225 '246 AbH6R_' 238 101 238 114 c19602_2mgt 1 226 '63 AbH6R_' 239 101 239 114 c19602_2mgt 1 227 '140 AbH6R_' 240 101 240 114 c19602_2mgt 1 228 '107 AbH6R_' 241 101 241 114 c19602_2mgt 1 229 '238 AbH6R_' 242 101 242 114 c19602_2mgt 1 230 '20 AbH6R_' 243 101 243 114 c19602_2mgt 1 231 '213 AbH6R_' 244 101 244 114 c19602_2mgt 1 232 '23 AbH6R_' 245 101 245 114 c19602_2mgt 1 233 '25 AbH6R_' 246 101 246 114 c19602_2mgt 1 234 '247 AbH6R_' 247 101 247 114 c19602_2mgt 1 235 '26 AbH6R_' 248 101 248 114 c19602_2mgt 1 236 '75 AbH6R_' 249 101 249 114 c19602_2mgt 1 237 '27 AbH6R_' 250 101 250 114 c19602_2mgt 1 238 '28 AbH6R_' 251 101 251 114 c19602_2mgt 1 239 '119 AbH6R_' 252 101 252 114 c19602_2mgt 1 240 '114 AbH6R_' 253 101 253 114 c19602_2mgt 1 241 '113 AbH6R_' 254 101 254 114 c19602_2mgt 1 242 '99 AbH6R_' 255 101 255 114 c19602_2mgt 1 243 '66 AbH6R_' 256 101 256 114 c19602_2mgt 1 244 '235 AbH6R_' 257 101 257 114 c19602_2mgt 1 245 '130 AbH6R_' 258 101 258 114 c19602_2mgt 1 246 '131 AbH6R_' 259 101 259 118 c19602_2mgt 1 247 '128 AbH6R_' 260 101 260 114 c19602_2mgt 1 248 '227 AbH6R_' 261 101 261 114 c19602_2mgt 1 249 '226 AbH6R_' 262 101 262 114 c19602_2mgt 1 250 '76 AbH6R_' 263 101 263 114 c19602_2mgt 1 251 '176 AbH6R_' 264 101 264 114 c19602_2mgt 1 252 '31 AbH6R_' 265 101 265 114 c19602_2mgt 1 253 '32 AbH6R_' 266 101 266 114 c19602_2mgt 1 254 '137 AbH6R_' 267 101 267 114 c19602_2mgt 1 255 '122 AbH6R_' 268 101 268 114 c19602_2mgt 1 256 '123 AbH6R_' 269 101 269 114 c19602_2mgt 1 257 '121 AbH6R_' 270 101 270 114 c19602_2mgt 1 258 '132 AbH6R_' 271 101 271 114 c19602_2mgt 1 259 '236 AbH6R_' 272 101 272 114 c19602_2mgt 1 260 '41 AbH6R_' 273 101 273 114 c19602_2mgt 1 261 '83 AbH6R_' 274 101 274 114 c19602_2mgt 1 262 '47 AbH6R_' 275 101 275 114 c19602_2mgt 1 263 ; 260 AbH6R_ Intra-residue NOEs chain B ; 276 101 278 29 c19602_2mgt 1 264 '216 AbH6R_' 279 101 279 114 c19602_2mgt 1 265 '194 AbH6R_' 280 101 280 114 c19602_2mgt 1 266 '217 AbH6R_' 281 101 281 114 c19602_2mgt 1 267 '199 AbH6R_' 282 101 282 114 c19602_2mgt 1 268 '202 AbH6R_' 283 101 283 118 c19602_2mgt 1 269 '245 AbH6R_' 284 101 284 114 c19602_2mgt 1 270 '244 AbH6R_' 285 101 285 114 c19602_2mgt 1 271 '218 AbH6R_' 286 101 286 114 c19602_2mgt 1 272 '124 AbH6R_' 287 101 287 114 c19602_2mgt 1 273 '99 AbH6R_' 288 101 288 114 c19602_2mgt 1 274 '100 AbH6R_' 289 101 289 114 c19602_2mgt 1 275 '111 AbH6R_' 290 101 290 114 c19602_2mgt 1 276 '33 AbH6R_' 