data_c19759_2mk7 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID c19759_2mk7 _Entry.Title ; Tetra-O-GalNAc glycosylated mucin sequence from alpha dystroglycan mucin domain ; _Entry.Type . _Entry.Version_type original _Entry.Submission_date 2014-02-02 _Entry.Accession_date 2014-02-02 _Entry.Last_release_date 2015-02-02 _Entry.Original_release_date 2015-02-02 _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 NMR' _Entry.Details 'Effects of O-GalNAc glycosylation on structure' _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 David Live . . . c19759_2mk7 2 Andrew Borgert . . . c19759_2mk7 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' . c19759_2mk7 stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID alpha-dystroglycan . c19759_2mk7 glycoprotein . c19759_2mk7 glycosylation . c19759_2mk7 'mucin domain' . c19759_2mk7 N-acetyl-galactosamine . c19759_2mk7 'Tn antigen' . c19759_2mk7 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 c19759_2mk7 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 62 c19759_2mk7 '15N chemical shifts' 10 c19759_2mk7 '1H chemical shifts' 109 c19759_2mk7 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 . . 2015-02-02 2014-02-02 original author . c19759_2mk7 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 2MK7 'BMRB Entry Tracking System' c19759_2mk7 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID c19759_2mk7 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID . _Citation.Full_citation . _Citation.Title 'Differential Conformational Effects of O-GalNAc and O-Man Glycan Protein Modifications: Implications for the role of O-GalNAc glycans in the Mucin-Like Region of alpha-Dystroglycan' _Citation.Status 'in preparation' _Citation.Type journal _Citation.Journal_abbrev 'to be published' _Citation.Journal_name_full . _Citation.Journal_volume . _Citation.Journal_issue . _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 . _Citation.Page_last . _Citation.Year . _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Andrew Borgert . . . c19759_2mk7 1 2 Lachele Foley . . . c19759_2mk7 1 3 David Live . . . c19759_2mk7 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID c19759_2mk7 _Assembly.ID 1 _Assembly.Name 'Tetra-O-GalNAc glycosylated mucin sequence from alpha dystroglycan mucin domain' _Assembly.BMRB_code . _Assembly.Number_of_components 2 _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 aDG_Mucin_Domain_Peptide 1 $aDG_Mucin_Domain_Peptide A . yes native no no . . . c19759_2mk7 1 2 'SUGAR (4-MER)' 2 $SUGAR_(4-MER) B . yes native no no . . . c19759_2mk7 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_aDG_Mucin_Domain_Peptide _Entity.Sf_category entity _Entity.Sf_framecode aDG_Mucin_Domain_Peptide _Entity.Entry_ID c19759_2mk7 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name aDG_Mucin_Domain_Peptide _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID A _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code XPPTTTTKKPX _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details 'All T residues in this molecule are modified with alpha-linked N-acetylgalactosamine' _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 11 _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 936.116 _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 . ACE . c19759_2mk7 1 2 . PRO . c19759_2mk7 1 3 . PRO . c19759_2mk7 1 4 . THR . c19759_2mk7 1 5 . THR . c19759_2mk7 1 6 . THR . c19759_2mk7 1 7 . THR . c19759_2mk7 1 8 . LYS . c19759_2mk7 1 9 . LYS . c19759_2mk7 1 10 . PRO . c19759_2mk7 1 11 . NH2 . c19759_2mk7 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 c19759_2mk7 1 . PRO 2 2 c19759_2mk7 1 . PRO 3 3 c19759_2mk7 1 . THR 4 4 c19759_2mk7 1 . THR 5 5 c19759_2mk7 1 . THR 6 6 c19759_2mk7 1 . THR 7 7 c19759_2mk7 1 . LYS 8 8 c19759_2mk7 1 . LYS 9 9 c19759_2mk7 1 . PRO 10 10 c19759_2mk7 1 . NH2 11 11 c19759_2mk7 1 stop_ save_ save_SUGAR_(4-MER) _Entity.Sf_category entity _Entity.Sf_framecode SUGAR_(4-MER) _Entity.Entry_ID c19759_2mk7 _Entity.ID 2 _Entity.BMRB_code . _Entity.Name SUGAR_(4-MER) _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polysaccharide(D) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID B _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code XXXX _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 4 _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 . _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 . A2G . c19759_2mk7 2 2 . A2G . c19759_2mk7 2 3 . A2G . c19759_2mk7 2 4 . A2G . c19759_2mk7 2 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 . A2G 1 1 c19759_2mk7 2 . A2G 2 2 c19759_2mk7 2 . A2G 3 3 c19759_2mk7 2 . A2G 4 4 c19759_2mk7 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 c19759_2mk7 _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 $aDG_Mucin_Domain_Peptide . 9606 organism . 'Homo sapiens' human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . . . . DAG1 . . . . c19759_2mk7 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 c19759_2mk7 _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 $aDG_Mucin_Domain_Peptide . 'chemical synthesis' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . c19759_2mk7 1 stop_ save_ ################################# # Polymer residues and ligands # ################################# save_chem_comp_ACE _Chem_comp.Sf_category chem_comp _Chem_comp.Sf_framecode chem_comp_ACE _Chem_comp.Entry_ID c19759_2mk7 _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 c19759_2mk7 ACE CC=O SMILES 'OpenEye OEToolkits' 1.5.0 c19759_2mk7 ACE CC=O SMILES_CANONICAL CACTVS 3.341 c19759_2mk7 ACE CC=O SMILES_CANONICAL 'OpenEye OEToolkits' 1.5.0 c19759_2mk7 ACE IKHGUXGNUITLKF-UHFFFAOYSA-N InChIKey InChI 1.03 c19759_2mk7 ACE InChI=1S/C2H4O/c1-2-3/h2H,1H3 InChI InChI 1.03 c19759_2mk7 ACE O=CC SMILES ACDLabs 10.04 c19759_2mk7 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 c19759_2mk7 ACE ethanal 'SYSTEMATIC NAME' 'OpenEye OEToolkits' 1.5.0 c19759_2mk7 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 . c19759_2mk7 ACE O O O O . O . . N 0 . . . 1 no no . . . . 1.973 . -10.223 . 6.862 . -1.113 -0.252 0.000 2 . c19759_2mk7 ACE CH3 CH3 CH3 CH3 . C . . N 0 . . . 1 no no . . . . -0.322 . -10.677 . 7.405 . 1.241 -0.167 0.000 3 . c19759_2mk7 ACE H H H H . H . . N 0 . . . 1 no no . . . . 0.685 . -9.453 . 5.669 . -0.240 1.528 0.000 4 . c19759_2mk7 ACE H1 H1 H1 1H . H . . N 0 . . . 1 no no . . . . -1.191 . -10.444 . 7.018 . 1.360 -0.785 0.890 5 . c19759_2mk7 ACE H2 H2 H2 2H . H . . N 0 . . . 1 no no . . . . -0.269 . -10.331 . 8.320 . 1.360 -0.785 -0.890 6 . c19759_2mk7 ACE H3 H3 H3 3H . H . . N 0 . . . 1 no no . . . . -0.221 . -11.652 . 7.418 . 1.995 0.620 0.000 7 . c19759_2mk7 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 . c19759_2mk7 ACE 2 . SING C CH3 no N 2 . c19759_2mk7 ACE 3 . SING C H no N 3 . c19759_2mk7 ACE 4 . SING CH3 H1 no N 4 . c19759_2mk7 ACE 5 . SING CH3 H2 no N 5 . c19759_2mk7 ACE 6 . SING CH3 H3 no N 6 . c19759_2mk7 ACE stop_ save_ save_chem_comp_NH2 _Chem_comp.Sf_category chem_comp _Chem_comp.Sf_framecode chem_comp_NH2 _Chem_comp.Entry_ID c19759_2mk7 _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 c19759_2mk7 NH2 N SMILES ACDLabs 10.04 c19759_2mk7 NH2 [NH2] SMILES CACTVS 3.341 c19759_2mk7 NH2 [NH2] SMILES 'OpenEye OEToolkits' 1.5.0 c19759_2mk7 NH2 [NH2] SMILES_CANONICAL CACTVS 3.341 c19759_2mk7 NH2 [NH2] SMILES_CANONICAL 'OpenEye OEToolkits' 1.5.0 c19759_2mk7 NH2 QGZKDVFQNNGYKY-UHFFFAOYAF InChIKey InChI 1.02b c19759_2mk7 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 c19759_2mk7 NH2 l^{2}-azane 'SYSTEMATIC NAME' 'OpenEye OEToolkits' 1.5.0 c19759_2mk7 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 . c19759_2mk7 NH2 HN1 HN1 HN1 1HN . H . . N 0 . . . 1 no no . . . . 9.517 . 8.769 . -7.044 . -0.385 -0.545 -0.771 2 . c19759_2mk7 NH2 HN2 HN2 HN2 2HN . H . . N 0 . . . 1 no no . . . . 10.323 . 9.890 . -8.082 . 1.020 0.000 0.000 3 . c19759_2mk7 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 . c19759_2mk7 NH2 2 . SING N HN2 no N 2 . c19759_2mk7 NH2 stop_ save_ save_chem_comp_A2G _Chem_comp.Sf_category chem_comp _Chem_comp.Sf_framecode chem_comp_A2G _Chem_comp.Entry_ID c19759_2mk7 _Chem_comp.ID A2G _Chem_comp.Provenance PDB _Chem_comp.Name N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE _Chem_comp.Type SACCHARIDE _Chem_comp.BMRB_code A2G _Chem_comp.PDB_code A2G _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 A2G _Chem_comp.Number_atoms_all 30 _Chem_comp.Number_atoms_nh 15 _Chem_comp.PubChem_code . _Chem_comp.Subcomponent_list . _Chem_comp.InCHi_code InChI=1S/C8H15NO6/c1-3(11)9-5-7(13)6(12)4(2-10)15-8(5)14/h4-8,10,12-14H,2H2,1H3,(H,9,11)/t4-,5-,6+,7-,8+/m1/s1 _Chem_comp.Mon_nstd_flag . _Chem_comp.Mon_nstd_class . _Chem_comp.Mon_nstd_details . _Chem_comp.Mon_nstd_parent . _Chem_comp.Mon_nstd_parent_comp_ID . _Chem_comp.Std_deriv_one_letter_code . _Chem_comp.Std_deriv_three_letter_code . _Chem_comp.Std_deriv_BMRB_code . _Chem_comp.Std_deriv_PDB_code . _Chem_comp.Std_deriv_chem_comp_name . _Chem_comp.Synonyms . _Chem_comp.Formal_charge 0 _Chem_comp.Paramagnetic . _Chem_comp.Aromatic no _Chem_comp.Formula 'C8 H15 N O6' _Chem_comp.Formula_weight 221.208 _Chem_comp.Formula_mono_iso_wt_nat . _Chem_comp.Formula_mono_iso_wt_13C . _Chem_comp.Formula_mono_iso_wt_15N . _Chem_comp.Formula_mono_iso_wt_13C_15N . _Chem_comp.Image_file_name . _Chem_comp.Image_file_format . _Chem_comp.Topo_file_name . _Chem_comp.Topo_file_format . _Chem_comp.Struct_file_name . _Chem_comp.Struct_file_format . _Chem_comp.Stereochem_param_file_name . _Chem_comp.Stereochem_param_file_format . _Chem_comp.Model_details . _Chem_comp.Model_erf . _Chem_comp.Model_source . _Chem_comp.Model_coordinates_details . _Chem_comp.Model_coordinates_missing_flag no _Chem_comp.Ideal_coordinates_details Corina _Chem_comp.Ideal_coordinates_missing_flag no _Chem_comp.Model_coordinates_db_code 1D0H _Chem_comp.Processing_site RCSB _Chem_comp.Vendor . _Chem_comp.Vendor_product_code . _Chem_comp.Details . _Chem_comp.DB_query_date . _Chem_comp.DB_last_query_revised_last_date . loop_ _Chem_comp_descriptor.Descriptor _Chem_comp_descriptor.Type _Chem_comp_descriptor.Program _Chem_comp_descriptor.Program_version _Chem_comp_descriptor.Entry_ID _Chem_comp_descriptor.Comp_ID CC(=O)NC1C(C(C(OC1O)CO)O)O SMILES 'OpenEye OEToolkits' 1.7.0 c19759_2mk7 A2G CC(=O)N[C@@H]1[C@H]([C@H]([C@H](O[C@@H]1O)CO)O)O SMILES_CANONICAL 'OpenEye OEToolkits' 1.7.0 c19759_2mk7 A2G CC(=O)N[C@H]1[C@@H](O)O[C@H](CO)[C@H](O)[C@@H]1O SMILES_CANONICAL CACTVS 3.370 c19759_2mk7 A2G CC(=O)N[CH]1[CH](O)O[CH](CO)[CH](O)[CH]1O SMILES CACTVS 3.370 c19759_2mk7 A2G InChI=1S/C8H15NO6/c1-3(11)9-5-7(13)6(12)4(2-10)15-8(5)14/h4-8,10,12-14H,2H2,1H3,(H,9,11)/t4-,5-,6+,7-,8+/m1/s1 InChI InChI 1.03 c19759_2mk7 A2G O=C(NC1C(O)C(O)C(OC1O)CO)C SMILES ACDLabs 12.01 c19759_2mk7 A2G OVRNDRQMDRJTHS-CBQIKETKSA-N InChIKey InChI 1.03 c19759_2mk7 A2G stop_ loop_ _Chem_comp_identifier.Identifier _Chem_comp_identifier.Type _Chem_comp_identifier.Program _Chem_comp_identifier.Program_version _Chem_comp_identifier.Entry_ID _Chem_comp_identifier.Comp_ID 2-(acetylamino)-2-deoxy-alpha-D-galactopyranose 'SYSTEMATIC NAME' ACDLabs 12.01 c19759_2mk7 A2G N-[(2S,3R,4R,5R,6R)-2,4,5-trihydroxy-6-(hydroxymethyl)oxan-3-yl]ethanamide 'SYSTEMATIC NAME' 'OpenEye OEToolkits' 1.7.0 c19759_2mk7 A2G 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 O O O O . O . . N 0 . . . 1 no no . . . . -5.612 . 11.751 . 77.615 . -1.252 -1.038 -0.470 1 . c19759_2mk7 A2G C1 C1 C1 C1 . C . . S 0 . . . 1 no no . . . . -5.734 . 10.437 . 77.081 . 0.092 -1.175 -0.005 2 . c19759_2mk7 A2G O1 O1 O1 O1 . O . . N 0 . . . 1 no yes . . . . -7.066 . 10.103 . 76.864 . 0.084 -1.632 1.349 3 . c19759_2mk7 A2G C2 C2 C2 C2 . C . . R 0 . . . 1 no no . . . . -4.970 . 9.427 . 77.919 . 0.798 0.181 -0.082 4 . c19759_2mk7 A2G N2 N2 N2 N2 . N . . N 0 . . . 1 no no . . . . -5.227 . 8.059 . 77.552 . 2.158 0.055 0.449 5 . c19759_2mk7 A2G C3 C3 C3 C3 . C . . R 0 . . . 1 no no . . . . -5.269 . 9.590 . 79.411 . 0.016 1.203 0.749 6 . c19759_2mk7 A2G O3 O3 O3 O3 . O . . N 0 . . . 1 no no . . . . -4.423 . 8.760 . 80.199 . 0.627 2.489 0.624 7 . c19759_2mk7 A2G C4 C4 C4 C4 . C . . R 0 . . . 1 no no . . . . -5.097 . 10.998 . 79.898 . -1.425 1.268 0.234 8 . c19759_2mk7 A2G O4 O4 O4 O4 . O . . N 0 . . . 1 no no . . . . -3.702 . 11.231 . 80.050 . -1.428 1.730 -1.118 9 . c19759_2mk7 A2G C5 C5 C5 C5 . C . . R 0 . . . 1 no no . . . . -5.779 . 12.014 . 78.997 . -2.045 -0.130 0.298 10 . c19759_2mk7 A2G C6 C6 C6 C6 . C . . N 0 . . . 1 no no . . . . -5.250 . 13.419 . 79.214 . -3.465 -0.085 -0.271 11 . c19759_2mk7 A2G O6 O6 O6 O6 . O . . N 0 . . . 1 no no . . . . -6.015 . 14.280 . 80.023 . -4.085 -1.362 -0.105 12 . c19759_2mk7 A2G C7 C7 C7 C7 . C . . N 0 . . . 1 no no . . . . -4.545 . 7.133 . 76.933 . 3.158 -0.365 -0.351 13 . c19759_2mk7 A2G O7 O7 O7 O7 . O . . N 0 . . . 1 no no . . . . -3.358 . 7.160 . 76.598 . 2.932 -0.639 -1.511 14 . c19759_2mk7 A2G C8 C8 C8 C8 . C . . N 0 . . . 1 no no . . . . -5.417 . 5.932 . 76.619 . 4.556 -0.494 0.195 15 . c19759_2mk7 A2G H1 H1 H1 H1 . H . . N 0 . . . 1 no no . . . . -5.259 . 10.414 . 76.089 . 0.620 -1.896 -0.629 16 . c19759_2mk7 A2G HO1 HO1 HO1 HO1 . H . . N 0 . . . 1 no yes . . . . -7.119 . 9.224 . 76.508 . -0.350 -2.488 1.472 17 . c19759_2mk7 A2G H2 H2 H2 H2 . H . . N 0 . . . 1 no no . . . . -3.911 . 9.643 . 77.716 . 0.841 0.511 -1.120 18 . c19759_2mk7 A2G HN2 HN2 HN2 HN2 . H . . N 0 . . . 1 no no . . . . -6.134 . 7.747 . 77.835 . 2.338 0.275 1.377 19 . c19759_2mk7 A2G H3 H3 H3 H3 . H . . N 0 . . . 1 no no . . . . -6.324 . 9.299 . 79.524 . 0.016 0.898 1.796 20 . c19759_2mk7 A2G HO3 HO3 HO3 HO3 . H . . N 0 . . . 1 no no . . . . -4.629 . 8.880 . 81.119 . 0.183 3.186 1.125 21 . c19759_2mk7 A2G H4 H4 H4 H4 . H . . N 0 . . . 1 no no . . . . -5.597 . 11.126 . 80.870 . -2.003 1.953 0.854 22 . c19759_2mk7 A2G HO4 HO4 HO4 HO4 . H . . N 0 . . . 1 no no . . . . -3.560 . 12.118 . 80.359 . -2.310 1.796 -1.510 23 . c19759_2mk7 A2G H5 H5 H5 H5 . H . . N 0 . . . 1 no no . . . . -6.840 . 11.931 . 79.275 . -2.079 -0.465 1.335 24 . c19759_2mk7 A2G H6 H6 H6 H6 . H . . N 0 . . . 1 no no . . . . -4.265 . 13.320 . 79.694 . -4.044 0.671 0.258 25 . c19759_2mk7 A2G H8 H8 H8 H8 . H . . N 0 . . . 1 no no . . . . -4.822 . 5.176 . 76.086 . 4.564 -0.206 1.247 26 . c19759_2mk7 A2G H8A H8A H8A H8A . H . . N 0 . . . 1 no no . . . . -5.801 . 5.503 . 77.556 . 4.890 -1.527 0.099 27 . c19759_2mk7 A2G H8B H8B H8B H8B . H . . N 0 . . . 1 no no . . . . -6.261 . 6.247 . 75.987 . 5.227 0.158 -0.365 28 . c19759_2mk7 A2G H14 H14 H14 H14 . H . . N 0 . . . 1 no no . . . . -5.178 . 13.891 . 78.223 . -3.424 0.164 -1.331 29 . c19759_2mk7 A2G H15 H15 H15 H15 . H . . N 0 . . . 1 no no . . . . -5.584 . 15.125 . 80.083 . -4.989 -1.407 -0.444 30 . c19759_2mk7 A2G 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 O C5 no N 1 . c19759_2mk7 A2G 2 . SING C1 O no N 2 . c19759_2mk7 A2G 3 . SING C1 C2 no N 3 . c19759_2mk7 A2G 4 . SING C1 H1 no N 4 . c19759_2mk7 A2G 5 . SING O1 C1 no N 5 . c19759_2mk7 A2G 6 . SING O1 HO1 no N 6 . c19759_2mk7 A2G 7 . SING C2 C3 no N 7 . c19759_2mk7 A2G 8 . SING C2 H2 no N 8 . c19759_2mk7 A2G 9 . SING N2 C2 no N 9 . c19759_2mk7 A2G 10 . SING N2 HN2 no N 10 . c19759_2mk7 A2G 11 . SING C3 C4 no N 11 . c19759_2mk7 A2G 12 . SING C3 O3 no N 12 . c19759_2mk7 A2G 13 . SING C3 H3 no N 13 . c19759_2mk7 A2G 14 . SING O3 HO3 no N 14 . c19759_2mk7 A2G 15 . SING C4 O4 no N 15 . c19759_2mk7 A2G 16 . SING C4 H4 no N 16 . c19759_2mk7 A2G 17 . SING O4 HO4 no N 17 . c19759_2mk7 A2G 18 . SING C5 C4 no N 18 . c19759_2mk7 A2G 19 . SING C5 C6 no N 19 . c19759_2mk7 A2G 20 . SING C5 H5 no N 20 . c19759_2mk7 A2G 21 . SING C6 O6 no N 21 . c19759_2mk7 A2G 22 . SING C6 H6 no N 22 . c19759_2mk7 A2G 23 . SING C7 N2 no N 23 . c19759_2mk7 A2G 24 . DOUB O7 C7 no N 24 . c19759_2mk7 A2G 25 . SING C8 C7 no N 25 . c19759_2mk7 A2G 26 . SING C8 H8 no N 26 . c19759_2mk7 A2G 27 . SING C8 H8A no N 27 . c19759_2mk7 A2G 28 . SING C8 H8B no N 28 . c19759_2mk7 A2G 29 . SING C6 H14 no N 29 . c19759_2mk7 A2G 30 . SING O6 H15 no N 30 . c19759_2mk7 A2G stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_d2o _Sample.Sf_category sample _Sample.Sf_framecode sample_d2o _Sample.Entry_ID c19759_2mk7 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _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 aDG_Mucin_Domain_Peptide 'natural abundance' . . 1 $aDG_Mucin_Domain_Peptide . . . 2 10 mM . . . . c19759_2mk7 1 2 D2O 'natural abundance' . . . . . . 100 . . % . . . . c19759_2mk7 1 stop_ save_ save_sample_h2o _Sample.Sf_category sample _Sample.Sf_framecode sample_h2o _Sample.Entry_ID c19759_2mk7 _Sample.ID 2 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '95% H2O/5% 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 aDG_Mucin_Domain_Peptide 'natural abundance' . . 1 $aDG_Mucin_Domain_Peptide . . . 2 10 mM . . . . c19759_2mk7 2 2 D2O 'natural abundance' . . . . . . 5 . . % . . . . c19759_2mk7 2 3 H2O 'natural abundance' . . . . . . 95 . . % . . . . c19759_2mk7 2 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions_all _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_all _Sample_condition_list.Entry_ID c19759_2mk7 _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 0 . M c19759_2mk7 1 pH 4.5 . pH c19759_2mk7 1 pressure 1 . atm c19759_2mk7 1 temperature 273 . K c19759_2mk7 1 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 c19759_2mk7 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model INOVA _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_2 _NMR_spectrometer.Entry_ID c19759_2mk7 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model INOVA _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ save_spectrometer_3 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_3 _NMR_spectrometer.Entry_ID c19759_2mk7 _NMR_spectrometer.ID 3 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model INOVA _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 900 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 c19759_2mk7 _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 Varian INOVA . 600 . . . c19759_2mk7 1 2 spectrometer_2 Varian INOVA . 800 . . . c19759_2mk7 1 3 spectrometer_3 Varian INOVA . 900 . . . c19759_2mk7 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 c19759_2mk7 _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_d2o isotropic . . 1 $sample_conditions_all . . . 3 $spectrometer_3 . . . . . . . . . . . . . . . . c19759_2mk7 1 2 '3D TOCSY-NOESY' no . . . . . . . . . . 2 $sample_h2o isotropic . . 1 $sample_conditions_all . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . c19759_2mk7 1 3 '2D 1H-15N HSQC' no . . . . . . . . . . 2 $sample_h2o isotropic . . 1 $sample_conditions_all . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . c19759_2mk7 1 4 '2D 1H-13C HSQC' no . . . . . . . . . . 2 $sample_h2o isotropic . . 1 $sample_conditions_all . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . c19759_2mk7 1 5 '2D 1H-1H TOCSY' no . . . . . . . . . . 2 $sample_h2o isotropic . . 1 $sample_conditions_all . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . c19759_2mk7 1 6 '2D 1H-1H COSY' no . . . . . . . . . . 1 $sample_d2o isotropic . . 1 $sample_conditions_all . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . c19759_2mk7 1 7 '2D 1H-13C HMBC' no . . . . . . . . . . 2 $sample_h2o isotropic . . 1 $sample_conditions_all . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . c19759_2mk7 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 c19759_2mk7 _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 DSS 'methyl protons' . . . . ppm 0.00 internal indirect 0.251449930 . . . . . . . . . c19759_2mk7 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . . . . . . . c19759_2mk7 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 internal indirect 0.101329118 . . . . . . . . . c19759_2mk7 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 c19759_2mk7 _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_all _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 0.005 _Assigned_chem_shift_list.Chem_shift_13C_err 0.03 _Assigned_chem_shift_list.Chem_shift_15N_err 0.05 _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 3 '2D 1H-15N HSQC' . . . c19759_2mk7 1 4 '2D 1H-13C HSQC' . . . c19759_2mk7 1 5 '2D 1H-1H TOCSY' . . . c19759_2mk7 1 6 '2D 1H-1H COSY' . . . c19759_2mk7 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 2 2 PRO HA H 1 4.69 0.005 . 1 . . . A 2 PRO HA . c19759_2mk7 1 2 . 1 1 2 2 PRO HB2 H 1 2.36 0.005 . 2 . . . A 2 PRO HB2 . c19759_2mk7 1 3 . 1 1 2 2 PRO HB3 H 1 1.93 0.005 . 2 . . . A 2 PRO HB3 . c19759_2mk7 1 4 . 1 1 2 2 PRO HG2 H 1 1.99 0.005 . 2 . . . A 2 PRO HG2 . c19759_2mk7 1 5 . 1 1 2 2 PRO HG3 H 1 1.99 0.005 . 2 . . . A 2 PRO HG3 . c19759_2mk7 1 6 . 1 1 2 2 PRO HD2 H 1 3.64 0.005 . 2 . . . A 2 PRO HD2 . c19759_2mk7 1 7 . 1 1 2 2 PRO HD3 H 1 3.64 0.005 . 2 . . . A 2 PRO HD3 . c19759_2mk7 1 8 . 1 1 2 2 PRO CA C 13 61.04 0.03 . 1 . . . A 2 PRO CA . c19759_2mk7 1 9 . 1 1 2 2 PRO CB C 13 31.40 0.03 . 1 . . . A 2 PRO CB . c19759_2mk7 1 10 . 1 1 2 2 PRO CG C 13 27.00 0.03 . 1 . . . A 2 PRO CG . c19759_2mk7 1 11 . 1 1 2 2 PRO CD C 13 51.46 0.03 . 1 . . . A 2 PRO CD . c19759_2mk7 1 12 . 1 1 3 3 PRO HA H 1 4.65 0.005 . 1 . . . A 3 PRO HA . c19759_2mk7 1 13 . 1 1 3 3 PRO HB2 H 1 2.34 0.005 . 2 . . . A 3 PRO HB2 . c19759_2mk7 1 14 . 1 1 3 3 PRO HB3 H 1 1.96 0.005 . 2 . . . A 3 PRO HB3 . c19759_2mk7 1 15 . 1 1 3 3 PRO HG2 H 1 2.04 0.005 . 2 . . . A 3 PRO HG2 . c19759_2mk7 1 16 . 1 1 3 3 PRO HG3 H 1 2.04 0.005 . 2 . . . A 3 PRO HG3 . c19759_2mk7 1 17 . 1 1 3 3 PRO HD2 H 1 3.83 0.005 . 2 . . . A 3 PRO HD2 . c19759_2mk7 1 18 . 1 1 3 3 PRO HD3 H 1 3.65 0.005 . 2 . . . A 3 PRO HD3 . c19759_2mk7 1 19 . 1 1 3 3 PRO CA C 13 62.77 0.03 . 1 . . . A 3 PRO CA . c19759_2mk7 1 20 . 1 1 3 3 PRO CB C 13 32.12 0.03 . 1 . . . A 3 PRO CB . c19759_2mk7 1 21 . 1 1 3 3 PRO CG C 13 27.37 0.03 . 1 . . . A 3 PRO CG . c19759_2mk7 1 22 . 1 1 3 3 PRO CD C 13 50.43 0.03 . 1 . . . A 3 PRO CD . c19759_2mk7 1 23 . 1 1 4 4 THR H H 1 8.71 0.005 . 1 . . . A 4 THR H . c19759_2mk7 1 24 . 1 1 4 4 THR HA H 1 4.71 0.005 . 1 . . . A 4 THR HA . c19759_2mk7 1 25 . 1 1 4 4 THR HB H 1 4.41 0.005 . 1 . . . A 4 THR HB . c19759_2mk7 1 26 . 1 1 4 4 THR HG21 H 1 1.34 0.005 . 1 . . . A 4 THR HG21 . c19759_2mk7 1 27 . 1 1 4 4 THR HG22 H 1 1.34 0.005 . 1 . . . A 4 THR HG22 . c19759_2mk7 1 28 . 1 1 4 4 THR HG23 H 1 1.34 0.005 . 1 . . . A 4 THR HG23 . c19759_2mk7 1 29 . 1 1 4 4 THR CA C 13 59.90 0.03 . 1 . . . A 4 THR CA . c19759_2mk7 1 30 . 1 1 4 4 THR CB C 13 79.32 0.03 . 1 . . . A 4 THR CB . c19759_2mk7 1 31 . 1 1 4 4 THR CG2 C 13 21.26 0.03 . 1 . . . A 4 THR CG2 . c19759_2mk7 1 32 . 1 1 4 4 THR N N 15 113.20 0.05 . 1 . . . A 4 THR N . c19759_2mk7 1 33 . 1 1 5 5 THR H H 1 8.91 0.005 . 1 . . . A 5 THR H . c19759_2mk7 1 34 . 1 1 5 5 THR HA H 1 4.79 0.005 . 1 . . . A 5 THR HA . c19759_2mk7 1 35 . 1 1 5 5 THR HB H 1 4.45 0.005 . 1 . . . A 5 THR HB . c19759_2mk7 1 36 . 1 1 5 5 THR HG21 H 1 1.26 0.005 . 1 . . . A 5 THR HG21 . c19759_2mk7 1 37 . 1 1 5 5 THR HG22 H 1 1.26 0.005 . 1 . . . A 5 THR HG22 . c19759_2mk7 1 38 . 1 1 5 5 THR HG23 H 1 1.26 0.005 . 1 . . . A 5 THR HG23 . c19759_2mk7 1 39 . 1 1 5 5 THR CA C 13 59.28 0.03 . 1 . . . A 5 THR CA . c19759_2mk7 1 40 . 1 1 5 5 THR CB C 13 80.09 0.03 . 1 . . . A 5 THR CB . c19759_2mk7 1 41 . 1 1 5 5 THR CG2 C 13 21.37 0.03 . 1 . . . A 5 THR CG2 . c19759_2mk7 1 42 . 1 1 5 5 THR N N 15 111.80 0.05 . 1 . . . A 5 THR N . c19759_2mk7 1 43 . 1 1 6 6 THR H H 1 8.94 0.005 . 1 . . . A 6 THR H . c19759_2mk7 1 44 . 1 1 6 6 THR HA H 1 4.75 0.005 . 1 . . . A 6 THR HA . c19759_2mk7 1 45 . 1 1 6 6 THR HB H 1 4.42 0.005 . 1 . . . A 6 THR HB . c19759_2mk7 1 46 . 1 1 6 6 THR HG21 H 1 1.22 0.005 . 1 . . . A 6 THR HG21 . c19759_2mk7 1 47 . 1 1 6 6 THR HG22 H 1 1.22 0.005 . 1 . . . A 6 THR HG22 . c19759_2mk7 1 48 . 1 1 6 6 THR HG23 H 1 1.22 0.005 . 1 . . . A 6 THR HG23 . c19759_2mk7 1 49 . 1 1 6 6 THR CA C 13 59.27 0.03 . 1 . . . A 6 THR CA . c19759_2mk7 1 50 . 1 1 6 6 THR CB C 13 80.72 0.03 . 1 . . . A 6 THR CB . c19759_2mk7 1 51 . 1 1 6 6 THR CG2 C 13 21.42 0.03 . 1 . . . A 6 THR CG2 . c19759_2mk7 1 52 . 1 1 6 6 THR N N 15 110.60 0.05 . 1 . . . A 6 THR N . c19759_2mk7 1 53 . 1 1 7 7 THR H H 1 8.88 0.005 . 1 . . . A 7 THR H . c19759_2mk7 1 54 . 1 1 7 7 THR HA H 1 4.53 0.005 . 1 . . . A 7 THR HA . c19759_2mk7 1 55 . 1 1 7 7 THR HB H 1 4.28 0.005 . 1 . . . A 7 THR HB . c19759_2mk7 1 56 . 1 1 7 7 THR HG21 H 1 1.21 0.005 . 1 . . . A 7 THR HG21 . c19759_2mk7 1 57 . 1 1 7 7 THR HG22 H 1 1.21 0.005 . 1 . . . A 7 THR HG22 . c19759_2mk7 1 58 . 1 1 7 7 THR HG23 H 1 1.21 0.005 . 1 . . . A 7 THR HG23 . c19759_2mk7 1 59 . 1 1 7 7 THR CA C 13 59.22 0.03 . 1 . . . A 7 THR CA . c19759_2mk7 1 60 . 1 1 7 7 THR CB C 13 79.40 0.03 . 1 . . . A 7 THR CB . c19759_2mk7 1 61 . 1 1 7 7 THR CG2 C 13 21.53 0.03 . 1 . . . A 7 THR CG2 . c19759_2mk7 1 62 . 1 1 7 7 THR N N 15 109.80 0.05 . 1 . . . A 7 THR N . c19759_2mk7 1 63 . 1 1 8 8 LYS H H 1 8.46 0.005 . 1 . . . A 8 LYS H . c19759_2mk7 1 64 . 1 1 8 8 LYS HA H 1 4.24 0.005 . 1 . . . A 8 LYS HA . c19759_2mk7 1 65 . 1 1 8 8 LYS HB2 H 1 1.72 0.005 . 2 . . . A 8 LYS HB2 . c19759_2mk7 1 66 . 1 1 8 8 LYS HB3 H 1 1.70 0.005 . 2 . . . A 8 LYS HB3 . c19759_2mk7 1 67 . 1 1 8 8 LYS HG2 H 1 1.43 0.005 . 2 . . . A 8 LYS HG2 . c19759_2mk7 1 68 . 1 1 8 8 LYS HG3 H 1 1.43 0.005 . 2 . . . A 8 LYS HG3 . c19759_2mk7 1 69 . 1 1 8 8 LYS HD2 H 1 1.70 0.005 . 2 . . . A 8 LYS HD2 . c19759_2mk7 1 70 . 1 1 8 8 LYS HD3 H 1 1.70 0.005 . 2 . . . A 8 LYS HD3 . c19759_2mk7 1 71 . 1 1 8 8 LYS HE2 H 1 3.02 0.005 . 2 . . . A 8 LYS HE2 . c19759_2mk7 1 72 . 1 1 8 8 LYS HE3 H 1 3.02 0.005 . 2 . . . A 8 LYS HE3 . c19759_2mk7 1 73 . 1 1 8 8 LYS CA C 13 55.34 0.03 . 1 . . . A 8 LYS CA . c19759_2mk7 1 74 . 1 1 8 8 LYS CB C 13 33.94 0.03 . 1 . . . A 8 LYS CB . c19759_2mk7 1 75 . 1 1 8 8 LYS CG C 13 24.73 0.03 . 1 . . . A 8 LYS CG . c19759_2mk7 1 76 . 1 1 8 8 LYS CD C 13 29.18 0.03 . 1 . . . A 8 LYS CD . c19759_2mk7 1 77 . 1 1 8 8 LYS CE C 13 41.83 0.03 . 1 . . . A 8 LYS CE . c19759_2mk7 1 78 . 1 1 8 8 LYS N N 15 119.60 0.05 . 1 . . . A 8 LYS N . c19759_2mk7 1 79 . 1 1 9 9 LYS H H 1 8.50 0.005 . 1 . . . A 9 LYS H . c19759_2mk7 1 80 . 1 1 9 9 LYS HA H 1 4.40 0.005 . 1 . . . A 9 LYS HA . c19759_2mk7 1 81 . 1 1 9 9 LYS HB2 H 1 1.79 0.005 . 2 . . . A 9 LYS HB2 . c19759_2mk7 1 82 . 1 1 9 9 LYS HB3 H 1 1.79 0.005 . 2 . . . A 9 LYS HB3 . c19759_2mk7 1 83 . 1 1 9 9 LYS HG2 H 1 1.52 0.005 . 2 . . . A 9 LYS HG2 . c19759_2mk7 1 84 . 1 1 9 9 LYS HG3 H 1 1.52 0.005 . 2 . . . A 9 LYS HG3 . c19759_2mk7 1 85 . 1 1 9 9 LYS HD2 H 1 1.72 0.005 . 2 . . . A 9 LYS HD2 . c19759_2mk7 1 86 . 1 1 9 9 LYS HD3 H 1 1.72 0.005 . 2 . . . A 9 LYS HD3 . c19759_2mk7 1 87 . 1 1 9 9 LYS HE2 H 1 3.02 0.005 . 2 . . . A 9 LYS HE2 . c19759_2mk7 1 88 . 1 1 9 9 LYS HE3 H 1 3.02 0.005 . 2 . . . A 9 LYS HE3 . c19759_2mk7 1 89 . 1 1 9 9 LYS CA C 13 54.57 0.03 . 1 . . . A 9 LYS CA . c19759_2mk7 1 90 . 1 1 9 9 LYS CB C 13 32.58 0.03 . 1 . . . A 9 LYS CB . c19759_2mk7 1 91 . 1 1 9 9 LYS CG C 13 24.41 0.03 . 1 . . . A 9 LYS CG . c19759_2mk7 1 92 . 1 1 9 9 LYS CD C 13 29.42 0.03 . 1 . . . A 9 LYS CD . c19759_2mk7 1 93 . 1 1 9 9 LYS CE C 13 41.83 0.03 . 1 . . . A 9 LYS CE . c19759_2mk7 1 94 . 1 1 9 9 LYS N N 15 124.60 0.05 . 1 . . . A 9 LYS N . c19759_2mk7 1 95 . 1 1 10 10 PRO HA H 1 4.36 0.005 . 1 . . . A 10 PRO HA . c19759_2mk7 1 96 . 1 1 10 10 PRO HB2 H 1 2.32 0.005 . 2 . . . A 10 PRO HB2 . c19759_2mk7 1 97 . 1 1 10 10 PRO HB3 H 1 1.92 0.005 . 2 . . . A 10 PRO HB3 . c19759_2mk7 1 98 . 1 1 10 10 PRO HG2 H 1 2.06 0.005 . 2 . . . A 10 PRO HG2 . c19759_2mk7 1 99 . 1 1 10 10 PRO HG3 H 1 2.04 0.005 . 2 . . . A 10 PRO HG3 . c19759_2mk7 1 100 . 1 1 10 10 PRO HD2 H 1 3.93 0.005 . 2 . . . A 10 PRO HD2 . c19759_2mk7 1 101 . 1 1 10 10 PRO HD3 H 1 3.64 0.005 . 2 . . . A 10 PRO HD3 . c19759_2mk7 1 102 . 1 1 10 10 PRO CA C 13 63.05 0.03 . 1 . . . A 10 PRO CA . c19759_2mk7 1 103 . 1 1 10 10 PRO CB C 13 32.33 0.03 . 1 . . . A 10 PRO CB . c19759_2mk7 1 104 . 1 1 10 10 PRO CG C 13 27.48 0.03 . 1 . . . A 10 PRO CG . c19759_2mk7 1 105 . 1 1 10 10 PRO CD C 13 51.02 0.03 . 1 . . . A 10 PRO CD . c19759_2mk7 1 106 . 2 2 1 1 A2G C1 C 13 101.67 0.03 . 1 . . . A 101 A2G C1 . c19759_2mk7 1 107 . 2 2 1 1 A2G C2 C 13 52.47 0.03 . 1 . . . A 101 A2G C2 . c19759_2mk7 1 108 . 2 2 1 1 A2G C3 C 13 70.92 0.03 . 1 . . . A 101 A2G C3 . c19759_2mk7 1 109 . 2 2 1 1 A2G C4 C 13 71.22 0.03 . 1 . . . A 101 A2G C4 . c19759_2mk7 1 110 . 2 2 1 1 A2G C5 C 13 74.12 0.03 . 1 . . . A 101 A2G C5 . c19759_2mk7 1 111 . 2 2 1 1 A2G C6 C 13 64.10 0.03 . 1 . . . A 101 A2G C6 . c19759_2mk7 1 112 . 2 2 1 1 A2G C8 C 13 25.18 0.03 . 1 . . . A 101 A2G C8 . c19759_2mk7 1 113 . 2 2 1 1 A2G H1 H 1 4.74 0.005 . 1 . . . A 101 A2G H1 . c19759_2mk7 1 114 . 2 2 1 1 A2G H14 H 1 3.73 0.005 . 2 . . . A 101 A2G H14 . c19759_2mk7 1 115 . 2 2 1 1 A2G H2 H 1 4.03 0.005 . 1 . . . A 101 A2G H2 . c19759_2mk7 1 116 . 2 2 1 1 A2G H3 H 1 3.89 0.005 . 1 . . . A 101 A2G H3 . c19759_2mk7 1 117 . 2 2 1 1 A2G H4 H 1 3.96 0.005 . 1 . . . A 101 A2G H4 . c19759_2mk7 1 118 . 2 2 1 1 A2G H5 H 1 4.05 0.005 . 1 . . . A 101 A2G H5 . c19759_2mk7 1 119 . 2 2 1 1 A2G H6 H 1 3.73 0.005 . 2 . . . A 101 A2G H6 . c19759_2mk7 1 120 . 2 2 1 1 A2G H8 H 1 2.05 0.005 . 2 . . . A 101 A2G H8 . c19759_2mk7 1 121 . 2 2 1 1 A2G H8A H 1 2.05 0.005 . 2 . . . A 101 A2G H8A . c19759_2mk7 1 122 . 2 2 1 1 A2G H8B H 1 2.05 0.005 . 2 . . . A 101 A2G H8B . c19759_2mk7 1 123 . 2 2 1 1 A2G HN2 H 1 7.75 0.005 . 1 . . . A 101 A2G HN2 . c19759_2mk7 1 124 . 2 2 1 1 A2G N2 N 15 122.00 0.05 . 1 . . . A 101 A2G N2 . c19759_2mk7 1 125 . 2 2 2 2 A2G C1 C 13 101.86 0.03 . 1 . . . A 102 A2G C1 . c19759_2mk7 1 126 . 2 2 2 2 A2G C2 C 13 52.33 0.03 . 1 . . . A 102 A2G C2 . c19759_2mk7 1 127 . 2 2 2 2 A2G C3 C 13 70.90 0.03 . 1 . . . A 102 A2G C3 . c19759_2mk7 1 128 . 2 2 2 2 A2G C4 C 13 71.20 0.03 . 1 . . . A 102 A2G C4 . c19759_2mk7 1 129 . 2 2 2 2 A2G C5 C 13 74.00 0.03 . 1 . . . A 102 A2G C5 . c19759_2mk7 1 130 . 2 2 2 2 A2G C6 C 13 64.10 0.03 . 1 . . . A 102 A2G C6 . c19759_2mk7 1 131 . 2 2 2 2 A2G C8 C 13 25.17 0.03 . 1 . . . A 102 A2G C8 . c19759_2mk7 1 132 . 2 2 2 2 A2G H1 H 1 4.71 0.005 . 1 . . . A 102 A2G H1 . c19759_2mk7 1 133 . 2 2 2 2 A2G H14 H 1 3.73 0.005 . 2 . . . A 102 A2G H14 . c19759_2mk7 1 134 . 2 2 2 2 A2G H2 H 1 4.01 0.005 . 1 . . . A 102 A2G H2 . c19759_2mk7 1 135 . 2 2 2 2 A2G H3 H 1 3.88 0.005 . 1 . . . A 102 A2G H3 . c19759_2mk7 1 136 . 2 2 2 2 A2G H4 H 1 3.94 0.005 . 1 . . . A 102 A2G H4 . c19759_2mk7 1 137 . 2 2 2 2 A2G H5 H 1 4.00 0.005 . 1 . . . A 102 A2G H5 . c19759_2mk7 1 138 . 2 2 2 2 A2G H6 H 1 3.73 0.005 . 2 . . . A 102 A2G H6 . c19759_2mk7 1 139 . 2 2 2 2 A2G H8 H 1 2.04 0.005 . 2 . . . A 102 A2G H8 . c19759_2mk7 1 140 . 2 2 2 2 A2G H8A H 1 2.04 0.005 . 2 . . . A 102 A2G H8A . c19759_2mk7 1 141 . 2 2 2 2 A2G H8B H 1 2.04 0.005 . 2 . . . A 102 A2G H8B . c19759_2mk7 1 142 . 2 2 2 2 A2G HN2 H 1 7.67 0.005 . 1 . . . A 102 A2G HN2 . c19759_2mk7 1 143 . 2 2 2 2 A2G N2 N 15 121.90 0.05 . 1 . . . A 102 A2G N2 . c19759_2mk7 1 144 . 2 2 3 3 A2G C1 C 13 102.18 0.03 . 1 . . . A 103 A2G C1 . c19759_2mk7 1 145 . 2 2 3 3 A2G C2 C 13 52.34 0.03 . 1 . . . A 103 A2G C2 . c19759_2mk7 1 146 . 2 2 3 3 A2G C3 C 13 70.88 0.03 . 1 . . . A 103 A2G C3 . c19759_2mk7 1 147 . 2 2 3 3 A2G C4 C 13 71.05 0.03 . 1 . . . A 103 A2G C4 . c19759_2mk7 1 148 . 2 2 3 3 A2G C5 C 13 74.00 0.03 . 1 . . . A 103 A2G C5 . c19759_2mk7 1 149 . 2 2 3 3 A2G C6 C 13 64.10 0.03 . 1 . . . A 103 A2G C6 . c19759_2mk7 1 150 . 2 2 3 3 A2G C8 C 13 25.15 0.03 . 1 . . . A 103 A2G C8 . c19759_2mk7 1 151 . 2 2 3 3 A2G H1 H 1 4.82 0.005 . 1 . . . A 103 A2G H1 . c19759_2mk7 1 152 . 2 2 3 3 A2G H14 H 1 3.73 0.005 . 2 . . . A 103 A2G H14 . c19759_2mk7 1 153 . 2 2 3 3 A2G H2 H 1 4.09 0.005 . 1 . . . A 103 A2G H2 . c19759_2mk7 1 154 . 2 2 3 3 A2G H3 H 1 3.87 0.005 . 1 . . . A 103 A2G H3 . c19759_2mk7 1 155 . 2 2 3 3 A2G H4 H 1 3.99 0.005 . 1 . . . A 103 A2G H4 . c19759_2mk7 1 156 . 2 2 3 3 A2G H5 H 1 4.00 0.005 . 1 . . . A 103 A2G H5 . c19759_2mk7 1 157 . 2 2 3 3 A2G H6 H 1 3.73 0.005 . 2 . . . A 103 A2G H6 . c19759_2mk7 1 158 . 2 2 3 3 A2G H8 H 1 2.03 0.005 . 2 . . . A 103 A2G H8 . c19759_2mk7 1 159 . 2 2 3 3 A2G H8A H 1 2.03 0.005 . 2 . . . A 103 A2G H8A . c19759_2mk7 1 160 . 2 2 3 3 A2G H8B H 1 2.03 0.005 . 2 . . . A 103 A2G H8B . c19759_2mk7 1 161 . 2 2 3 3 A2G HN2 H 1 7.49 0.005 . 1 . . . A 103 A2G HN2 . c19759_2mk7 1 162 . 2 2 3 3 A2G N2 N 15 121.90 0.05 . 1 . . . A 103 A2G N2 . c19759_2mk7 1 163 . 2 2 4 4 A2G C1 C 13 101.61 0.03 . 1 . . . A 104 A2G C1 . c19759_2mk7 1 164 . 2 2 4 4 A2G C2 C 13 52.21 0.03 . 1 . . . A 104 A2G C2 . c19759_2mk7 1 165 . 2 2 4 4 A2G C3 C 13 70.87 0.03 . 1 . . . A 104 A2G C3 . c19759_2mk7 1 166 . 2 2 4 4 A2G C4 C 13 71.10 0.03 . 1 . . . A 104 A2G C4 . c19759_2mk7 1 167 . 2 2 4 4 A2G C5 C 13 74.00 0.03 . 1 . . . A 104 A2G C5 . c19759_2mk7 1 168 . 2 2 4 4 A2G C6 C 13 64.10 0.03 . 1 . . . A 104 A2G C6 . c19759_2mk7 1 169 . 2 2 4 4 A2G C8 C 13 25.20 0.03 . 1 . . . A 104 A2G C8 . c19759_2mk7 1 170 . 2 2 4 4 A2G H1 H 1 4.85 0.005 . 1 . . . A 104 A2G H1 . c19759_2mk7 1 171 . 2 2 4 4 A2G H14 H 1 3.73 0.005 . 2 . . . A 104 A2G H14 . c19759_2mk7 1 172 . 2 2 4 4 A2G H2 H 1 4.09 0.005 . 1 . . . A 104 A2G H2 . c19759_2mk7 1 173 . 2 2 4 4 A2G H3 H 1 3.86 0.005 . 1 . . . A 104 A2G H3 . c19759_2mk7 1 174 . 2 2 4 4 A2G H4 H 1 3.98 0.005 . 1 . . . A 104 A2G H4 . c19759_2mk7 1 175 . 2 2 4 4 A2G H5 H 1 4.00 0.005 . 1 . . . A 104 A2G H5 . c19759_2mk7 1 176 . 2 2 4 4 A2G H6 H 1 3.73 0.005 . 2 . . . A 104 A2G H6 . c19759_2mk7 1 177 . 2 2 4 4 A2G H8 H 1 2.06 0.005 . 2 . . . A 104 A2G H8 . c19759_2mk7 1 178 . 2 2 4 4 A2G H8A H 1 2.06 0.005 . 2 . . . A 104 A2G H8A . c19759_2mk7 1 179 . 2 2 4 4 A2G H8B H 1 2.06 0.005 . 2 . . . A 104 A2G H8B . c19759_2mk7 1 180 . 2 2 4 4 A2G HN2 H 1 7.61 0.005 . 1 . . . A 104 A2G HN2 . c19759_2mk7 1 181 . 2 2 4 4 A2G N2 N 15 121.80 0.05 . 1 . . . A 104 A2G N2 . c19759_2mk7 1 stop_ save_ ############################## # Structure determinations # ############################## ########################## # Conformer statistics # ########################## save_conformer_statistics _Conformer_stat_list.Sf_category conformer_statistics _Conformer_stat_list.Sf_framecode conformer_statistics _Conformer_stat_list.Entry_ID c19759_2mk7 _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 16 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 c19759_2mk7 _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 . . . c19759_2mk7 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 . . . . c19759_2mk7 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 -1.164 -23.394 7.503 . . . 1.0 . . . . . . . . . . . . A . 1 ACE C . . . . . . . . . c19759_2mk7 1 . 1 . 2 . 1 1 1 ACE CH3 C -2.669 -23.162 7.424 . . . 1.0 . . . . . . . . . . . . A . 1 ACE CH3 . . . . . . . . . c19759_2mk7 1 . 1 . 3 . 1 1 1 ACE H1 H -2.866 -22.268 6.851 . . . 1.0 . . . . . . . . . . . . A . 1 ACE H1 . . . . . . . . . c19759_2mk7 1 . 1 . 4 . 1 1 1 ACE H2 H -3.069 -23.045 8.421 . . . 1.0 . . . . . . . . . . . . A . 1 ACE H2 . . . . . . . . . c19759_2mk7 1 . 1 . 5 . 1 1 1 ACE H3 H -3.139 -24.007 6.944 . . . 1.0 . . . . . . . . . . . . A . 1 ACE H3 . . . . . . . . . c19759_2mk7 1 . 1 . 6 . 1 1 1 ACE O O -0.544 -23.173 8.544 . . . 1.0 . . . . . . . . . . . . A . 1 ACE O . . . . . . . . . c19759_2mk7 1 . 1 . 7 . 1 1 2 PRO C C 1.708 -22.991 6.994 . . . 1.0 . . . . . . . . . . . . A . 2 PRO C . . . . . . . . . c19759_2mk7 1 . 1 . 8 . 1 1 2 PRO CA C 0.886 -24.106 6.353 . . . 1.0 . . . . . . . . . . . . A . 2 PRO CA . . . . . . . . . c19759_2mk7 1 . 1 . 9 . 1 1 2 PRO CB C 1.184 -24.208 4.849 . . . 1.0 . . . . . . . . . . . . A . 2 PRO CB . . . . . . . . . c19759_2mk7 1 . 1 . 10 . 1 1 2 PRO CD C -1.237 -24.118 5.154 . . . 1.0 . . . . . . . . . . . . A . 2 PRO CD . . . . . . . . . c19759_2mk7 1 . 1 . 11 . 1 1 2 PRO CG C -0.113 -23.985 4.129 . . . 1.0 . . . . . . . . . . . . A . 2 PRO CG . . . . . . . . . c19759_2mk7 1 . 1 . 12 . 1 1 2 PRO HA H 1.109 -25.049 6.826 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HA . . . . . . . . . c19759_2mk7 1 . 1 . 13 . 1 1 2 PRO HB2 H 1.901 -23.451 4.564 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HB2 . . . . . . . . . c19759_2mk7 1 . 1 . 14 . 1 1 2 PRO HB3 H 1.569 -25.189 4.614 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HB3 . . . . . . . . . c19759_2mk7 1 . 1 . 15 . 1 1 2 PRO HD2 H -2.017 -23.395 4.957 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HD2 . . . . . . . . . c19759_2mk7 1 . 1 . 16 . 1 1 2 PRO HD3 H -1.635 -25.120 5.156 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HD3 . . . . . . . . . c19759_2mk7 1 . 1 . 17 . 1 1 2 PRO HG2 H -0.125 -22.996 3.692 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HG2 . . . . . . . . . c19759_2mk7 1 . 1 . 18 . 1 1 2 PRO HG3 H -0.238 -24.729 3.357 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HG3 . . . . . . . . . c19759_2mk7 1 . 1 . 19 . 1 1 2 PRO N N -0.575 -23.833 6.425 . . . 1.0 . . . . . . . . . . . . A . 2 PRO N . . . . . . . . . c19759_2mk7 1 . 1 . 20 . 1 1 2 PRO O O 1.213 -21.885 7.210 . . . 1.0 . . . . . . . . . . . . A . 2 PRO O . . . . . . . . . c19759_2mk7 1 . 1 . 21 . 1 1 3 PRO C C 3.772 -20.910 7.272 . . . 1.0 . . . . . . . . . . . . A . 3 PRO C . . . . . . . . . c19759_2mk7 1 . 1 . 22 . 1 1 3 PRO CA C 3.866 -22.284 7.930 . . . 1.0 . . . . . . . . . . . . A . 3 PRO CA . . . . . . . . . c19759_2mk7 1 . 1 . 23 . 1 1 3 PRO CB C 5.266 -22.887 7.736 . . . 1.0 . . . . . . . . . . . . A . 3 PRO CB . . . . . . . . . c19759_2mk7 1 . 1 . 24 . 1 1 3 PRO CD C 3.608 -24.552 7.072 . . . 1.0 . . . . . . . . . . . . A . 3 PRO CD . . . . . . . . . c19759_2mk7 1 . 1 . 25 . 1 1 3 PRO CG C 5.088 -24.183 7.001 . . . 1.0 . . . . . . . . . . . . A . 3 PRO CG . . . . . . . . . c19759_2mk7 1 . 1 . 26 . 1 1 3 PRO HA H 3.654 -22.204 8.984 . . . 1.0 . . . . . . . . . . . . A . 3 PRO HA . . . . . . . . . c19759_2mk7 1 . 1 . 27 . 1 1 3 PRO HB2 H 5.880 -22.213 7.156 . . . 1.0 . . . . . . . . . . . . A . 3 PRO HB2 . . . . . . . . . c19759_2mk7 1 . 1 . 28 . 1 1 3 PRO HB3 H 5.725 -23.071 8.696 . . . 1.0 . . . . . . . . . . . . A . 3 PRO HB3 . . . . . . . . . c19759_2mk7 1 . 1 . 29 . 1 1 3 PRO HD2 H 3.282 -24.992 6.139 . . . 1.0 . . . . . . . . . . . . A . 3 PRO HD2 . . . . . . . . . c19759_2mk7 1 . 1 . 30 . 1 1 3 PRO HD3 H 3.420 -25.220 7.898 . . . 1.0 . . . . . . . . . . . . A . 3 PRO HD3 . . . . . . . . . c19759_2mk7 1 . 1 . 31 . 1 1 3 PRO HG2 H 5.391 -24.064 5.970 . . . 1.0 . . . . . . . . . . . . A . 3 PRO HG2 . . . . . . . . . c19759_2mk7 1 . 1 . 32 . 1 1 3 PRO HG3 H 5.676 -24.956 7.471 . . . 1.0 . . . . . . . . . . . . A . 3 PRO HG3 . . . . . . . . . c19759_2mk7 1 . 1 . 33 . 1 1 3 PRO N N 2.947 -23.268 7.298 . . . 1.0 . . . . . . . . . . . . A . 3 PRO N . . . . . . . . . c19759_2mk7 1 . 1 . 34 . 1 1 3 PRO O O 4.191 -20.729 6.128 . . . 1.0 . . . . . . . . . . . . A . 3 PRO O . . . . . . . . . c19759_2mk7 1 . 1 . 35 . 1 1 4 THR C C 4.251 -17.721 7.916 . . . 1.0 . . . . . . . . . . . . A . 4 THR C . . . . . . . . . c19759_2mk7 1 . 1 . 36 . 1 1 4 THR CA C 3.077 -18.592 7.479 . . . 1.0 . . . . . . . . . . . . A . 4 THR CA . . . . . . . . . c19759_2mk7 1 . 1 . 37 . 1 1 4 THR CB C 1.768 -17.975 7.977 . . . 1.0 . . . . . . . . . . . . A . 4 THR CB . . . . . . . . . c19759_2mk7 1 . 1 . 38 . 1 1 4 THR CG2 C 0.586 -18.839 7.534 . . . 1.0 . . . . . . . . . . . . A . 4 THR CG2 . . . . . . . . . c19759_2mk7 1 . 1 . 39 . 1 1 4 THR H H 2.905 -20.148 8.907 . . . 1.0 . . . . . . . . . . . . A . 4 THR H . . . . . . . . . c19759_2mk7 1 . 1 . 40 . 1 1 4 THR HA H 3.054 -18.634 6.400 . . . 1.0 . . . . . . . . . . . . A . 4 THR HA . . . . . . . . . c19759_2mk7 1 . 1 . 41 . 1 1 4 THR HB H 1.657 -16.981 7.574 . . . 1.0 . . . . . . . . . . . . A . 4 THR HB . . . . . . . . . c19759_2mk7 1 . 1 . 42 . 1 1 4 THR HG21 H -0.296 -18.223 7.443 . . . 1.0 . . . . . . . . . . . . A . 4 THR HG21 . . . . . . . . . c19759_2mk7 1 . 1 . 43 . 1 1 4 THR HG22 H 0.411 -19.613 8.267 . . . 1.0 . . . . . . . . . . . . A . 4 THR HG22 . . . . . . . . . c19759_2mk7 1 . 1 . 44 . 1 1 4 THR HG23 H 0.809 -19.292 6.579 . . . 1.0 . . . . . . . . . . . . A . 4 THR HG23 . . . . . . . . . c19759_2mk7 1 . 1 . 45 . 1 1 4 THR N N 3.220 -19.946 8.002 . . . 1.0 . . . . . . . . . . . . A . 4 THR N . . . . . . . . . c19759_2mk7 1 . 1 . 46 . 1 1 4 THR O O 5.018 -18.097 8.803 . . . 1.0 . . . . . . . . . . . . A . 4 THR O . . . . . . . . . c19759_2mk7 1 . 1 . 47 . 1 1 4 THR OG1 O 1.798 -17.933 9.387 . . . 1.0 . . . . . . . . . . . . A . 4 THR OG1 . . . . . . . . . c19759_2mk7 1 . 1 . 48 . 1 1 5 THR C C 4.942 -14.216 7.760 . . . 1.0 . . . . . . . . . . . . A . 5 THR C . . . . . . . . . c19759_2mk7 1 . 1 . 49 . 1 1 5 THR CA C 5.468 -15.641 7.622 . . . 1.0 . . . . . . . . . . . . A . 5 THR CA . . . . . . . . . c19759_2mk7 1 . 1 . 50 . 1 1 5 THR CB C 6.544 -15.687 6.534 . . . 1.0 . . . . . . . . . . . . A . 5 THR CB . . . . . . . . . c19759_2mk7 1 . 1 . 51 . 1 1 5 THR CG2 C 6.969 -17.135 6.286 . . . 1.0 . . . . . . . . . . . . A . 5 THR CG2 . . . . . . . . . c19759_2mk7 1 . 1 . 52 . 1 1 5 THR H H 3.741 -16.310 6.591 . . . 1.0 . . . . . . . . . . . . A . 5 THR H . . . . . . . . . c19759_2mk7 1 . 1 . 53 . 1 1 5 THR HA H 5.908 -15.945 8.560 . . . 1.0 . . . . . . . . . . . . A . 5 THR HA . . . . . . . . . c19759_2mk7 1 . 1 . 54 . 1 1 5 THR HB H 7.400 -15.109 6.843 . . . 1.0 . . . . . . . . . . . . A . 5 THR HB . . . . . . . . . c19759_2mk7 1 . 1 . 55 . 1 1 5 THR HG21 H 6.424 -17.531 5.442 . . . 1.0 . . . . . . . . . . . . A . 5 THR HG21 . . . . . . . . . c19759_2mk7 1 . 1 . 56 . 1 1 5 THR HG22 H 6.755 -17.728 7.163 . . . 1.0 . . . . . . . . . . . . A . 5 THR HG22 . . . . . . . . . c19759_2mk7 1 . 1 . 57 . 1 1 5 THR HG23 H 8.028 -17.169 6.079 . . . 1.0 . . . . . . . . . . . . A . 5 THR HG23 . . . . . . . . . c19759_2mk7 1 . 1 . 58 . 1 1 5 THR N N 4.383 -16.557 7.289 . . . 1.0 . . . . . . . . . . . . A . 5 THR N . . . . . . . . . c19759_2mk7 1 . 1 . 59 . 1 1 5 THR O O 4.062 -13.793 7.010 . . . 1.0 . . . . . . . . . . . . A . 5 THR O . . . . . . . . . c19759_2mk7 1 . 1 . 60 . 1 1 5 THR OG1 O 6.002 -15.161 5.342 . . . 1.0 . . . . . . . . . . . . A . 5 THR OG1 . . . . . . . . . c19759_2mk7 1 . 1 . 61 . 1 1 6 THR C C 6.105 -11.127 8.407 . . . 1.0 . . . . . . . . . . . . A . 6 THR C . . . . . . . . . c19759_2mk7 1 . 1 . 62 . 1 1 6 THR CA C 5.065 -12.102 8.950 . . . 1.0 . . . . . . . . . . . . A . 6 THR CA . . . . . . . . . c19759_2mk7 1 . 1 . 63 . 1 1 6 THR CB C 4.865 -11.857 10.447 . . . 1.0 . . . . . . . . . . . . A . 6 THR CB . . . . . . . . . c19759_2mk7 1 . 1 . 64 . 1 1 6 THR CG2 C 3.952 -12.935 11.031 . . . 1.0 . . . . . . . . . . . . A . 6 THR CG2 . . . . . . . . . c19759_2mk7 1 . 1 . 65 . 1 1 6 THR H H 6.185 -13.869 9.290 . . . 1.0 . . . . . . . . . . . . A . 6 THR H . . . . . . . . . c19759_2mk7 1 . 1 . 66 . 1 1 6 THR HA H 4.128 -11.935 8.441 . . . 1.0 . . . . . . . . . . . . A . 6 THR HA . . . . . . . . . c19759_2mk7 1 . 1 . 67 . 1 1 6 THR HB H 4.420 -10.887 10.601 . . . 1.0 . . . . . . . . . . . . A . 6 THR HB . . . . . . . . . c19759_2mk7 1 . 1 . 68 . 1 1 6 THR HG21 H 3.230 -13.239 10.287 . . . 1.0 . . . . . . . . . . . . A . 6 THR HG21 . . . . . . . . . c19759_2mk7 1 . 1 . 69 . 1 1 6 THR HG22 H 3.435 -12.541 11.894 . . . 1.0 . . . . . . . . . . . . A . 6 THR HG22 . . . . . . . . . c19759_2mk7 1 . 1 . 70 . 1 1 6 THR HG23 H 4.545 -13.788 11.326 . . . 1.0 . . . . . . . . . . . . A . 6 THR HG23 . . . . . . . . . c19759_2mk7 1 . 1 . 71 . 1 1 6 THR N N 5.487 -13.480 8.723 . . . 1.0 . . . . . . . . . . . . A . 6 THR N . . . . . . . . . c19759_2mk7 1 . 1 . 72 . 1 1 6 THR O O 7.291 -11.449 8.329 . . . 1.0 . . . . . . . . . . . . A . 6 THR O . . . . . . . . . c19759_2mk7 1 . 1 . 73 . 1 1 6 THR OG1 O 6.120 -11.928 11.087 . . . 1.0 . . . . . . . . . . . . A . 6 THR OG1 . . . . . . . . . c19759_2mk7 1 . 1 . 74 . 1 1 7 THR C C 6.895 -7.890 8.570 . . . 1.0 . . . . . . . . . . . . A . 7 THR C . . . . . . . . . c19759_2mk7 1 . 1 . 75 . 1 1 7 THR CA C 6.553 -8.920 7.499 . . . 1.0 . . . . . . . . . . . . A . 7 THR CA . . . . . . . . . c19759_2mk7 1 . 1 . 76 . 1 1 7 THR CB C 5.901 -8.220 6.304 . . . 1.0 . . . . . . . . . . . . A . 7 THR CB . . . . . . . . . c19759_2mk7 1 . 1 . 77 . 1 1 7 THR CG2 C 5.523 -9.252 5.241 . . . 1.0 . . . . . . . . . . . . A . 7 THR CG2 . . . . . . . . . c19759_2mk7 1 . 1 . 78 . 1 1 7 THR H H 4.697 -9.734 8.118 . . . 1.0 . . . . . . . . . . . . A . 7 THR H . . . . . . . . . c19759_2mk7 1 . 1 . 79 . 1 1 7 THR HA H 7.463 -9.398 7.169 . . . 1.0 . . . . . . . . . . . . A . 7 THR HA . . . . . . . . . c19759_2mk7 1 . 1 . 80 . 1 1 7 THR HB H 6.588 -7.503 5.882 . . . 1.0 . . . . . . . . . . . . A . 7 THR HB . . . . . . . . . c19759_2mk7 1 . 1 . 81 . 1 1 7 THR HG21 H 5.510 -8.780 4.270 . . . 1.0 . . . . . . . . . . . . A . 7 THR HG21 . . . . . . . . . c19759_2mk7 1 . 1 . 82 . 1 1 7 THR HG22 H 4.544 -9.652 5.460 . . . 1.0 . . . . . . . . . . . . A . 7 THR HG22 . . . . . . . . . c19759_2mk7 1 . 1 . 83 . 1 1 7 THR HG23 H 6.248 -10.052 5.242 . . . 1.0 . . . . . . . . . . . . A . 7 THR HG23 . . . . . . . . . c19759_2mk7 1 . 1 . 84 . 1 1 7 THR N N 5.652 -9.935 8.033 . . . 1.0 . . . . . . . . . . . . A . 7 THR N . . . . . . . . . c19759_2mk7 1 . 1 . 85 . 1 1 7 THR O O 6.052 -7.530 9.392 . . . 1.0 . . . . . . . . . . . . A . 7 THR O . . . . . . . . . c19759_2mk7 1 . 1 . 86 . 1 1 7 THR OG1 O 4.729 -7.571 6.747 . . . 1.0 . . . . . . . . . . . . A . 7 THR OG1 . . . . . . . . . c19759_2mk7 1 . 1 . 87 . 1 1 8 LYS C C 8.129 -5.031 9.120 . . . 1.0 . . . . . . . . . . . . A . 8 LYS C . . . . . . . . . c19759_2mk7 1 . 1 . 88 . 1 1 8 LYS CA C 8.580 -6.429 9.531 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CA . . . . . . . . . c19759_2mk7 1 . 1 . 89 . 1 1 8 LYS CB C 10.105 -6.460 9.652 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CB . . . . . . . . . c19759_2mk7 1 . 1 . 90 . 1 1 8 LYS CD C 11.539 -6.077 11.662 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CD . . . . . . . . . c19759_2mk7 1 . 1 . 91 . 1 1 8 LYS CE C 12.735 -6.636 10.888 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CE . . . . . . . . . c19759_2mk7 1 . 1 . 92 . 1 1 8 LYS CG C 10.557 -5.427 10.686 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CG . . . . . . . . . c19759_2mk7 1 . 1 . 93 . 1 1 8 LYS H H 8.767 -7.741 7.877 . . . 1.0 . . . . . . . . . . . . A . 8 LYS H . . . . . . . . . c19759_2mk7 1 . 1 . 94 . 1 1 8 LYS HA H 8.150 -6.668 10.492 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HA . . . . . . . . . c19759_2mk7 1 . 1 . 95 . 1 1 8 LYS HB2 H 10.421 -7.445 9.963 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HB2 . . . . . . . . . c19759_2mk7 1 . 1 . 96 . 1 1 8 LYS HB3 H 10.547 -6.226 8.695 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HB3 . . . . . . . . . c19759_2mk7 1 . 1 . 97 . 1 1 8 LYS HD2 H 11.882 -5.339 12.373 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HD2 . . . . . . . . . c19759_2mk7 1 . 1 . 98 . 1 1 8 LYS HD3 H 11.046 -6.881 12.187 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HD3 . . . . . . . . . c19759_2mk7 1 . 1 . 99 . 1 1 8 LYS HE2 H 12.657 -7.711 10.833 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HE2 . . . . . . . . . c19759_2mk7 1 . 1 . 100 . 1 1 8 LYS HE3 H 12.742 -6.223 9.890 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HE3 . . . . . . . . . c19759_2mk7 1 . 1 . 101 . 1 1 8 LYS HG2 H 11.041 -4.603 10.182 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HG2 . . . . . . . . . c19759_2mk7 1 . 1 . 102 . 1 1 8 LYS HG3 H 9.699 -5.063 11.230 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HG3 . . . . . . . . . c19759_2mk7 1 . 1 . 103 . 1 1 8 LYS HZ1 H 14.437 -5.455 11.106 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ1 . . . . . . . . . c19759_2mk7 1 . 1 . 104 . 1 1 8 LYS HZ2 H 14.651 -7.074 11.576 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ2 . . . . . . . . . c19759_2mk7 1 . 1 . 105 . 1 1 8 LYS HZ3 H 13.785 -6.004 12.572 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ3 . . . . . . . . . c19759_2mk7 1 . 1 . 106 . 1 1 8 LYS N N 8.138 -7.418 8.556 . . . 1.0 . . . . . . . . . . . . A . 8 LYS N . . . . . . . . . c19759_2mk7 1 . 1 . 107 . 1 1 8 LYS NZ N 13.997 -6.264 11.588 . . . 1.0 . . . . . . . . . . . . A . 8 LYS NZ . . . . . . . . . c19759_2mk7 1 . 1 . 108 . 1 1 8 LYS O O 8.405 -4.582 8.008 . . . 1.0 . . . . . . . . . . . . A . 8 LYS O . . . . . . . . . c19759_2mk7 1 . 1 . 109 . 1 1 9 LYS C C 8.117 -2.048 9.521 . . . 1.0 . . . . . . . . . . . . A . 9 LYS C . . . . . . . . . c19759_2mk7 1 . 1 . 110 . 1 1 9 LYS CA C 6.949 -3.003 9.744 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CA . . . . . . . . . c19759_2mk7 1 . 1 . 111 . 1 1 9 LYS CB C 6.094 -2.502 10.910 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CB . . . . . . . . . c19759_2mk7 1 . 1 . 112 . 1 1 9 LYS CD C 4.738 -0.574 11.739 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CD . . . . . . . . . c19759_2mk7 1 . 1 . 113 . 1 1 9 LYS CE C 4.025 0.717 11.334 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CE . . . . . . . . . c19759_2mk7 1 . 1 . 114 . 1 1 9 LYS CG C 5.388 -1.207 10.507 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CG . . . . . . . . . c19759_2mk7 1 . 1 . 115 . 1 1 9 LYS H H 7.243 -4.759 10.894 . . . 1.0 . . . . . . . . . . . . A . 9 LYS H . . . . . . . . . c19759_2mk7 1 . 1 . 116 . 1 1 9 LYS HA H 6.341 -3.028 8.852 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HA . . . . . . . . . c19759_2mk7 1 . 1 . 117 . 1 1 9 LYS HB2 H 5.358 -3.251 11.164 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HB2 . . . . . . . . . c19759_2mk7 1 . 1 . 118 . 1 1 9 LYS HB3 H 6.726 -2.314 11.765 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HB3 . . . . . . . . . c19759_2mk7 1 . 1 . 119 . 1 1 9 LYS HD2 H 4.023 -1.264 12.163 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HD2 . . . . . . . . . c19759_2mk7 1 . 1 . 120 . 1 1 9 LYS HD3 H 5.498 -0.348 12.471 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HD3 . . . . . . . . . c19759_2mk7 1 . 1 . 121 . 1 1 9 LYS HE2 H 4.554 1.565 11.745 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HE2 . . . . . . . . . c19759_2mk7 1 . 1 . 122 . 1 1 9 LYS HE3 H 4.003 0.794 10.257 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HE3 . . . . . . . . . c19759_2mk7 1 . 1 . 123 . 1 1 9 LYS HG2 H 6.108 -0.520 10.086 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HG2 . . . . . . . . . c19759_2mk7 1 . 1 . 124 . 1 1 9 LYS HG3 H 4.626 -1.425 9.773 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HG3 . . . . . . . . . c19759_2mk7 1 . 1 . 125 . 1 1 9 LYS HZ1 H 2.581 1.259 12.734 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HZ1 . . . . . . . . . c19759_2mk7 1 . 1 . 126 . 1 1 9 LYS HZ2 H 2.347 -0.282 12.057 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HZ2 . . . . . . . . . c19759_2mk7 1 . 1 . 127 . 1 1 9 LYS HZ3 H 1.988 1.111 11.152 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HZ3 . . . . . . . . . c19759_2mk7 1 . 1 . 128 . 1 1 9 LYS N N 7.433 -4.350 10.024 . . . 1.0 . . . . . . . . . . . . A . 9 LYS N . . . . . . . . . c19759_2mk7 1 . 1 . 129 . 1 1 9 LYS NZ N 2.630 0.700 11.859 . . . 1.0 . . . . . . . . . . . . A . 9 LYS NZ . . . . . . . . . c19759_2mk7 1 . 1 . 130 . 1 1 9 LYS O O 9.062 -2.010 10.309 . . . 1.0 . . . . . . . . . . . . A . 9 LYS O . . . . . . . . . c19759_2mk7 1 . 1 . 131 . 1 1 10 PRO C C 9.603 0.486 9.324 . . . 1.0 . . . . . . . . . . . . A . 10 PRO C . . . . . . . . . c19759_2mk7 1 . 1 . 132 . 1 1 10 PRO CA C 9.134 -0.313 8.111 . . . 1.0 . . . . . . . . . . . . A . 10 PRO CA . . . . . . . . . c19759_2mk7 1 . 1 . 133 . 1 1 10 PRO CB C 8.486 0.610 7.067 . . . 1.0 . . . . . . . . . . . . A . 10 PRO CB . . . . . . . . . c19759_2mk7 1 . 1 . 134 . 1 1 10 PRO CD C 6.977 -1.263 7.487 . . . 1.0 . . . . . . . . . . . . A . 10 PRO CD . . . . . . . . . c19759_2mk7 1 . 1 . 135 . 1 1 10 PRO CG C 7.077 0.130 6.872 . . . 1.0 . . . . . . . . . . . . A . 10 PRO CG . . . . . . . . . c19759_2mk7 1 . 1 . 136 . 1 1 10 PRO HA H 9.968 -0.828 7.664 . . . 1.0 . . . . . . . . . . . . A . 10 PRO HA . . . . . . . . . c19759_2mk7 1 . 1 . 137 . 1 1 10 PRO HB2 H 8.484 1.629 7.428 . . . 1.0 . . . . . . . . . . . . A . 10 PRO HB2 . . . . . . . . . c19759_2mk7 1 . 1 . 138 . 1 1 10 PRO HB3 H 9.025 0.549 6.134 . . . 1.0 . . . . . . . . . . . . A . 10 PRO HB3 . . . . . . . . . c19759_2mk7 1 . 1 . 139 . 1 1 10 PRO HD2 H 6.020 -1.394 7.975 . . . 1.0 . . . . . . . . . . . . A . 10 PRO HD2 . . . . . . . . . c19759_2mk7 1 . 1 . 140 . 1 1 10 PRO HD3 H 7.132 -2.024 6.738 . . . 1.0 . . . . . . . . . . . . A . 10 PRO HD3 . . . . . . . . . c19759_2mk7 1 . 1 . 141 . 1 1 10 PRO HG2 H 6.390 0.804 7.365 . . . 1.0 . . . . . . . . . . . . A . 10 PRO HG2 . . . . . . . . . c19759_2mk7 1 . 1 . 142 . 1 1 10 PRO HG3 H 6.850 0.077 5.819 . . . 1.0 . . . . . . . . . . . . A . 10 PRO HG3 . . . . . . . . . c19759_2mk7 1 . 1 . 143 . 1 1 10 PRO N N 8.064 -1.285 8.464 . . . 1.0 . . . . . . . . . . . . A . 10 PRO N . . . . . . . . . c19759_2mk7 1 . 1 . 144 . 1 1 10 PRO O O 10.744 0.945 9.364 . . . 1.0 . . . . . . . . . . . . A . 10 PRO O . . . . . . . . . c19759_2mk7 1 . 1 . 145 . 1 1 11 NH2 HN1 H 7.830 0.828 10.150 . . . 1.0 . . . . . . . . . . . . A . 11 NH2 HN1 . . . . . . . . . c19759_2mk7 1 . 1 . 146 . 1 1 11 NH2 HN2 H 9.125 0.701 11.240 . . . 1.0 . . . . . . . . . . . . A . 11 NH2 HN2 . . . . . . . . . c19759_2mk7 1 . 1 . 147 . 1 1 11 NH2 N N 8.783 0.682 10.321 . . . 1.0 . . . . . . . . . . . . A . 11 NH2 N . . . . . . . . . c19759_2mk7 1 . 1 . 148 . 2 2 1 A2G C1 C 1.861 -16.615 9.885 . . . 1.0 . . . . . . . . . . . . A . 101 A2G C1 . . . . . . . . . c19759_2mk7 1 . 1 . 149 . 2 2 1 A2G C2 C 2.092 -16.686 11.396 . . . 1.0 . . . . . . . . . . . . A . 101 A2G C2 . . . . . . . . . c19759_2mk7 1 . 1 . 150 . 2 2 1 A2G C3 C 0.909 -17.400 12.051 . . . 1.0 . . . . . . . . . . . . A . 101 A2G C3 . . . . . . . . . c19759_2mk7 1 . 1 . 151 . 2 2 1 A2G C4 C -0.393 -16.704 11.649 . . . 1.0 . . . . . . . . . . . . A . 101 A2G C4 . . . . . . . . . c19759_2mk7 1 . 1 . 152 . 2 2 1 A2G C5 C -0.471 -16.610 10.124 . . . 1.0 . . . . . . . . . . . . A . 