291 101 291 114 c19602_2mgt 1 277 '112 AbH6R_' 292 101 292 114 c19602_2mgt 1 278 '15 AbH6R_' 293 101 293 114 c19602_2mgt 1 279 '78 AbH6R_' 294 101 294 114 c19602_2mgt 1 280 '193 AbH6R_' 295 101 295 114 c19602_2mgt 1 281 '68 AbH6R_' 296 101 296 114 c19602_2mgt 1 282 '192 AbH6R_' 297 101 297 114 c19602_2mgt 1 283 '67 AbH6R_' 298 101 298 114 c19602_2mgt 1 284 '69 AbH6R_' 299 101 299 114 c19602_2mgt 1 285 '5 AbH6R_' 300 101 300 114 c19602_2mgt 1 286 '62 AbH6R_' 301 101 301 114 c19602_2mgt 1 287 '106 AbH6R_' 302 101 302 114 c19602_2mgt 1 288 '105 AbH6R_' 303 101 303 114 c19602_2mgt 1 289 '184 AbH6R_' 304 101 304 114 c19602_2mgt 1 290 '8 AbH6R_' 305 101 305 114 c19602_2mgt 1 291 '135 AbH6R_' 306 101 306 114 c19602_2mgt 1 292 '152 AbH6R_' 307 101 307 114 c19602_2mgt 1 293 '153 AbH6R_' 308 101 308 114 c19602_2mgt 1 294 '66 AbH6R_' 309 101 309 114 c19602_2mgt 1 295 '21 AbH6R_' 310 101 310 114 c19602_2mgt 1 296 '154 AbH6R_' 311 101 311 114 c19602_2mgt 1 297 '82 AbH6R_' 312 101 312 114 c19602_2mgt 1 298 '215 AbH6R_' 313 101 313 114 c19602_2mgt 1 299 '201 AbH6R_' 314 101 314 114 c19602_2mgt 1 300 '81 AbH6R_' 315 101 315 114 c19602_2mgt 1 301 '77 AbH6R_' 316 101 316 114 c19602_2mgt 1 302 '6 AbH6R_' 317 101 317 114 c19602_2mgt 1 303 '155 AbH6R_' 318 101 318 114 c19602_2mgt 1 304 '22 AbH6R_' 319 101 319 114 c19602_2mgt 1 305 '167 AbH6R_' 320 101 320 114 c19602_2mgt 1 306 '17 AbH6R_' 321 101 321 114 c19602_2mgt 1 307 '263 AbH6R_' 322 101 322 117 c19602_2mgt 1 308 '87 AbH6R_' 323 101 323 114 c19602_2mgt 1 309 '86 AbH6R_' 324 101 324 114 c19602_2mgt 1 310 '264 AbH6R_' 325 101 325 114 c19602_2mgt 1 311 '200 AbH6R_' 326 101 326 114 c19602_2mgt 1 312 '261 AbH6R_' 327 101 327 114 c19602_2mgt 1 313 '85 AbH6R_' 328 101 328 114 c19602_2mgt 1 314 '166 AbH6R_' 329 101 329 114 c19602_2mgt 1 315 '165 AbH6R_' 330 101 330 114 c19602_2mgt 1 316 '94 AbH6R_' 331 101 331 114 c19602_2mgt 1 317 '164 AbH6R_' 332 101 332 114 c19602_2mgt 1 318 '24 AbH6R_' 333 101 333 114 c19602_2mgt 1 319 '16 AbH6R_' 334 101 334 114 c19602_2mgt 1 320 '10 AbH6R_' 335 101 335 114 c19602_2mgt 1 321 '8 AbH6R_' 336 101 336 114 c19602_2mgt 1 322 '11 AbH6R_' 337 101 337 114 c19602_2mgt 1 323 '145 AbH6R_' 338 101 338 118 c19602_2mgt 1 324 '144 AbH6R_' 339 101 339 114 c19602_2mgt 1 325 '68 AbH6R_' 340 101 340 114 c19602_2mgt 1 326 '69 AbH6R_' 341 101 341 114 c19602_2mgt 1 327 '67 AbH6R_' 342 101 342 114 c19602_2mgt 1 328 '63 AbH6R_' 343 101 343 114 