101 A2G C5 . . . . . . . . . c19759_2mk7 1 . 1 . 153 . 2 2 1 A2G C6 C -1.727 -15.836 9.719 . . . 1.0 . . . . . . . . . . . . A . 101 A2G C6 . . . . . . . . . c19759_2mk7 1 . 1 . 154 . 2 2 1 A2G C7 C 4.329 -16.814 12.332 . . . 1.0 . . . . . . . . . . . . A . 101 A2G C7 . . . . . . . . . c19759_2mk7 1 . 1 . 155 . 2 2 1 A2G C8 C 5.598 -17.642 12.507 . . . 1.0 . . . . . . . . . . . . A . 101 A2G C8 . . . . . . . . . c19759_2mk7 1 . 1 . 156 . 2 2 1 A2G H1 H 2.685 -16.090 9.424 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H1 . . . . . . . . . c19759_2mk7 1 . 1 . 157 . 2 2 1 A2G H14 H -1.953 -16.034 8.681 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H14 . . . . . . . . . c19759_2mk7 1 . 1 . 158 . 2 2 1 A2G H15 H -2.705 -17.181 10.727 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H15 . . . . . . . . . c19759_2mk7 1 . 1 . 159 . 2 2 1 A2G H2 H 2.164 -15.684 11.791 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H2 . . . . . . . . . c19759_2mk7 1 . 1 . 160 . 2 2 1 A2G H3 H 0.883 -18.429 11.724 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H3 . . . . . . . . . c19759_2mk7 1 . 1 . 161 . 2 2 1 A2G H4 H -1.234 -17.272 12.019 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H4 . . . . . . . . . c19759_2mk7 1 . 1 . 162 . 2 2 1 A2G H5 H -0.501 -17.602 9.699 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H5 . . . . . . . . . c19759_2mk7 1 . 1 . 163 . 2 2 1 A2G H6 H -1.559 -14.778 9.855 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H6 . . . . . . . . . c19759_2mk7 1 . 1 . 164 . 2 2 1 A2G H8 H 5.429 -18.408 13.249 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H8 . . . . . . . . . c19759_2mk7 1 . 1 . 165 . 2 2 1 A2G H8A H 6.405 -17.001 12.828 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H8A . . . . . . . . . c19759_2mk7 1 . 1 . 166 . 2 2 1 A2G H8B H 5.858 -18.104 11.566 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H8B . . . . . . . . . c19759_2mk7 1 . 1 . 167 . 2 2 1 A2G HN2 H 3.428 -18.331 11.388 . . . 1.0 . . . . . . . . . . . . A . 101 A2G HN2 . . . . . . . . . c19759_2mk7 1 . 1 . 168 . 2 2 1 A2G HO3 H 1.841 -16.848 13.666 . . . 1.0 . . . . . . . . . . . . A . 101 A2G HO3 . . . . . . . . . c19759_2mk7 1 . 1 . 169 . 2 2 1 A2G HO4 H -0.275 -14.769 11.496 . . . 1.0 . . . . . . . . . . . . A . 101 A2G HO4 . . . . . . . . . c19759_2mk7 1 . 1 . 170 . 2 2 1 A2G N2 N 3.330 -17.402 11.681 . . . 1.0 . . . . . . . . . . . . A . 101 A2G N2 . . . . . . . . . c19759_2mk7 1 . 1 . 171 . 2 2 1 A2G O O 0.661 -15.912 9.656 . . . 1.0 . . . . . . . . . . . . A . 101 A2G O . . . . . . . . . c19759_2mk7 1 . 1 . 172 . 2 2 1 A2G O3 O 1.052 -17.357 13.463 . . . 1.0 . . . . . . . . . . . . A . 101 A2G O3 . . . . . . . . . c19759_2mk7 1 . 1 . 173 . 2 2 1 A2G O4 O -0.423 -15.398 12.207 . . . 1.0 . . . . . . . . . . . . A . 101 A2G O4 . . . . . . . . . c19759_2mk7 1 . 1 . 174 . 2 2 1 A2G O6 O -2.819 -16.250 10.527 . . . 1.0 . . . . . . . . . . . . A . 101 A2G O6 . . . . . . . . . c19759_2mk7 1 . 1 . 175 . 2 2 1 A2G O7 O 4.277 -15.650 12.730 . . . 1.0 . . . . . . . . . . . . A . 101 A2G O7 . . . . . . . . . c19759_2mk7 1 . 2 . 176 . 1 1 1 ACE C C 1.384 -23.988 4.291 . . . 1.0 . . . . . . . . . . . . A . 1 ACE C . . . . . . . . . c19759_2mk7 1 . 2 . 177 . 1 1 1 ACE CH3 C 2.179 -24.649 3.170 . . . 1.0 . . . . . . . . . . . . A . 1 ACE CH3 . . . . . . . . . c19759_2mk7 1 . 2 . 178 . 1 1 1 ACE H1 H 1.605 -25.465 2.756 . . . 1.0 . . . . . . . . . . . . A . 1 ACE H1 . . . . . . . . . c19759_2mk7 1 . 2 . 179 . 1 1 1 ACE H2 H 3.111 -25.027 3.564 . . . 1.0 . . . . . . . . . . . . A . 1 ACE H2 . . . . . . . . . c19759_2mk7 1 . 2 . 180 . 1 1 1 ACE H3 H 2.381 -23.923 2.397 . . . 1.0 . . . . . . . . . . . . A . 1 ACE H3 . . . . . . . . . c19759_2mk7 1 . 2 . 181 . 1 1 1 ACE O O 1.282 -22.763 4.357 . . . 1.0 . . . . . . . . . . . . A . 1 ACE O . . . . . . . . . c19759_2mk7 1 . 2 . 182 . 1 1 2 PRO C C 0.691 -23.099 7.012 . . . 1.0 . . . . . . . . . . . . A . 2 PRO C . . . . . . . . . c19759_2mk7 1 . 2 . 183 . 1 1 2 PRO CA C 0.019 -24.279 6.313 . . . 1.0 . . . . . . . . . . . . A . 2 PRO CA . . . . . . . . . c19759_2mk7 1 . 2 . 184 . 1 1 2 PRO CB C -0.089 -25.484 7.261 . . . 1.0 . . . . . . . . . . . . A . 2 PRO CB . . . . . . . . . c19759_2mk7 1 . 2 . 185 . 1 1 2 PRO CD C 0.899 -26.239 5.159 . . . 1.0 . . . . . . . . . . . . A . 2 PRO CD . . . . . . . . . c19759_2mk7 1 . 2 . 186 . 1 1 2 PRO CG C 0.661 -26.616 6.619 . . . 1.0 . . . . . . . . . . . . A . 2 PRO CG . . . . . . . . . c19759_2mk7 1 . 2 . 187 . 1 1 2 PRO HA H -0.966 -23.999 5.979 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HA . . . . . . . . . c19759_2mk7 1 . 2 . 188 . 1 1 2 PRO HB2 H 0.354 -25.242 8.217 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HB2 . . . . . . . . . c19759_2mk7 1 . 2 . 189 . 1 1 2 PRO HB3 H -1.124 -25.759 7.392 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HB3 . . . . . . . . . c19759_2mk7 1 . 2 . 190 . 1 1 2 PRO HD2 H 1.876 -26.572 4.837 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HD2 . . . . . . . . . c19759_2mk7 1 . 2 . 191 . 1 1 2 PRO HD3 H 0.127 -26.650 4.528 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HD3 . . . . . . . . . c19759_2mk7 1 . 2 . 192 . 1 1 2 PRO HG2 H 1.605 -26.761 7.123 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HG2 . . . . . . . . . c19759_2mk7 1 . 2 . 193 . 1 1 2 PRO HG3 H 0.074 -27.519 6.667 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HG3 . . . . . . . . . c19759_2mk7 1 . 2 . 194 . 1 1 2 PRO N N 0.825 -24.779 5.167 . . . 1.0 . . . . . . . . . . . . A . 2 PRO N . . . . . . . . . c19759_2mk7 1 . 2 . 195 . 1 1 2 PRO O O 0.086 -22.042 7.190 . . . 1.0 . . . . . . . . . . . . A . 2 PRO O . . . . . . . . . c19759_2mk7 1 . 2 . 196 . 1 1 3 PRO C C 2.534 -20.845 7.447 . . . 1.0 . . . . . . . . . . . . A . 3 PRO C . . . . . . . . . c19759_2mk7 1 . 2 . 197 . 1 1 3 PRO CA C 2.702 -22.211 8.107 . . . 1.0 . . . . . . . . . . . . A . 3 PRO CA . . . . . . . . . c19759_2mk7 1 . 2 . 198 . 1 1 3 PRO CB C 4.161 -22.685 8.016 . . . 1.0 . . . . . . . . . . . . A . 3 PRO CB . . . . . . . . . c19759_2mk7 1 . 2 . 199 . 1 1 3 PRO CD C 2.712 -24.484 7.225 . . . 1.0 . . . . . . . . . . . . A . 3 PRO CD . . . . . . . . . c19759_2mk7 1 . 2 . 200 . 1 1 3 PRO CG C 4.155 -23.984 7.265 . . . 1.0 . . . . . . . . . . . . A . 3 PRO CG . . . . . . . . . c19759_2mk7 1 . 2 . 201 . 1 1 3 PRO HA H 2.407 -22.160 9.143 . . . 1.0 . . . . . . . . . . . . A . 3 PRO HA . . . . . . . . . c19759_2mk7 1 . 2 . 202 . 1 1 3 PRO HB2 H 4.753 -21.952 7.484 . . . 1.0 . . . . . . . . . . . . A . 3 PRO HB2 . . . . . . . . . c19759_2mk7 1 . 2 . 203 . 1 1 3 PRO HB3 H 4.563 -22.836 9.006 . . . 1.0 . . . . . . . . . . . . A . 3 PRO HB3 . . . . . . . . . c19759_2mk7 1 . 2 . 204 . 1 1 3 PRO HD2 H 2.496 -24.943 6.270 . . . 1.0 . . . . . . . . . . . . A . 3 PRO HD2 . . . . . . . . . c19759_2mk7 1 . 2 . 205 . 1 1 3 PRO HD3 H 2.525 -25.174 8.034 . . . 1.0 . . . . . . . . . . . . A . 3 PRO HD3 . . . . . . . . . c19759_2mk7 1 . 2 . 206 . 1 1 3 PRO HG2 H 4.521 -23.828 6.260 . . . 1.0 . . . . . . . . . . . . A . 3 PRO HG2 . . . . . . . . . c19759_2mk7 1 . 2 . 207 . 1 1 3 PRO HG3 H 4.773 -24.706 7.776 . . . 1.0 . . . . . . . . . . . . A . 3 PRO HG3 . . . . . . . . . c19759_2mk7 1 . 2 . 208 . 1 1 3 PRO N N 1.923 -23.267 7.406 . . . 1.0 . . . . . . . . . . . . A . 3 PRO N . . . . . . . . . c19759_2mk7 1 . 2 . 209 . 1 1 3 PRO O O 2.046 -20.744 6.322 . . . 1.0 . . . . . . . . . . . . A . 3 PRO O . . . . . . . . . c19759_2mk7 1 . 2 . 210 . 1 1 4 THR C C 4.017 -17.593 8.077 . . . 1.0 . . . . . . . . . . . . A . 4 THR C . . . . . . . . . c19759_2mk7 1 . 2 . 211 . 1 1 4 THR CA C 2.830 -18.440 7.630 . . . 1.0 . . . . . . . . . . . . A . 4 THR CA . . . . . . . . . c19759_2mk7 1 . 2 . 212 . 1 1 4 THR CB C 1.530 -17.797 8.115 . . . 1.0 . . . . . . . . . . . . A . 4 THR CB . . . . . . . . . c19759_2mk7 1 . 2 . 213 . 1 1 4 THR CG2 C 0.335 -18.635 7.660 . . . 1.0 . . . . . . . . . . . . A . 4 THR CG2 . . . . . . . . . c19759_2mk7 1 . 2 . 214 . 1 1 4 THR H H 3.323 -19.937 9.048 . . . 1.0 . . . . . . . . . . . . A . 4 THR H . . . . . . . . . c19759_2mk7 1 . 2 . 215 . 1 1 4 THR HA H 2.817 -18.483 6.551 . . . 1.0 . . . . . . . . . . . . A . 4 THR HA . . . . . . . . . c19759_2mk7 1 . 2 . 216 . 1 1 4 THR HB H 1.443 -16.800 7.713 . . . 1.0 . . . . . . . . . . . . A . 4 THR HB . . . . . . . . . c19759_2mk7 1 . 2 . 217 . 1 1 4 THR HG21 H 0.521 -19.020 6.668 . . . 1.0 . . . . . . . . . . . . A . 4 THR HG21 . . . . . . . . . c19759_2mk7 1 . 2 . 218 . 1 1 4 THR HG22 H -0.553 -18.020 7.646 . . . 1.0 . . . . . . . . . . . . A . 4 THR HG22 . . . . . . . . . c19759_2mk7 1 . 2 . 219 . 1 1 4 THR HG23 H 0.191 -19.459 8.343 . . . 1.0 . . . . . . . . . . . . A . 4 THR HG23 . . . . . . . . . c19759_2mk7 1 . 2 . 220 . 1 1 4 THR N N 2.941 -19.796 8.156 . . . 1.0 . . . . . . . . . . . . A . 4 THR N . . . . . . . . . c19759_2mk7 1 . 2 . 221 . 1 1 4 THR O O 4.764 -17.980 8.976 . . . 1.0 . . . . . . . . . . . . A . 4 THR O . . . . . . . . . c19759_2mk7 1 . 2 . 222 . 1 1 4 THR OG1 O 1.546 -17.756 9.526 . . . 1.0 . . . . . . . . . . . . A . 4 THR OG1 . . . . . . . . . c19759_2mk7 1 . 2 . 223 . 1 1 5 THR C C 4.790 -14.106 7.904 . . . 1.0 . . . . . . . . . . . . A . 5 THR C . . . . . . . . . c19759_2mk7 1 . 2 . 224 . 1 1 5 THR CA C 5.286 -15.543 7.783 . . . 1.0 . . . . . . . . . . . . A . 5 THR CA . . . . . . . . . c19759_2mk7 1 . 2 . 225 . 1 1 5 THR CB C 6.374 -15.623 6.711 . . . 1.0 . . . . . . . . . . . . A . 5 THR CB . . . . . . . . . c19759_2mk7 1 . 2 . 226 . 1 1 5 THR CG2 C 6.781 -17.081 6.493 . . . 1.0 . . . . . . . . . . . . A . 5 THR CG2 . . . . . . . . . c19759_2mk7 1 . 2 . 227 . 1 1 5 THR H H 3.558 -16.182 6.734 . . . 1.0 . . . . . . . . . . . . A . 5 THR H . . . . . . . . . c19759_2mk7 1 . 2 . 228 . 1 1 5 THR HA H 5.705 -15.850 8.730 . . . 1.0 . . . . . . . . . . . . A . 5 THR HA . . . . . . . . . c19759_2mk7 1 . 2 . 229 . 1 1 5 THR HB H 7.235 -15.053 7.022 . . . 1.0 . . . . . . . . . . . . A . 5 THR HB . . . . . . . . . c19759_2mk7 1 . 2 . 230 . 1 1 5 THR HG21 H 6.242 -17.482 5.647 . . . 1.0 . . . . . . . . . . . . A . 5 THR HG21 . . . . . . . . . c19759_2mk7 1 . 2 . 231 . 1 1 5 THR HG22 H 6.546 -17.657 7.375 . . . 1.0 . . . . . . . . . . . . A . 5 THR HG22 . . . . . . . . . c19759_2mk7 1 . 2 . 232 . 1 1 5 THR HG23 H 7.843 -17.133 6.300 . . . 1.0 . . . . . . . . . . . . A . 5 THR HG23 . . . . . . . . . c19759_2mk7 1 . 2 . 233 . 1 1 5 THR N N 4.185 -16.438 7.443 . . . 1.0 . . . . . . . . . . . . A . 5 THR N . . . . . . . . . c19759_2mk7 1 . 2 . 234 . 1 1 5 THR O O 3.894 -13.685 7.172 . . . 1.0 . . . . . . . . . . . . A . 5 THR O . . . . . . . . . c19759_2mk7 1 . 2 . 235 . 1 1 5 THR OG1 O 5.856 -15.108 5.504 . . . 1.0 . . . . . . . . . . . . A . 5 THR OG1 . . . . . . . . . c19759_2mk7 1 . 2 . 236 . 1 1 6 THR C C 6.030 -11.024 8.437 . . . 1.0 . . . . . . . . . . . . A . 6 THR C . . . . . . . . . c19759_2mk7 1 . 2 . 237 . 1 1 6 THR CA C 4.990 -11.968 9.036 . . . 1.0 . . . . . . . . . . . . A . 6 THR CA . . . . . . . . . c19759_2mk7 1 . 2 . 238 . 1 1 6 THR CB C 4.843 -11.683 10.532 . . . 1.0 . . . . . . . . . . . . A . 6 THR CB . . . . . . . . . c19759_2mk7 1 . 2 . 239 . 1 1 6 THR CG2 C 3.915 -12.718 11.168 . . . 1.0 . . . . . . . . . . . . A . 6 THR CG2 . . . . . . . . . c19759_2mk7 1 . 2 . 240 . 1 1 6 THR H H 6.088 -13.746 9.384 . . . 1.0 . . . . . . . . . . . . A . 6 THR H . . . . . . . . . c19759_2mk7 1 . 2 . 241 . 1 1 6 THR HA H 4.040 -11.794 8.554 . . . 1.0 . . . . . . . . . . . . A . 6 THR HA . . . . . . . . . c19759_2mk7 1 . 2 . 242 . 1 1 6 THR HB H 4.433 -10.695 10.678 . . . 1.0 . . . . . . . . . . . . A . 6 THR HB . . . . . . . . . c19759_2mk7 1 . 2 . 243 . 1 1 6 THR HG21 H 4.493 -13.577 11.477 . . . 1.0 . . . . . . . . . . . . A . 6 THR HG21 . . . . . . . . . c19759_2mk7 1 . 2 . 244 . 1 1 6 THR HG22 H 3.171 -13.024 10.450 . . . 1.0 . . . . . . . . . . . . A . 6 THR HG22 . . . . . . . . . c19759_2mk7 1 . 2 . 245 . 1 1 6 THR HG23 H 3.428 -12.285 12.030 . . . 1.0 . . . . . . . . . . . . A . 6 THR HG23 . . . . . . . . . c19759_2mk7 1 . 2 . 246 . 1 1 6 THR N N 5.380 -13.357 8.830 . . . 1.0 . . . . . . . . . . . . A . 6 THR N . . . . . . . . . c19759_2mk7 1 . 2 . 247 . 1 1 6 THR O O 7.199 -11.384 8.296 . . . 1.0 . . . . . . . . . . . . A . 6 THR O . . . . . . . . . c19759_2mk7 1 . 2 . 248 . 1 1 6 THR OG1 O 6.115 -11.777 11.136 . . . 1.0 . . . . . . . . . . . . A . 6 THR OG1 . . . . . . . . . c19759_2mk7 1 . 2 . 249 . 1 1 7 THR C C 6.928 -7.814 8.552 . . . 1.0 . . . . . . . . . . . . A . 7 THR C . . . . . . . . . c19759_2mk7 1 . 2 . 250 . 1 1 7 THR CA C 6.497 -8.833 7.502 . . . 1.0 . . . . . . . . . . . . A . 7 THR CA . . . . . . . . . c19759_2mk7 1 . 2 . 251 . 1 1 7 THR CB C 5.805 -8.112 6.343 . . . 1.0 . . . . . . . . . . . . A . 7 THR CB . . . . . . . . . c19759_2mk7 1 . 2 . 252 . 1 1 7 THR CG2 C 5.388 -9.126 5.277 . . . 1.0 . . . . . . . . . . . . A . 7 THR CG2 . . . . . . . . . c19759_2mk7 1 . 2 . 253 . 1 1 7 THR H H 4.653 -9.589 8.221 . . . 1.0 . . . . . . . . . . . . A . 7 THR H . . . . . . . . . c19759_2mk7 1 . 2 . 254 . 1 1 7 THR HA H 7.373 -9.339 7.124 . . . 1.0 . . . . . . . . . . . . A . 7 THR HA . . . . . . . . . c19759_2mk7 1 . 2 . 255 . 1 1 7 THR HB H 6.478 -7.389 5.908 . . . 1.0 . . . . . . . . . . . . A . 7 THR HB . . . . . . . . . c19759_2mk7 1 . 2 . 256 . 1 1 7 THR HG21 H 5.320 -8.634 4.318 . . . 1.0 . . . . . . . . . . . . A . 7 THR HG21 . . . . . . . . . c19759_2mk7 1 . 2 . 257 . 1 1 7 THR HG22 H 4.427 -9.546 5.536 . . . 1.0 . . . . . . . . . . . . A . 7 THR HG22 . . . . . . . . . c19759_2mk7 1 . 2 . 258 . 1 1 7 THR HG23 H 6.123 -9.916 5.225 . . . 1.0 . . . . . . . . . . . . A . 7 THR HG23 . . . . . . . . . c19759_2mk7 1 . 2 . 259 . 1 1 7 THR N N 5.595 -9.820 8.086 . . . 1.0 . . . . . . . . . . . . A . 7 THR N . . . . . . . . . c19759_2mk7 1 . 2 . 260 . 1 1 7 THR O O 6.142 -7.429 9.418 . . . 1.0 . . . . . . . . . . . . A . 7 THR O . . . . . . . . . c19759_2mk7 1 . 2 . 261 . 1 1 7 THR OG1 O 4.650 -7.470 6.837 . . . 1.0 . . . . . . . . . . . . A . 7 THR OG1 . . . . . . . . . c19759_2mk7 1 . 2 . 262 . 1 1 8 LYS C C 8.278 -4.995 9.030 . . . 1.0 . . . . . . . . . . . . A . 8 LYS C . . . . . . . . . c19759_2mk7 1 . 2 . 263 . 1 1 8 LYS CA C 8.707 -6.406 9.418 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CA . . . . . . . . . c19759_2mk7 1 . 2 . 264 . 1 1 8 LYS CB C 10.235 -6.484 9.457 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CB . . . . . . . . . c19759_2mk7 1 . 2 . 265 . 1 1 8 LYS CD C 12.169 -5.581 10.757 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CD . . . . . . . . . c19759_2mk7 1 . 2 . 266 . 1 1 8 LYS CE C 12.785 -4.315 11.354 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CE . . . . . . . . . c19759_2mk7 1 . 2 . 267 . 1 1 8 LYS CG C 10.792 -5.253 10.175 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CG . . . . . . . . . c19759_2mk7 1 . 2 . 268 . 1 1 8 LYS H H 8.764 -7.723 7.759 . . . 1.0 . . . . . . . . . . . . A . 8 LYS H . . . . . . . . . c19759_2mk7 1 . 2 . 269 . 1 1 8 LYS HA H 8.323 -6.632 10.402 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HA . . . . . . . . . c19759_2mk7 1 . 2 . 270 . 1 1 8 LYS HB2 H 10.537 -7.377 9.984 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HB2 . . . . . . . . . c19759_2mk7 1 . 2 . 271 . 1 1 8 LYS HB3 H 10.619 -6.514 8.448 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HB3 . . . . . . . . . c19759_2mk7 1 . 2 . 272 . 1 1 8 LYS HD2 H 12.063 -6.330 11.529 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HD2 . . . . . . . . . c19759_2mk7 1 . 2 . 273 . 1 1 8 LYS HD3 H 12.810 -5.959 9.975 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HD3 . . . . . . . . . c19759_2mk7 1 . 2 . 274 . 1 1 8 LYS HE2 H 13.661 -4.578 11.929 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HE2 . . . . . . . . . c19759_2mk7 1 . 2 . 275 . 1 1 8 LYS HE3 H 13.066 -3.642 10.558 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HE3 . . . . . . . . . c19759_2mk7 1 . 2 . 276 . 1 1 8 LYS HG2 H 10.883 -4.438 9.473 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HG2 . . . . . . . . . c19759_2mk7 1 . 2 . 277 . 1 1 8 LYS HG3 H 10.124 -4.970 10.974 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HG3 . . . . . . . . . c19759_2mk7 1 . 2 . 278 . 1 1 8 LYS HZ1 H 11.334 -2.868 11.726 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ1 . . . . . . . . . c19759_2mk7 1 . 2 . 279 . 1 1 8 LYS HZ2 H 12.275 -3.274 13.082 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ2 . . . . . . . . . c19759_2mk7 1 . 2 . 280 . 1 1 8 LYS HZ3 H 11.069 -4.337 12.533 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ3 . . . . . . . . . c19759_2mk7 1 . 2 . 281 . 1 1 8 LYS N N 8.182 -7.381 8.470 . . . 1.0 . . . . . . . . . . . . A . 8 LYS N . . . . . . . . . c19759_2mk7 1 . 2 . 282 . 1 1 8 LYS NZ N 11.791 -3.649 12.241 . . . 1.0 . . . . . . . . . . . . A . 8 LYS NZ . . . . . . . . . c19759_2mk7 1 . 2 . 283 . 1 1 8 LYS O O 8.151 -4.678 7.847 . . . 1.0 . . . . . . . . . . . . A . 8 LYS O . . . . . . . . . c19759_2mk7 1 . 2 . 284 . 1 1 9 LYS C C 8.724 -2.018 9.025 . . . 1.0 . . . . . . . . . . . . A . 9 LYS C . . . . . . . . . c19759_2mk7 1 . 2 . 285 . 1 1 9 LYS CA C 7.641 -2.777 9.784 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CA . . . . . . . . . c19759_2mk7 1 . 2 . 286 . 1 1 9 LYS CB C 7.354 -2.069 11.111 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CB . . . . . . . . . c19759_2mk7 1 . 2 . 287 . 1 1 9 LYS CD C 4.960 -1.524 11.578 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CD . . . . . . . . . c19759_2mk7 1 . 2 . 288 . 1 1 9 LYS CE C 3.661 -2.038 12.200 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CE . . . . . . . . . c19759_2mk7 1 . 2 . 289 . 1 1 9 LYS CG C 6.045 -2.597 11.700 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CG . . . . . . . . . c19759_2mk7 1 . 2 . 290 . 1 1 9 LYS H H 8.173 -4.461 10.957 . . . 1.0 . . . . . . . . . . . . A . 9 LYS H . . . . . . . . . c19759_2mk7 1 . 2 . 291 . 1 1 9 LYS HA H 6.737 -2.784 9.193 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HA . . . . . . . . . c19759_2mk7 1 . 2 . 292 . 1 1 9 LYS HB2 H 8.163 -2.259 11.801 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HB2 . . . . . . . . . c19759_2mk7 1 . 2 . 293 . 1 1 9 LYS HB3 H 7.268 -1.007 10.941 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HB3 . . . . . . . . . c19759_2mk7 1 . 2 . 294 . 1 1 9 LYS HD2 H 5.280 -0.631 12.096 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HD2 . . . . . . . . . c19759_2mk7 1 . 2 . 295 . 1 1 9 LYS HD3 H 4.795 -1.297 10.536 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HD3 . . . . . . . . . c19759_2mk7 1 . 2 . 296 . 1 1 9 LYS HE2 H 2.922 -2.179 11.424 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HE2 . . . . . . . . . c19759_2mk7 1 . 2 . 297 . 1 1 9 LYS HE3 H 3.846 -2.980 12.694 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HE3 . . . . . . . . . c19759_2mk7 1 . 2 . 298 . 1 1 9 LYS HG2 H 5.739 -3.482 11.160 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HG2 . . . . . . . . . c19759_2mk7 1 . 2 . 299 . 1 1 9 LYS HG3 H 6.191 -2.843 12.741 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HG3 . . . . . . . . . c19759_2mk7 1 . 2 . 300 . 1 1 9 LYS HZ1 H 2.445 -1.496 13.801 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HZ1 . . . . . . . . . c19759_2mk7 1 . 2 . 301 . 1 1 9 LYS HZ2 H 2.728 -0.243 12.688 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HZ2 . . . . . . . . . c19759_2mk7 1 . 2 . 302 . 1 1 9 LYS HZ3 H 3.947 -0.709 13.776 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HZ3 . . . . . . . . . c19759_2mk7 1 . 2 . 303 . 1 1 9 LYS N N 8.056 -4.152 10.034 . . . 1.0 . . . . . . . . . . . . A . 9 LYS N . . . . . . . . . c19759_2mk7 1 . 2 . 304 . 1 1 9 LYS NZ N 3.157 -1.046 13.191 . . . 1.0 . . . . . . . . . . . . A . 9 LYS NZ . . . . . . . . . c19759_2mk7 1 . 2 . 305 . 1 1 9 LYS O O 9.913 -2.308 9.163 . . . 1.0 . . . . . . . . . . . . A . 9 LYS O . . . . . . . . . c19759_2mk7 1 . 2 . 306 . 1 1 10 PRO C C 10.488 0.204 8.236 . . . 1.0 . . . . . . . . . . . . A . 10 PRO C . . . . . . . . . c19759_2mk7 1 . 2 . 307 . 1 1 10 PRO CA C 9.273 -0.240 7.423 . . . 1.0 . . . . . . . . . . . . A . 10 PRO CA . . . . . . . . . c19759_2mk7 1 . 2 . 308 . 1 1 10 PRO CB C 8.442 0.974 6.979 . . . 1.0 . . . . . . . . . . . . A . 10 PRO CB . . . . . . . . . c19759_2mk7 1 . 2 . 309 . 1 1 10 PRO CD C 6.945 -0.652 8.018 . . . 1.0 . . . . . . . . . . . . A . 10 PRO CD . . . . . . . . . c19759_2mk7 1 . 2 . 310 . 1 1 10 PRO CG C 7.066 0.798 7.554 . . . 1.0 . . . . . . . . . . . . A . 10 PRO CG . . . . . . . . . c19759_2mk7 1 . 2 . 311 . 1 1 10 PRO HA H 9.592 -0.792 6.553 . . . 1.0 . . . . . . . . . . . . A . 10 PRO HA . . . . . . . . . c19759_2mk7 1 . 2 . 312 . 1 1 10 PRO HB2 H 8.887 1.884 7.356 . . . 1.0 . . . . . . . . . . . . A . 10 PRO HB2 . . . . . . . . . c19759_2mk7 1 . 2 . 313 . 1 1 10 PRO HB3 H 8.385 1.009 5.901 . . . 1.0 . . . . . . . . . . . . A . 10 PRO HB3 . . . . . . . . . c19759_2mk7 1 . 2 . 314 . 1 1 10 PRO HD2 H 6.381 -0.709 8.939 . . . 1.0 . . . . . . . . . . . . A . 10 PRO HD2 . . . . . . . . . c19759_2mk7 1 . 2 . 315 . 1 1 10 PRO HD3 H 6.490 -1.261 7.251 . . . 1.0 . . . . . . . . . . . . A . 10 PRO HD3 . . . . . . . . . c19759_2mk7 1 . 2 . 316 . 1 1 10 PRO HG2 H 6.932 1.467 8.393 . . . 1.0 . . . . . . . . . . . . A . 10 PRO HG2 . . . . . . . . . c19759_2mk7 1 . 2 . 317 . 1 1 10 PRO HG3 H 6.323 0.999 6.799 . . . 1.0 . . . . . . . . . . . . A . 10 PRO HG3 . . . . . . . . . c19759_2mk7 1 . 2 . 318 . 1 1 10 PRO N N 8.332 -1.061 8.232 . . . 1.0 . . . . . . . . . . . . A . 10 PRO N . . . . . . . . . c19759_2mk7 1 . 2 . 319 . 1 1 10 PRO O O 10.394 0.371 9.451 . . . 1.0 . . . . . . . . . . . . A . 10 PRO O . . . . . . . . . c19759_2mk7 1 . 2 . 320 . 1 1 11 NH2 HN1 H 11.991 -0.279 7.031 . . . 1.0 . . . . . . . . . . . . A . 11 NH2 HN1 . . . . . . . . . c19759_2mk7 1 . 2 . 321 . 1 1 11 NH2 HN2 H 12.122 1.236 7.784 . . . 1.0 . . . . . . . . . . . . A . 11 NH2 HN2 . . . . . . . . . c19759_2mk7 1 . 2 . 322 . 1 1 11 NH2 N N 11.627 0.404 7.632 . . . 1.0 . . . . . . . . . . . . A . 11 NH2 N . . . . . . . . . c19759_2mk7 1 . 2 . 323 . 2 2 1 A2G C1 C 1.606 -16.439 10.028 . . . 1.0 . . . . . . . . . . . . A . 101 A2G C1 . . . . . . . . . c19759_2mk7 1 . 2 . 324 . 2 2 1 A2G C2 C 1.875 -16.512 11.532 . . . 1.0 . . . . . . . . . . . . A . 101 A2G C2 . . . . . . . . . c19759_2mk7 1 . 2 . 325 . 2 2 1 A2G C3 C 0.720 -17.244 12.216 . . . 1.0 . . . . . . . . . . . . A . 101 A2G C3 . . . . . . . . . c19759_2mk7 1 . 2 . 326 . 2 2 1 A2G C4 C -0.606 -16.574 11.843 . . . 1.0 . . . . . . . . . . . . A . 101 A2G C4 . . . . . . . . . c19759_2mk7 1 . 2 . 327 . 2 2 1 A2G C5 C -0.720 -16.464 10.320 . . . 1.0 . . . . . . . . . . . . A . 101 A2G C5 . . . . . . . . . c19759_2mk7 1 . 2 . 328 . 2 2 1 A2G C6 C -1.993 -15.699 9.954 . . . 1.0 . . . . . . . . . . . . A . 101 A2G C6 . . . . . . . . . c19759_2mk7 1 . 2 . 329 . 2 2 1 A2G C7 C 4.134 -16.614 12.418 . . . 1.0 . . . . . . . . . . . . A . 101 A2G C7 . . . . . . . . . c19759_2mk7 1 . 2 . 330 . 2 2 1 A2G C8 C 5.380 -17.461 12.654 . . . 1.0 . . . . . . . . . . . . A . 101 A2G C8 . . . . . . . . . c19759_2mk7 1 . 2 . 331 . 2 2 1 A2G H1 H 2.411 -15.903 9.548 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H1 . . . . . . . . . c19759_2mk7 1 . 2 . 332 . 2 2 1 A2G H14 H -2.079 -15.636 8.879 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H14 . . . . . . . . . c19759_2mk7 1 . 2 . 333 . 2 2 1 A2G H15 H -3.606 -15.765 11.037 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H15 . . . . . . . . . c19759_2mk7 1 . 2 . 334 . 2 2 1 A2G H2 H 1.944 -15.510 11.928 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H2 . . . . . . . . . c19759_2mk7 1 . 2 . 335 . 2 2 1 A2G H3 H 0.706 -18.275 11.895 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H3 . . . . . . . . . c19759_2mk7 1 . 2 . 336 . 2 2 1 A2G H4 H -1.426 -17.165 12.224 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H4 . . . . . . . . . c19759_2mk7 1 . 2 . 337 . 2 2 1 A2G H5 H -0.752 -17.452 9.884 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H5 . . . . . . . . . c19759_2mk7 1 . 2 . 338 . 2 2 1 A2G H6 H -1.947 -14.703 10.370 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H6 . . . . . . . . . c19759_2mk7 1 . 2 . 339 . 2 2 1 A2G H8 H 5.104 -18.368 13.173 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H8 . . . . . . . . . c19759_2mk7 1 . 2 . 340 . 2 2 1 A2G H8A H 6.086 -16.904 13.252 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H8A . . . . . . . . . c19759_2mk7 1 . 2 . 341 . 2 2 1 A2G H8B H 5.830 -17.713 11.705 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H8B . . . . . . . . . c19759_2mk7 1 . 2 . 342 . 2 2 1 A2G HN2 H 3.236 -18.136 11.479 . . . 1.0 . . . . . . . . . . . . A . 101 A2G HN2 . . . . . . . . . c19759_2mk7 1 . 2 . 343 . 2 2 1 A2G HO3 H 1.788 -16.885 13.800 . . . 1.0 . . . . . . . . . . . . A . 101 A2G HO3 . . . . . . . . . c19759_2mk7 1 . 2 . 344 . 2 2 1 A2G HO4 H -0.667 -14.636 11.699 . . . 1.0 . . . . . . . . . . . . A . 101 A2G HO4 . . . . . . . . . c19759_2mk7 1 . 2 . 345 . 2 2 1 A2G N2 N 3.131 -17.210 11.783 . . . 1.0 . . . . . . . . . . . . A . 101 A2G N2 . . . . . . . . . c19759_2mk7 1 . 2 . 346 . 2 2 1 A2G O O 0.393 -15.750 9.831 . . . 1.0 . . . . . . . . . . . . A . 101 A2G O . . . . . . . . . c19759_2mk7 1 . 2 . 347 . 2 2 1 A2G O3 O 0.896 -17.191 13.625 . . . 1.0 . . . . . . . . . . . . A . 101 A2G O3 . . . . . . . . . c19759_2mk7 1 . 2 . 348 . 2 2 1 A2G O4 O -0.655 -15.275 12.414 . . . 1.0 . . . . . . . . . . . . A . 101 A2G O4 . . . . . . . . . c19759_2mk7 1 . 2 . 349 . 2 2 1 A2G O6 O -3.123 -16.379 10.479 . . . 1.0 . . . . . . . . . . . . A . 101 A2G O6 . . . . . . . . . c19759_2mk7 1 . 2 . 350 . 2 2 1 A2G O7 O 4.073 -15.454 12.828 . . . 1.0 . . . . . . . . . . . . A . 101 A2G O7 . . . . . . . . . c19759_2mk7 1 . 3 . 351 . 1 1 1 ACE C C -0.502 -22.761 6.649 . . . 1.0 . . . . . . . . . . . . A . 1 ACE C . . . . . . . . . c19759_2mk7 1 . 3 . 352 . 1 1 1 ACE CH3 C -1.364 -23.520 5.646 . . . 1.0 . . . . . . . . . . . . A . 1 ACE CH3 . . . . . . . . . c19759_2mk7 1 . 3 . 353 . 1 1 1 ACE H1 H -0.758 -24.253 5.132 . . . 1.0 . . . . . . . . . . . . A . 1 ACE H1 . . . . . . . . . c19759_2mk7 1 . 3 . 354 . 1 1 1 ACE H2 H -1.774 -22.826 4.927 . . . 1.0 . . . . . . . . . . . . A . 1 ACE H2 . . . . . . . . . c19759_2mk7 1 . 3 . 355 . 1 1 1 ACE H3 H -2.168 -24.018 6.166 . . . 1.0 . . . . . . . . . . . . A . 1 ACE H3 . . . . . . . . . c19759_2mk7 1 . 3 . 356 . 1 1 1 ACE O O -0.147 -21.603 6.429 . . . 1.0 . . . . . . . . . . . . A . 1 ACE O . . . . . . . . . c19759_2mk7 1 . 3 . 357 . 1 1 2 PRO C C 1.868 -22.030 8.236 . . . 1.0 . . . . . . . . . . . . A . 2 PRO C . . . . . . . . . c19759_2mk7 1 . 3 . 358 . 1 1 2 PRO CA C 0.670 -22.782 8.808 . . . 1.0 . . . . . . . . . . . . A . 2 PRO CA . . . . . . . . . c19759_2mk7 1 . 3 . 359 . 1 1 2 PRO CB C 1.131 -23.972 9.664 . . . 1.0 . . . . . . . . . . . . A . 2 PRO CB . . . . . . . . . c19759_2mk7 1 . 3 . 360 . 1 1 2 PRO CD C -0.544 -24.766 8.073 . . . 1.0 . . . . . . . . . . . . A . 2 PRO CD . . . . . . . . . c19759_2mk7 1 . 3 . 361 . 1 1 2 PRO CG C 0.545 -25.209 9.048 . . . 1.0 . . . . . . . . . . . . A . 2 PRO CG . . . . . . . . . c19759_2mk7 1 . 3 . 362 . 1 1 2 PRO HA H 0.071 -22.120 9.410 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HA . . . . . . . . . c19759_2mk7 1 . 3 . 363 . 1 1 2 PRO HB2 H 2.210 -24.033 9.660 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HB2 . . . . . . . . . c19759_2mk7 1 . 3 . 364 . 1 1 2 PRO HB3 H 0.770 -23.863 10.675 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HB3 . . . . . . . . . c19759_2mk7 1 . 3 . 365 . 1 1 2 PRO HD2 H -0.540 -25.391 7.191 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HD2 . . . . . . . . . c19759_2mk7 1 . 3 . 366 . 1 1 2 PRO HD3 H -1.512 -24.781 8.550 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HD3 . . . . . . . . . c19759_2mk7 1 . 3 . 367 . 1 1 2 PRO HG2 H 1.314 -25.755 8.519 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HG2 . . . . . . . . . c19759_2mk7 1 . 3 . 368 . 1 1 2 PRO HG3 H 0.112 -25.833 9.815 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HG3 . . . . . . . . . c19759_2mk7 1 . 3 . 369 . 1 1 2 PRO N N -0.165 -23.395 7.739 . . . 1.0 . . . . . . . . . . . . A . 2 PRO N . . . . . . . . . c19759_2mk7 1 . 3 . 370 . 1 1 2 PRO O O 2.082 -20.857 8.540 . . . 1.0 . . . . . . . . . . . . A . 2 PRO O . . . . . . . . . c19759_2mk7 1 . 3 . 371 . 1 1 3 PRO C C 3.583 -20.683 6.256 . . . 1.0 . . . . . . . . . . . . A . 3 PRO C . . . . . . . . . c19759_2mk7 1 . 3 . 372 . 1 1 3 PRO CA C 3.853 -22.088 6.789 . . . 1.0 . . . . . . . . . . . . A . 3 PRO CA . . . . . . . . . c19759_2mk7 1 . 3 . 373 . 1 1 3 PRO CB C 4.205 -23.049 5.643 . . . 1.0 . . . . . . . . . . . . A . 3 PRO CB . . . . . . . . . c19759_2mk7 1 . 3 . 374 . 1 1 3 PRO CD C 2.456 -24.076 7.002 . . . 1.0 . . . . . . . . . . . . A . 3 PRO CD . . . . . . . . . c19759_2mk7 1 . 3 . 375 . 1 1 3 PRO CG C 3.185 -24.149 5.662 . . . 1.0 . . . . . . . . . . . . A . 3 PRO CG . . . . . . . . . c19759_2mk7 1 . 3 . 376 . 1 1 3 PRO HA H 4.665 -22.064 7.497 . . . 1.0 . . . . . . . . . . . . A . 3 PRO HA . . . . . . . . . c19759_2mk7 1 . 3 . 377 . 1 1 3 PRO HB2 H 4.167 -22.525 4.697 . . . 1.0 . . . . . . . . . . . . A . 3 PRO HB2 . . . . . . . . . c19759_2mk7 1 . 3 . 378 . 1 1 3 PRO HB3 H 5.191 -23.461 5.796 . . . 1.0 . . . . . . . . . . . . A . 3 PRO HB3 . . . . . . . . . c19759_2mk7 1 . 3 . 379 . 1 1 3 PRO HD2 H 1.406 -24.299 6.875 . . . 1.0 . . . . . . . . . . . . A . 3 PRO HD2 . . . . . . . . . c19759_2mk7 1 . 3 . 380 . 1 1 3 PRO HD3 H 2.906 -24.745 7.718 . . . 1.0 . . . . . . . . . . . . A . 3 PRO HD3 . . . . . . . . . c19759_2mk7 1 . 3 . 381 . 1 1 3 PRO HG2 H 2.483 -24.012 4.851 . . . 1.0 . . . . . . . . . . . . A . 3 PRO HG2 . . . . . . . . . c19759_2mk7 1 . 3 . 382 . 1 1 3 PRO HG3 H 3.674 -25.106 5.569 . . . 1.0 . . . . . . . . . . . . A . 3 PRO HG3 . . . . . . . . . c19759_2mk7 1 . 3 . 383 . 1 1 3 PRO N N 2.645 -22.688 7.418 . . . 1.0 . . . . . . . . . . . . A . 3 PRO N . . . . . . . . . c19759_2mk7 1 . 3 . 384 . 1 1 3 PRO O O 3.160 -20.515 5.112 . . . 1.0 . . . . . . . . . . . . A . 3 PRO O . . . . . . . . . c19759_2mk7 1 . 3 . 385 . 1 1 4 THR C C 4.655 -17.383 7.331 . . . 1.0 . . . . . . . . . . . . A . 4 THR C . . . . . . . . . c19759_2mk7 1 . 3 . 386 . 1 1 4 THR CA C 3.611 -18.295 6.693 . . . 1.0 . . . . . . . . . . . . A . 4 THR CA . . . . . . . . . c19759_2mk7 1 . 3 . 387 . 1 1 4 THR CB C 2.210 -17.845 7.114 . . . 1.0 . . . . . . . . . . . . A . 4 THR CB . . . . . . . . . c19759_2mk7 1 . 3 . 388 . 1 1 4 THR CG2 C 1.155 -18.672 6.379 . . . 1.0 . . . . . . . . . . . . A . 4 THR CG2 . . . . . . . . . c19759_2mk7 1 . 3 . 389 . 1 1 4 THR H H 4.163 -19.875 7.992 . . . 1.0 . . . . . . . . . . . . A . 4 THR H . . . . . . . . . c19759_2mk7 1 . 3 . 390 . 1 1 4 THR HA H 3.692 -18.223 5.619 . . . 1.0 . . . . . . . . . . . . A . 4 THR HA . . . . . . . . . c19759_2mk7 1 . 3 . 391 . 1 1 4 THR HB H 2.077 -16.801 6.878 . . . 1.0 . . . . . . . . . . . . A . 4 THR HB . . . . . . . . . c19759_2mk7 1 . 3 . 392 . 1 1 4 THR HG21 H 0.229 -18.119 6.337 . . . 1.0 . . . . . . . . . . . . A . 4 THR HG21 . . . . . . . . . c19759_2mk7 1 . 3 . 393 . 1 1 4 THR HG22 H 0.996 -19.601 6.906 . . . 1.0 . . . . . . . . . . . . A . 4 THR HG22 . . . . . . . . . c19759_2mk7 1 . 3 . 394 . 1 1 4 THR HG23 H 1.496 -18.881 5.376 . . . 1.0 . . . . . . . . . . . . A . 4 THR HG23 . . . . . . . . . c19759_2mk7 1 . 3 . 395 . 1 1 4 THR N N 3.829 -19.681 7.093 . . . 1.0 . . . . . . . . . . . . A . 4 THR N . . . . . . . . . c19759_2mk7 1 . 3 . 396 . 1 1 4 THR O O 5.123 -17.640 8.439 . . . 1.0 . . . . . . . . . . . . A . 4 THR O . . . . . . . . . c19759_2mk7 1 . 3 . 397 . 1 1 4 THR OG1 O 2.068 -18.054 8.502 . . . 1.0 . . . . . . . . . . . . A . 4 THR OG1 . . . . . . . . . c19759_2mk7 1 . 3 . 398 . 1 1 5 THR C C 5.330 -14.089 7.595 . . . 1.0 . . . . . . . . . . . . A . 5 THR C . . . . . . . . . c19759_2mk7 1 . 3 . 399 . 1 1 5 THR CA C 6.005 -15.375 7.128 . . . 1.0 . . . . . . . . . . . . A . 5 THR CA . . . . . . . . . c19759_2mk7 1 . 3 . 400 . 1 1 5 THR CB C 7.025 -15.052 6.035 . . . 1.0 . . . . . . . . . . . . A . 5 THR CB . . . . . . . . . c19759_2mk7 1 . 3 . 401 . 1 1 5 THR CG2 C 7.700 -16.339 5.557 . . . 1.0 . . . . . . . . . . . . A . 5 THR CG2 . . . . . . . . . c19759_2mk7 1 . 3 . 402 . 1 1 5 THR H H 4.607 -16.164 5.744 . . . 1.0 . . . . . . . . . . . . A . 5 THR H . . . . . . . . . c19759_2mk7 1 . 3 . 403 . 1 1 5 THR HA H 6.520 -15.823 7.965 . . . 1.0 . . . . . . . . . . . . A . 5 THR HA . . . . . . . . . c19759_2mk7 1 . 3 . 404 . 1 1 5 THR HB H 7.773 -14.376 6.422 . . . 1.0 . . . . . . . . . . . . A . 5 THR HB . . . . . . . . . c19759_2mk7 1 . 3 . 405 . 1 1 5 THR HG21 H 7.216 -16.685 4.656 . . . 1.0 . . . . . . . . . . . . A . 5 THR HG21 . . . . . . . . . c19759_2mk7 1 . 3 . 406 . 1 1 5 THR HG22 H 7.615 -17.095 6.323 . . . 1.0 . . . . . . . . . . . . A . 5 THR HG22 . . . . . . . . . c19759_2mk7 1 . 3 . 407 . 1 1 5 THR HG23 H 8.743 -16.145 5.356 . . . 1.0 . . . . . . . . . . . . A . 5 THR HG23 . . . . . . . . . c19759_2mk7 1 . 3 . 408 . 1 1 5 THR N N 5.015 -16.318 6.621 . . . 1.0 . . . . . . . . . . . . A . 5 THR N . . . . . . . . . c19759_2mk7 1 . 3 . 409 . 1 1 5 THR O O 4.382 -13.613 6.969 . . . 1.0 . . . . . . . . . . . . A . 5 THR O . . . . . . . . . c19759_2mk7 1 . 3 . 410 . 1 1 5 THR OG1 O 6.349 -14.461 4.947 . . . 1.0 . . . . . . . . . . . . A . 5 THR OG1 . . . . . . . . . c19759_2mk7 1 . 3 . 411 . 1 1 6 THR C C 6.170 -11.114 8.922 . . . 1.0 . . . . . . . . . . . . A . 6 THR C . . . . . . . . . c19759_2mk7 1 . 3 . 412 . 1 1 6 THR CA C 5.262 -12.300 9.234 . . . 1.0 . . . . . . . . . . . . A . 6 THR CA . . . . . . . . . c19759_2mk7 1 . 3 . 413 . 1 1 6 THR CB C 5.087 -12.426 10.750 . . . 1.0 . . . . . . . . . . . . A . 6 THR CB . . . . . . . . . c19759_2mk7 1 . 3 . 414 . 1 1 6 THR CG2 C 4.348 -13.723 11.080 . . . 1.0 . . . . . . . . . . . . A . 6 THR CG2 . . . . . . . . . c19759_2mk7 1 . 3 . 415 . 1 1 6 THR H H 6.583 -13.956 9.150 . . . 1.0 . . . . . . . . . . . . A . 6 THR H . . . . . . . . . c19759_2mk7 1 . 3 . 416 . 1 1 6 THR HA H 4.296 -12.128 8.785 . . . 1.0 . . . . . . . . . . . . A . 6 THR HA . . . . . . . . . c19759_2mk7 1 . 3 . 417 . 1 1 6 THR HB H 4.523 -11.585 11.122 . . . 1.0 . . . . . . . . . . . . A . 6 THR HB . . . . . . . . . c19759_2mk7 1 . 3 . 418 . 1 1 6 THR HG21 H 5.049 -14.545 11.084 . . . 1.0 . . . . . . . . . . . . A . 6 THR HG21 . . . . . . . . . c19759_2mk7 1 . 3 . 419 . 1 1 6 THR HG22 H 3.586 -13.903 10.335 . . . 1.0 . . . . . . . . . . . . A . 6 THR HG22 . . . . . . . . . c19759_2mk7 1 . 3 . 420 . 1 1 6 THR HG23 H 3.887 -13.637 12.053 . . . 1.0 . . . . . . . . . . . . A . 6 THR HG23 . . . . . . . . . c19759_2mk7 1 . 3 . 421 . 1 1 6 THR N N 5.826 -13.532 8.694 . . . 1.0 . . . . . . . . . . . . A . 6 THR N . . . . . . . . . c19759_2mk7 1 . 3 . 422 . 1 1 6 THR O O 7.395 -11.227 8.972 . . . 1.0 . . . . . . . . . . . . A . 6 THR O . . . . . . . . . c19759_2mk7 1 . 3 . 423 . 1 1 6 THR OG1 O 6.363 -12.463 11.350 . . . 1.0 . . . . . . . . . . . . A . 6 THR OG1 . . . . . . . . . c19759_2mk7 1 . 3 . 424 . 1 1 7 THR C C 6.359 -7.830 9.480 . . . 1.0 . . . . . . . . . . . . A . 7 THR C . . . . . . . . . c19759_2mk7 1 . 3 . 425 . 1 1 7 THR CA C 6.325 -8.776 8.284 . . . 1.0 . . . . . . . . . . . . A . 7 THR CA . . . . . . . . . c19759_2mk7 1 . 3 . 426 . 1 1 7 THR CB C 5.701 -8.062 7.083 . . . 1.0 . . . . . . . . . . . . A . 7 THR CB . . . . . . . . . c19759_2mk7 1 . 3 . 427 . 1 1 7 THR CG2 C 5.539 -9.045 5.922 . . . 1.0 . . . . . . . . . . . . A . 7 THR CG2 . . . . . . . . . c19759_2mk7 1 . 3 . 428 . 1 1 7 THR H H 4.582 -9.946 8.578 . . . 1.0 . . . . . . . . . . . . A . 7 THR H . . . . . . . . . c19759_2mk7 1 . 3 . 429 . 1 1 7 THR HA H 7.336 -9.059 8.033 . . . 1.0 . . . . . . . . . . . . A . 7 THR HA . . . . . . . . . c19759_2mk7 1 . 3 . 430 . 1 1 7 THR HB H 6.333 -7.244 6.776 . . . 1.0 . . . . . . . . . . . . A . 7 THR HB . . . . . . . . . c19759_2mk7 1 . 3 . 431 . 1 1 7 THR HG21 H 5.545 -8.502 4.988 . . . 1.0 . . . . . . . . . . . . A . 7 THR HG21 . . . . . . . . . c19759_2mk7 1 . 3 . 432 . 1 1 7 THR HG22 H 4.603 -9.573 6.025 . . . 1.0 . . . . . . . . . . . . A . 7 THR HG22 . . . . . . . . . c19759_2mk7 1 . 3 . 433 . 1 1 7 THR HG23 H 6.355 -9.752 5.933 . . . 1.0 . . . . . . . . . . . . A . 7 THR HG23 . . . . . . . . . c19759_2mk7 1 . 3 . 434 . 1 1 7 THR N N 5.562 -9.977 8.602 . . . 1.0 . . . . . . . . . . . . A . 7 THR N . . . . . . . . . c19759_2mk7 1 . 3 . 435 . 1 1 7 THR O O 5.662 -8.043 10.472 . . . 1.0 . . . . . . . . . . . . A . 7 THR O . . . . . . . . . c19759_2mk7 1 . 3 . 436 . 1 1 7 THR OG1 O 4.427 -7.584 7.456 . . . 1.0 . . . . . . . . . . . . A . 7 THR OG1 . . . . . . . . . c19759_2mk7 1 . 3 . 437 . 1 1 8 LYS C C 7.848 -4.493 9.934 . . . 1.0 . . . . . . . . . . . . A . 8 LYS C . . . . . . . . . c19759_2mk7 1 . 3 . 438 . 1 1 8 LYS CA C 7.288 -5.811 10.457 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CA . . . . . . . . . c19759_2mk7 1 . 3 . 439 . 1 1 8 LYS CB C 8.203 -6.357 11.556 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CB . . . . . . . . . c19759_2mk7 1 . 3 . 440 . 1 1 8 LYS CD C 8.858 -5.802 13.903 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CD . . . . . . . . . c19759_2mk7 1 . 3 . 441 . 1 1 8 LYS CE C 9.570 -4.753 14.760 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CE . . . . . . . . . c19759_2mk7 1 . 3 . 442 . 1 1 8 LYS CG C 8.583 -5.225 12.514 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CG . . . . . . . . . c19759_2mk7 1 . 3 . 443 . 1 1 8 LYS H H 7.704 -6.665 8.563 . . . 1.0 . . . . . . . . . . . . A . 8 LYS H . . . . . . . . . c19759_2mk7 1 . 3 . 444 . 1 1 8 LYS HA H 6.309 -5.634 10.877 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HA . . . . . . . . . c19759_2mk7 1 . 3 . 445 . 1 1 8 LYS HB2 H 7.687 -7.132 12.102 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HB2 . . . . . . . . . c19759_2mk7 1 . 3 . 446 . 1 1 8 LYS HB3 H 9.098 -6.763 11.110 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HB3 . . . . . . . . . c19759_2mk7 1 . 3 . 447 . 1 1 8 LYS HD2 H 7.923 -6.076 14.371 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HD2 . . . . . . . . . c19759_2mk7 1 . 3 . 448 . 1 1 8 LYS HD3 H 9.486 -6.675 13.813 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HD3 . . . . . . . . . c19759_2mk7 1 . 3 . 449 . 1 1 8 LYS HE2 H 9.270 -4.867 15.791 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HE2 . . . . . . . . . c19759_2mk7 1 . 3 . 450 . 1 1 8 LYS HE3 H 10.639 -4.886 14.679 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HE3 . . . . . . . . . c19759_2mk7 1 . 3 . 451 . 1 1 8 LYS HG2 H 9.468 -4.726 12.147 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HG2 . . . . . . . . . c19759_2mk7 1 . 3 . 452 . 1 1 8 LYS HG3 H 7.770 -4.516 12.574 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HG3 . . . . . . . . . c19759_2mk7 1 . 3 . 453 . 1 1 8 LYS HZ1 H 8.190 -3.365 14.050 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ1 . . . . . . . . . c19759_2mk7 1 . 3 . 454 . 1 1 8 LYS HZ2 H 9.760 -3.157 13.435 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ2 . . . . . . . . . c19759_2mk7 1 . 3 . 455 . 1 1 8 LYS HZ3 H 9.401 -2.696 15.031 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ3 . . . . . . . . . c19759_2mk7 1 . 3 . 456 . 1 1 8 LYS N N 7.172 -6.784 9.378 . . . 1.0 . . . . . . . . . . . . A . 8 LYS N . . . . . . . . . c19759_2mk7 1 . 3 . 457 . 1 1 8 LYS NZ N 9.202 -3.389 14.284 . . . 1.0 . . . . . . . . . . . . A . 8 LYS NZ . . . . . . . . . c19759_2mk7 1 . 3 . 458 . 1 1 8 LYS O O 9.002 -4.422 9.510 . . . 1.0 . . . . . . . . . . . . A . 8 LYS O . . . . . . . . . c19759_2mk7 1 . 3 . 459 . 1 1 9 LYS C C 8.654 -2.269 8.565 . . . 1.0 . . . . . . . . . . . . A . 9 LYS C . . . . . . . . . c19759_2mk7 1 . 3 . 460 . 1 1 9 LYS CA C 7.448 -2.139 9.489 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CA . . . . . . . . . c19759_2mk7 1 . 3 . 461 . 1 1 9 LYS CB C 7.807 -1.243 10.675 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CB . . . . . . . . . c19759_2mk7 1 . 3 . 462 . 1 1 9 LYS CD C 6.447 0.842 10.441 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CD . . . . . . . . . c19759_2mk7 1 . 3 . 463 . 1 1 9 LYS CE C 6.323 2.114 9.602 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CE . . . . . . . . . c19759_2mk7 1 . 3 . 464 . 1 1 9 LYS CG C 7.828 0.218 10.224 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CG . . . . . . . . . c19759_2mk7 1 . 3 . 465 . 1 1 9 LYS H H 6.116 -3.565 10.315 . . . 1.0 . . . . . . . . . . . . A . 9 LYS H . . . . . . . . . c19759_2mk7 1 . 3 . 466 . 1 1 9 LYS HA H 6.635 -1.685 8.942 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HA . . . . . . . . . c19759_2mk7 1 . 3 . 467 . 1 1 9 LYS HB2 H 7.070 -1.368 11.456 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HB2 . . . . . . . . . c19759_2mk7 1 . 3 . 468 . 1 1 9 LYS HB3 H 8.781 -1.516 11.051 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HB3 . . . . . . . . . c19759_2mk7 1 . 3 . 469 . 1 1 9 LYS HD2 H 5.684 0.137 10.143 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HD2 . . . . . . . . . c19759_2mk7 1 . 3 . 470 . 1 1 9 LYS HD3 H 6.324 1.087 11.485 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HD3 . . . . . . . . . c19759_2mk7 1 . 3 . 471 . 1 1 9 LYS HE2 H 6.375 1.861 8.553 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HE2 . . . . . . . . . c19759_2mk7 1 . 3 . 472 . 1 1 9 LYS HE3 H 5.377 2.592 9.811 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HE3 . . . . . . . . . c19759_2mk7 1 . 3 . 473 . 1 1 9 LYS HG2 H 8.563 0.762 10.799 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HG2 . . . . . . . . . c19759_2mk7 1 . 3 . 474 . 1 1 9 LYS HG3 H 8.082 0.268 9.175 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HG3 . . . . . . . . . c19759_2mk7 1 . 3 . 475 . 1 1 9 LYS HZ1 H 8.040 3.186 9.109 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HZ1 . . . . . . . . . c19759_2mk7 1 . 3 . 476 . 1 1 9 LYS HZ2 H 8.002 2.639 10.717 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HZ2 . . . . . . . . . c19759_2mk7 1 . 3 . 477 . 1 1 9 LYS HZ3 H 7.044 3.960 10.242 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HZ3 . . . . . . . . . c19759_2mk7 1 . 3 . 478 . 1 1 9 LYS N N 7.024 -3.451 9.965 . . . 1.0 . . . . . . . . . . . . A . 9 LYS N . . . . . . . . . c19759_2mk7 1 . 3 . 479 . 1 1 9 LYS NZ N 7.436 3.045 9.944 . . . 1.0 . . . . . . . . . . . . A . 9 LYS NZ . . . . . . . . . c19759_2mk7 1 . 3 . 480 . 1 1 9 LYS O O 9.779 -1.947 8.944 . . . 1.0 . . . . . . . . . . . . A . 9 LYS O . . . . . . . . . c19759_2mk7 1 . 3 . 481 . 1 1 10 PRO C C 9.950 -1.588 5.744 . . . 1.0 . . . . . . . . . . . . A . 10 PRO C . . . . . . . . . c19759_2mk7 1 . 3 . 482 . 1 1 10 PRO CA C 9.511 -2.915 6.355 . . . 1.0 . . . . . . . . . . . . A . 10 PRO CA . . . . . . . . . c19759_2mk7 1 . 3 . 483 . 1 1 10 PRO CB C 8.887 -3.827 5.287 . . . 1.0 . . . . . . . . . . . . A . 10 PRO CB . . . . . . . . . c19759_2mk7 1 . 3 . 484 . 1 1 10 PRO CD C 7.132 -3.140 6.839 . . . 1.0 . . . . . . . . . . . . A . 10 PRO CD . . . . . . . . . c19759_2mk7 1 . 3 . 485 . 1 1 10 PRO CG C 7.487 -4.131 5.733 . . . 1.0 . . . . . . . . . . . . A . 10 PRO CG . . . . . . . . . c19759_2mk7 1 . 3 . 486 . 1 1 10 PRO HA H 10.357 -3.414 6.802 . . . 1.0 . . . . . . . . . . . . A . 10 PRO HA . . . . . . . . . c19759_2mk7 1 . 3 . 487 . 1 1 10 PRO HB2 H 8.871 -3.320 4.334 . . . 1.0 . . . . . . . . . . . . A . 10 PRO HB2 . . . . . . . . . c19759_2mk7 1 . 3 . 488 . 1 1 10 PRO HB3 H 9.453 -4.744 5.209 . . . 1.0 . . . . . . . . . . . . A . 10 PRO HB3 . . . . . . . . . c19759_2mk7 1 . 3 . 489 . 1 1 10 PRO HD2 H 6.601 -2.291 6.431 . . . 1.0 . . . . . . . . . . . . A . 10 PRO HD2 . . . . . . . . . c19759_2mk7 1 . 3 . 490 . 1 1 10 PRO HD3 H 6.550 -3.622 7.610 . . . 1.0 . . . . . . . . . . . . A . 10 PRO HD3 . . . . . . . . . c19759_2mk7 1 . 3 . 491 . 1 1 10 PRO HG2 H 6.806 -4.017 4.901 . . . 1.0 . . . . . . . . . . . . A . 10 PRO HG2 . . . . . . . . . c19759_2mk7 1 . 3 . 492 . 1 1 10 PRO HG3 H 7.433 -5.137 6.118 . . . 1.0 . . . . . . . . . . . . A . 10 PRO HG3 . . . . . . . . . c19759_2mk7 1 . 3 . 493 . 1 1 10 PRO N N 8.435 -2.734 7.365 . . . 1.0 . . . . . . . . . . . . A . 10 PRO N . . . . . . . . . c19759_2mk7 1 . 3 . 494 . 1 1 10 PRO O O 10.548 -1.565 4.668 . . . 1.0 . . . . . . . . . . . . A . 10 PRO O . . . . . . . . . c19759_2mk7 1 . 3 . 495 . 1 1 11 NH2 HN1 H 10.418 0.113 6.657 . . . 1.0 . . . . . . . . . . . . A . 11 NH2 HN1 . . . . . . . . . c19759_2mk7 1 . 3 . 496 . 1 1 11 NH2 HN2 H 8.757 -0.218 6.546 . . . 1.0 . . . . . . . . . . . . A . 11 NH2 HN2 . . . . . . . . . c19759_2mk7 1 . 3 . 497 . 1 1 11 NH2 N N 9.687 -0.472 6.369 . . . 1.0 . . . . . . . . . . . . A . 11 NH2 N . . . . . . . . . c19759_2mk7 1 . 3 . 498 . 2 2 1 A2G C1 C 1.908 -16.849 9.217 . . . 1.0 . . . . . . . . . . . . A . 101 A2G C1 . . . . . . . . . c19759_2mk7 1 . 3 . 499 . 2 2 1 A2G C2 C 2.017 -17.161 10.711 . . . 1.0 . . . . . . . . . . . . A . 101 A2G C2 . . . . . . . . . c19759_2mk7 1 . 3 . 500 . 2 2 1 A2G C3 C 0.891 -18.117 11.107 . . . 1.0 . . . . . . . . . . . . A . 101 A2G C3 . . . . . . . . . c19759_2mk7 1 . 3 . 501 . 2 2 1 A2G C4 C -0.456 -17.522 10.688 . . . 1.0 . . . . . . . . . . . . A . 101 A2G C4 . . . . . . . . . c19759_2mk7 1 . 3 . 502 . 2 2 1 A2G C5 C -0.415 -17.167 9.200 . . . 1.0 . . . . . . . . . . . . A . 101 A2G C5 . . . . . . . . . c19759_2mk7 1 . 3 . 503 . 2 2 1 A2G C6 C -1.727 -16.491 8.796 . . . 1.0 . . . . . . . . . . . . A . 101 A2G C6 . . . . . . . . . c19759_2mk7 1 . 3 . 504 . 2 2 1 A2G C7 C 4.163 -17.181 11.845 . . . 1.0 . . . . . . . . . . . . A . 101 A2G C7 . . . . . . . . . c19759_2mk7 1 . 3 . 505 . 2 2 1 A2G C8 C 5.466 -17.929 12.106 . . . 1.0 . . . . . . . . . . . . A . 101 A2G C8 . . . . . . . . . c19759_2mk7 1 . 3 . 506 . 2 2 1 A2G H1 H 2.687 -16.155 8.940 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H1 . . . . . . . . . c19759_2mk7 1 . 3 . 507 . 2 2 1 A2G H14 H -2.042 -16.865 7.833 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H14 . . . . . . . . . c19759_2mk7 1 . 3 . 508 . 2 2 1 A2G H15 H -3.583 -16.666 9.346 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H15 . . . . . . . . . c19759_2mk7 1 . 3 . 509 . 2 2 1 A2G H2 H 1.915 -16.243 11.271 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H2 . . . . . . . . . c19759_2mk7 1 . 3 . 510 . 2 2 1 A2G H3 H 1.033 -19.067 10.613 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H3 . . . . . . . . . c19759_2mk7 1 . 3 . 511 . 2 2 1 A2G H4 H -1.239 -18.244 10.864 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H4 . . . . . . . . . c19759_2mk7 1 . 3 . 512 . 2 2 1 A2G H5 H -0.272 -18.064 8.615 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H5 . . . . . . . . . c19759_2mk7 1 . 3 . 513 . 2 2 1 A2G H6 H -1.577 -15.423 8.735 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H6 . . . . . . . . . c19759_2mk7 1 . 3 . 514 . 2 2 1 A2G H8 H 5.340 -18.584 12.957 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H8 . . . . . . . . . c19759_2mk7 1 . 3 . 515 . 2 2 1 A2G H8A H 6.254 -17.219 12.312 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H8A . . . . . . . . . c19759_2mk7 1 . 3 . 516 . 2 2 1 A2G H8B H 5.726 -18.514 11.236 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H8B . . . . . . . . . c19759_2mk7 1 . 3 . 517 . 2 2 1 A2G HN2 H 3.559 -18.607 10.577 . . . 1.0 . . . . . . . . . . . . A . 101 A2G HN2 . . . . . . . . . c19759_2mk7 1 . 3 . 518 . 2 2 1 A2G HO3 H 0.051 -18.039 12.859 . . . 1.0 . . . . . . . . . . . . A . 101 A2G HO3 . . . . . . . . . c19759_2mk7 1 . 3 . 519 . 2 2 1 A2G HO4 H -0.742 -16.598 12.375 . . . 1.0 . . . . . . . . . . . . A . 101 A2G HO4 . . . . . . . . . c19759_2mk7 1 . 3 . 520 . 2 2 1 A2G N2 N 3.312 -17.761 11.005 . . . 1.0 . . . . . . . . . . . . A . 101 A2G N2 . . . . . . . . . c19759_2mk7 1 . 3 . 521 . 2 2 1 A2G O O 0.646 -16.266 8.978 . . . 1.0 . . . . . . . . . . . . A . 101 A2G O . . . . . . . . . c19759_2mk7 1 . 3 . 522 . 2 2 1 A2G O3 O 0.905 -18.309 12.514 . . . 1.0 . . . . . . . . . . . . A . 101 A2G O3 . . . . . . . . . c19759_2mk7 1 . 3 . 523 . 2 2 1 A2G O4 O -0.712 -16.350 11.447 . . . 1.0 . . . . . . . . . . . . A . 101 A2G O4 . . . . . . . . . c19759_2mk7 1 . 3 . 524 . 2 2 1 A2G O6 O -2.726 -16.776 9.764 . . . 1.0 . . . . . . . . . . . . A . 101 A2G O6 . . . . . . . . . c19759_2mk7 1 . 3 . 525 . 2 2 1 A2G O7 O 3.920 -16.119 12.419 . . . 1.0 . . . . . . . . . . . . A . 101 A2G O7 . . . . . . . . . c19759_2mk7 1 . 4 . 526 . 1 1 1 ACE C C -1.353 -24.375 7.402 . . . 1.0 . . . . . . . . . . . . A . 1 ACE C . . . . . . . . . c19759_2mk7 1 . 4 . 527 . 1 1 1 ACE CH3 C -2.875 -24.429 7.484 . . . 1.0 . . . . . . . . . . . . A . 1 ACE CH3 . . . . . . . . . c19759_2mk7 1 . 4 . 528 . 1 1 1 ACE H1 H -3.291 -23.524 7.066 . . . 1.0 . . . . . . . . . . . . A . 1 ACE H1 . . . . . . . . . c19759_2mk7 1 . 4 . 529 . 1 1 1 ACE H2 H -3.177 -24.520 8.516 . . . 1.0 . . . . . . . . . . . . A . 1 ACE H2 . . . . . . . . . c19759_2mk7 1 . 4 . 530 . 1 1 1 ACE H3 H -3.235 -25.281 6.926 . . . 1.0 . . . . . . . . . . . . A . 1 ACE H3 . . . . . . . . . c19759_2mk7 1 . 4 . 531 . 1 1 1 ACE O O -0.673 -24.184 8.409 . . . 1.0 . . . . . . . . . . . . A . 1 ACE O . . . . . . . . . c19759_2mk7 1 . 4 . 532 . 1 1 2 PRO C C 1.327 -23.359 6.727 . . . 1.0 . . . . . . . . . . . . A . 2 PRO C . . . . . . . . . c19759_2mk7 1 . 4 . 533 . 1 1 2 PRO CA C 0.652 -24.514 5.991 . . . 1.0 . . . . . . . . . . . . A . 2 PRO CA . . . . . . . . . c19759_2mk7 1 . 4 . 534 . 1 1 2 PRO CB C 0.796 -24.349 4.470 . . . 1.0 . . . . . . . . . . . . A . 2 PRO CB . . . . . . . . . c19759_2mk7 1 . 4 . 535 . 1 1 2 PRO CD C -1.553 -24.771 4.983 . . . 1.0 . . . . . . . . . . . . A . 2 PRO CD . . . . . . . . . c19759_2mk7 1 . 4 . 536 . 1 1 2 PRO CG C -0.591 -24.285 3.901 . . . 1.0 . . . . . . . . . . . . A . 2 PRO CG . . . . . . . . . c19759_2mk7 1 . 4 . 537 . 1 1 2 PRO HA H 1.091 -25.451 6.293 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HA . . . . . . . . . c19759_2mk7 1 . 4 . 538 . 1 1 2 PRO HB2 H 1.331 -23.436 4.247 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HB2 . . . . . . . . . c19759_2mk7 1 . 4 . 539 . 1 1 2 PRO HB3 H 1.322 -25.196 4.055 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HB3 . . . . . . . . . c19759_2mk7 1 . 4 . 540 . 1 1 2 PRO HD2 H -2.467 -24.192 4.965 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HD2 . . . . . . . . . c19759_2mk7 1 . 4 . 541 . 1 1 2 PRO HD3 H -1.763 -25.822 4.862 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HD3 . . . . . . . . . c19759_2mk7 1 . 4 . 542 . 1 1 2 PRO HG2 H -0.827 -23.266 3.626 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HG2 . . . . . . . . . c19759_2mk7 1 . 4 . 543 . 1 1 2 PRO HG3 H -0.665 -24.927 3.037 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HG3 . . . . . . . . . c19759_2mk7 1 . 4 . 544 . 1 1 2 PRO N N -0.817 -24.540 6.224 . . . 1.0 . . . . . . . . . . . . A . 2 PRO N . . . . . . . . . c19759_2mk7 1 . 4 . 545 . 1 1 2 PRO O O 0.669 -22.409 7.152 . . . 1.0 . . . . . . . . . . . . A . 2 PRO O . . . . . . . . . c19759_2mk7 1 . 4 . 546 . 1 1 3 PRO C C 3.003 -20.977 7.154 . . . 1.0 . . . . . . . . . . . . A . 3 PRO C . . . . . . . . . c19759_2mk7 1 . 4 . 547 . 1 1 3 PRO CA C 3.413 -22.384 7.581 . . . 1.0 . . . . . . . . . . . . A . 3 PRO CA . . . . . . . . . c19759_2mk7 1 . 4 . 548 . 1 1 3 PRO CB C 4.869 -22.673 7.181 . . . 1.0 . . . . . . . . . . . . A . 3 PRO CB . . . . . . . . . c19759_2mk7 1 . 4 . 549 . 1 1 3 PRO CD C 3.472 -24.519 6.406 . . . 1.0 . . . . . . . . . . . . A . 3 PRO CD . . . . . . . . . c19759_2mk7 1 . 4 . 550 . 1 1 3 PRO CG C 4.845 -23.866 6.271 . . . 1.0 . . . . . . . . . . . . A . 3 PRO CG . . . . . . . . . c19759_2mk7 1 . 4 . 551 . 1 1 3 PRO HA H 3.307 -22.491 8.648 . . . 1.0 . . . . . . . . . . . . A . 3 PRO HA . . . . . . . . . c19759_2mk7 1 . 4 . 552 . 1 1 3 PRO HB2 H 5.285 -21.820 6.663 . . . 1.0 . . . . . . . . . . . . A . 3 PRO HB2 . . . . . . . . . c19759_2mk7 1 . 4 . 553 . 1 1 3 PRO HB3 H 5.455 -22.895 8.059 . . . 1.0 . . . . . . . . . . . . A . 3 PRO HB3 . . . . . . . . . c19759_2mk7 1 . 4 . 554 . 1 1 3 PRO HD2 H 3.129 -24.884 5.446 . . . 1.0 . . . . . . . . . . . . A . 3 PRO HD2 . . . . . . . . . c19759_2mk7 1 . 4 . 555 . 1 1 3 PRO HD3 H 3.499 -25.318 7.130 . . . 1.0 . . . . . . . . . . . . A . 3 PRO HD3 . . . . . . . . . c19759_2mk7 1 . 4 . 556 . 1 1 3 PRO HG2 H 5.006 -23.550 5.248 . . . 1.0 . . . . . . . . . . . . A . 3 PRO HG2 . . . . . . . . . c19759_2mk7 1 . 4 . 557 . 1 1 3 PRO HG3 H 5.610 -24.568 6.564 . . . 1.0 . . . . . . . . . . . . A . 3 PRO HG3 . . . . . . . . . c19759_2mk7 1 . 4 . 558 . 1 1 3 PRO N N 2.621 -23.432 6.882 . . . 1.0 . . . . . . . . . . . . A . 3 PRO N . . . . . . . . . c19759_2mk7 1 . 4 . 559 . 1 1 3 PRO O O 2.349 -20.794 6.127 . . . 1.0 . . . . . . . . . . . . A . 3 PRO O . . . . . . . . . c19759_2mk7 1 . 4 . 560 . 1 1 4 THR C C 4.201 -17.672 8.047 . . . 1.0 . . . . . . . . . . . . A . 4 THR C . . . . . . . . . c19759_2mk7 1 . 4 . 561 . 1 1 4 THR CA C 3.058 -18.599 7.645 . . . 1.0 . . . . . . . . . . . . A . 4 THR CA . . . . . . . . . c19759_2mk7 1 . 4 . 562 . 1 1 4 THR CB C 1.783 -18.193 8.387 . . . 1.0 . . . . . . . . . . . . A . 4 THR CB . . . . . . . . . c19759_2mk7 1 . 4 . 563 . 1 1 4 THR CG2 C 0.658 -19.176 8.061 . . . 1.0 . . . . . . . . . . . . A . 4 THR CG2 . . . . . . . . . c19759_2mk7 1 . 4 . 564 . 1 1 4 THR H H 3.912 -20.190 8.755 . . . 1.0 . . . . . . . . . . . . A . 4 THR H . . . . . . . . . c19759_2mk7 1 . 4 . 565 . 1 1 4 THR HA H 2.888 -18.505 6.583 . . . 1.0 . . . . . . . . . . . . A . 4 THR HA . . . . . . . . . c19759_2mk7 1 . 4 . 566 . 1 1 4 THR HB H 1.489 -17.198 8.090 . . . 1.0 . . . . . . . . . . . . A . 4 THR HB . . . . . . . . . c19759_2mk7 1 . 4 . 567 . 1 1 4 THR HG21 H -0.295 -18.718 8.283 . . . 1.0 . . . . . . . . . . . . A . 4 THR HG21 . . . . . . . . . c19759_2mk7 1 . 4 . 568 . 1 1 4 THR HG22 H 0.776 -20.069 8.658 . . . 1.0 . . . . . . . . . . . . A . 4 THR HG22 . . . . . . . . . c19759_2mk7 1 . 4 . 569 . 1 1 4 THR HG23 H 0.698 -19.436 7.014 . . . 1.0 . . . . . . . . . . . . A . 