c19602_2mgt 1 329 '70 AbH6R_' 344 101 344 114 c19602_2mgt 1 330 '30 AbH6R_' 345 101 345 114 c19602_2mgt 1 331 '84 AbH6R_' 346 101 346 114 c19602_2mgt 1 332 '73 AbH6R_' 347 101 347 114 c19602_2mgt 1 333 '26 AbH6R_' 348 101 348 114 c19602_2mgt 1 334 '254 AbH6R_' 349 101 349 114 c19602_2mgt 1 335 '115 AbH6R_' 350 101 350 114 c19602_2mgt 1 336 '40 AbH6R_' 351 101 351 114 c19602_2mgt 1 337 '138 AbH6R_' 352 101 352 114 c19602_2mgt 1 338 '118 AbH6R_' 353 101 353 114 c19602_2mgt 1 339 '7 AbH6R_' 354 101 354 114 c19602_2mgt 1 340 '34 AbH6R_' 355 101 355 114 c19602_2mgt 1 341 '137 AbH6R_' 356 101 356 114 c19602_2mgt 1 342 '136 AbH6R_' 357 101 357 114 c19602_2mgt 1 343 '117 AbH6R_' 358 101 358 114 c19602_2mgt 1 344 '116 AbH6R_' 359 101 359 114 c19602_2mgt 1 345 '35 AbH6R_' 360 101 360 114 c19602_2mgt 1 346 '39 AbH6R_' 361 101 361 114 c19602_2mgt 1 347 '38 AbH6R_' 362 101 362 114 c19602_2mgt 1 348 '37 AbH6R_' 363 101 363 114 c19602_2mgt 1 349 '36 AbH6R_' 364 101 364 114 c19602_2mgt 1 350 '191 AbH6R_' 365 101 365 114 c19602_2mgt 1 351 '173 AbH6R_' 366 101 366 114 c19602_2mgt 1 352 '252 AbH6R_' 367 101 367 114 c19602_2mgt 1 353 '251 AbH6R_' 368 101 368 114 c19602_2mgt 1 354 '250 AbH6R_' 369 101 369 114 c19602_2mgt 1 355 '249 AbH6R_' 370 101 370 114 c19602_2mgt 1 356 '248 AbH6R_' 371 101 371 114 c19602_2mgt 1 357 '75 AbH6R_' 372 101 372 114 c19602_2mgt 1 358 '74 AbH6R_' 373 101 373 114 c19602_2mgt 1 359 '11 AbH6R_' 374 101 374 114 c19602_2mgt 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 c19602_2mgt _Gen_dist_constraint_list.ID 2 _Gen_dist_constraint_list.Constraint_type 'general distance' _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 . . . . c19602_2mgt 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 . . 3 2 1 1 ZN ZN Zn . . . 1 1 12 12 GLU OE1 O . . . . . 2.1 1.6 2.6 . . . . . A . 101 ZN ZN . . A . 11 GLU OE1 . . . 17 . ZN . . . A . 11 . OE1 . . c19602_2mgt 2 2 1 . . 3 2 1 1 ZN ZN Zn . . . 1 1 12 12 GLU OE2 O . . . . . 2.1 1.6 2.6 . . . . . A . 101 ZN ZN . . A . 11 GLU OE2 . . . 17 . ZN . . . A . 11 . OE2 . . c19602_2mgt 2 3 1 . . 3 2 1 1 ZN ZN Zn . . . 1 1 15 15 HIS NE2 N . . . . . 2.1 1.6 2.6 . . . . . A . 101 ZN ZN . . A . 14 HIS NE2 . . . 17 . ZN . . . A . 14 . NE2 . . c19602_2mgt 2 4 1 . . 3 2 1 1 ZN ZN Zn . . . 2 1 12 12 GLU OE1 O . . . . . 2.1 1.6 2.6 . . . . . A . 101 ZN ZN . . B . 11 GLU OE1 . . . 17 . ZN . . . B . 11 . OE1 . . c19602_2mgt 2 5 1 . . 3 2 1 1 ZN ZN Zn . . . 