4 THR HG23 . . . . . . . . . c19759_2mk7 1 . 4 . 570 . 1 1 4 THR N N 3.392 -19.986 7.949 . . . 1.0 . . . . . . . . . . . . A . 4 THR N . . . . . . . . . c19759_2mk7 1 . 4 . 571 . 1 1 4 THR O O 4.817 -17.850 9.098 . . . 1.0 . . . . . . . . . . . . A . 4 THR O . . . . . . . . . c19759_2mk7 1 . 4 . 572 . 1 1 4 THR OG1 O 2.038 -18.234 9.774 . . . 1.0 . . . . . . . . . . . . A . 4 THR OG1 . . . . . . . . . c19759_2mk7 1 . 4 . 573 . 1 1 5 THR C C 4.975 -14.388 7.916 . . . 1.0 . . . . . . . . . . . . A . 5 THR C . . . . . . . . . c19759_2mk7 1 . 4 . 574 . 1 1 5 THR CA C 5.550 -15.733 7.482 . . . 1.0 . . . . . . . . . . . . A . 5 THR CA . . . . . . . . . c19759_2mk7 1 . 4 . 575 . 1 1 5 THR CB C 6.415 -15.542 6.235 . . . 1.0 . . . . . . . . . . . . A . 5 THR CB . . . . . . . . . c19759_2mk7 1 . 4 . 576 . 1 1 5 THR CG2 C 6.895 -16.902 5.724 . . . 1.0 . . . . . . . . . . . . A . 5 THR CG2 . . . . . . . . . c19759_2mk7 1 . 4 . 577 . 1 1 5 THR H H 3.954 -16.589 6.382 . . . 1.0 . . . . . . . . . . . . A . 5 THR H . . . . . . . . . c19759_2mk7 1 . 4 . 578 . 1 1 5 THR HA H 6.166 -16.123 8.279 . . . 1.0 . . . . . . . . . . . . A . 5 THR HA . . . . . . . . . c19759_2mk7 1 . 4 . 579 . 1 1 5 THR HB H 7.269 -14.926 6.475 . . . 1.0 . . . . . . . . . . . . A . 5 THR HB . . . . . . . . . c19759_2mk7 1 . 4 . 580 . 1 1 5 THR HG21 H 6.933 -17.602 6.545 . . . 1.0 . . . . . . . . . . . . A . 5 THR HG21 . . . . . . . . . c19759_2mk7 1 . 4 . 581 . 1 1 5 THR HG22 H 7.880 -16.797 5.294 . . . 1.0 . . . . . . . . . . . . A . 5 THR HG22 . . . . . . . . . c19759_2mk7 1 . 4 . 582 . 1 1 5 THR HG23 H 6.210 -17.265 4.972 . . . 1.0 . . . . . . . . . . . . A . 5 THR HG23 . . . . . . . . . c19759_2mk7 1 . 4 . 583 . 1 1 5 THR N N 4.478 -16.682 7.205 . . . 1.0 . . . . . . . . . . . . A . 5 THR N . . . . . . . . . c19759_2mk7 1 . 4 . 584 . 1 1 5 THR O O 3.778 -14.140 7.775 . . . 1.0 . . . . . . . . . . . . A . 5 THR O . . . . . . . . . c19759_2mk7 1 . 4 . 585 . 1 1 5 THR OG1 O 5.634 -14.929 5.235 . . . 1.0 . . . . . . . . . . . . A . 5 THR OG1 . . . . . . . . . c19759_2mk7 1 . 4 . 586 . 1 1 6 THR C C 6.377 -11.133 8.424 . . . 1.0 . . . . . . . . . . . . A . 6 THR C . . . . . . . . . c19759_2mk7 1 . 4 . 587 . 1 1 6 THR CA C 5.403 -12.207 8.895 . . . 1.0 . . . . . . . . . . . . A . 6 THR CA . . . . . . . . . c19759_2mk7 1 . 4 . 588 . 1 1 6 THR CB C 5.310 -12.182 10.423 . . . 1.0 . . . . . . . . . . . . A . 6 THR CB . . . . . . . . . c19759_2mk7 1 . 4 . 589 . 1 1 6 THR CG2 C 4.560 -13.420 10.918 . . . 1.0 . . . . . . . . . . . . A . 6 THR CG2 . . . . . . . . . c19759_2mk7 1 . 4 . 590 . 1 1 6 THR H H 6.778 -13.778 8.533 . . . 1.0 . . . . . . . . . . . . A . 6 THR H . . . . . . . . . c19759_2mk7 1 . 4 . 591 . 1 1 6 THR HA H 4.426 -12.000 8.484 . . . 1.0 . . . . . . . . . . . . A . 6 THR HA . . . . . . . . . c19759_2mk7 1 . 4 . 592 . 1 1 6 THR HB H 4.787 -11.293 10.742 . . . 1.0 . . . . . . . . . . . . A . 6 THR HB . . . . . . . . . c19759_2mk7 1 . 4 . 593 . 1 1 6 THR HG21 H 5.248 -14.249 10.997 . . . 1.0 . . . . . . . . . . . . A . 6 THR HG21 . . . . . . . . . c19759_2mk7 1 . 4 . 594 . 1 1 6 THR HG22 H 3.776 -13.669 10.219 . . . 1.0 . . . . . . . . . . . . A . 6 THR HG22 . . . . . . . . . c19759_2mk7 1 . 4 . 595 . 1 1 6 THR HG23 H 4.129 -13.216 11.887 . . . 1.0 . . . . . . . . . . . . A . 6 THR HG23 . . . . . . . . . c19759_2mk7 1 . 4 . 596 . 1 1 6 THR N N 5.836 -13.525 8.444 . . . 1.0 . . . . . . . . . . . . A . 6 THR N . . . . . . . . . c19759_2mk7 1 . 4 . 597 . 1 1 6 THR O O 7.496 -11.434 8.010 . . . 1.0 . . . . . . . . . . . . A . 6 THR O . . . . . . . . . c19759_2mk7 1 . 4 . 598 . 1 1 6 THR OG1 O 6.617 -12.198 10.954 . . . 1.0 . . . . . . . . . . . . A . 6 THR OG1 . . . . . . . . . c19759_2mk7 1 . 4 . 599 . 1 1 7 THR C C 6.652 -7.594 9.035 . . . 1.0 . . . . . . . . . . . . A . 7 THR C . . . . . . . . . c19759_2mk7 1 . 4 . 600 . 1 1 7 THR CA C 6.787 -8.766 8.069 . . . 1.0 . . . . . . . . . . . . A . 7 THR CA . . . . . . . . . c19759_2mk7 1 . 4 . 601 . 1 1 7 THR CB C 6.393 -8.317 6.660 . . . 1.0 . . . . . . . . . . . . A . 7 THR CB . . . . . . . . . c19759_2mk7 1 . 4 . 602 . 1 1 7 THR CG2 C 6.382 -9.520 5.716 . . . 1.0 . . . . . . . . . . . . A . 7 THR CG2 . . . . . . . . . c19759_2mk7 1 . 4 . 603 . 1 1 7 THR H H 5.043 -9.697 8.831 . . . 1.0 . . . . . . . . . . . . A . 7 THR H . . . . . . . . . c19759_2mk7 1 . 4 . 604 . 1 1 7 THR HA H 7.817 -9.091 8.055 . . . 1.0 . . . . . . . . . . . . A . 7 THR HA . . . . . . . . . c19759_2mk7 1 . 4 . 605 . 1 1 7 THR HB H 7.098 -7.583 6.300 . . . 1.0 . . . . . . . . . . . . A . 7 THR HB . . . . . . . . . c19759_2mk7 1 . 4 . 606 . 1 1 7 THR HG21 H 6.532 -9.183 4.702 . . . 1.0 . . . . . . . . . . . . A . 7 THR HG21 . . . . . . . . . c19759_2mk7 1 . 4 . 607 . 1 1 7 THR HG22 H 5.433 -10.028 5.791 . . . 1.0 . . . . . . . . . . . . A . 7 THR HG22 . . . . . . . . . c19759_2mk7 1 . 4 . 608 . 1 1 7 THR HG23 H 7.176 -10.199 5.990 . . . 1.0 . . . . . . . . . . . . A . 7 THR HG23 . . . . . . . . . c19759_2mk7 1 . 4 . 609 . 1 1 7 THR N N 5.944 -9.878 8.492 . . . 1.0 . . . . . . . . . . . . A . 7 THR N . . . . . . . . . c19759_2mk7 1 . 4 . 610 . 1 1 7 THR O O 5.782 -7.593 9.907 . . . 1.0 . . . . . . . . . . . . A . 7 THR O . . . . . . . . . c19759_2mk7 1 . 4 . 611 . 1 1 7 THR OG1 O 5.095 -7.765 6.709 . . . 1.0 . . . . . . . . . . . . A . 7 THR OG1 . . . . . . . . . c19759_2mk7 1 . 4 . 612 . 1 1 8 LYS C C 8.186 -4.245 9.070 . . . 1.0 . . . . . . . . . . . . A . 8 LYS C . . . . . . . . . c19759_2mk7 1 . 4 . 613 . 1 1 8 LYS CA C 7.483 -5.423 9.738 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CA . . . . . . . . . c19759_2mk7 1 . 4 . 614 . 1 1 8 LYS CB C 8.164 -5.736 11.072 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CB . . . . . . . . . c19759_2mk7 1 . 4 . 615 . 1 1 8 LYS CD C 8.590 -4.906 13.390 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CD . . . . . . . . . c19759_2mk7 1 . 4 . 616 . 1 1 8 LYS CE C 7.668 -4.572 14.563 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CE . . . . . . . . . c19759_2mk7 1 . 4 . 617 . 1 1 8 LYS CG C 7.868 -4.618 12.072 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CG . . . . . . . . . c19759_2mk7 1 . 4 . 618 . 1 1 8 LYS H H 8.187 -6.652 8.162 . . . 1.0 . . . . . . . . . . . . A . 8 LYS H . . . . . . . . . c19759_2mk7 1 . 4 . 619 . 1 1 8 LYS HA H 6.454 -5.155 9.927 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HA . . . . . . . . . c19759_2mk7 1 . 4 . 620 . 1 1 8 LYS HB2 H 7.789 -6.674 11.456 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HB2 . . . . . . . . . c19759_2mk7 1 . 4 . 621 . 1 1 8 LYS HB3 H 9.232 -5.809 10.923 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HB3 . . . . . . . . . c19759_2mk7 1 . 4 . 622 . 1 1 8 LYS HD2 H 8.863 -5.951 13.430 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HD2 . . . . . . . . . c19759_2mk7 1 . 4 . 623 . 1 1 8 LYS HD3 H 9.481 -4.300 13.452 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HD3 . . . . . . . . . c19759_2mk7 1 . 4 . 624 . 1 1 8 LYS HE2 H 6.827 -5.250 14.564 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HE2 . . . . . . . . . c19759_2mk7 1 . 4 . 625 . 1 1 8 LYS HE3 H 8.212 -4.673 15.490 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HE3 . . . . . . . . . c19759_2mk7 1 . 4 . 626 . 1 1 8 LYS HG2 H 8.211 -3.676 11.672 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HG2 . . . . . . . . . c19759_2mk7 1 . 4 . 627 . 1 1 8 LYS HG3 H 6.804 -4.568 12.252 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HG3 . . . . . . . . . c19759_2mk7 1 . 4 . 628 . 1 1 8 LYS HZ1 H 6.470 -3.125 13.665 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ1 . . . . . . . . . c19759_2mk7 1 . 4 . 629 . 1 1 8 LYS HZ2 H 7.976 -2.545 14.198 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ2 . . . . . . . . . c19759_2mk7 1 . 4 . 630 . 1 1 8 LYS HZ3 H 6.742 -2.867 15.319 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ3 . . . . . . . . . c19759_2mk7 1 . 4 . 631 . 1 1 8 LYS N N 7.517 -6.597 8.874 . . . 1.0 . . . . . . . . . . . . A . 8 LYS N . . . . . . . . . c19759_2mk7 1 . 4 . 632 . 1 1 8 LYS NZ N 7.176 -3.172 14.426 . . . 1.0 . . . . . . . . . . . . A . 8 LYS NZ . . . . . . . . . c19759_2mk7 1 . 4 . 633 . 1 1 8 LYS O O 9.368 -4.325 8.735 . . . 1.0 . . . . . . . . . . . . A . 8 LYS O . . . . . . . . . c19759_2mk7 1 . 4 . 634 . 1 1 9 LYS C C 9.142 -1.392 9.102 . . . 1.0 . . . . . . . . . . . . A . 9 LYS C . . . . . . . . . c19759_2mk7 1 . 4 . 635 . 1 1 9 LYS CA C 8.016 -1.967 8.250 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CA . . . . . . . . . c19759_2mk7 1 . 4 . 636 . 1 1 9 LYS CB C 6.926 -0.909 8.060 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CB . . . . . . . . . c19759_2mk7 1 . 4 . 637 . 1 1 9 LYS CD C 4.704 -0.128 8.894 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CD . . . . . . . . . c19759_2mk7 1 . 4 . 638 . 1 1 9 LYS CE C 3.383 -0.584 9.518 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CE . . . . . . . . . c19759_2mk7 1 . 4 . 639 . 1 1 9 LYS CG C 5.689 -1.299 8.871 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CG . . . . . . . . . c19759_2mk7 1 . 4 . 640 . 1 1 9 LYS H H 6.514 -3.149 9.167 . . . 1.0 . . . . . . . . . . . . A . 9 LYS H . . . . . . . . . c19759_2mk7 1 . 4 . 641 . 1 1 9 LYS HA H 8.411 -2.236 7.282 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HA . . . . . . . . . c19759_2mk7 1 . 4 . 642 . 1 1 9 LYS HB2 H 7.292 0.050 8.398 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HB2 . . . . . . . . . c19759_2mk7 1 . 4 . 643 . 1 1 9 LYS HB3 H 6.663 -0.845 7.015 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HB3 . . . . . . . . . c19759_2mk7 1 . 4 . 644 . 1 1 9 LYS HD2 H 5.119 0.680 9.479 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HD2 . . . . . . . . . c19759_2mk7 1 . 4 . 645 . 1 1 9 LYS HD3 H 4.524 0.211 7.886 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HD3 . . . . . . . . . c19759_2mk7 1 . 4 . 646 . 1 1 9 LYS HE2 H 2.835 -1.181 8.804 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HE2 . . . . . . . . . c19759_2mk7 1 . 4 . 647 . 1 1 9 LYS HE3 H 3.587 -1.175 10.399 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HE3 . . . . . . . . . c19759_2mk7 1 . 4 . 648 . 1 1 9 LYS HG2 H 5.218 -2.159 8.418 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HG2 . . . . . . . . . c19759_2mk7 1 . 4 . 649 . 1 1 9 LYS HG3 H 5.982 -1.540 9.882 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HG3 . . . . . . . . . c19759_2mk7 1 . 4 . 650 . 1 1 9 LYS HZ1 H 3.182 1.304 10.372 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HZ1 . . . . . . . . . c19759_2mk7 1 . 4 . 651 . 1 1 9 LYS HZ2 H 1.807 0.318 10.537 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HZ2 . . . . . . . . . c19759_2mk7 1 . 4 . 652 . 1 1 9 LYS HZ3 H 2.166 1.036 9.039 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HZ3 . . . . . . . . . c19759_2mk7 1 . 4 . 653 . 1 1 9 LYS N N 7.451 -3.155 8.879 . . . 1.0 . . . . . . . . . . . . A . 9 LYS N . . . . . . . . . c19759_2mk7 1 . 4 . 654 . 1 1 9 LYS NZ N 2.573 0.608 9.895 . . . 1.0 . . . . . . . . . . . . A . 9 LYS NZ . . . . . . . . . c19759_2mk7 1 . 4 . 655 . 1 1 9 LYS O O 9.228 -1.659 10.301 . . . 1.0 . . . . . . . . . . . . A . 9 LYS O . . . . . . . . . c19759_2mk7 1 . 4 . 656 . 1 1 10 PRO C C 10.747 0.606 10.553 . . . 1.0 . . . . . . . . . . . . A . 10 PRO C . . . . . . . . . c19759_2mk7 1 . 4 . 657 . 1 1 10 PRO CA C 11.151 0.018 9.204 . . . 1.0 . . . . . . . . . . . . A . 10 PRO CA . . . . . . . . . c19759_2mk7 1 . 4 . 658 . 1 1 10 PRO CB C 11.626 1.122 8.248 . . . 1.0 . . . . . . . . . . . . A . 10 PRO CB . . . . . . . . . c19759_2mk7 1 . 4 . 659 . 1 1 10 PRO CD C 9.966 -0.244 7.089 . . . 1.0 . . . . . . . . . . . . A . 10 PRO CD . . . . . . . . . c19759_2mk7 1 . 4 . 660 . 1 1 10 PRO CG C 10.727 1.080 7.047 . . . 1.0 . . . . . . . . . . . . A . 10 PRO CG . . . . . . . . . c19759_2mk7 1 . 4 . 661 . 1 1 10 PRO HA H 11.941 -0.704 9.338 . . . 1.0 . . . . . . . . . . . . A . 10 PRO HA . . . . . . . . . c19759_2mk7 1 . 4 . 662 . 1 1 10 PRO HB2 H 11.553 2.086 8.732 . . . 1.0 . . . . . . . . . . . . A . 10 PRO HB2 . . . . . . . . . c19759_2mk7 1 . 4 . 663 . 1 1 10 PRO HB3 H 12.646 0.936 7.946 . . . 1.0 . . . . . . . . . . . . A . 10 PRO HB3 . . . . . . . . . c19759_2mk7 1 . 4 . 664 . 1 1 10 PRO HD2 H 8.948 -0.106 6.752 . . . 1.0 . . . . . . . . . . . . A . 10 PRO HD2 . . . . . . . . . c19759_2mk7 1 . 4 . 665 . 1 1 10 PRO HD3 H 10.468 -0.991 6.496 . . . 1.0 . . . . . . . . . . . . A . 10 PRO HD3 . . . . . . . . . c19759_2mk7 1 . 4 . 666 . 1 1 10 PRO HG2 H 10.033 1.908 7.080 . . . 1.0 . . . . . . . . . . . . A . 10 PRO HG2 . . . . . . . . . c19759_2mk7 1 . 4 . 667 . 1 1 10 PRO HG3 H 11.316 1.129 6.144 . . . 1.0 . . . . . . . . . . . . A . 10 PRO HG3 . . . . . . . . . c19759_2mk7 1 . 4 . 668 . 1 1 10 PRO N N 10.000 -0.612 8.503 . . . 1.0 . . . . . . . . . . . . A . 10 PRO N . . . . . . . . . c19759_2mk7 1 . 4 . 669 . 1 1 10 PRO O O 11.532 0.587 11.500 . . . 1.0 . . . . . . . . . . . . A . 10 PRO O . . . . . . . . . c19759_2mk7 1 . 4 . 670 . 1 1 11 NH2 HN1 H 9.017 0.908 11.481 . . . 1.0 . . . . . . . . . . . . A . 11 NH2 HN1 . . . . . . . . . c19759_2mk7 1 . 4 . 671 . 1 1 11 NH2 HN2 H 9.217 1.757 10.025 . . . 1.0 . . . . . . . . . . . . A . 11 NH2 HN2 . . . . . . . . . c19759_2mk7 1 . 4 . 672 . 1 1 11 NH2 N N 9.560 1.131 10.696 . . . 1.0 . . . . . . . . . . . . A . 11 NH2 N . . . . . . . . . c19759_2mk7 1 . 4 . 673 . 2 2 1 A2G C1 C 1.988 -16.958 10.371 . . . 1.0 . . . . . . . . . . . . A . 101 A2G C1 . . . . . . . . . c19759_2mk7 1 . 4 . 674 . 2 2 1 A2G C2 C 2.545 -17.071 11.791 . . . 1.0 . . . . . . . . . . . . A . 101 A2G C2 . . . . . . . . . c19759_2mk7 1 . 4 . 675 . 2 2 1 A2G C3 C 1.667 -18.029 12.600 . . . 1.0 . . . . . . . . . . . . A . 101 A2G C3 . . . . . . . . . c19759_2mk7 1 . 4 . 676 . 2 2 1 A2G C4 C 0.207 -17.572 12.528 . . . 1.0 . . . . . . . . . . . . A . 101 A2G C4 . . . . . . . . . c19759_2mk7 1 . 4 . 677 . 2 2 1 A2G C5 C -0.209 -17.391 11.066 . . . 1.0 . . . . . . . . . . . . A . 101 A2G C5 . . . . . . . . . c19759_2mk7 1 . 4 . 678 . 2 2 1 A2G C6 C -1.631 -16.829 11.001 . . . 1.0 . . . . . . . . . . . . A . 101 A2G C6 . . . . . . . . . c19759_2mk7 1 . 4 . 679 . 2 2 1 A2G C7 C 4.918 -16.836 12.246 . . . 1.0 . . . . . . . . . . . . A . 101 A2G C7 . . . . . . . . . c19759_2mk7 1 . 4 . 680 . 2 2 1 A2G C8 C 6.315 -17.431 12.101 . . . 1.0 . . . . . . . . . . . . A . 101 A2G C8 . . . . . . . . . c19759_2mk7 1 . 4 . 681 . 2 2 1 A2G H1 H 2.596 -16.267 9.805 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H1 . . . . . . . . . c19759_2mk7 1 . 4 . 682 . 2 2 1 A2G H14 H -1.985 -16.863 9.981 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H14 . . . . . . . . . c19759_2mk7 1 . 4 . 683 . 2 2 1 A2G H15 H -2.093 -17.651 12.701 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H15 . . . . . . . . . c19759_2mk7 1 . 4 . 684 . 2 2 1 A2G H2 H 2.528 -16.097 12.257 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H2 . . . . . . . . . c19759_2mk7 1 . 4 . 685 . 2 2 1 A2G H3 H 1.754 -19.026 12.195 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H3 . . . . . . . . . c19759_2mk7 1 . 4 . 686 . 2 2 1 A2G H4 H -0.425 -18.314 12.992 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H4 . . . . . . . . . c19759_2mk7 1 . 4 . 687 . 2 2 1 A2G H5 H -0.170 -18.341 10.555 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H5 . . . . . . . . . c19759_2mk7 1 . 4 . 688 . 2 2 1 A2G H6 H -1.630 -15.806 11.347 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H6 . . . . . . . . . c19759_2mk7 1 . 4 . 689 . 2 2 1 A2G H8 H 6.468 -18.180 12.864 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H8 . . . . . . . . . c19759_2mk7 1 . 4 . 690 . 2 2 1 A2G H8A H 7.052 -16.649 12.210 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H8A . . . . . . . . . c19759_2mk7 1 . 4 . 691 . 2 2 1 A2G H8B H 6.413 -17.885 11.126 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H8B . . . . . . . . . c19759_2mk7 1 . 4 . 692 . 2 2 1 A2G HN2 H 4.107 -18.436 11.360 . . . 1.0 . . . . . . . . . . . . A . 101 A2G HN2 . . . . . . . . . c19759_2mk7 1 . 4 . 693 . 2 2 1 A2G HO3 H 1.426 -18.479 14.476 . . . 1.0 . . . . . . . . . . . . A . 101 A2G HO3 . . . . . . . . . c19759_2mk7 1 . 4 . 694 . 2 2 1 A2G HO4 H 0.396 -16.455 14.109 . . . 1.0 . . . . . . . . . . . . A . 101 A2G HO4 . . . . . . . . . c19759_2mk7 1 . 4 . 695 . 2 2 1 A2G N2 N 3.918 -17.559 11.754 . . . 1.0 . . . . . . . . . . . . A . 101 A2G N2 . . . . . . . . . c19759_2mk7 1 . 4 . 696 . 2 2 1 A2G O O 0.668 -16.471 10.454 . . . 1.0 . . . . . . . . . . . . A . 101 A2G O . . . . . . . . . c19759_2mk7 1 . 4 . 697 . 2 2 1 A2G O3 O 2.095 -18.031 13.954 . . . 1.0 . . . . . . . . . . . . A . 101 A2G O3 . . . . . . . . . c19759_2mk7 1 . 4 . 698 . 2 2 1 A2G O4 O 0.065 -16.336 13.215 . . . 1.0 . . . . . . . . . . . . A . 101 A2G O4 . . . . . . . . . c19759_2mk7 1 . 4 . 699 . 2 2 1 A2G O6 O -2.486 -17.607 11.826 . . . 1.0 . . . . . . . . . . . . A . 101 A2G O6 . . . . . . . . . c19759_2mk7 1 . 4 . 700 . 2 2 1 A2G O7 O 4.756 -15.727 12.756 . . . 1.0 . . . . . . . . . . . . A . 101 A2G O7 . . . . . . . . . c19759_2mk7 1 . 5 . 701 . 1 1 1 ACE C C -1.479 -21.981 8.425 . . . 1.0 . . . . . . . . . . . . A . 1 ACE C . . . . . . . . . c19759_2mk7 1 . 5 . 702 . 1 1 1 ACE CH3 C -2.948 -21.574 8.363 . . . 1.0 . . . . . . . . . . . . A . 1 ACE CH3 . . . . . . . . . c19759_2mk7 1 . 5 . 703 . 1 1 1 ACE H1 H -3.287 -21.297 9.350 . . . 1.0 . . . . . . . . . . . . A . 1 ACE H1 . . . . . . . . . c19759_2mk7 1 . 5 . 704 . 1 1 1 ACE H2 H -3.536 -22.404 7.999 . . . 1.0 . . . . . . . . . . . . A . 1 ACE H2 . . . . . . . . . c19759_2mk7 1 . 5 . 705 . 1 1 1 ACE H3 H -3.061 -20.733 7.695 . . . 1.0 . . . . . . . . . . . . A . 1 ACE H3 . . . . . . . . . c19759_2mk7 1 . 5 . 706 . 1 1 1 ACE O O -0.797 -21.736 9.419 . . . 1.0 . . . . . . . . . . . . A . 1 ACE O . . . . . . . . . c19759_2mk7 1 . 5 . 707 . 1 1 2 PRO C C 1.397 -21.988 7.798 . . . 1.0 . . . . . . . . . . . . A . 2 PRO C . . . . . . . . . c19759_2mk7 1 . 5 . 708 . 1 1 2 PRO CA C 0.423 -23.052 7.299 . . . 1.0 . . . . . . . . . . . . A . 2 PRO CA . . . . . . . . . c19759_2mk7 1 . 5 . 709 . 1 1 2 PRO CB C 0.646 -23.338 5.806 . . . 1.0 . . . . . . . . . . . . A . 2 PRO CB . . . . . . . . . c19759_2mk7 1 . 5 . 710 . 1 1 2 PRO CD C -1.733 -22.921 6.166 . . . 1.0 . . . . . . . . . . . . A . 2 PRO CD . . . . . . . . . c19759_2mk7 1 . 5 . 711 . 1 1 2 PRO CG C -0.642 -23.031 5.102 . . . 1.0 . . . . . . . . . . . . A . 2 PRO CG . . . . . . . . . c19759_2mk7 1 . 5 . 712 . 1 1 2 PRO HA H 0.550 -23.962 7.861 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HA . . . . . . . . . c19759_2mk7 1 . 5 . 713 . 1 1 2 PRO HB2 H 1.438 -22.708 5.425 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HB2 . . . . . . . . . c19759_2mk7 1 . 5 . 714 . 1 1 2 PRO HB3 H 0.901 -24.378 5.664 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HB3 . . . . . . . . . c19759_2mk7 1 . 5 . 715 . 1 1 2 PRO HD2 H -2.427 -22.131 5.916 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HD2 . . . . . . . . . c19759_2mk7 1 . 5 . 716 . 1 1 2 PRO HD3 H -2.248 -23.862 6.283 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HD3 . . . . . . . . . c19759_2mk7 1 . 5 . 717 . 1 1 2 PRO HG2 H -0.553 -22.096 4.565 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HG2 . . . . . . . . . c19759_2mk7 1 . 5 . 718 . 1 1 2 PRO HG3 H -0.886 -23.828 4.416 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HG3 . . . . . . . . . c19759_2mk7 1 . 5 . 719 . 1 1 2 PRO N N -0.990 -22.595 7.382 . . . 1.0 . . . . . . . . . . . . A . 2 PRO N . . . . . . . . . c19759_2mk7 1 . 5 . 720 . 1 1 2 PRO O O 1.048 -20.813 7.912 . . . 1.0 . . . . . . . . . . . . A . 2 PRO O . . . . . . . . . c19759_2mk7 1 . 5 . 721 . 1 1 3 PRO C C 3.705 -20.159 7.802 . . . 1.0 . . . . . . . . . . . . A . 3 PRO C . . . . . . . . . c19759_2mk7 1 . 5 . 722 . 1 1 3 PRO CA C 3.660 -21.462 8.596 . . . 1.0 . . . . . . . . . . . . A . 3 PRO CA . . . . . . . . . c19759_2mk7 1 . 5 . 723 . 1 1 3 PRO CB C 4.969 -22.249 8.428 . . . 1.0 . . . . . . . . . . . . A . 3 PRO CB . . . . . . . . . c19759_2mk7 1 . 5 . 724 . 1 1 3 PRO CD C 3.098 -23.755 7.986 . . . 1.0 . . . . . . . . . . . . A . 3 PRO CD . . . . . . . . . c19759_2mk7 1 . 5 . 725 . 1 1 3 PRO CG C 4.607 -23.580 7.836 . . . 1.0 . . . . . . . . . . . . A . 3 PRO CG . . . . . . . . . c19759_2mk7 1 . 5 . 726 . 1 1 3 PRO HA H 3.501 -21.252 9.642 . . . 1.0 . . . . . . . . . . . . A . 3 PRO HA . . . . . . . . . c19759_2mk7 1 . 5 . 727 . 1 1 3 PRO HB2 H 5.636 -21.717 7.764 . . . 1.0 . . . . . . . . . . . . A . 3 PRO HB2 . . . . . . . . . c19759_2mk7 1 . 5 . 728 . 1 1 3 PRO HB3 H 5.440 -22.392 9.388 . . . 1.0 . . . . . . . . . . . . A . 3 PRO HB3 . . . . . . . . . c19759_2mk7 1 . 5 . 729 . 1 1 3 PRO HD2 H 2.685 -24.243 7.113 . . . 1.0 . . . . . . . . . . . . A . 3 PRO HD2 . . . . . . . . . c19759_2mk7 1 . 5 . 730 . 1 1 3 PRO HD3 H 2.865 -24.309 8.881 . . . 1.0 . . . . . . . . . . . . A . 3 PRO HD3 . . . . . . . . . c19759_2mk7 1 . 5 . 731 . 1 1 3 PRO HG2 H 4.882 -23.603 6.790 . . . 1.0 . . . . . . . . . . . . A . 3 PRO HG2 . . . . . . . . . c19759_2mk7 1 . 5 . 732 . 1 1 3 PRO HG3 H 5.117 -24.370 8.368 . . . 1.0 . . . . . . . . . . . . A . 3 PRO HG3 . . . . . . . . . c19759_2mk7 1 . 5 . 733 . 1 1 3 PRO N N 2.605 -22.383 8.095 . . . 1.0 . . . . . . . . . . . . A . 3 PRO N . . . . . . . . . c19759_2mk7 1 . 5 . 734 . 1 1 3 PRO O O 4.187 -20.129 6.669 . . . 1.0 . . . . . . . . . . . . A . 3 PRO O . . . . . . . . . c19759_2mk7 1 . 5 . 735 . 1 1 4 THR C C 4.408 -16.967 8.153 . . . 1.0 . . . . . . . . . . . . A . 4 THR C . . . . . . . . . c19759_2mk7 1 . 5 . 736 . 1 1 4 THR CA C 3.190 -17.787 7.742 . . . 1.0 . . . . . . . . . . . . A . 4 THR CA . . . . . . . . . c19759_2mk7 1 . 5 . 737 . 1 1 4 THR CB C 1.912 -17.027 8.108 . . . 1.0 . . . . . . . . . . . . A . 4 THR CB . . . . . . . . . c19759_2mk7 1 . 5 . 738 . 1 1 4 THR CG2 C 0.687 -17.825 7.658 . . . 1.0 . . . . . . . . . . . . A . 4 THR CG2 . . . . . . . . . c19759_2mk7 1 . 5 . 739 . 1 1 4 THR H H 2.831 -19.171 9.307 . . . 1.0 . . . . . . . . . . . . A . 4 THR H . . . . . . . . . c19759_2mk7 1 . 5 . 740 . 1 1 4 THR HA H 3.213 -17.937 6.674 . . . 1.0 . . . . . . . . . . . . A . 4 THR HA . . . . . . . . . c19759_2mk7 1 . 5 . 741 . 1 1 4 THR HB H 1.911 -16.063 7.624 . . . 1.0 . . . . . . . . . . . . A . 4 THR HB . . . . . . . . . c19759_2mk7 1 . 5 . 742 . 1 1 4 THR HG21 H 0.362 -18.468 8.462 . . . 1.0 . . . . . . . . . . . . A . 4 THR HG21 . . . . . . . . . c19759_2mk7 1 . 5 . 743 . 1 1 4 THR HG22 H 0.945 -18.424 6.797 . . . 1.0 . . . . . . . . . . . . A . 4 THR HG22 . . . . . . . . . c19759_2mk7 1 . 5 . 744 . 1 1 4 THR HG23 H -0.110 -17.144 7.397 . . . 1.0 . . . . . . . . . . . . A . 4 THR HG23 . . . . . . . . . c19759_2mk7 1 . 5 . 745 . 1 1 4 THR N N 3.201 -19.086 8.403 . . . 1.0 . . . . . . . . . . . . A . 4 THR N . . . . . . . . . c19759_2mk7 1 . 5 . 746 . 1 1 4 THR O O 5.117 -17.319 9.096 . . . 1.0 . . . . . . . . . . . . A . 4 THR O . . . . . . . . . c19759_2mk7 1 . 5 . 747 . 1 1 4 THR OG1 O 1.865 -16.871 9.509 . . . 1.0 . . . . . . . . . . . . A . 4 THR OG1 . . . . . . . . . c19759_2mk7 1 . 5 . 748 . 1 1 5 THR C C 5.354 -13.542 7.744 . . . 1.0 . . . . . . . . . . . . A . 5 THR C . . . . . . . . . c19759_2mk7 1 . 5 . 749 . 1 1 5 THR CA C 5.781 -15.007 7.740 . . . 1.0 . . . . . . . . . . . . A . 5 THR CA . . . . . . . . . c19759_2mk7 1 . 5 . 750 . 1 1 5 THR CB C 6.884 -15.215 6.699 . . . 1.0 . . . . . . . . . . . . A . 5 THR CB . . . . . . . . . c19759_2mk7 1 . 5 . 751 . 1 1 5 THR CG2 C 7.333 -16.677 6.704 . . . 1.0 . . . . . . . . . . . . A . 5 THR CG2 . . . . . . . . . c19759_2mk7 1 . 5 . 752 . 1 1 5 THR H H 4.045 -15.638 6.701 . . . 1.0 . . . . . . . . . . . . A . 5 THR H . . . . . . . . . c19759_2mk7 1 . 5 . 753 . 1 1 5 THR HA H 6.169 -15.262 8.714 . . . 1.0 . . . . . . . . . . . . A . 5 THR HA . . . . . . . . . c19759_2mk7 1 . 5 . 754 . 1 1 5 THR HB H 7.725 -14.580 6.927 . . . 1.0 . . . . . . . . . . . . A . 5 THR HB . . . . . . . . . c19759_2mk7 1 . 5 . 755 . 1 1 5 THR HG21 H 7.011 -17.149 7.621 . . . 1.0 . . . . . . . . . . . . A . 5 THR HG21 . . . . . . . . . c19759_2mk7 1 . 5 . 756 . 1 1 5 THR HG22 H 8.410 -16.724 6.635 . . . 1.0 . . . . . . . . . . . . A . 5 THR HG22 . . . . . . . . . c19759_2mk7 1 . 5 . 757 . 1 1 5 THR HG23 H 6.894 -17.192 5.862 . . . 1.0 . . . . . . . . . . . . A . 5 THR HG23 . . . . . . . . . c19759_2mk7 1 . 5 . 758 . 1 1 5 THR N N 4.644 -15.870 7.440 . . . 1.0 . . . . . . . . . . . . A . 5 THR N . . . . . . . . . c19759_2mk7 1 . 5 . 759 . 1 1 5 THR O O 4.538 -13.121 6.926 . . . 1.0 . . . . . . . . . . . . A . 5 THR O . . . . . . . . . c19759_2mk7 1 . 5 . 760 . 1 1 5 THR OG1 O 6.365 -14.903 5.424 . . . 1.0 . . . . . . . . . . . . A . 5 THR OG1 . . . . . . . . . c19759_2mk7 1 . 5 . 761 . 1 1 6 THR C C 6.711 -10.500 8.211 . . . 1.0 . . . . . . . . . . . . A . 6 THR C . . . . . . . . . c19759_2mk7 1 . 5 . 762 . 1 1 6 THR CA C 5.582 -11.355 8.775 . . . 1.0 . . . . . . . . . . . . A . 6 THR CA . . . . . . . . . c19759_2mk7 1 . 5 . 763 . 1 1 6 THR CB C 5.338 -10.980 10.239 . . . 1.0 . . . . . . . . . . . . A . 6 THR CB . . . . . . . . . c19759_2mk7 1 . 5 . 764 . 1 1 6 THR CG2 C 4.204 -11.833 10.811 . . . 1.0 . . . . . . . . . . . . A . 6 THR CG2 . . . . . . . . . c19759_2mk7 1 . 5 . 765 . 1 1 6 THR H H 6.557 -13.163 9.300 . . . 1.0 . . . . . . . . . . . . A . 6 THR H . . . . . . . . . c19759_2mk7 1 . 5 . 766 . 1 1 6 THR HA H 4.682 -11.164 8.211 . . . 1.0 . . . . . . . . . . . . A . 6 THR HA . . . . . . . . . c19759_2mk7 1 . 5 . 767 . 1 1 6 THR HB H 5.073 -9.937 10.309 . . . 1.0 . . . . . . . . . . . . A . 6 THR HB . . . . . . . . . c19759_2mk7 1 . 5 . 768 . 1 1 6 THR HG21 H 3.625 -11.243 11.506 . . . 1.0 . . . . . . . . . . . . A . 6 THR HG21 . . . . . . . . . c19759_2mk7 1 . 5 . 769 . 1 1 6 THR HG22 H 4.619 -12.689 11.322 . . . 1.0 . . . . . . . . . . . . A . 6 THR HG22 . . . . . . . . . c19759_2mk7 1 . 5 . 770 . 1 1 6 THR HG23 H 3.565 -12.169 10.006 . . . 1.0 . . . . . . . . . . . . A . 6 THR HG23 . . . . . . . . . c19759_2mk7 1 . 5 . 771 . 1 1 6 THR N N 5.912 -12.773 8.673 . . . 1.0 . . . . . . . . . . . . A . 6 THR N . . . . . . . . . c19759_2mk7 1 . 5 . 772 . 1 1 6 THR O O 7.877 -10.684 8.561 . . . 1.0 . . . . . . . . . . . . A . 6 THR O . . . . . . . . . c19759_2mk7 1 . 5 . 773 . 1 1 6 THR OG1 O 6.515 -11.238 10.973 . . . 1.0 . . . . . . . . . . . . A . 6 THR OG1 . . . . . . . . . c19759_2mk7 1 . 5 . 774 . 1 1 7 THR C C 7.353 -7.323 7.415 . . . 1.0 . . . . . . . . . . . . A . 7 THR C . . . . . . . . . c19759_2mk7 1 . 5 . 775 . 1 1 7 THR CA C 7.351 -8.685 6.729 . . . 1.0 . . . . . . . . . . . . A . 7 THR CA . . . . . . . . . c19759_2mk7 1 . 5 . 776 . 1 1 7 THR CB C 7.049 -8.508 5.239 . . . 1.0 . . . . . . . . . . . . A . 7 THR CB . . . . . . . . . c19759_2mk7 1 . 5 . 777 . 1 1 7 THR CG2 C 6.959 -9.876 4.561 . . . 1.0 . . . . . . . . . . . . A . 7 THR CG2 . . . . . . . . . c19759_2mk7 1 . 5 . 778 . 1 1 7 THR H H 5.413 -9.461 7.097 . . . 1.0 . . . . . . . . . . . . A . 7 THR H . . . . . . . . . c19759_2mk7 1 . 5 . 779 . 