2 1 12 12 GLU OE2 O . . . . . 2.1 1.6 2.6 . . . . . A . 101 ZN ZN . . B . 11 GLU OE2 . . . 17 . ZN . . . B . 11 . OE2 . . c19602_2mgt 2 6 1 . . 3 2 1 1 ZN ZN Zn . . . 2 1 15 15 HIS NE2 N . . . . . 2.1 1.6 2.6 . . . . . A . 101 ZN ZN . . B . 14 HIS NE2 . . . 17 . ZN . . . B . 14 . NE2 . . c19602_2mgt 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 'Zn RESTRAINTS' 1 1 1 15 c19602_2mgt 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 c19602_2mgt _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 . . . . c19602_2mgt 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 12 12 GLU CD C . . 2 1 15 15 HIS NE2 N . . 3 2 1 1 ZN ZN Zn . . 2 1 12 12 GLU CD C . 115.0 125.0 . . . A . 11 GLU CD . . B . 14 HIS NE2 . . A . 101 ZN ZN . . B . 11 GLU CD . A . 11 . CD . . . B . 14 . NE2 . . . . . 17 . ZN . . . B . 11 . CD . . c19602_2mgt 1 2 . . 1 1 12 12 GLU CD C . . 2 1 15 15 HIS NE2 N . . 3 2 1 1 ZN ZN Zn . . 2 1 12 12 GLU CD C . 115.0 125.0 . . . A . 11 GLU CD . . B . 14 HIS NE2 . . A . 101 ZN ZN . . B . 11 GLU CD . A . 11 . CD . . . B . 14 . NE2 . . . . . 17 . ZN . . . B . 11 . CD . . c19602_2mgt 1 3 . . 1 1 12 12 GLU CD C . . 2 1 15 15 HIS NE2 N . . 3 2 1 1 ZN ZN Zn . . 2 1 12 12 GLU CD C . 115.0 125.0 . . . A . 11 GLU CD . . B . 14 HIS NE2 . . A . 101 ZN ZN . . B . 11 GLU CD . A . 11 . CD . . . B . 14 . NE2 . . . . . 17 . ZN . . . B . 11 . CD . . c19602_2mgt 1 4 . . 2 1 12 12 GLU CD C . . 2 1 15 15 HIS NE2 N . . 3 2 1 1 ZN ZN Zn . . 1 1 15 15 HIS NE2 N . 115.0 125.0 . . . B . 11 GLU CD . . B . 14 HIS NE2 . . A . 101 ZN ZN . . A . 14 HIS NE2 . B . 11 . CD . . . B . 14 . NE2 . . . . . 17 . ZN . . . A . 14 . NE2 . . c19602_2mgt 1 5 . . 2 1 12 12 GLU CD C . . 2 1 15 15 HIS NE2 N . . 3 2 1 1 ZN ZN Zn . . 1 1 15 15 HIS NE2 N . 115.0 125.0 . . . B . 11 GLU CD . . B . 14 HIS NE2 . . A . 101 ZN ZN . . A . 14 HIS NE2 . B . 11 . CD . . . B . 14 . NE2 . . . . . 17 . ZN . . . A . 14 . NE2 . . c19602_2mgt 1 6 . . 1 1 15 15 HIS NE2 N . . 2 1 15 15 HIS NE2 N . . 3 2 1 1 ZN ZN Zn . . 1 1 12 12 GLU CD C . 115.0 125.0 . . . A . 14 HIS NE2 . . B . 14 HIS NE2 . . A . 101 ZN ZN . . A . 11 GLU CD . A . 14 . NE2 . . . B . 14 . NE2 . . . . . 17 . ZN . . . A . 11 . CD . . c19602_2mgt 1 7 . . 1 1 15 15 HIS NE2 N . . 2 1 15 15 HIS NE2 N . . 3 2 1 1 ZN ZN Zn . . 1 1 12 12 GLU CD C . 115.0 125.0 . . . A . 14 HIS NE2 . . B . 14 HIS NE2 . . A . 101 ZN ZN . . A . 11 GLU CD . A . 14 . NE2 . . . B . 14 . NE2 . . . . . 17 . ZN . . . A . 11 . CD . . c19602_2mgt 1 8 . . 1 1 15 15 HIS NE2 N . . 2 1 15 15 HIS NE2 N . . 3 2 1 1 ZN ZN Zn . . 1 1 12 12 GLU CD C . 115.0 125.0 . . . A . 14 HIS NE2 . . B . 14 HIS NE2 . . A . 101 ZN ZN . . A . 11 GLU CD . A . 14 . NE2 . . . B . 14 . NE2 . . . . . 17 . ZN . . . A . 11 . CD . . c19602_2mgt 1 9 . . 2 1 12 12 GLU CD C . . 1 1 15 15 HIS NE2 N . . 3 2 1 1 ZN ZN Zn . . 1 1 12 12 GLU CD C . 115.0 125.0 . . . B . 11 GLU CD . . A . 14 HIS NE2 . . A . 101 ZN ZN . . A . 11 GLU CD . B . 11 . CD . . . A . 14 . NE2 . . . . . 17 . ZN . . . A . 11 . CD . . c19602_2mgt 1 10 . . 2 1 12 12 GLU CD C . . 1 1 15 15 HIS NE2 N . . 3 2 1 1 ZN ZN Zn . . 1 1 12 12 GLU CD C . 115.0 125.0 . . . B . 11 GLU CD . . A . 14 HIS NE2 . . A . 101 ZN ZN . . A . 11 GLU CD . B . 11 . CD . . . A . 14 . NE2 . . . . . 17 . ZN . . . A . 11 . CD . . c19602_2mgt 1 11 . . 2 1 12 12 GLU CD C . . 1 1 15 15 HIS NE2 N . . 3 2 1 1 ZN ZN Zn . . 1 1 12 12 GLU CD C . 115.0 125.0 . . . B . 11 GLU CD . . A . 14 HIS NE2 . . A . 101 ZN ZN . . A . 11 GLU CD . B . 11 . CD . . . A . 14 . NE2 . . . . . 17 . ZN . . . A . 11 . CD . . c19602_2mgt 1 12 . . 3 2 1 1 ZN ZN Zn . . 1 1 12 12 GLU OE2 O . . 1 1 12 12 GLU CD C . . 1 1 12 12 GLU CG C . 175.0 185.0 . . . A . 101 ZN ZN . . A . 11 GLU OE2 . . A . 11 GLU CD . . A . 11 GLU CG . . . 17 . ZN . . . A . 11 . OE2 . . . A . 11 . CD . . . A . 11 . CG . . c19602_2mgt 1 13 . . 3 2 1 1 ZN ZN Zn . . 1 1 12 12 GLU OE1 O . . 1 1 12 12 GLU CD C . . 1 1 12 12 GLU CG C . -185.0 -175.0 . . . A . 101 ZN ZN . . A . 11 GLU OE1 . . A . 11 GLU CD . . A . 11 GLU CG . . . 17 . ZN . . . A . 11 . OE1 . . . A . 11 . CD . . . A . 11 . CG . . c19602_2mgt 1 14 . . 3 2 1 1 ZN ZN Zn . . 1 1 15 15 HIS NE2 N . . 1 1 15 15 HIS CE1 C . . 1 1 15 15 HIS ND1 N . 175.0 185.0 . . . A . 101 ZN ZN . . A . 14 HIS NE2 . . A . 14 HIS CE1 . . A . 14 HIS ND1 . . . 17 . ZN . . . A . 14 . NE2 . . . A . 14 . CE1 . . . A . 14 . ND1 . . c19602_2mgt 1 15 . . 3 2 1 1 ZN ZN Zn . . 1 1 15 15 HIS NE2 N . . 1 1 15 15 HIS CD2 C . . 1 1 15 15 HIS CG C . -185.0 -175.0 . . . A . 101 ZN ZN . . A . 14 HIS NE2 . . A . 14 HIS CD2 . . A . 14 HIS CG . . . 17 . ZN . . . A . 14 . NE2 . . . A . 14 . CD2 . . . A . 14 . CG . . c19602_2mgt 1 16 . . 3 2 1 1 ZN ZN Zn . . 2 1 12 12 GLU OE2 O . . 2 1 12 12 GLU CD C . . 2 1 12 12 GLU CG C . 175.0 185.0 . . . A . 101 ZN ZN . . B . 11 GLU OE2 . . B . 11 GLU CD . . B . 11 GLU CG . . . 