1 1 7 THR HA H 8.327 -9.134 6.836 . . . 1.0 . . . . . . . . . . . . A . 7 THR HA . . . . . . . . . c19759_2mk7 1 . 5 . 780 . 1 1 7 THR HB H 7.831 -7.928 4.775 . . . 1.0 . . . . . . . . . . . . A . 7 THR HB . . . . . . . . . c19759_2mk7 1 . 5 . 781 . 1 1 7 THR HG21 H 7.757 -10.509 4.921 . . . 1.0 . . . . . . . . . . . . A . 7 THR HG21 . . . . . . . . . c19759_2mk7 1 . 5 . 782 . 1 1 7 THR HG22 H 7.049 -9.755 3.492 . . . 1.0 . . . . . . . . . . . . A . 7 THR HG22 . . . . . . . . . c19759_2mk7 1 . 5 . 783 . 1 1 7 THR HG23 H 6.007 -10.330 4.794 . . . 1.0 . . . . . . . . . . . . A . 7 THR HG23 . . . . . . . . . c19759_2mk7 1 . 5 . 784 . 1 1 7 THR N N 6.358 -9.563 7.337 . . . 1.0 . . . . . . . . . . . . A . 7 THR N . . . . . . . . . c19759_2mk7 1 . 5 . 785 . 1 1 7 THR O O 6.384 -6.570 7.327 . . . 1.0 . . . . . . . . . . . . A . 7 THR O . . . . . . . . . c19759_2mk7 1 . 5 . 786 . 1 1 7 THR OG1 O 5.808 -7.850 5.106 . . . 1.0 . . . . . . . . . . . . A . 7 THR OG1 . . . . . . . . . c19759_2mk7 1 . 5 . 787 . 1 1 8 LYS C C 7.272 -5.399 9.520 . . . 1.0 . . . . . . . . . . . . A . 8 LYS C . . . . . . . . . c19759_2mk7 1 . 5 . 788 . 1 1 8 LYS CA C 8.569 -5.736 8.794 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CA . . . . . . . . . c19759_2mk7 1 . 5 . 789 . 1 1 8 LYS CB C 8.901 -4.627 7.793 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CB . . . . . . . . . c19759_2mk7 1 . 5 . 790 . 1 1 8 LYS CD C 9.967 -5.081 5.581 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CD . . . . . . . . . c19759_2mk7 1 . 5 . 791 . 1 1 8 LYS CE C 11.289 -5.377 4.867 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CE . . . . . . . . . c19759_2mk7 1 . 5 . 792 . 1 1 8 LYS CG C 10.217 -4.953 7.084 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CG . . . . . . . . . c19759_2mk7 1 . 5 . 793 . 1 1 8 LYS H H 9.192 -7.653 8.137 . . . 1.0 . . . . . . . . . . . . A . 8 LYS H . . . . . . . . . c19759_2mk7 1 . 5 . 794 . 1 1 8 LYS HA H 9.369 -5.804 9.516 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HA . . . . . . . . . c19759_2mk7 1 . 5 . 795 . 1 1 8 LYS HB2 H 8.106 -4.551 7.065 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HB2 . . . . . . . . . c19759_2mk7 1 . 5 . 796 . 1 1 8 LYS HB3 H 8.999 -3.688 8.318 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HB3 . . . . . . . . . c19759_2mk7 1 . 5 . 797 . 1 1 8 LYS HD2 H 9.271 -5.886 5.398 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HD2 . . . . . . . . . c19759_2mk7 1 . 5 . 798 . 1 1 8 LYS HD3 H 9.557 -4.157 5.204 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HD3 . . . . . . . . . c19759_2mk7 1 . 5 . 799 . 1 1 8 LYS HE2 H 11.734 -6.265 5.289 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HE2 . . . . . . . . . c19759_2mk7 1 . 5 . 800 . 1 1 8 LYS HE3 H 11.103 -5.532 3.815 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HE3 . . . . . . . . . c19759_2mk7 1 . 5 . 801 . 1 1 8 LYS HG2 H 10.929 -4.162 7.267 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HG2 . . . . . . . . . c19759_2mk7 1 . 5 . 802 . 1 1 8 LYS HG3 H 10.608 -5.886 7.463 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HG3 . . . . . . . . . c19759_2mk7 1 . 5 . 803 . 1 1 8 LYS HZ1 H 11.666 -3.356 5.198 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ1 . . . . . . . . . c19759_2mk7 1 . 5 . 804 . 1 1 8 LYS HZ2 H 12.802 -4.117 4.189 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ2 . . . . . . . . . c19759_2mk7 1 . 5 . 805 . 1 1 8 LYS HZ3 H 12.830 -4.394 5.865 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ3 . . . . . . . . . c19759_2mk7 1 . 5 . 806 . 1 1 8 LYS N N 8.451 -7.013 8.099 . . . 1.0 . . . . . . . . . . . . A . 8 LYS N . . . . . . . . . c19759_2mk7 1 . 5 . 807 . 1 1 8 LYS NZ N 12.216 -4.225 5.044 . . . 1.0 . . . . . . . . . . . . A . 8 LYS NZ . . . . . . . . . c19759_2mk7 1 . 5 . 808 . 1 1 8 LYS O O 6.340 -4.857 8.927 . . . 1.0 . . . . . . . . . . . . A . 8 LYS O . . . . . . . . . c19759_2mk7 1 . 5 . 809 . 1 1 9 LYS C C 5.772 -3.947 11.685 . . . 1.0 . . . . . . . . . . . . A . 9 LYS C . . . . . . . . . c19759_2mk7 1 . 5 . 810 . 1 1 9 LYS CA C 6.031 -5.448 11.607 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CA . . . . . . . . . c19759_2mk7 1 . 5 . 811 . 1 1 9 LYS CB C 6.208 -6.011 13.019 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CB . . . . . . . . . c19759_2mk7 1 . 5 . 812 . 1 1 9 LYS CD C 7.918 -6.558 14.758 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CD . . . . . . . . . c19759_2mk7 1 . 5 . 813 . 1 1 9 LYS CE C 9.354 -7.032 14.983 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CE . . . . . . . . . c19759_2mk7 1 . 5 . 814 . 1 1 9 LYS CG C 7.687 -6.316 13.265 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CG . . . . . . . . . c19759_2mk7 1 . 5 . 815 . 1 1 9 LYS H H 7.994 -6.153 11.229 . . . 1.0 . . . . . . . . . . . . A . 9 LYS H . . . . . . . . . c19759_2mk7 1 . 5 . 816 . 1 1 9 LYS HA H 5.181 -5.927 11.146 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HA . . . . . . . . . c19759_2mk7 1 . 5 . 817 . 1 1 9 LYS HB2 H 5.865 -5.285 13.741 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HB2 . . . . . . . . . c19759_2mk7 1 . 5 . 818 . 1 1 9 LYS HB3 H 5.634 -6.919 13.119 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HB3 . . . . . . . . . c19759_2mk7 1 . 5 . 819 . 1 1 9 LYS HD2 H 7.753 -5.638 15.300 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HD2 . . . . . . . . . c19759_2mk7 1 . 5 . 820 . 1 1 9 LYS HD3 H 7.232 -7.313 15.110 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HD3 . . . . . . . . . c19759_2mk7 1 . 5 . 821 . 1 1 9 LYS HE2 H 9.499 -7.259 16.029 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HE2 . . . . . . . . . c19759_2mk7 1 . 5 . 822 . 1 1 9 LYS HE3 H 9.538 -7.918 14.393 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HE3 . . . . . . . . . c19759_2mk7 1 . 5 . 823 . 1 1 9 LYS HG2 H 7.969 -7.199 12.708 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HG2 . . . . . . . . . c19759_2mk7 1 . 5 . 824 . 1 1 9 LYS HG3 H 8.287 -5.480 12.940 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HG3 . . . . . . . . . c19759_2mk7 1 . 5 . 825 . 1 1 9 LYS HZ1 H 9.770 -5.155 14.183 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HZ1 . . . . . . . . . c19759_2mk7 1 . 5 . 826 . 1 1 9 LYS HZ2 H 10.954 -6.328 13.849 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HZ2 . . . . . . . . . c19759_2mk7 1 . 5 . 827 . 1 1 9 LYS HZ3 H 10.846 -5.640 15.399 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HZ3 . . . . . . . . . c19759_2mk7 1 . 5 . 828 . 1 1 9 LYS N N 7.220 -5.722 10.809 . . . 1.0 . . . . . . . . . . . . A . 9 LYS N . . . . . . . . . c19759_2mk7 1 . 5 . 829 . 1 1 9 LYS NZ N 10.302 -5.958 14.572 . . . 1.0 . . . . . . . . . . . . A . 9 LYS NZ . . . . . . . . . c19759_2mk7 1 . 5 . 830 . 1 1 9 LYS O O 6.678 -3.138 11.481 . . . 1.0 . . . . . . . . . . . . A . 9 LYS O . . . . . . . . . c19759_2mk7 1 . 5 . 831 . 1 1 10 PRO C C 5.173 -1.318 12.869 . . . 1.0 . . . . . . . . . . . . A . 10 PRO C . . . . . . . . . c19759_2mk7 1 . 5 . 832 . 1 1 10 PRO CA C 4.156 -2.141 12.083 . . . 1.0 . . . . . . . . . . . . A . 10 PRO CA . . . . . . . . . c19759_2mk7 1 . 5 . 833 . 1 1 10 PRO CB C 2.803 -2.176 12.811 . . . 1.0 . . . . . . . . . . . . A . 10 PRO CB . . . . . . . . . c19759_2mk7 1 . 5 . 834 . 1 1 10 PRO CD C 3.431 -4.464 12.235 . . . 1.0 . . . . . . . . . . . . A . 10 PRO CD . . . . . . . . . c19759_2mk7 1 . 5 . 835 . 1 1 10 PRO CG C 2.492 -3.616 13.091 . . . 1.0 . . . . . . . . . . . . A . 10 PRO CG . . . . . . . . . c19759_2mk7 1 . 5 . 836 . 1 1 10 PRO HA H 4.022 -1.719 11.100 . . . 1.0 . . . . . . . . . . . . A . 10 PRO HA . . . . . . . . . c19759_2mk7 1 . 5 . 837 . 1 1 10 PRO HB2 H 2.869 -1.623 13.738 . . . 1.0 . . . . . . . . . . . . A . 10 PRO HB2 . . . . . . . . . c19759_2mk7 1 . 5 . 838 . 1 1 10 PRO HB3 H 2.034 -1.752 12.183 . . . 1.0 . . . . . . . . . . . . A . 10 PRO HB3 . . . . . . . . . c19759_2mk7 1 . 5 . 839 . 1 1 10 PRO HD2 H 3.755 -5.340 12.782 . . . 1.0 . . . . . . . . . . . . A . 10 PRO HD2 . . . . . . . . . c19759_2mk7 1 . 5 . 840 . 1 1 10 PRO HD3 H 2.955 -4.744 11.310 . . . 1.0 . . . . . . . . . . . . A . 10 PRO HD3 . . . . . . . . . c19759_2mk7 1 . 5 . 841 . 1 1 10 PRO HG2 H 2.653 -3.828 14.139 . . . 1.0 . . . . . . . . . . . . A . 10 PRO HG2 . . . . . . . . . c19759_2mk7 1 . 5 . 842 . 1 1 10 PRO HG3 H 1.468 -3.831 12.824 . . . 1.0 . . . . . . . . . . . . A . 10 PRO HG3 . . . . . . . . . c19759_2mk7 1 . 5 . 843 . 1 1 10 PRO N N 4.557 -3.569 11.976 . . . 1.0 . . . . . . . . . . . . A . 10 PRO N . . . . . . . . . c19759_2mk7 1 . 5 . 844 . 1 1 10 PRO O O 5.917 -0.528 12.288 . . . 1.0 . . . . . . . . . . . . A . 10 PRO O . . . . . . . . . c19759_2mk7 1 . 5 . 845 . 1 1 11 NH2 HN1 H 5.473 -0.688 14.729 . . . 1.0 . . . . . . . . . . . . A . 11 NH2 HN1 . . . . . . . . . c19759_2mk7 1 . 5 . 846 . 1 1 11 NH2 HN2 H 5.077 -2.331 14.574 . . . 1.0 . . . . . . . . . . . . A . 11 NH2 HN2 . . . . . . . . . c19759_2mk7 1 . 5 . 847 . 1 1 11 NH2 N N 5.249 -1.458 14.165 . . . 1.0 . . . . . . . . . . . . A . 11 NH2 N . . . . . . . . . c19759_2mk7 1 . 5 . 848 . 2 2 1 A2G C1 C 1.936 -15.520 9.904 . . . 1.0 . . . . . . . . . . . . A . 101 A2G C1 . . . . . . . . . c19759_2mk7 1 . 5 . 849 . 2 2 1 A2G C2 C 2.051 -15.473 11.430 . . . 1.0 . . . . . . . . . . . . A . 101 A2G C2 . . . . . . . . . c19759_2mk7 1 . 5 . 850 . 2 2 1 A2G C3 C 0.798 -16.099 12.047 . . . 1.0 . . . . . . . . . . . . A . 101 A2G C3 . . . . . . . . . c19759_2mk7 1 . 5 . 851 . 2 2 1 A2G C4 C -0.446 -15.404 11.491 . . . 1.0 . . . . . . . . . . . . A . 101 A2G C4 . . . . . . . . . c19759_2mk7 1 . 5 . 852 . 2 2 1 A2G C5 C -0.407 -15.433 9.963 . . . 1.0 . . . . . . . . . . . . A . 101 A2G C5 . . . . . . . . . c19759_2mk7 1 . 5 . 853 . 2 2 1 A2G C6 C -1.604 -14.661 9.401 . . . 1.0 . . . . . . . . . . . . A . 101 A2G C6 . . . . . . . . . c19759_2mk7 1 . 5 . 854 . 2 2 1 A2G C7 C 4.202 -15.587 12.550 . . . 1.0 . . . . . . . . . . . . A . 101 A2G C7 . . . . . . . . . c19759_2mk7 1 . 5 . 855 . 2 2 1 A2G C8 C 5.388 -16.452 12.961 . . . 1.0 . . . . . . . . . . . . A . 101 A2G C8 . . . . . . . . . c19759_2mk7 1 . 5 . 856 . 2 2 1 A2G H1 H 2.808 -15.057 9.468 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H1 . . . . . . . . . c19759_2mk7 1 . 5 . 857 . 2 2 1 A2G H14 H -1.994 -15.181 8.538 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H14 . . . . . . . . . c19759_2mk7 1 . 5 . 858 . 2 2 1 A2G H15 H -2.688 -13.645 10.656 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H15 . . . . . . . . . c19759_2mk7 1 . 5 . 859 . 2 2 1 A2G H2 H 2.126 -14.444 11.748 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H2 . . . . . . . . . c19759_2mk7 1 . 5 . 860 . 2 2 1 A2G H3 H 0.762 -17.150 11.801 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H3 . . . . . . . . . c19759_2mk7 1 . 5 . 861 . 2 2 1 A2G H4 H -1.331 -15.917 11.839 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H4 . . . . . . . . . c19759_2mk7 1 . 5 . 862 . 2 2 1 A2G H5 H -0.438 -16.455 9.616 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H5 . . . . . . . . . c19759_2mk7 1 . 5 . 863 . 2 2 1 A2G H6 H -1.289 -13.669 9.111 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H6 . . . . . . . . . c19759_2mk7 1 . 5 . 864 . 2 2 1 A2G H8 H 5.265 -16.769 13.986 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H8 . . . . . . . . . c19759_2mk7 1 . 5 . 865 . 2 2 1 A2G H8A H 6.301 -15.882 12.868 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H8A . . . . . . . . . c19759_2mk7 1 . 5 . 866 . 2 2 1 A2G H8B H 5.440 -17.320 12.320 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H8B . . . . . . . . . c19759_2mk7 1 . 5 . 867 . 2 2 1 A2G HN2 H 3.331 -17.147 11.649 . . . 1.0 . . . . . . . . . . . . A . 101 A2G HN2 . . . . . . . . . c19759_2mk7 1 . 5 . 868 . 2 2 1 A2G HO3 H 0.783 -16.817 13.854 . . . 1.0 . . . . . . . . . . . . A . 101 A2G HO3 . . . . . . . . . c19759_2mk7 1 . 5 . 869 . 2 2 1 A2G HO4 H -1.286 -13.655 11.622 . . . 1.0 . . . . . . . . . . . . A . 101 A2G HO4 . . . . . . . . . c19759_2mk7 1 . 5 . 870 . 2 2 1 A2G N2 N 3.240 -16.196 11.866 . . . 1.0 . . . . . . . . . . . . A . 101 A2G N2 . . . . . . . . . c19759_2mk7 1 . 5 . 871 . 2 2 1 A2G O O 0.779 -14.806 9.529 . . . 1.0 . . . . . . . . . . . . A . 101 A2G O . . . . . . . . . c19759_2mk7 1 . 5 . 872 . 2 2 1 A2G O3 O 0.838 -15.945 13.458 . . . 1.0 . . . . . . . . . . . . A . 101 A2G O3 . . . . . . . . . c19759_2mk7 1 . 5 . 873 . 2 2 1 A2G O4 O -0.474 -14.056 11.939 . . . 1.0 . . . . . . . . . . . . A . 101 A2G O4 . . . . . . . . . c19759_2mk7 1 . 5 . 874 . 2 2 1 A2G O6 O -2.614 -14.566 10.394 . . . 1.0 . . . . . . . . . . . . A . 101 A2G O6 . . . . . . . . . c19759_2mk7 1 . 5 . 875 . 2 2 1 A2G O7 O 4.155 -14.395 12.856 . . . 1.0 . . . . . . . . . . . . A . 101 A2G O7 . . . . . . . . . c19759_2mk7 1 . 6 . 876 . 1 1 1 ACE C C -1.346 -22.979 5.301 . . . 1.0 . . . . . . . . . . . . A . 1 ACE C . . . . . . . . . c19759_2mk7 1 . 6 . 877 . 1 1 1 ACE CH3 C -2.617 -22.835 4.470 . . . 1.0 . . . . . . . . . . . . A . 1 ACE CH3 . . . . . . . . . c19759_2mk7 1 . 6 . 878 . 1 1 1 ACE H1 H -3.474 -22.786 5.127 . . . 1.0 . . . . . . . . . . . . A . 1 ACE H1 . . . . . . . . . c19759_2mk7 1 . 6 . 879 . 1 1 1 ACE H2 H -2.716 -23.686 3.813 . . . 1.0 . . . . . . . . . . . . A . 1 ACE H2 . . . . . . . . . c19759_2mk7 1 . 6 . 880 . 1 1 1 ACE H3 H -2.562 -21.931 3.883 . . . 1.0 . . . . . . . . . . . . A . 1 ACE H3 . . . . . . . . . c19759_2mk7 1 . 6 . 881 . 1 1 1 ACE O O -1.357 -22.769 6.514 . . . 1.0 . . . . . . . . . . . . A . 1 ACE O . . . . . . . . . c19759_2mk7 1 . 6 . 882 . 1 1 2 PRO C C 1.349 -22.380 6.324 . . . 1.0 . . . . . . . . . . . . A . 2 PRO C . . . . . . . . . c19759_2mk7 1 . 6 . 883 . 1 1 2 PRO CA C 1.051 -23.513 5.345 . . . 1.0 . . . . . . . . . . . . A . 2 PRO CA . . . . . . . . . c19759_2mk7 1 . 6 . 884 . 1 1 2 PRO CB C 2.076 -23.527 4.200 . . . 1.0 . . . . . . . . . . . . A . 2 PRO CB . . . . . . . . . c19759_2mk7 1 . 6 . 885 . 1 1 2 PRO CD C -0.166 -23.597 3.234 . . . 1.0 . . . . . . . . . . . . A . 2 PRO CD . . . . . . . . . c19759_2mk7 1 . 6 . 886 . 1 1 2 PRO CG C 1.309 -23.350 2.922 . . . 1.0 . . . . . . . . . . . . A . 2 PRO CG . . . . . . . . . c19759_2mk7 1 . 6 . 887 . 1 1 2 PRO HA H 1.075 -24.460 5.857 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HA . . . . . . . . . c19759_2mk7 1 . 6 . 888 . 1 1 2 PRO HB2 H 2.779 -22.715 4.325 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HB2 . . . . . . . . . c19759_2mk7 1 . 6 . 889 . 1 1 2 PRO HB3 H 2.599 -24.471 4.184 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HB3 . . . . . . . . . c19759_2mk7 1 . 6 . 890 . 1 1 2 PRO HD2 H -0.791 -22.915 2.674 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HD2 . . . . . . . . . c19759_2mk7 1 . 6 . 891 . 1 1 2 PRO HD3 H -0.434 -24.621 3.024 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HD3 . . . . . . . . . c19759_2mk7 1 . 6 . 892 . 1 1 2 PRO HG2 H 1.444 -22.344 2.550 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HG2 . . . . . . . . . c19759_2mk7 1 . 6 . 893 . 1 1 2 PRO HG3 H 1.646 -24.064 2.188 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HG3 . . . . . . . . . c19759_2mk7 1 . 6 . 894 . 1 1 2 PRO N N -0.261 -23.332 4.667 . . . 1.0 . . . . . . . . . . . . A . 2 PRO N . . . . . . . . . c19759_2mk7 1 . 6 . 895 . 1 1 2 PRO O O 0.731 -21.317 6.269 . . . 1.0 . . . . . . . . . . . . A . 2 PRO O . . . . . . . . . c19759_2mk7 1 . 6 . 896 . 1 1 3 PRO C C 2.826 -20.193 7.630 . . . 1.0 . . . . . . . . . . . . A . 3 PRO C . . . . . . . . . c19759_2mk7 1 . 6 . 897 . 1 1 3 PRO CA C 2.676 -21.588 8.232 . . . 1.0 . . . . . . . . . . . . A . 3 PRO CA . . . . . . . . . c19759_2mk7 1 . 6 . 898 . 1 1 3 PRO CB C 4.024 -22.095 8.771 . . . 1.0 . . . . . . . . . . . . A . 3 PRO CB . . . . . . . . . c19759_2mk7 1 . 6 . 899 . 1 1 3 PRO CD C 3.060 -23.824 7.342 . . . 1.0 . . . . . . . . . . . . A . 3 PRO CD . . . . . . . . . c19759_2mk7 1 . 6 . 900 . 1 1 3 PRO CG C 4.340 -23.364 8.036 . . . 1.0 . . . . . . . . . . . . A . 3 PRO CG . . . . . . . . . c19759_2mk7 1 . 6 . 901 . 1 1 3 PRO HA H 1.956 -21.569 9.033 . . . 1.0 . . . . . . . . . . . . A . 3 PRO HA . . . . . . . . . c19759_2mk7 1 . 6 . 902 . 1 1 3 PRO HB2 H 4.795 -21.359 8.588 . . . 1.0 . . . . . . . . . . . . A . 3 PRO HB2 . . . . . . . . . c19759_2mk7 1 . 6 . 903 . 1 1 3 PRO HB3 H 3.947 -22.295 9.829 . . . 1.0 . . . . . . . . . . . . A . 3 PRO HB3 . . . . . . . . . c19759_2mk7 1 . 6 . 904 . 1 1 3 PRO HD2 H 3.285 -24.241 6.369 . . . 1.0 . . . . . . . . . . . . A . 3 PRO HD2 . . . . . . . . . c19759_2mk7 1 . 6 . 905 . 1 1 3 PRO HD3 H 2.532 -24.540 7.952 . . . 1.0 . . . . . . . . . . . . A . 3 PRO HD3 . . . . . . . . . c19759_2mk7 1 . 6 . 906 . 1 1 3 PRO HG2 H 5.113 -23.179 7.302 . . . 1.0 . . . . . . . . . . . . A . 3 PRO HG2 . . . . . . . . . c19759_2mk7 1 . 6 . 907 . 1 1 3 PRO HG3 H 4.666 -24.121 8.732 . . . 1.0 . . . . . . . . . . . . A . 3 PRO HG3 . . . . . . . . . c19759_2mk7 1 . 6 . 908 . 1 1 3 PRO N N 2.281 -22.595 7.213 . . . 1.0 . . . . . . . . . . . . A . 3 PRO N . . . . . . . . . c19759_2mk7 1 . 6 . 909 . 1 1 3 PRO O O 3.308 -20.039 6.509 . . . 1.0 . . . . . . . . . . . . A . 3 PRO O . . . . . . . . . c19759_2mk7 1 . 6 . 910 . 1 1 4 THR C C 3.779 -17.148 8.422 . . . 1.0 . . . . . . . . . . . . A . 4 THR C . . . . . . . . . c19759_2mk7 1 . 6 . 911 . 1 1 4 THR CA C 2.499 -17.803 7.914 . . . 1.0 . . . . . . . . . . . . A . 4 THR CA . . . . . . . . . c19759_2mk7 1 . 6 . 912 . 1 1 4 THR CB C 1.286 -17.004 8.398 . . . 1.0 . . . . . . . . . . . . A . 4 THR CB . . . . . . . . . c19759_2mk7 1 . 6 . 913 . 1 1 4 THR CG2 C -0.002 -17.697 7.955 . . . 1.0 . . . . . . . . . . . . A . 4 THR CG2 . . . . . . . . . c19759_2mk7 1 . 6 . 914 . 1 1 4 THR H H 2.030 -19.364 9.270 . . . 1.0 . . . . . . . . . . . . A . 4 THR H . . . . . . . . . c19759_2mk7 1 . 6 . 915 . 1 1 4 THR HA H 2.508 -17.800 6.834 . . . 1.0 . . . . . . . . . . . . A . 4 THR HA . . . . . . . . . c19759_2mk7 1 . 6 . 916 . 1 1 4 THR HB H 1.318 -16.007 7.987 . . . 1.0 . . . . . . . . . . . . A . 4 THR HB . . . . . . . . . c19759_2mk7 1 . 6 . 917 . 1 1 4 THR HG21 H -0.640 -16.985 7.453 . . . 1.0 . . . . . . . . . . . . A . 4 THR HG21 . . . . . . . . . c19759_2mk7 1 . 6 . 918 . 1 1 4 THR HG22 H -0.516 -18.091 8.820 . . . 1.0 . . . . . . . . . . . . A . 4 THR HG22 . . . . . . . . . c19759_2mk7 1 . 6 . 919 . 1 1 4 THR HG23 H 0.237 -18.505 7.279 . . . 1.0 . . . . . . . . . . . . A . 4 THR HG23 . . . . . . . . . c19759_2mk7 1 . 6 . 920 . 1 1 4 THR N N 2.407 -19.181 8.383 . . . 1.0 . . . . . . . . . . . . A . 4 THR N . . . . . . . . . c19759_2mk7 1 . 6 . 921 . 1 1 4 THR O O 4.434 -17.664 9.327 . . . 1.0 . . . . . . . . . . . . A . 4 THR O . . . . . . . . . c19759_2mk7 1 . 6 . 922 . 1 1 4 THR OG1 O 1.315 -16.954 9.808 . . . 1.0 . . . . . . . . . . . . A . 4 THR OG1 . . . . . . . . . c19759_2mk7 1 . 6 . 923 . 1 1 5 THR C C 5.042 -13.801 8.391 . . . 1.0 . . . . . . . . . . . . A . 5 THR C . . . . . . . . . c19759_2mk7 1 . 6 . 924 . 1 1 5 THR CA C 5.332 -15.290 8.236 . . . 1.0 . . . . . . . . . . . . A . 5 THR CA . . . . . . . . . c19759_2mk7 1 . 6 . 925 . 1 1 5 THR CB C 6.433 -15.491 7.190 . . . 1.0 . . . . . . . . . . . . A . 5 THR CB . . . . . . . . . c19759_2mk7 1 . 6 . 926 . 1 1 5 THR CG2 C 6.732 -16.983 7.033 . . . 1.0 . . . . . . . . . . . . A . 5 THR CG2 . . . . . . . . . c19759_2mk7 1 . 6 . 927 . 1 1 5 THR H H 3.566 -15.643 7.118 . . . 1.0 . . . . . . . . . . . . A . 5 THR H . . . . . . . . . c19759_2mk7 1 . 6 . 928 . 1 1 5 THR HA H 5.674 -15.682 9.181 . . . 1.0 . . . . . . . . . . . . A . 5 THR HA . . . . . . . . . c19759_2mk7 1 . 6 . 929 . 1 1 5 THR HB H 7.328 -14.976 7.500 . . . 1.0 . . . . . . . . . . . . A . 5 THR HB . . . . . . . . . c19759_2mk7 1 . 6 . 930 . 1 1 5 THR HG21 H 6.195 -17.369 6.179 . . . 1.0 . . . . . . . . . . . . A . 5 THR HG21 . . . . . . . . . c19759_2mk7 1 . 6 . 931 . 1 1 5 THR HG22 H 6.419 -17.509 7.923 . . . 1.0 . . . . . . . . . . . . A . 5 THR HG22 . . . . . . . . . c19759_2mk7 1 . 6 . 932 . 1 1 5 THR HG23 H 7.792 -17.124 6.885 . . . 1.0 . . . . . . . . . . . . A . 5 THR HG23 . . . . . . . . . c19759_2mk7 1 . 6 . 933 . 1 1 5 THR N N 4.128 -16.008 7.834 . . . 1.0 . . . . . . . . . . . . A . 5 THR N . . . . . . . . . c19759_2mk7 1 . 6 . 934 . 1 1 5 THR O O 4.187 -13.249 7.697 . . . 1.0 . . . . . . . . . . . . A . 5 THR O . . . . . . . . . c19759_2mk7 1 . 6 . 935 . 1 1 5 THR OG1 O 5.978 -14.985 5.955 . . . 1.0 . . . . . . . . . . . . A . 5 THR OG1 . . . . . . . . . c19759_2mk7 1 . 6 . 936 . 1 1 6 THR C C 6.707 -10.928 8.923 . . . 1.0 . . . . . . . . . . . . A . 6 THR C . . . . . . . . . c19759_2mk7 1 . 6 . 937 . 1 1 6 THR CA C 5.569 -11.729 9.545 . . . 1.0 . . . . . . . . . . . . A . 6 THR CA . . . . . . . . . c19759_2mk7 1 . 6 . 938 . 1 1 6 THR CB C 5.509 -11.455 11.049 . . . 1.0 . . . . . . . . . . . . A . 6 THR CB . . . . . . . . . c19759_2mk7 1 . 6 . 939 . 1 1 6 THR CG2 C 4.507 -12.402 11.710 . . . 1.0 . . . . . . . . . . . . A . 6 THR CG2 . . . . . . . . . c19759_2mk7 1 . 6 . 940 . 1 1 6 THR H H 6.424 -13.647 9.830 . . . 1.0 . . . . . . . . . . . . A . 6 THR H . . . . . . . . . c19759_2mk7 1 . 6 . 941 . 1 1 6 THR HA H 4.636 -11.420 9.097 . . . 1.0 . . . . . . . . . . . . A . 6 THR HA . . . . . . . . . c19759_2mk7 1 . 6 . 942 . 1 1 6 THR HB H 5.207 -10.434 11.221 . . . 1.0 . . . . . . . . . . . . A . 6 THR HB . . . . . . . . . c19759_2mk7 1 . 6 . 943 . 1 1 6 THR HG21 H 5.037 -13.106 12.335 . . . 1.0 . . . . . . . . . . . . A . 6 THR HG21 . . . . . . . . . c19759_2mk7 1 . 6 . 944 . 1 1 6 THR HG22 H 3.961 -12.938 10.948 . . . 1.0 . . . . . . . . . . . . A . 6 THR HG22 . . . . . . . . . c19759_2mk7 1 . 6 . 945 . 1 1 6 THR HG23 H 3.818 -11.832 12.314 . . . 1.0 . . . . . . . . . . . . A . 6 THR HG23 . . . . . . . . . c19759_2mk7 1 . 6 . 946 . 1 1 6 THR N N 5.758 -13.156 9.306 . . . 1.0 . . . . . . . . . . . . A . 6 THR N . . . . . . . . . c19759_2mk7 1 . 6 . 947 . 1 1 6 THR O O 7.876 -11.293 9.045 . . . 1.0 . . . . . . . . . . . . A . 6 THR O . . . . . . . . . c19759_2mk7 1 . 6 . 948 . 1 1 6 THR OG1 O 6.788 -11.686 11.600 . . . 1.0 . . . . . . . . . . . . A . 6 THR OG1 . . . . . . . . . c19759_2mk7 1 . 6 . 949 . 1 1 7 THR C C 7.645 -7.757 8.477 . . . 1.0 . . . . . . . . . . . . A . 7 THR C . . . . . . . . . c19759_2mk7 1 . 6 . 950 . 1 1 7 THR CA C 7.358 -8.985 7.619 . . . 1.0 . . . . . . . . . . . . A . 7 THR CA . . . . . . . . . c19759_2mk7 1 . 6 . 951 . 1 1 7 THR CB C 6.867 -8.542 6.238 . . . 1.0 . . . . . . . . . . . . A . 7 THR CB . . . . . . . . . c19759_2mk7 1 . 6 . 952 . 1 1 7 THR CG2 C 7.163 -9.634 5.209 . . . 1.0 . . . . . . . . . . . . A . 7 THR CG2 . . . . . . . . . c19759_2mk7 1 . 6 . 953 . 1 1 7 THR H H 5.409 -9.590 8.191 . . . 1.0 . . . . . . . . . . . . A . 7 THR H . . . . . . . . . c19759_2mk7 1 . 6 . 954 . 1 1 7 THR HA H 8.271 -9.549 7.500 . . . 1.0 . . . . . . . . . . . . A . 7 THR HA . . . . . . . . . c19759_2mk7 1 . 6 . 955 . 1 1 7 THR HB H 7.365 -7.631 5.950 . . . 1.0 . . . . . . . . . . . . A . 7 THR HB . . . . . . . . . c19759_2mk7 1 . 6 . 956 . 1 1 7 THR HG21 H 6.658 -10.544 5.494 . . . 1.0 . . . . . . . . . . . . A . 7 THR HG21 . . . . . . . . . c19759_2mk7 1 . 6 . 957 . 1 1 7 THR HG22 H 8.228 -9.810 5.167 . . . 1.0 . . . . . . . . . . . . A . 7 THR HG22 . . . . . . . . . c19759_2mk7 1 . 6 . 958 . 1 1 7 THR HG23 H 6.813 -9.316 4.237 . . . 1.0 . . . . . . . . . . . . A . 7 THR HG23 . . . . . . . . . c19759_2mk7 1 . 6 . 959 . 1 1 7 THR N N 6.357 -9.832 8.256 . . . 1.0 . . . . . . . . . . . . A . 7 THR N . . . . . . . . . c19759_2mk7 1 . 6 . 960 . 1 1 7 THR O O 6.907 -7.458 9.416 . . . 1.0 . . . . . . . . . . . . A . 7 THR O . . . . . . . . . c19759_2mk7 1 . 6 . 961 . 1 1 7 THR OG1 O 5.472 -8.340 6.300 . . . 1.0 . . . . . . . . . . . . A . 7 THR OG1 . . . . . . . . . c19759_2mk7 1 . 6 . 962 . 1 1 8 LYS C C 8.264 -4.657 8.443 . . . 1.0 . . . . . . . . . . . . A . 8 LYS C . . . . . . . . . c19759_2mk7 1 . 6 . 963 . 1 1 8 LYS CA C 9.095 -5.854 8.896 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CA . . . . . . . . . c19759_2mk7 1 . 6 . 964 . 1 1 8 LYS CB C 10.581 -5.554 8.690 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CB . . . . . . . . . c19759_2mk7 1 . 6 . 965 . 1 1 8 LYS CD C 12.901 -6.157 9.395 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CD . . . . . . . . . c19759_2mk7 1 . 6 . 966 . 1 1 8 LYS CE C 13.525 -7.348 8.665 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CE . . . . . . . . . c19759_2mk7 1 . 6 . 967 . 1 1 8 LYS CG C 11.413 -6.427 9.630 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CG . . . . . . . . . c19759_2mk7 1 . 6 . 968 . 1 1 8 LYS H H 9.272 -7.334 7.389 . . . 1.0 . . . . . . . . . . . . A . 8 LYS H . . . . . . . . . c19759_2mk7 1 . 6 . 969 . 1 1 8 LYS HA H 8.916 -6.027 9.946 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HA . . . . . . . . . c19759_2mk7 1 . 6 . 970 . 1 1 8 LYS HB2 H 10.852 -5.765 7.666 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HB2 . . . . . . . . . c19759_2mk7 1 . 6 . 971 . 1 1 8 LYS HB3 H 10.770 -4.513 8.906 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HB3 . . . . . . . . . c19759_2mk7 1 . 6 . 972 . 1 1 8 LYS HD2 H 13.014 -5.266 8.797 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HD2 . . . . . . . . . c19759_2mk7 1 . 6 . 973 . 1 1 8 LYS HD3 H 13.396 -6.020 10.345 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HD3 . . . . . . . . . c19759_2mk7 1 . 6 . 974 . 1 1 8 LYS HE2 H 14.541 -7.106 8.387 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HE2 . . . . . . . . . c19759_2mk7 1 . 6 . 975 . 1 1 8 LYS HE3 H 13.526 -8.209 9.316 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HE3 . . . . . . . . . c19759_2mk7 1 . 6 . 976 . 1 1 8 LYS HG2 H 11.161 -6.193 10.656 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HG2 . . . . . . . . . c19759_2mk7 1 . 6 . 977 . 1 1 8 LYS HG3 H 11.203 -7.468 9.436 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HG3 . . . . . . . . . c19759_2mk7 1 . 6 . 978 . 1 1 8 LYS HZ1 H 13.340 -8.126 6.743 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ1 . . . . . . . . . c19759_2mk7 1 . 6 . 979 . 1 1 8 LYS HZ2 H 12.370 -6.763 7.034 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ2 . . . . . . . . . c19759_2mk7 1 . 6 . 980 . 1 1 8 LYS HZ3 H 11.938 -8.271 7.685 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ3 . . . . . . . . . c19759_2mk7 1 . 6 . 981 . 1 1 8 LYS N N 8.720 -7.049 8.148 . . . 1.0 . . . . . . . . . . . . A . 8 LYS N . . . . . . . . . c19759_2mk7 1 . 6 . 982 . 1 1 8 LYS NZ N 12.734 -7.650 7.439 . . . 1.0 . . . . . . . . . . . . A . 8 LYS NZ . . . . . . . . . c19759_2mk7 1 . 6 . 983 . 1 1 8 LYS O O 8.652 -3.930 7.528 . . . 1.0 . . . . . . . . . . . . A . 8 LYS O . . . . . . . . . c19759_2mk7 1 . 6 . 984 . 1 1 9 LYS C C 6.940 -2.012 9.005 . . . 1.0 . . . . . . . . . . . . A . 9 LYS C . . . . . . . . . c19759_2mk7 1 . 6 . 985 . 1 1 9 LYS CA C 6.243 -3.345 8.746 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CA . . . . . . . . . c19759_2mk7 1 . 6 . 986 . 1 1 9 LYS CB C 4.957 -3.419 9.571 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CB . . . . . . . . . c19759_2mk7 1 . 