17 . ZN . . . B . 11 . OE2 . . . B . 11 . CD . . . B . 11 . CG . . c19602_2mgt 1 17 . . 3 2 1 1 ZN ZN Zn . . 2 1 12 12 GLU OE1 O . . 2 1 12 12 GLU CD C . . 2 1 12 12 GLU CG C . -185.0 -175.0 . . . A . 101 ZN ZN . . B . 11 GLU OE1 . . B . 11 GLU CD . . B . 11 GLU CG . . . 17 . ZN . . . B . 11 . OE1 . . . B . 11 . CD . . . B . 11 . CG . . c19602_2mgt 1 18 . . 3 2 1 1 ZN ZN Zn . . 2 1 15 15 HIS NE2 N . . 2 1 15 15 HIS CE1 C . . 2 1 15 15 HIS ND1 N . 175.0 185.0 . . . A . 101 ZN ZN . . B . 14 HIS NE2 . . B . 14 HIS CE1 . . B . 14 HIS ND1 . . . 17 . ZN . . . B . 14 . NE2 . . . B . 14 . CE1 . . . B . 14 . ND1 . . c19602_2mgt 1 19 . . 3 2 1 1 ZN ZN Zn . . 2 1 15 15 HIS NE2 N . . 2 1 15 15 HIS CD2 C . . 2 1 15 15 HIS CG C . -185.0 -175.0 . . . A . 101 ZN ZN . . B . 14 HIS NE2 . . B . 14 HIS CD2 . . B . 14 HIS CG . . . 17 . ZN . . . B . 14 . NE2 . . . B . 14 . CD2 . . . B . 14 . CG . . c19602_2mgt 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 'impropers for Zn coordination taken from QM/MM calculations' 1 1 1 68 c19602_2mgt 1 stop_ loop_ _TA_constraint_conv_err.ID _TA_constraint_conv_err.Parse_file_ID _TA_constraint_conv_err.Parse_file_constraint_ID _TA_constraint_conv_err.Conv_error_type _TA_constraint_conv_err.Conv_error_note _TA_constraint_conv_err.Entry_ID _TA_constraint_conv_err.Torsion_angle_constraint_list_ID 1 4 6 1 'Not handling dihedral restraint (original ID 6) - duplicate resonances' c19602_2mgt 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 c19602_2mgt _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 PROTEIN FIBRIL, METAL BINDING PROTEIN 06-NOV-13 2MGT *TITLE ZINC INDUCED DIMER OF THE METAL BINDING DOMAIN 1-16 OF HUMAN AMYLOID *TITLE 2 BETA-PEPTIDE WITH ALZHEIMER'S DISEASE PATHOGENIC ENGLISH MUTATION H6R *COMPND MOL_ID: 1; *COMPND 2 MOLECULE: AMYLOID BETA A4 PROTEIN; *COMPND 3 CHAIN: A, B; *COMPND 4 FRAGMENT: METAL BINDING DOMAIN, UNP RESIDUES 672-687; *COMPND 5 ENGINEERED: YES; *COMPND 6 MUTATION: YES *SOURCE MOL_ID: 1; *SOURCE 2 SYNTHETIC: YES; *SOURCE 3 ORGANISM_SCIENTIFIC: HOMO SAPIENS; *SOURCE 4 ORGANISM_COMMON: HUMAN; *SOURCE 5 ORGANISM_TAXID: 9606; *SOURCE 6 OTHER_DETAILS: PURCHASED FROM BIOPEPTIDE CO., LLC (SAN DIEGO, CA, *SOURCE 7 USA) *KEYWDS ALZHEIMER'S DISEASE, HUMAN AMYLOID -PEPTIDE, ZINC BINDING, PROTEIN *KEYWDS 2 FIBRIL, METAL BINDING PROTEIN *EXPDTA SOLUTION NMR *NUMMDL 20 *AUTHOR V.POLSHAKOV, A.ISTRATE, S.KOZIN *REVDAT 1 12-NOV-14 2MGT 0 ; save_