6 . 987 . 1 1 9 LYS CD C 3.965 -4.309 11.685 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CD . . . . . . . . . c19759_2mk7 1 . 6 . 988 . 1 1 9 LYS CE C 4.178 -5.268 12.857 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CE . . . . . . . . . c19759_2mk7 1 . 6 . 989 . 1 1 9 LYS CG C 5.138 -4.426 10.709 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CG . . . . . . . . . c19759_2mk7 1 . 6 . 990 . 1 1 9 LYS H H 6.863 -5.069 9.811 . . . 1.0 . . . . . . . . . . . . A . 9 LYS H . . . . . . . . . c19759_2mk7 1 . 6 . 991 . 1 1 9 LYS HA H 5.990 -3.410 7.699 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HA . . . . . . . . . c19759_2mk7 1 . 6 . 992 . 1 1 9 LYS HB2 H 4.736 -2.444 9.982 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HB2 . . . . . . . . . c19759_2mk7 1 . 6 . 993 . 1 1 9 LYS HB3 H 4.142 -3.737 8.939 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HB3 . . . . . . . . . c19759_2mk7 1 . 6 . 994 . 1 1 9 LYS HD2 H 3.904 -3.295 12.055 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HD2 . . . . . . . . . c19759_2mk7 1 . 6 . 995 . 1 1 9 LYS HD3 H 3.047 -4.563 11.177 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HD3 . . . . . . . . . c19759_2mk7 1 . 6 . 996 . 1 1 9 LYS HE2 H 3.226 -5.500 13.310 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HE2 . . . . . . . . . c19759_2mk7 1 . 6 . 997 . 1 1 9 LYS HE3 H 4.639 -6.178 12.500 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HE3 . . . . . . . . . c19759_2mk7 1 . 6 . 998 . 1 1 9 LYS HG2 H 5.172 -5.426 10.303 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HG2 . . . . . . . . . c19759_2mk7 1 . 6 . 999 . 1 1 9 LYS HG3 H 6.060 -4.216 11.232 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HG3 . . . . . . . . . c19759_2mk7 1 . 6 . 1000 . 1 1 9 LYS HZ1 H 5.290 -3.658 13.569 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HZ1 . . . . . . . . . c19759_2mk7 1 . 6 . 1001 . 1 1 9 LYS HZ2 H 5.947 -5.176 13.953 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HZ2 . . . . . . . . . c19759_2mk7 1 . 6 . 1002 . 1 1 9 LYS HZ3 H 4.583 -4.601 14.788 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HZ3 . . . . . . . . . c19759_2mk7 1 . 6 . 1003 . 1 1 9 LYS N N 7.121 -4.458 9.090 . . . 1.0 . . . . . . . . . . . . A . 9 LYS N . . . . . . . . . c19759_2mk7 1 . 6 . 1004 . 1 1 9 LYS NZ N 5.067 -4.628 13.868 . . . 1.0 . . . . . . . . . . . . A . 9 LYS NZ . . . . . . . . . c19759_2mk7 1 . 6 . 1005 . 1 1 9 LYS O O 7.897 -1.940 9.775 . . . 1.0 . . . . . . . . . . . . A . 9 LYS O . . . . . . . . . c19759_2mk7 1 . 6 . 1006 . 1 1 10 PRO C C 7.342 0.734 9.987 . . . 1.0 . . . . . . . . . . . . A . 10 PRO C . . . . . . . . . c19759_2mk7 1 . 6 . 1007 . 1 1 10 PRO CA C 7.054 0.394 8.527 . . . 1.0 . . . . . . . . . . . . A . 10 PRO CA . . . . . . . . . c19759_2mk7 1 . 6 . 1008 . 1 1 10 PRO CB C 5.983 1.333 7.949 . . . 1.0 . . . . . . . . . . . . A . 10 PRO CB . . . . . . . . . c19759_2mk7 1 . 6 . 1009 . 1 1 10 PRO CD C 5.342 -0.971 7.452 . . . 1.0 . . . . . . . . . . . . A . 10 PRO CD . . . . . . . . . c19759_2mk7 1 . 6 . 1010 . 1 1 10 PRO CG C 4.841 0.470 7.498 . . . 1.0 . . . . . . . . . . . . A . 10 PRO CG . . . . . . . . . c19759_2mk7 1 . 6 . 1011 . 1 1 10 PRO HA H 7.956 0.478 7.944 . . . 1.0 . . . . . . . . . . . . A . 10 PRO HA . . . . . . . . . c19759_2mk7 1 . 6 . 1012 . 1 1 10 PRO HB2 H 5.649 2.023 8.711 . . . 1.0 . . . . . . . . . . . . A . 10 PRO HB2 . . . . . . . . . c19759_2mk7 1 . 6 . 1013 . 1 1 10 PRO HB3 H 6.383 1.877 7.108 . . . 1.0 . . . . . . . . . . . . A . 10 PRO HB3 . . . . . . . . . c19759_2mk7 1 . 6 . 1014 . 1 1 10 PRO HD2 H 4.573 -1.652 7.789 . . . 1.0 . . . . . . . . . . . . A . 10 PRO HD2 . . . . . . . . . c19759_2mk7 1 . 6 . 1015 . 1 1 10 PRO HD3 H 5.673 -1.227 6.458 . . . 1.0 . . . . . . . . . . . . A . 10 PRO HD3 . . . . . . . . . c19759_2mk7 1 . 6 . 1016 . 1 1 10 PRO HG2 H 4.021 0.553 8.198 . . . 1.0 . . . . . . . . . . . . A . 10 PRO HG2 . . . . . . . . . c19759_2mk7 1 . 6 . 1017 . 1 1 10 PRO HG3 H 4.517 0.772 6.515 . . . 1.0 . . . . . . . . . . . . A . 10 PRO HG3 . . . . . . . . . c19759_2mk7 1 . 6 . 1018 . 1 1 10 PRO N N 6.475 -0.968 8.377 . . . 1.0 . . . . . . . . . . . . A . 10 PRO N . . . . . . . . . c19759_2mk7 1 . 6 . 1019 . 1 1 10 PRO O O 6.975 -0.022 10.886 . . . 1.0 . . . . . . . . . . . . A . 10 PRO O . . . . . . . . . c19759_2mk7 1 . 6 . 1020 . 1 1 11 NH2 HN1 H 8.863 2.006 9.885 . . . 1.0 . . . . . . . . . . . . A . 11 NH2 HN1 . . . . . . . . . c19759_2mk7 1 . 6 . 1021 . 1 1 11 NH2 HN2 H 7.581 2.486 10.890 . . . 1.0 . . . . . . . . . . . . A . 11 NH2 HN2 . . . . . . . . . c19759_2mk7 1 . 6 . 1022 . 1 1 11 NH2 N N 7.981 1.834 10.277 . . . 1.0 . . . . . . . . . . . . A . 11 NH2 N . . . . . . . . . c19759_2mk7 1 . 6 . 1023 . 2 2 1 A2G C1 C 1.633 -15.669 10.295 . . . 1.0 . . . . . . . . . . . . A . 101 A2G C1 . . . . . . . . . c19759_2mk7 1 . 6 . 1024 . 2 2 1 A2G C2 C 1.874 -15.776 11.802 . . . 1.0 . . . . . . . . . . . . A . 101 A2G C2 . . . . . . . . . c19759_2mk7 1 . 6 . 1025 . 2 2 1 A2G C3 C 0.589 -16.252 12.483 . . . 1.0 . . . . . . . . . . . . A . 101 A2G C3 . . . . . . . . . c19759_2mk7 1 . 6 . 1026 . 2 2 1 A2G C4 C -0.566 -15.325 12.097 . . . 1.0 . . . . . . . . . . . . A . 101 A2G C4 . . . . . . . . . c19759_2mk7 1 . 6 . 1027 . 2 2 1 A2G C5 C -0.652 -15.225 10.573 . . . 1.0 . . . . . . . . . . . . A . 101 A2G C5 . . . . . . . . . c19759_2mk7 1 . 6 . 1028 . 2 2 1 A2G C6 C -1.747 -14.231 10.182 . . . 1.0 . . . . . . . . . . . . A . 101 A2G C6 . . . . . . . . . c19759_2mk7 1 . 6 . 1029 . 2 2 1 A2G C7 C 4.058 -16.321 12.713 . . . 1.0 . . . . . . . . . . . . A . 101 A2G C7 . . . . . . . . . c19759_2mk7 1 . 6 . 1030 . 2 2 1 A2G C8 C 5.144 -17.376 12.891 . . . 1.0 . . . . . . . . . . . . A . 101 A2G C8 . . . . . . . . . c19759_2mk7 1 . 6 . 1031 . 2 2 1 A2G H1 H 2.532 -15.311 9.817 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H1 . . . . . . . . . c19759_2mk7 1 . 6 . 1032 . 2 2 1 A2G H14 H -2.031 -14.393 9.153 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H14 . . . . . . . . . c19759_2mk7 1 . 6 . 1033 . 2 2 1 A2G H15 H -3.637 -14.596 10.458 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H15 . . . . . . . . . c19759_2mk7 1 . 6 . 1034 . 2 2 1 A2G H2 H 2.139 -14.802 12.189 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H2 . . . . . . . . . c19759_2mk7 1 . 6 . 1035 . 2 2 1 A2G H3 H 0.364 -17.259 12.164 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H3 . . . . . . . . . c19759_2mk7 1 . 6 . 1036 . 2 2 1 A2G H4 H -1.492 -15.724 12.485 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H4 . . . . . . . . . c19759_2mk7 1 . 6 . 1037 . 2 2 1 A2G H5 H -0.875 -16.196 10.156 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H5 . . . . . . . . . c19759_2mk7 1 . 6 . 1038 . 2 2 1 A2G H6 H -1.377 -13.223 10.299 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H6 . . . . . . . . . c19759_2mk7 1 . 6 . 1039 . 2 2 1 A2G H8 H 4.869 -18.043 13.694 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H8 . . . . . . . . . c19759_2mk7 1 . 6 . 1040 . 2 2 1 A2G H8A H 6.080 -16.893 13.128 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H8A . . . . . . . . . c19759_2mk7 1 . 6 . 1041 . 2 2 1 A2G H8B H 5.251 -17.939 11.975 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H8B . . . . . . . . . c19759_2mk7 1 . 6 . 1042 . 2 2 1 A2G HN2 H 2.879 -17.641 11.778 . . . 1.0 . . . . . . . . . . . . A . 101 A2G HN2 . . . . . . . . . c19759_2mk7 1 . 6 . 1043 . 2 2 1 A2G HO3 H 0.070 -16.767 14.285 . . . 1.0 . . . . . . . . . . . . A . 101 A2G HO3 . . . . . . . . . c19759_2mk7 1 . 6 . 1044 . 2 2 1 A2G HO4 H 0.218 -14.134 13.419 . . . 1.0 . . . . . . . . . . . . A . 101 A2G HO4 . . . . . . . . . c19759_2mk7 1 . 6 . 1045 . 2 2 1 A2G N2 N 2.961 -16.710 12.073 . . . 1.0 . . . . . . . . . . . . A . 101 A2G N2 . . . . . . . . . c19759_2mk7 1 . 6 . 1046 . 2 2 1 A2G O O 0.582 -14.755 10.080 . . . 1.0 . . . . . . . . . . . . A . 101 A2G O . . . . . . . . . c19759_2mk7 1 . 6 . 1047 . 2 2 1 A2G O3 O 0.762 -16.229 13.892 . . . 1.0 . . . . . . . . . . . . A . 101 A2G O3 . . . . . . . . . c19759_2mk7 1 . 6 . 1048 . 2 2 1 A2G O4 O -0.341 -14.035 12.645 . . . 1.0 . . . . . . . . . . . . A . 101 A2G O4 . . . . . . . . . c19759_2mk7 1 . 6 . 1049 . 2 2 1 A2G O6 O -2.878 -14.420 11.020 . . . 1.0 . . . . . . . . . . . . A . 101 A2G O6 . . . . . . . . . c19759_2mk7 1 . 6 . 1050 . 2 2 1 A2G O7 O 4.227 -15.168 13.114 . . . 1.0 . . . . . . . . . . . . A . 101 A2G O7 . . . . . . . . . c19759_2mk7 1 . 7 . 1051 . 1 1 1 ACE C C -0.522 -23.863 5.363 . . . 1.0 . . . . . . . . . . . . A . 1 ACE C . . . . . . . . . c19759_2mk7 1 . 7 . 1052 . 1 1 1 ACE CH3 C -1.811 -23.962 4.554 . . . 1.0 . . . . . . . . . . . . A . 1 ACE CH3 . . . . . . . . . c19759_2mk7 1 . 7 . 1053 . 1 1 1 ACE H1 H -1.951 -23.053 3.987 . . . 1.0 . . . . . . . . . . . . A . 1 ACE H1 . . . . . . . . . c19759_2mk7 1 . 7 . 1054 . 1 1 1 ACE H2 H -2.647 -24.101 5.223 . . . 1.0 . . . . . . . . . . . . A . 1 ACE H2 . . . . . . . . . c19759_2mk7 1 . 7 . 1055 . 1 1 1 ACE H3 H -1.749 -24.801 3.877 . . . 1.0 . . . . . . . . . . . . A . 1 ACE H3 . . . . . . . . . c19759_2mk7 1 . 7 . 1056 . 1 1 1 ACE O O -0.552 -23.695 6.582 . . . 1.0 . . . . . . . . . . . . A . 1 ACE O . . . . . . . . . c19759_2mk7 1 . 7 . 1057 . 1 1 2 PRO C C 2.011 -22.748 6.369 . . . 1.0 . . . . . . . . . . . . A . 2 PRO C . . . . . . . . . c19759_2mk7 1 . 7 . 1058 . 1 1 2 PRO CA C 1.933 -23.889 5.357 . . . 1.0 . . . . . . . . . . . . A . 2 PRO CA . . . . . . . . . c19759_2mk7 1 . 7 . 1059 . 1 1 2 PRO CB C 2.917 -23.657 4.199 . . . 1.0 . . . . . . . . . . . . A . 2 PRO CB . . . . . . . . . c19759_2mk7 1 . 7 . 1060 . 1 1 2 PRO CD C 0.719 -24.164 3.260 . . . 1.0 . . . . . . . . . . . . A . 2 PRO CD . . . . . . . . . c19759_2mk7 1 . 7 . 1061 . 1 1 2 PRO CG C 2.105 -23.608 2.938 . . . 1.0 . . . . . . . . . . . . A . 2 PRO CG . . . . . . . . . c19759_2mk7 1 . 7 . 1062 . 1 1 2 PRO HA H 2.164 -24.825 5.839 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HA . . . . . . . . . c19759_2mk7 1 . 7 . 1063 . 1 1 2 PRO HB2 H 3.440 -22.721 4.341 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HB2 . . . . . . . . . c19759_2mk7 1 . 7 . 1064 . 1 1 2 PRO HB3 H 3.623 -24.472 4.146 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HB3 . . . . . . . . . c19759_2mk7 1 . 7 . 1065 . 1 1 2 PRO HD2 H -0.044 -23.609 2.732 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HD2 . . . . . . . . . c19759_2mk7 1 . 7 . 1066 . 1 1 2 PRO HD3 H 0.665 -25.214 3.022 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HD3 . . . . . . . . . c19759_2mk7 1 . 7 . 1067 . 1 1 2 PRO HG2 H 2.023 -22.585 2.596 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HG2 . . . . . . . . . c19759_2mk7 1 . 7 . 1068 . 1 1 2 PRO HG3 H 2.569 -24.215 2.177 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HG3 . . . . . . . . . c19759_2mk7 1 . 7 . 1069 . 1 1 2 PRO N N 0.600 -23.965 4.704 . . . 1.0 . . . . . . . . . . . . A . 2 PRO N . . . . . . . . . c19759_2mk7 1 . 7 . 1070 . 1 1 2 PRO O O 1.185 -21.834 6.355 . . . 1.0 . . . . . . . . . . . . A . 2 PRO O . . . . . . . . . c19759_2mk7 1 . 7 . 1071 . 1 1 3 PRO C C 3.027 -20.339 7.724 . . . 1.0 . . . . . . . . . . . . A . 3 PRO C . . . . . . . . . c19759_2mk7 1 . 7 . 1072 . 1 1 3 PRO CA C 3.182 -21.752 8.283 . . . 1.0 . . . . . . . . . . . . A . 3 PRO CA . . . . . . . . . c19759_2mk7 1 . 7 . 1073 . 1 1 3 PRO CB C 4.616 -21.984 8.787 . . . 1.0 . . . . . . . . . . . . A . 3 PRO CB . . . . . . . . . c19759_2mk7 1 . 7 . 1074 . 1 1 3 PRO CD C 4.003 -23.834 7.317 . . . 1.0 . . . . . . . . . . . . A . 3 PRO CD . . . . . . . . . c19759_2mk7 1 . 7 . 1075 . 1 1 3 PRO CG C 5.174 -23.138 8.008 . . . 1.0 . . . . . . . . . . . . A . 3 PRO CG . . . . . . . . . c19759_2mk7 1 . 7 . 1076 . 1 1 3 PRO HA H 2.489 -21.905 9.094 . . . 1.0 . . . . . . . . . . . . A . 3 PRO HA . . . . . . . . . c19759_2mk7 1 . 7 . 1077 . 1 1 3 PRO HB2 H 5.214 -21.099 8.618 . . . 1.0 . . . . . . . . . . . . A . 3 PRO HB2 . . . . . . . . . c19759_2mk7 1 . 7 . 1078 . 1 1 3 PRO HB3 H 4.602 -22.225 9.840 . . . 1.0 . . . . . . . . . . . . A . 3 PRO HB3 . . . . . . . . . c19759_2mk7 1 . 7 . 1079 . 1 1 3 PRO HD2 H 4.290 -24.167 6.329 . . . 1.0 . . . . . . . . . . . . A . 3 PRO HD2 . . . . . . . . . c19759_2mk7 1 . 7 . 1080 . 1 1 3 PRO HD3 H 3.646 -24.661 7.911 . . . 1.0 . . . . . . . . . . . . A . 3 PRO HD3 . . . . . . . . . c19759_2mk7 1 . 7 . 1081 . 1 1 3 PRO HG2 H 5.877 -22.777 7.270 . . . 1.0 . . . . . . . . . . . . A . 3 PRO HG2 . . . . . . . . . c19759_2mk7 1 . 7 . 1082 . 1 1 3 PRO HG3 H 5.662 -23.831 8.675 . . . 1.0 . . . . . . . . . . . . A . 3 PRO HG3 . . . . . . . . . c19759_2mk7 1 . 7 . 1083 . 1 1 3 PRO N N 2.984 -22.790 7.237 . . . 1.0 . . . . . . . . . . . . A . 3 PRO N . . . . . . . . . c19759_2mk7 1 . 7 . 1084 . 1 1 3 PRO O O 3.294 -20.095 6.547 . . . 1.0 . . . . . . . . . . . . A . 3 PRO O . . . . . . . . . c19759_2mk7 1 . 7 . 1085 . 1 1 4 THR C C 3.646 -17.201 8.478 . . . 1.0 . . . . . . . . . . . . A . 4 THR C . . . . . . . . . c19759_2mk7 1 . 7 . 1086 . 1 1 4 THR CA C 2.408 -18.032 8.155 . . . 1.0 . . . . . . . . . . . . A . 4 THR CA . . . . . . . . . c19759_2mk7 1 . 7 . 1087 . 1 1 4 THR CB C 1.190 -17.430 8.861 . . . 1.0 . . . . . . . . . . . . A . 4 THR CB . . . . . . . . . c19759_2mk7 1 . 7 . 1088 . 1 1 4 THR CG2 C -0.044 -18.293 8.588 . . . 1.0 . . . . . . . . . . . . A . 4 THR CG2 . . . . . . . . . c19759_2mk7 1 . 7 . 1089 . 1 1 4 THR H H 2.397 -19.669 9.501 . . . 1.0 . . . . . . . . . . . . A . 4 THR H . . . . . . . . . c19759_2mk7 1 . 7 . 1090 . 1 1 4 THR HA H 2.240 -18.009 7.089 . . . 1.0 . . . . . . . . . . . . A . 4 THR HA . . . . . . . . . c19759_2mk7 1 . 7 . 1091 . 1 1 4 THR HB H 1.016 -16.430 8.499 . . . 1.0 . . . . . . . . . . . . A . 4 THR HB . . . . . . . . . c19759_2mk7 1 . 7 . 1092 . 1 1 4 THR HG21 H -0.197 -18.973 9.414 . . . 1.0 . . . . . . . . . . . . A . 4 THR HG21 . . . . . . . . . c19759_2mk7 1 . 7 . 1093 . 1 1 4 THR HG22 H 0.104 -18.858 7.680 . . . 1.0 . . . . . . . . . . . . A . 4 THR HG22 . . . . . . . . . c19759_2mk7 1 . 7 . 1094 . 1 1 4 THR HG23 H -0.911 -17.657 8.480 . . . 1.0 . . . . . . . . . . . . A . 4 THR HG23 . . . . . . . . . c19759_2mk7 1 . 7 . 1095 . 1 1 4 THR N N 2.595 -19.415 8.575 . . . 1.0 . . . . . . . . . . . . A . 4 THR N . . . . . . . . . c19759_2mk7 1 . 7 . 1096 . 1 1 4 THR O O 4.206 -17.304 9.570 . . . 1.0 . . . . . . . . . . . . A . 4 THR O . . . . . . . . . c19759_2mk7 1 . 7 . 1097 . 1 1 4 THR OG1 O 1.436 -17.414 10.249 . . . 1.0 . . . . . . . . . . . . A . 4 THR OG1 . . . . . . . . . c19759_2mk7 1 . 7 . 1098 . 1 1 5 THR C C 4.827 -14.085 7.944 . . . 1.0 . . . . . . . . . . . . A . 5 THR C . . . . . . . . . c19759_2mk7 1 . 7 . 1099 . 1 1 5 THR CA C 5.241 -15.536 7.719 . . . 1.0 . . . . . . . . . . . . A . 5 THR CA . . . . . . . . . c19759_2mk7 1 . 7 . 1100 . 1 1 5 THR CB C 6.157 -15.623 6.495 . . . 1.0 . . . . . . . . . . . . A . 5 THR CB . . . . . . . . . c19759_2mk7 1 . 7 . 1101 . 1 1 5 THR CG2 C 6.567 -17.077 6.256 . . . 1.0 . . . . . . . . . . . . A . 5 THR CG2 . . . . . . . . . c19759_2mk7 1 . 7 . 1102 . 1 1 5 THR H H 3.581 -16.338 6.674 . . . 1.0 . . . . . . . . . . . . A . 5 THR H . . . . . . . . . c19759_2mk7 1 . 7 . 1103 . 1 1 5 THR HA H 5.783 -15.885 8.585 . . . 1.0 . . . . . . . . . . . . A . 5 THR HA . . . . . . . . . c19759_2mk7 1 . 7 . 1104 . 1 1 5 THR HB H 7.038 -15.022 6.654 . . . 1.0 . . . . . . . . . . . . A . 5 THR HB . . . . . . . . . c19759_2mk7 1 . 7 . 1105 . 1 1 5 THR HG21 H 6.534 -17.618 7.191 . . . 1.0 . . . . . . . . . . . . A . 5 THR HG21 . . . . . . . . . c19759_2mk7 1 . 7 . 1106 . 1 1 5 THR HG22 H 7.570 -17.107 5.858 . . . 1.0 . . . . . . . . . . . . A . 5 THR HG22 . . . . . . . . . c19759_2mk7 1 . 7 . 1107 . 1 1 5 THR HG23 H 5.886 -17.532 5.553 . . . 1.0 . . . . . . . . . . . . A . 5 THR HG23 . . . . . . . . . c19759_2mk7 1 . 7 . 1108 . 1 1 5 THR N N 4.068 -16.379 7.524 . . . 1.0 . . . . . . . . . . . . A . 5 THR N . . . . . . . . . c19759_2mk7 1 . 7 . 1109 . 1 1 5 THR O O 3.891 -13.592 7.315 . . . 1.0 . . . . . . . . . . . . A . 5 THR O . . . . . . . . . c19759_2mk7 1 . 7 . 1110 . 1 1 5 THR OG1 O 5.446 -15.160 5.368 . . . 1.0 . . . . . . . . . . . . A . 5 THR OG1 . . . . . . . . . c19759_2mk7 1 . 7 . 1111 . 1 1 6 THR C C 6.257 -11.090 8.501 . . . 1.0 . . . . . . . . . . . . A . 6 THR C . . . . . . . . . c19759_2mk7 1 . 7 . 1112 . 1 1 6 THR CA C 5.227 -12.013 9.146 . . . 1.0 . . . . . . . . . . . . A . 6 THR CA . . . . . . . . . c19759_2mk7 1 . 7 . 1113 . 1 1 6 THR CB C 5.219 -11.795 10.660 . . . 1.0 . . . . . . . . . . . . A . 6 THR CB . . . . . . . . . c19759_2mk7 1 . 7 . 1114 . 1 1 6 THR CG2 C 4.175 -12.703 11.310 . . . 1.0 . . . . . . . . . . . . A . 6 THR CG2 . . . . . . . . . c19759_2mk7 1 . 7 . 1115 . 1 1 6 THR H H 6.267 -13.852 9.315 . . . 1.0 . . . . . . . . . . . . A . 6 THR H . . . . . . . . . c19759_2mk7 1 . 7 . 1116 . 1 1 6 THR HA H 4.250 -11.775 8.754 . . . 1.0 . . . . . . . . . . . . A . 6 THR HA . . . . . . . . . c19759_2mk7 1 . 7 . 1117 . 1 1 6 THR HB H 4.987 -10.764 10.879 . . . 1.0 . . . . . . . . . . . . A . 6 THR HB . . . . . . . . . c19759_2mk7 1 . 7 . 1118 . 1 1 6 THR HG21 H 4.614 -13.670 11.511 . . . 1.0 . . . . . . . . . . . . A . 6 THR HG21 . . . . . . . . . c19759_2mk7 1 . 7 . 1119 . 1 1 6 THR HG22 H 3.335 -12.821 10.642 . . . 1.0 . . . . . . . . . . . . A . 6 THR HG22 . . . . . . . . . c19759_2mk7 1 . 7 . 1120 . 1 1 6 THR HG23 H 3.840 -12.260 12.236 . . . 1.0 . . . . . . . . . . . . A . 6 THR HG23 . . . . . . . . . c19759_2mk7 1 . 7 . 1121 . 1 1 6 THR N N 5.531 -13.408 8.845 . . . 1.0 . . . . . . . . . . . . A . 6 THR N . . . . . . . . . c19759_2mk7 1 . 7 . 1122 . 1 1 6 THR O O 7.439 -11.421 8.424 . . . 1.0 . . . . . . . . . . . . A . 6 THR O . . . . . . . . . c19759_2mk7 1 . 7 . 1123 . 1 1 6 THR OG1 O 6.493 -12.127 11.170 . . . 1.0 . . . . . . . . . . . . A . 6 THR OG1 . . . . . . . . . c19759_2mk7 1 . 7 . 1124 . 1 1 7 THR C C 7.059 -7.854 8.383 . . . 1.0 . . . . . . . . . . . . A . 7 THR C . . . . . . . . . c19759_2mk7 1 . 7 . 1125 . 1 1 7 THR CA C 6.689 -8.966 7.405 . . . 1.0 . . . . . . . . . . . . A . 7 THR CA . . . . . . . . . c19759_2mk7 1 . 7 . 1126 . 1 1 7 THR CB C 6.011 -8.361 6.175 . . . 1.0 . . . . . . . . . . . . A . 7 THR CB . . . . . . . . . c19759_2mk7 1 . 7 . 1127 . 1 1 7 THR CG2 C 5.527 -9.477 5.247 . . . 1.0 . . . . . . . . . . . . A . 7 THR CG2 . . . . . . . . . c19759_2mk7 1 . 7 . 1128 . 1 1 7 THR H H 4.845 -9.720 8.130 . . . 1.0 . . . . . . . . . . . . A . 7 THR H . . . . . . . . . c19759_2mk7 1 . 7 . 1129 . 1 1 7 THR HA H 7.589 -9.474 7.093 . . . 1.0 . . . . . . . . . . . . A . 7 THR HA . . . . . . . . . c19759_2mk7 1 . 7 . 1130 . 1 1 7 THR HB H 6.708 -7.731 5.645 . . . 1.0 . . . . . . . . . . . . A . 7 THR HB . . . . . . . . . c19759_2mk7 1 . 7 . 1131 . 1 1 7 THR HG21 H 5.465 -9.103 4.236 . . . 1.0 . . . . . . . . . . . . A . 7 THR HG21 . . . . . . . . . c19759_2mk7 1 . 7 . 1132 . 1 1 7 THR HG22 H 4.553 -9.815 5.568 . . . 1.0 . . . . . . . . . . . . A . 7 THR HG22 . . . . . . . . . c19759_2mk7 1 . 7 . 1133 . 1 1 7 THR HG23 H 6.224 -10.302 5.283 . . . 1.0 . . . . . . . . . . . . A . 7 THR HG23 . . . . . . . . . c19759_2mk7 1 . 7 . 1134 . 1 1 7 THR N N 5.798 -9.930 8.041 . . . 1.0 . . . . . . . . . . . . A . 7 THR N . . . . . . . . . c19759_2mk7 1 . 7 . 1135 . 1 1 7 THR O O 6.189 -7.245 9.003 . . . 1.0 . . . . . . . . . . . . A . 7 THR O . . . . . . . . . c19759_2mk7 1 . 7 . 1136 . 1 1 7 THR OG1 O 4.896 -7.606 6.598 . . . 1.0 . . . . . . . . . . . . A . 7 THR OG1 . . . . . . . . . c19759_2mk7 1 . 7 . 1137 . 1 1 8 LYS C C 8.704 -5.182 8.767 . . . 1.0 . . . . . . . . . . . . A . 8 LYS C . . . . . . . . . c19759_2mk7 1 . 7 . 1138 . 1 1 8 LYS CA C 8.832 -6.555 9.417 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CA . . . . . . . . . c19759_2mk7 1 . 7 . 1139 . 1 1 8 LYS CB C 10.293 -6.813 9.788 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CB . . . . . . . . . c19759_2mk7 1 . 7 . 1140 . 1 1 8 LYS CD C 12.082 -5.942 11.300 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CD . . . . . . . . . c19759_2mk7 1 . 7 . 1141 . 1 1 8 LYS CE C 12.907 -4.694 11.619 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CE . . . . . . . . . c19759_2mk7 1 . 7 . 1142 . 1 1 8 LYS CG C 10.886 -5.555 10.426 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CG . . . . . . . . . c19759_2mk7 1 . 7 . 1143 . 1 1 8 LYS H H 9.005 -8.114 7.991 . . . 1.0 . . . . . . . . . . . . A . 8 LYS H . . . . . . . . . c19759_2mk7 1 . 7 . 1144 . 1 1 8 LYS HA H 8.235 -6.574 10.316 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HA . . . . . . . . . c19759_2mk7 1 . 7 . 1145 . 1 1 8 LYS HB2 H 10.347 -7.634 10.488 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HB2 . . . . . . . . . c19759_2mk7 1 . 7 . 1146 . 1 1 8 LYS HB3 H 10.852 -7.060 8.898 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HB3 . . . . . . . . . c19759_2mk7 1 . 7 . 1147 . 1 1 8 LYS HD2 H 11.727 -6.385 12.219 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HD2 . . . . . . . . . c19759_2mk7 1 . 7 . 1148 . 1 1 8 LYS HD3 H 12.699 -6.653 10.772 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HD3 . . . . . . . . . c19759_2mk7 1 . 7 . 1149 . 1 1 8 LYS HE2 H 13.634 -4.928 12.382 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HE2 . . . . . . . . . c19759_2mk7 1 . 7 . 1150 . 1 1 8 LYS HE3 H 13.414 -4.360 10.726 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HE3 . . . . . . . . . c19759_2mk7 1 . 7 . 1151 . 1 1 8 LYS HG2 H 11.211 -4.876 9.651 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HG2 . . . . . . . . . c19759_2mk7 1 . 7 . 1152 . 1 1 8 LYS HG3 H 10.138 -5.074 11.037 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HG3 . . . . . . . . . c19759_2mk7 1 . 7 . 1153 . 1 1 8 LYS HZ1 H 12.442 -3.138 12.923 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ1 . . . . . . . . . c19759_2mk7 1 . 7 . 1154 . 1 1 8 LYS HZ2 H 11.093 -4.028 12.397 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ2 . . . . . . . . . c19759_2mk7 1 . 7 . 1155 . 1 1 8 LYS HZ3 H 11.845 -2.922 11.350 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ3 . . . . . . . . . c19759_2mk7 1 . 7 . 1156 . 1 1 8 LYS N N 8.356 -7.597 8.512 . . . 1.0 . . . . . . . . . . . . A . 8 LYS N . . . . . . . . . c19759_2mk7 1 . 7 . 1157 . 1 1 8 LYS NZ N 12.003 -3.614 12.110 . . . 1.0 . . . . . . . . . . . . A . 8 LYS NZ . . . . . . . . . c19759_2mk7 1 . 7 . 1158 . 1 1 8 LYS O O 9.311 -4.915 7.729 . . . 1.0 . . . . . . . . . . . . A . 8 LYS O . . . . . . . . . c19759_2mk7 1 . 7 . 1159 . 1 1 9 LYS C C 6.839 -2.145 9.800 . . . 1.0 . . . . . . . . . . . . A . 9 LYS C . . . . . . . . . c19759_2mk7 1 . 7 . 1160 . 1 1 9 LYS CA C 7.708 -2.968 8.855 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CA . . . . . . . . . c19759_2mk7 1 . 7 . 1161 . 1 1 9 LYS CB C 7.042 -3.042 7.479 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CB . . . . . . . . . c19759_2mk7 1 . 7 . 1162 . 1 1 9 LYS CD C 6.444 -1.565 5.554 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CD . . . . . . . . . c19759_2mk7 1 . 7 . 1163 . 1 1 9 LYS CE C 6.949 -0.454 4.632 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CE . . . . . . . . . c19759_2mk7 1 . 7 . 1164 . 1 1 9 LYS CG C 7.494 -1.855 6.628 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CG . . . . . . . . . c19759_2mk7 1 . 7 . 1165 . 1 1 9 LYS H H 7.451 -4.580 10.207 . . . 1.0 . . . . . . . . . . . . A . 9 LYS H . . . . . . . . . c19759_2mk7 1 . 7 . 1166 . 1 1 9 LYS HA H 8.668 -2.485 8.751 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HA . . . . . . . . . c19759_2mk7 1 . 7 . 1167 . 1 1 9 LYS HB2 H 7.323 -3.964 6.992 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HB2 . . . . . . . . . c19759_2mk7 1 . 7 . 1168 . 1 1 9 LYS HB3 H 5.969 -3.009 7.598 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HB3 . . . . . . . . . c19759_2mk7 1 . 7 . 1169 . 1 1 9 LYS HD2 H 6.265 -2.460 4.977 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HD2 . . . . . . . . . c19759_2mk7 1 . 7 . 1170 . 1 1 9 LYS HD3 H 5.525 -1.250 6.025 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HD3 . . . . . . . . . c19759_2mk7 1 . 7 . 1171 . 1 1 9 LYS HE2 H 6.917 0.490 5.155 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HE2 . . . . . . . . . c19759_2mk7 1 . 7 . 1172 . 1 1 9 LYS HE3 H 7.964 -0.667 4.334 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HE3 . . . . . . . . . c19759_2mk7 1 . 7 . 1173 . 1 1 9 LYS HG2 H 7.615 -0.985 7.258 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HG2 . . . . . . . . . c19759_2mk7 1 . 7 . 1174 . 1 1 9 LYS HG3 H 8.436 -2.089 6.153 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HG3 . . . . . . . . . c19759_2mk7 1 . 7 . 1175 . 1 1 9 LYS HZ1 H 5.322 -1.086 3.496 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HZ1 . . . . . . . . . c19759_2mk7 1 . 7 . 1176 . 1 1 9 LYS HZ2 H 6.653 -0.574 2.575 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HZ2 . . . . . . . . . c19759_2mk7 1 . 7 . 1177 . 1 1 9 LYS HZ3 H 5.664 0.569 3.351 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HZ3 . . . . . . . . . c19759_2mk7 1 . 7 . 1178 . 1 1 9 LYS N N 7.909 -4.313 9.384 . . . 1.0 . . . . . . . . . . . . A . 9 LYS N . . . . . . . . . c19759_2mk7 1 . 7 . 1179 . 1 1 9 LYS NZ N 6.081 -0.381 3.422 . . . 1.0 . . . . . . . . . . . . A . 9 LYS NZ . . . . . . . . . c19759_2mk7 1 . 7 . 1180 . 1 1 9 LYS O O 5.897 -1.477 9.373 . . . 1.0 . . . . . . . . . . . . A . 9 LYS O . . . . . . . . . c19759_2mk7 1 . 7 . 1181 . 1 1 10 PRO C C 6.086 -0.003 11.675 . . . 1.0 . . . . . . . . . . . . A . 10 PRO C . . . . . . . . . c19759_2mk7 1 . 7 . 1182 . 1 1 10 PRO CA C 6.382 -1.438 12.107 . . . 1.0 . . . . . . . . . . . . A . 10 PRO CA . . . . . . . . . c19759_2mk7 1 . 7 . 1183 . 1 1 10 PRO CB C 7.300 -1.456 13.341 . . . 1.0 . . . . . . . . . . . . A . 10 PRO CB . . . . . . . . . c19759_2mk7 1 . 7 . 1184 . 1 1 10 PRO CD C 8.240 -2.951 11.655 . . . 1.0 . . . . . . . . . . . . A . 10 PRO CD . . . . . . . . . c19759_2mk7 1 . 7 . 1185 . 1 1 10 PRO CG C 8.539 -2.209 12.955 . . . 1.0 . . . . . . . . . . . . A . 10 PRO CG . . . . . . . . . c19759_2mk7 1 . 7 . 1186 . 1 1 10 PRO HA H 5.464 -1.951 12.337 . . . 1.0 . . . . . . . . . . . . A . 10 PRO HA . . . . . . . . . c19759_2mk7 1 . 7 . 1187 . 1 1 10 PRO HB2 H 7.553 -0.445 13.626 . . . 1.0 . . . . . . . . . . . . A . 10 PRO HB2 . . . . . . . . . c19759_2mk7 1 . 7 . 1188 . 1 1 10 PRO HB3 H 6.807 -1.959 14.159 . . . 1.0 . . . . . . . . . . . . A . 10 PRO HB3 . . . . . . . . . c19759_2mk7 1 . 7 . 1189 . 1 1 10 PRO HD2 H 9.103 -2.941 11.004 . . . 1.0 . . . . . . . . . . . . A . 10 PRO HD2 . . . . . . . . . c19759_2mk7 1 . 7 . 1190 . 1 1 10 PRO HD3 H 7.924 -3.963 11.858 . . . 1.0 . . . . . . . . . . . . A . 10 PRO HD3 . . . . . . . . . c19759_2mk7 1 . 7 . 1191 . 1 1 10 PRO HG2 H 9.356 -1.516 12.806 . . . 1.0 . . . . . . . . . . . . A . 10 PRO HG2 . . . . . . . . . c19759_2mk7 1 . 7 . 1192 . 1 1 10 PRO HG3 H 8.794 -2.918 13.726 . . . 1.0 . . . . . . . . . . . . A . 10 PRO HG3 . . . . . . . . . c19759_2mk7 1 . 7 . 1193 . 1 1 10 PRO N N 7.141 -2.186 11.069 . . . 1.0 . . . . . . . . . . . . A . 10 PRO N . . . . . . . . . c19759_2mk7 1 . 7 . 1194 . 1 1 10 PRO O O 6.586 0.453 10.647 . . . 1.0 . . . . . . . . . . . . A . 10 PRO O . . . . . . . . . c19759_2mk7 1 . 7 . 1195 . 1 1 11 NH2 HN1 H 4.456 1.075 12.029 . . . 1.0 . . . . . . . . . . . . A . 11 NH2 HN1 . . . . . . . . . c19759_2mk7 1 . 7 . 1196 . 1 1 11 NH2 HN2 H 5.549 0.964 13.324 . . . 1.0 . . . . . . . . . . . . A . 11 NH2 HN2 . . . . . . . . . c19759_2mk7 1 . 7 . 1197 . 1 1 11 NH2 N N 5.297 0.738 12.404 . . . 1.0 . . . . . . . . . . . . A . 11 NH2 N . . . . . . . . . c19759_2mk7 1 . 7 . 1198 . 2 2 1 A2G C1 C 1.639 -16.110 10.746 . . . 1.0 . . . . . . . . . . . . A . 101 A2G C1 . . . . . . . . . c19759_2mk7 1 . 7 . 1199 . 2 2 1 A2G C2 C 2.082 -16.218 12.206 . . . 1.0 . . . . . . . . . . . . A . 101 A2G C2 . . . . . . . . . c19759_2mk7 1 . 7 . 1200 . 2 2 1 A2G C3 C 0.973 -16.888 13.019 . . . 1.0 . . . . . . . . . . . . A . 101 A2G C3 . . . . . . . . . c19759_2mk7 1 . 7 . 1201 . 2 2 1 A2G C4 C -0.343 -16.134 12.813 . . . 1.0 . . . . . . . . . . . . A . 101 A2G C4 . . . . . . . . . c19759_2mk7 1 . 7 . 1202 . 2 2 1 A2G C5 C -0.633 -15.994 11.315 . . . 1.0 . . . . . . . . . . . . A . 101 A2G C5 . . . . . . . . . c19759_2mk7 1 . 7 . 1203 . 2 2 1 A2G C6 C -1.889 -15.145 11.110 . . . 1.0 . . . . . . . . . . . . A . 101 A2G C6 . . . . . . . . . c19759_2mk7 1 . 7 . 1204 . 2 2 1 A2G C7 C 4.424 -16.458 12.799 . . . 1.0 . . . . . . . . . . . . A . 101 A2G C7 . . . . . . . . . c19759_2mk7 1 . 7 . 1205 . 2 2 1 A2G C8 C 5.630 -17.386 12.898 . . . 1.0 . . . . . . . . . . . . A . 101 A2G C8 . . . . . . . . . c19759_2mk7 1 . 7 . 1206 . 2 2 1 A2G H1 H 2.413 -15.619 10.175 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H1 . . . . . . . . . c19759_2mk7 1 . 7 . 1207 . 2 2 1 A2G H14 H -2.614 -15.708 10.540 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H14 . . . . . . . . . c19759_2mk7 1 . 7 . 1208 . 2 2 1 A2G H15 H -3.377 -14.629 12.250 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H15 . . . . . . . . . c19759_2mk7 1 . 7 . 1209 . 2 2 1 A2G H2 H 2.256 -15.225 12.597 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H2 . . . . . . . . . c19759_2mk7 1 . 7 . 1210 . 2 2 1 A2G H3 H 0.857 -17.912 12.695 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H3 . . . . . . . . . c19759_2mk7 1 . 7 . 1211 . 2 2 1 A2G H4 H -1.148 -16.678 13.284 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H4 . . . . . . . . . c19759_2mk7 1 . 7 . 1212 . 2 2 1 A2G H5 H -0.779 -16.971 10.879 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H5 . . . . . . . . . c19759_2mk7 1 . 7 . 1213 . 2 2 1 A2G H6 H -1.631 -14.244 10.574 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H6 . . . . . . . . . c19759_2mk7 1 . 7 . 1214 . 2 2 1 A2G H8 H 5.726 -17.745 13.912 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H8 . . . . . . . . . c19759_2mk7 1 . 7 . 1215 . 2 2 1 A2G H8A H 6.523 -16.846 12.621 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H8A . . . . . . . . . c19759_2mk7 1 . 7 . 1216 . 2 2 1 A2G H8B H 5.495 -18.225 12.230 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H8B . . . . . . . . . c19759_2mk7 1 . 7 . 1217 . 2 2 1 A2G HN2 H 3.322 -17.923 11.993 . . . 1.0 . . . . . . . . . . . . A . 101 A2G HN2 . . . . . . . . . c19759_2mk7 1 . 7 . 1218 . 2 2 1 A2G HO3 H 1.639 -17.739 14.636 . . . 1.0 . . . . . . . . . . . . A . 101 A2G HO3 . . . . . . . . . c19759_2mk7 1 . 7 . 1219 . 2 2 1 A2G HO4 H -0.512 -14.198 12.737 . . . 1.0 . . . . . . . . . . . . A . 101 A2G HO4 . . . . . . . . . c19759_2mk7 1 . 7 . 1220 . 2 2 1 A2G N2 N 3.313 -16.992 12.302 . . . 1.0 . . . . . . . . . . . . A . 101 A2G N2 . . . . . . . . . c19759_2mk7 1 . 7 . 1221 . 2 2 1 A2G O O 0.457 -15.344 10.701 . . . 1.0 . . . . . . . . . . . . A . 101 A2G O . . . . . . . . . c19759_2mk7 1 . 7 . 1222 . 2 2 1 A2G O3 O 1.318 -16.866 14.397 . . . 1.0 . . . . . . . . . . . . A . 101 A2G O3 . . . . . . . . . c19759_2mk7 1 . 7 . 1223 . 2 2 1 A2G O4 O -0.244 -14.843 13.396 . . . 1.0 . . . . . . . . . . . . A . 101 A2G O4 . . . . . . . . . c19759_2mk7 1 . 7 . 1224 . 2 2 1 A2G O6 O -2.441 -14.805 12.373 . . . 1.0 . . . . . . . . . . . . A . 101 A2G O6 . . . . . . . . . c19759_2mk7 1 . 7 . 1225 . 2 2 1 A2G O7 O 4.486 -15.298 13.205 . . . 1.0 . . . . . . . . . . . . A . 101 A2G O7 . . . . . . . . . c19759_2mk7 1 . 8 . 1226 . 1 1 1 ACE C C 0.617 -23.785 4.598 . . . 1.0 . . . . . . . . . . . . A . 1 ACE C . . . . . . . . . c19759_2mk7 1 . 8 . 1227 . 1 1 1 ACE CH3 C 1.028 -24.572 3.358 . . . 1.0 . . . . . . . . . . . . A . 1 ACE CH3 . . . . . . . . . c19759_2mk7 1 . 8 . 1228 . 1 1 1 ACE H1 H 0.298 -25.344 3.164 . . . 1.0 . . . . . . . . . . . . A . 1 ACE H1 . . . . . . . . . c19759_2mk7 1 . 8 . 1229 . 1 1 1 ACE H2 H 1.995 -25.024 3.522 . . . 1.0 . . . . . . . . . . . . A . 1 ACE H2 . . . . . . . . . c19759_2mk7 1 . 8 . 1230 . 1 1 1 ACE H3 H 1.082 -23.906 2.510 . . . 1.0 . . . . . . . . . . . . A . 1 ACE H3 . . . . . . . . . c19759_2mk7 1 . 8 . 1231 . 1 1 1 ACE O O 0.644 -22.556 4.602 . . . 1.0 . . . . . . . . . . . . A . 1 ACE O . . . . . . . . . c19759_2mk7 1 . 8 . 1232 . 1 1 2 PRO C C 0.750 -22.721 7.353 . . . 1.0 . . . . . . . . . . . . A . 2 PRO C . . . . . . . . . c19759_2mk7 1 . 8 . 1233 . 1 1 2 PRO CA C -0.187 -23.848 6.921 . . . 1.0 . . . . . . . . . . . . A . 2 PRO CA . . . . . . . . . c19759_2mk7 1 . 8 . 1234 . 1 1 2 PRO CB C -0.152 -24.998 7.941 . . . 1.0 . . . . . . . . . . . . A . 2 PRO CB . . . . . . . . . c19759_2mk7 1 . 8 . 1235 . 1 1 2 PRO CD C 0.183 -25.934 5.711 . . . 1.0 . . . . . . . . . . . . A . 2 PRO CD . . . . . . . . . c19759_2mk7 1 . 8 . 1236 . 1 1 2 PRO CG C 0.300 -26.224 7.204 . . . 1.0 . . . . . . . . . . . . A . 2 PRO CG . . . . . . . . . c19759_2mk7 1 . 8 . 1237 . 1 1 2 PRO HA H -1.195 -23.479 6.833 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HA . . . . . . . . . c19759_2mk7 1 . 8 . 1238 . 1 1 2 PRO HB2 H 0.541 -24.764 8.736 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HB2 . . . . . . . . . c19759_2mk7 1 . 8 . 1239 . 1 1 2 PRO HB3 H -1.139 -25.160 8.348 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HB3 . . . . . . . . . c19759_2mk7 1 . 8 . 1240 . 1 1 2 PRO HD2 H 1.010 -26.378 5.172 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HD2 . . . . . . . . . c19759_2mk7 1 . 8 . 1241 . 1 1 2 PRO HD3 H -0.760 -26.289 5.327 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HD3 . . . . . . . . . c19759_2mk7 1 . 8 . 1242 . 1 1 2 PRO HG2 H 1.328 -26.444 7.460 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HG2 . . . . . . . . . c19759_2mk7 1 . 8 . 1243 . 1 1 2 PRO HG3 H -0.330 -27.061 7.461 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HG3 . . . . . . . . . c19759_2mk7 1 . 8 . 1244 . 1 1 2 PRO N N 0.242 -24.475 5.641 . . . 1.0 . . . . . . . . . . . . A . 2 PRO N . . . . . . . . . c19759_2mk7 1 . 8 . 1245 . 1 1 2 PRO O O 0.310 -21.603 7.623 . . . 1.0 . . . . . . . . . . . . A . 2 PRO O . . . . . . . . . c19759_2mk7 1 . 8 . 1246 . 1 1 3 PRO C C 2.831 -20.634 7.227 . . . 1.0 . . . . . . . . . . . . A . 3 PRO C . . . . . . . . . c19759_2mk7 1 . 8 . 1247 . 1 1 3 PRO CA C 3.053 -22.016 7.844 . . . 1.0 . . . . . . . . . . . . A . 3 PRO CA . . . . . . . . . c19759_2mk7 1 . 8 . 1248 . 1 1 3 PRO CB C 4.381 -22.630 7.370 . . . 1.0 . . . . . . . . . . . . A . 3 PRO CB . . . . . . . . . c19759_2mk7 1 . 8 . 1249 . 1 1 3 PRO CD C 2.619 -24.299 7.113 . . . 1.0 . . . . . . . . . . . . A . 3 PRO CD . . . . . . . . . c19759_2mk7 1 . 8 . 1250 . 1 1 3 PRO CG C 4.046 -23.937 6.710 . . . 1.0 . . . . . . . . . . . . A . 3 PRO CG . . . . . . . . . c19759_2mk7 1 . 8 . 1251 . 1 1 3 PRO HA H 3.066 -21.936 8.919 . . . 1.0 . . . . . . . . . . . . A . 3 PRO HA . . . . . . . . . c19759_2mk7 1 . 8 . 1252 . 1 1 3 PRO HB2 H 4.860 -21.968 6.662 . . . 1.0 . . . . . . . . . . . . A . 3 PRO HB2 . . . . . . . . . c19759_2mk7 1 . 8 . 1253 . 1 1 3 PRO HB3 H 5.031 -22.802 8.214 . . . 1.0 . . . . . . . . . . . . A . 3 PRO HB3 . . . . . . . . . c19759_2mk7 1 . 8 . 1254 . 1 1 3 PRO HD2 H 2.102 -24.774 6.290 . . . 1.0 . . . . . . . . . . . . A . 3 PRO HD2 . . . . . . . . . c19759_2mk7 1 . 8 . 1255 . 1 1 3 PRO HD3 H 2.617 -24.933 7.986 . . . 1.0 . . . . . . . . . . . . A . 3 PRO HD3 . . . . . . . . . c19759_2mk7 1 . 8 . 1256 . 1 1 3 PRO HG2 H 4.112 -23.834 5.636 . . . 1.0 . . . . . . . . . . . . A . 3 PRO HG2 . . . . . . . . . c19759_2mk7 1 . 8 . 1257 . 1 1 3 PRO HG3 H 4.724 -24.705 7.050 . . . 1.0 . . . . . . . . . . . . A . 3 PRO HG3 . . . . . . . . . c19759_2mk7 1 . 8 . 1258 . 1 1 3 PRO N N 2.020 -23.003 7.426 . . . 1.0 . . . . . . . . . . . . A . 3 PRO N . . . . . . . . . c19759_2mk7 1 . 8 . 1259 . 1 1 3 PRO O O 2.288 -20.513 6.130 . . . 1.0 . . . . . . . . . . . . A . 3 PRO O . . . . . . . . . c19759_2mk7 1 . 8 . 1260 . 1 1 4 THR C C 4.348 -17.404 7.887 . . . 1.0 . . . . . . . . . . . . A . 4 THR C . . . . . . . . . c19759_2mk7 1 . 8 . 1261 . 1 1 4 THR CA C 3.131 -18.229 7.454 . . . 1.0 . . . . . . . . . . . . A . 4 THR CA . . . . . . . . . c19759_2mk7 1 . 8 . 1262 . 1 1 4 THR CB C 1.827 -17.613 7.989 . . . 1.0 . . . . . . . . . . . . A . 4 THR CB . . . . . . . . . c19759_2mk7 1 . 8 . 1263 . 1 1 4 THR CG2 C 0.612 -18.415 7.502 . . . 1.0 . . . . . . . . . . . . A . 4 THR CG2 . . . . . . . . . c19759_2mk7 1 . 8 . 1264 . 1 1 4 THR H H 3.710 -19.761 8.798 . . . 1.0 . . . . . . . . . . . . A . 4 THR H . . . . . . . . . c19759_2mk7 1 . 8 . 1265 . 1 1 4 THR HA H 3.091 -18.248 6.375 . . . 1.0 . . . . . . . . . . . . A . 4 THR HA . . . . . . . . . c19759_2mk7 1 . 8 . 1266 . 1 1 4 THR HB H 1.744 -16.591 7.663 . . . 1.0 . . . . . . . . . . . . A . 4 THR HB . . . . . . . . . c19759_2mk7 1 . 8 . 1267 . 1 1 4 THR HG21 H 0.780 -18.749 6.488 . . . 1.0 . . . . . . . . . . . . A . 4 THR HG21 . . . . . . . . . c19759_2mk7 1 . 8 . 1268 . 1 1 4 THR HG22 H -0.269 -17.793 7.534 . . . 1.0 . . . . . . . . . . . . A . 4 THR HG22 . . . . . . . . . c19759_2mk7 1 . 8 . 1269 . 1 1 4 THR HG23 H 0.470 -19.273 8.142 . . . 1.0 . . . . . . . . . . . . A . 4 THR HG23 . . . . . . . . . c19759_2mk7 1 . 8 . 1270 . 1 1 4 THR N N 3.272 -19.600 7.937 . . . 1.0 . . . . . . . . . . . . A . 4 THR N . . . . . . . . . c19759_2mk7 1 . 8 . 1271 . 1 1 4 THR O O 5.198 -17.882 8.637 . . . 1.0 . . . . . . . . . . . . A . 4 THR O . . . . . . . . . c19759_2mk7 1 . 8 . 1272 . 1 1 4 THR OG1 O 1.855 -17.679 9.398 . . . 1.0 . . . . . . . . . . . . A . 4 THR OG1 . . . . . . . . . c19759_2mk7 1 . 8 . 1273 . 1 1 5 THR C C 5.054 -13.897 8.012 . . . 1.0 . . . . . . . . . . . . A . 5 THR C . . . . . . . . . c19759_2mk7 1 . 8 . 1274 . 1 1 5 THR CA C 5.567 -15.294 7.681 . . . 1.0 . . . . . . . . . . . . A . 5 THR CA . . . . . . . . . c19759_2mk7 1 . 8 . 1275 . 1 1 5 THR CB C 6.541 -15.189 6.500 . . . 1.0 . . . . . . . . . . . . A . 5 THR CB . . . . . . . . . c19759_2mk7 1 . 8 . 1276 . 1 1 5 THR CG2 C 6.988 -16.590 6.081 . . . 1.0 . . . . . . . . . . . . A . 5 THR CG2 . . . . . . . . . c19759_2mk7 1 . 8 . 1277 . 1 1 5 THR H H 3.747 -15.870 6.753 . . . 1.0 . . . . . . . . . . . . A . 5 THR H . . . . . . . . . c19759_2mk7 1 . 8 . 1278 . 1 1 5 THR HA H 6.095 -15.685 8.537 . . . 1.0 . . . . . . . . . . . . A . 5 THR HA . . . . . . . . . c19759_2mk7 1 . 8 . 1279 . 1 1 5 THR HB H 7.404 -14.611 6.790 . . . 1.0 . . . . . . . . . . . . A . 5 THR HB . . . . . . . . . c19759_2mk7 1 . 8 . 1280 . 1 1 5 THR HG21 H 8.035 -16.569 5.817 . . . 1.0 . . . . . . . . . . . . A . 5 THR HG21 . . . . . . . . . c19759_2mk7 1 . 8 . 1281 . 1 1 5 THR HG22 H 6.409 -16.913 5.229 . . . 1.0 . . . . . . . . . . . . A . 5 THR HG22 . . . . . . . . . c19759_2mk7 1 . 8 . 1282 . 1 1 5 THR HG23 H 6.837 -17.278 6.899 . . . 1.0 . . . . . . . . . . . . A . 5 THR HG23 . . . . . . . . . c19759_2mk7 1 . 8 . 1283 . 1 1 5 THR N N 4.440 -16.179 7.372 . . . 1.0 . . . . . . . . . . . . A . 5 THR N . . . . . . . . . c19759_2mk7 1 . 8 . 1284 . 1 1 5 THR O O 4.122 -13.405 7.377 . . . 1.0 . . . . . . . . . . . . A . 5 THR O . . . . . . . . . c19759_2mk7 1 . 8 . 1285 . 1 1 5 THR OG1 O 5.889 -14.579 5.411 . . . 1.0 . . . . . . . . . . . . A . 5 THR OG1 . . . . . . . . . c19759_2mk7 1 . 8 . 1286 . 1 1 6 THR C C 6.244 -10.876 8.885 . . . 1.0 . . . . . . . . . . . . A . 6 THR C . . . . . . . . . c19759_2mk7 1 . 8 . 1287 . 1 1 6 THR CA C 5.252 -11.918 9.394 . . . 1.0 . . . . . . . . . . . . A . 6 THR CA . . . . . . . . . c19759_2mk7 1 . 8 . 1288 . 1 1 6 THR CB C 5.158 -11.833 10.919 . . . 1.0 . . . . . . . . . . . . A . 6 THR CB . . . . . . . . . c19759_2mk7 1 . 8 . 1289 . 1 1 6 THR CG2 C 4.191 -12.896 11.442 . . . 1.0 . . . . . . . . . . . . A . 6 THR CG2 . . . . . . . . . c19759_2mk7 1 . 8 . 1290 . 1 1 6 THR H H 6.407 -13.694 9.473 . . . 1.0 . . . . . . . . . . . . A . 6 THR H . . . . . . . . . c19759_2mk7 1 . 8 . 1291 . 1 1 6 THR HA H 4.280 -11.713 8.974 . . . 1.0 . . . . . . . . . . . . A . 6 THR HA . . . . . . . . . c19759_2mk7 1 . 8 . 1292 . 1 1 6 THR HB H 4.806 -10.855 11.209 . . . 1.0 . . . . . . . . . . . . A . 6 THR HB . . . . . . . . . c19759_2mk7 1 . 8 . 1293 . 1 1 6 THR HG21 H 4.727 -13.817 11.614 . . . 1.0 . . . . . . . . . . . . A . 6 THR HG21 . . . . . . . . . c19759_2mk7 1 . 8 . 1294 . 1 1 6 THR HG22 H 3.412 -13.065 10.712 . . . 1.0 . . . . . . . . . . . . A . 6 THR HG22 . . . . . . . . . c19759_2mk7 1 . 8 . 1295 . 1 1 6 THR HG23 H 3.749 -12.558 12.367 . . . 1.0 . . . . . . . . . . . . A . 6 THR HG23 . . . . . . . . . c19759_2mk7 1 . 8 . 1296 . 1 1 6 THR N N 5.666 -13.260 9.003 . . . 1.0 . . . . . . . . . . . . A . 6 THR N . . . . . . . . . c19759_2mk7 1 . 8 . 1297 . 1 1 6 THR O O 7.455 -11.041 9.021 . . . 1.0 . . . . . . . . . . . . A . 6 THR O . . . . . . . . . c19759_2mk7 1 . 8 . 1298 . 1 1 6 THR OG1 O 6.437 -12.073 11.464 . . . 1.0 . . . . . . . . . . . . A . 6 THR OG1 . . . . . . . . . c19759_2mk7 1 . 8 . 1299 . 1 1 7 THR C C 6.616 -7.565 8.748 . . . 1.0 . . . . . . . . . . . . A . 7 THR C . . . . . . . . . c19759_2mk7 1 . 8 . 1300 . 1 1 7 THR CA C 6.573 -8.741 7.778 . . . 1.0 . . . . . . . . . . . . A . 7 THR CA . . . . . . . . . c19759_2mk7 1 . 8 . 1301 . 1 1 7 THR CB C 6.043 -8.267 6.422 . . . 1.0 . . . . . . . . . . . . A . 7 THR CB . . . . . . . . . c19759_2mk7 1 . 8 . 1302 . 1 1 7 THR CG2 C 5.833 -9.466 5.498 . . . 1.0 . . . . . . . . . . . . A . 7 THR CG2 . . . . . . . . . c19759_2mk7 1 . 8 . 1303 . 1 1 7 THR H H 4.747 -9.723 8.221 . . . 1.0 . . . . . . . . . . . . A . 7 THR H . . . . . . . . . c19759_2mk7 1 . 8 . 1304 . 1 1 7 THR HA H 7.573 -9.126 7.646 . . . 1.0 . . . . . . . . . . . . A . 7 THR HA . . . . . . . . . c19759_2mk7 1 . 8 . 1305 . 1 1 7 THR HB H 6.750 -7.586 5.973 . . . 1.0 . . . . . . . . . . . . A . 7 THR HB . . . . . . . . . c19759_2mk7 1 . 8 . 1306 . 1 1 7 THR HG21 H 6.655 -10.158 5.611 . . . 1.0 . . . . . . . . . . . . A . 7 THR HG21 . . . . . . . . . c19759_2mk7 1 . 8 . 1307 . 1 1 7 THR HG22 H 5.786 -9.127 4.474 . . . 1.0 . . . . . . . . . . . . A . 7 THR HG22 . . . . . . . . . c19759_2mk7 1 . 8 . 1308 . 1 1 7 THR HG23 H 4.908 -9.962 5.756 . . . 1.0 . . . . . . . . . . . . A . 7 THR HG23 . . . . . . . . . c19759_2mk7 1 . 8 . 1309 . 1 1 7 THR N N 5.721 -9.803 8.301 . . . 1.0 . . . . . . . . . . . . A . 7 THR N . . . . . . . . . c19759_2mk7 1 . 8 . 1310 . 1 1 7 THR O O 5.582 -7.127 9.252 . . . 1.0 . . . . . . . . . . . . A . 7 THR O . . . . . . . . . c19759_2mk7 1 . 8 . 1311 . 1 1 7 THR OG1 O 4.804 -7.622 6.623 . . . 1.0 . . . . . . . . . . . . A . 7 THR OG1 . . . . . . . . . c19759_2mk7 1 . 8 . 1312 . 1 1 8 LYS C C 7.667 -4.622 9.213 . . . 1.0 . . . . . . . . . . . . A . 8 LYS C . . . . . . . . . c19759_2mk7 1 . 8 . 1313 . 1 1 8 LYS CA C 7.981 -5.936 9.921 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CA . . . . . . . . . c19759_2mk7 1 . 8 . 1314 . 1 1 8 LYS CB C 9.414 -5.900 10.457 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CB . . . . . . . . . c19759_2mk7 1 . 8 . 1315 . 1 1 8 LYS CD C 9.249 -6.148 12.937 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CD . . . . . . . . . c19759_2mk7 1 . 8 . 1316 . 1 1 8 LYS CE C 9.249 -7.151 14.092 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CE . . . . . . . . . c19759_2mk7 1 . 8 . 1317 . 1 1 8 LYS CG C 9.547 -6.877 11.626 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CG . . . . . . . . . c19759_2mk7 1 . 8 . 1318 . 1 1 8 LYS H H 8.608 -7.451 8.577 . . . 1.0 . . . . . . . . . . . . A . 8 LYS H . . . . . . . . . c19759_2mk7 1 . 8 . 1319 . 1 1 8 LYS HA H 7.302 -6.058 10.751 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HA . . . . . . . . . c19759_2mk7 1 . 8 . 1320 . 1 1 8 LYS HB2 H 10.099 -6.184 9.670 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HB2 . . . . . . . . . c19759_2mk7 1 . 8 . 1321 . 1 1 8 LYS HB3 H 9.647 -4.903 10.796 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HB3 . . . . . . . . . c19759_2mk7 1 . 8 . 1322 . 1 1 8 LYS HD2 H 10.006 -5.397 13.111 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HD2 . . . . . . . . . c19759_2mk7 1 . 8 . 1323 . 1 1 8 LYS HD3 H 8.281 -5.675 12.874 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HD3 . . . . . . . . . c19759_2mk7 1 . 8 . 1324 . 1 1 8 LYS HE2 H 9.643 -8.095 13.748 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HE2 . . . . . . . . . c19759_2mk7 1 . 8 . 1325 . 1 1 8 LYS HE3 H 9.864 -6.775 14.896 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HE3 . . . . . . . . . c19759_2mk7 1 . 8 . 1326 . 1 1 8 LYS HG2 H 8.845 -7.689 11.498 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HG2 . . . . . . . . . c19759_2mk7 1 . 8 . 1327 . 1 1 8 LYS HG3 H 10.552 -7.270 11.656 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HG3 . . . . . . . . . c19759_2mk7 1 . 8 . 1328 . 1 1 8 LYS HZ1 H 7.510 -6.459 15.007 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ1 . . . . . . . . . c19759_2mk7 1 . 8 . 1329 . 1 1 8 LYS HZ2 H 7.841 -8.101 15.297 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ2 . . . . . . . . . c19759_2mk7 1 . 8 . 1330 . 1 1 8 LYS HZ3 H 7.240 -7.606 13.786 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ3 . . . . . . . . . c19759_2mk7 1 . 8 . 1331 . 1 1 8 LYS N N 7.818 -7.061 9.007 . . . 1.0 . . . . . . . . . . . . A . 8 LYS N . . . . . . . . . c19759_2mk7 1 . 8 . 1332 . 1 1 8 LYS NZ N 7.854 -7.343 14.583 . . . 1.0 . . . . . . . . . . . . A . 8 LYS NZ . . . . . . . . . c19759_2mk7 1 . 8 . 1333 . 1 1 8 LYS O O 7.465 -4.592 7.999 . . . 1.0 . . . . . . . . . . . . A . 8 LYS O . . . . . . . . . c19759_2mk7 1 . 8 . 1334 . 1 1 9 LYS C C 8.418 -1.817 8.422 . . . 1.0 . . . . . . . . . . . . A . 9 LYS C . . . . . . . . . c19759_2mk7 1 . 8 . 1335 . 1 1 9 LYS CA C 7.337 -2.225 9.418 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CA . . . . . . . . . c19759_2mk7 1 . 8 . 1336 . 1 1 9 LYS CB C 7.253 -1.184 10.537 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CB . . . . . . . . . c19759_2mk7 1 . 8 . 1337 . 1 1 9 LYS CD C 5.341 -2.446 11.536 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CD . . . . . . . . . c19759_2mk7 1 . 8 . 1338 . 1 1 9 LYS CE C 4.390 -2.256 12.718 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CE . . . . . . . . . c19759_2mk7 1 . 8 . 1339 . 1 1 9 LYS CG C 5.809 -1.079 11.029 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CG . . . . . . . . . c19759_2mk7 1 . 8 . 1340 . 1 1 9 LYS H H 7.797 -3.623 10.943 . . . 1.0 . . . . . . . . . . . . A . 9 LYS H . . . . . . . . . c19759_2mk7 1 . 8 . 1341 . 1 1 9 LYS HA H 6.387 -2.265 8.907 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HA . . . . . . . . . c19759_2mk7 1 . 8 . 1342 . 1 1 9 LYS HB2 H 7.893 -1.482 11.354 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HB2 . . . . . . . . . c19759_2mk7 1 . 8 . 1343 . 1 1 9 LYS HB3 H 7.573 -0.224 10.160 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HB3 . . . . . . . . . c19759_2mk7 1 . 8 . 1344 . 1 1 9 LYS HD2 H 4.830 -2.969 10.740 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HD2 . . . . . . . . . c19759_2mk7 1 . 8 . 1345 . 1 1 9 LYS HD3 H 6.197 -3.023 11.854 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HD3 . . . . . . . . . c19759_2mk7 1 . 8 . 1346 . 1 1 9 LYS HE2 H 3.543 -1.662 12.406 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HE2 . . . . . . . . . c19759_2mk7 1 . 8 . 1347 . 1 1 9 LYS HE3 H 4.046 -3.219 13.062 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HE3 . . . . . . . . . c19759_2mk7 1 . 8 . 1348 . 1 1 9 LYS HG2 H 5.754 -0.359 11.834 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HG2 . . . . . . . . . c19759_2mk7 1 . 8 . 1349 . 1 1 9 LYS HG3 H 5.173 -0.762 10.218 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HG3 . . . . . . . . . c19759_2mk7 1 . 8 . 1350 . 1 1 9 LYS HZ1 H 5.087 -0.532 13.656 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HZ1 . . . . . . . . . c19759_2mk7 1 . 8 . 1351 . 1 1 9 LYS HZ2 H 6.091 -1.888 13.860 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HZ2 . . . . . . . . . c19759_2mk7 1 . 8 . 1352 . 1 1 9 LYS HZ3 H 4.635 -1.768 14.727 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HZ3 . . . . . . . . . c19759_2mk7 1 . 8 . 1353 . 1 1 9 LYS N N 7.628 -3.538 9.981 . . . 1.0 . . . . . . . . . . . . A . 9 LYS N . . . . . . . . . c19759_2mk7 1 . 8 . 1354 . 1 1 9 LYS NZ N 5.105 -1.558 13.823 . . . 1.0 . . . . . . . . . . . . A . 9 LYS NZ . . . . . . . . . c19759_2mk7 1 . 8 . 1355 . 1 1 9 LYS O O 9.556 -2.280 8.500 . . . 1.0 . . . . . . . . . . . . A . 9 LYS O . . . . . . . . . c19759_2mk7 1 . 8 . 1356 . 1 1 10 PRO C C 10.385 -0.117 7.040 . . . 1.0 . . . . . . . . . . . . A . 10 PRO C . . . . . . . . . c19759_2mk7 1 . 8 . 1357 . 1 1 10 PRO CA C 9.023 -0.480 6.453 . . . 1.0 . . . . . . . . . . . . A . 10 PRO CA . . . . . . . . . c19759_2mk7 1 . 8 . 1358 . 1 1 10 PRO CB C 8.338 0.761 5.859 . . . 1.0 . . . . . . . . . . . . A . 10 PRO CB . . . . . . . . . c19759_2mk7 1 . 8 . 1359 . 1 1 10 PRO CD C 6.755 -0.366 7.337 . . . 1.0 . . . . . . . . . . . . A . 10 PRO CD . . . . . . . . . c19759_2mk7 1 . 8 . 1360 . 1 1 10 PRO CG C 7.036 0.933 6.587 . . . 1.0 . . . . . . . . . . . . A . 10 PRO CG . . . . . . . . . c19759_2mk7 1 . 8 . 1361 . 1 1 10 PRO HA H 9.140 -1.226 5.683 . . . 1.0 . . . . . . . . . . . . A . 10 PRO HA . . . . . . . . . c19759_2mk7 1 . 8 . 1362 . 1 1 10 PRO HB2 H 8.962 1.631 6.004 . . . 1.0 . . . . . . . . . . . . A . 10 PRO HB2 . . . . . . . . . c19759_2mk7 1 . 8 . 1363 . 1 1 10 PRO HB3 H 8.150 0.611 4.807 . . . 1.0 . . . . . . . . . . . . A . 10 PRO HB3 . . . . . . . . . c19759_2mk7 1 . 8 . 1364 . 1 1 10 PRO HD2 H 6.309 -0.159 8.301 . . . 1.0 . . . . . . . . . . . . A . 10 PRO HD2 . . . . . . . . . c19759_2mk7 1 . 8 . 1365 . 1 1 10 PRO HD3 H 6.119 -1.013 6.753 . . . 1.0 . . . . . . . . . . . . A . 10 PRO HD3 . . . . . . . . . c19759_2mk7 1 . 8 . 1366 . 1 1 10 PRO HG2 H 7.114 1.754 7.286 . . . 1.0 . . . . . . . . . . . . A . 10 PRO HG2 . . . . . . . . . c19759_2mk7 1 . 8 . 1367 . 1 1 10 PRO HG3 H 6.243 1.124 5.882 . . . 1.0 . . . . . . . . . . . . A . 10 PRO HG3 . . . . . . . . . c19759_2mk7 1 . 8 . 1368 . 1 1 10 PRO N N 8.078 -0.964 7.494 . . . 1.0 . . . . . . . . . . . . A . 10 PRO N . . . . . . . . . c19759_2mk7 1 . 8 . 1369 . 1 1 10 PRO O O 11.402 -0.201 6.351 . . . 1.0 . . . . . . . . . . . . A . 10 PRO O . . . . . . . . . c19759_2mk7 1 . 8 . 1370 . 1 1 11 NH2 HN1 H 11.224 0.829 8.571 . . . 1.0 . . . . . . . . . . . . A . 11 NH2 HN1 . . . . . . . . . c19759_2mk7 1 . 8 . 1371 . 1 1 11 NH2 HN2 H 9.749 0.060 8.913 . . . 1.0 . . . . . . . . . . . . A . 11 NH2 HN2 . . . . . . . . . c19759_2mk7 1 . 8 . 1372 . 1 1 11 NH2 N N 10.465 0.281 8.280 . . . 1.0 . . . . . . . . . . . . A . 11 NH2 N . . . . . . . . . c19759_2mk7 1 . 8 . 1373 . 2 2 1 A2G C1 C 2.053 -16.424 10.012 . . . 1.0 . . . . . . . . . . . . A . 101 A2G C1 . . . . . . . . . c19759_2mk7 1 . 8 . 1374 . 2 2 1 A2G C2 C 2.364 -16.648 11.488 . . . 1.0 . . . . . . . . . . . . A . 101 A2G C2 . . . . . . . . . c19759_2mk7 1 . 8 . 1375 . 2 2 1 A2G C3 C 1.207 -17.425 12.114 . . . 1.0 . . . . . . . . . . . . A . 101 A2G C3 . . . . . . . . . c19759_2mk7 1 . 8 . 1376 . 2 2 1 A2G C4 C -0.107 -16.671 11.864 . . . 1.0 . . . . . . . . . . . . A . 101 A2G C4 . . . . . . . . . c19759_2mk7 1 . 8 . 1377 . 2 2 1 A2G C5 C -0.250 -16.351 10.369 . . . 1.0 . . . . . . . . . . . . A . 101 A2G C5 . . . . . . . . . c19759_2mk7 1 . 8 . 1378 . 2 2 1 A2G C6 C -1.488 -15.482 10.137 . . . 1.0 . . . . . . . . . . . . A . 101 A2G C6 . . . . . . . . . c19759_2mk7 1 . 8 . 1379 . 2 2 1 A2G C7 C 4.624 -16.873 12.346 . . . 1.0 . . . . . . . . . . . . A . 101 A2G C7 . . . . . . . . . c19759_2mk7 1 . 8 . 1380 . 2 2 1 A2G C8 C 5.881 -17.731 12.433 . . . 1.0 . . . . . . . . . . . . A . 101 A2G C8 . . . . . . . . . c19759_2mk7 1 . 8 . 1381 . 2 2 1 A2G H1 H 2.877 -15.907 9.544 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H1 . . . . . . . . . c19759_2mk7 1 . 8 . 1382 . 2 2 1 A2G H14 H -1.960 -15.769 9.208 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H14 . . . . . . . . . c19759_2mk7 1 . 8 . 1383 . 2 2 1 A2G H15 H -2.443 -16.598 11.410 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H15 . . . . . . . . . c19759_2mk7 1 . 8 . 1384 . 2 2 1 A2G H2 H 2.453 -15.690 11.980 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H2 . . . . . . . . . c19759_2mk7 1 . 8 . 1385 . 2 2 1 A2G H3 H 1.150 -18.407 11.669 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H3 . . . . . . . . . c19759_2mk7 1 . 8 . 1386 . 2 2 1 A2G H4 H -0.936 -17.286 12.178 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H4 . . . . . . . . . c19759_2mk7 1 . 8 . 1387 . 2 2 1 A2G H5 H -0.343 -17.270 9.809 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H5 . . . . . . . . . c19759_2mk7 1 . 8 . 1388 . 2 2 1 A2G H6 H -1.194 -14.444 10.084 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H6 . . . . . . . . . c19759_2mk7 1 . 8 . 1389 . 2 2 1 A2G H8 H 5.870 -18.293 13.356 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H8 . . . . . . . . . c19759_2mk7 1 . 8 . 1390 . 2 2 1 A2G H8A H 6.754 -17.094 12.410 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H8A . . . . . . . . . c19759_2mk7 1 . 8 . 1391 . 2 2 1 A2G H8B H 5.910 -18.412 11.596 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H8B . . . . . . . . . c19759_2mk7 1 . 8 . 1392 . 2 2 1 A2G HN2 H 3.706 -18.271 11.246 . . . 1.0 . . . . . . . . . . . . A . 101 A2G HN2 . . . . . . . . . c19759_2mk7 1 . 8 . 1393 . 2 2 1 A2G HO3 H 0.678 -18.024 13.887 . . . 1.0 . . . . . . . . . . . . A . 101 A2G HO3 . . . . . . . . . c19759_2mk7 1 . 8 . 1394 . 2 2 1 A2G HO4 H 0.239 -15.650 13.481 . . . 1.0 . . . . . . . . . . . . A . 101 A2G HO4 . . . . . . . . . c19759_2mk7 1 . 8 . 1395 . 2 2 1 A2G N2 N 3.616 -17.380 11.642 . . . 1.0 . . . . . . . . . . . . A . 101 A2G N2 . . . . . . . . . c19759_2mk7 1 . 8 . 1396 . 2 2 1 A2G O O 0.889 -15.638 9.942 . . . 1.0 . . . . . . . . . . . . A . 101 A2G O . . . . . . . . . c19759_2mk7 1 . 8 . 1397 . 2 2 1 A2G O3 O 1.424 -17.551 13.512 . . . 1.0 . . . . . . . . . . . . A . 101 A2G O3 . . . . . . . . . c19759_2mk7 1 . 8 . 1398 . 2 2 1 A2G O4 O -0.108 -15.461 12.607 . . . 1.0 . . . . . . . . . . . . A . 101 A2G O4 . . . . . . . . . c19759_2mk7 1 . 8 . 1399 . 2 2 1 A2G O6 O -2.403 -15.660 11.206 . . . 1.0 . . . . . . . . . . . . A . 101 A2G O6 . . . . . . . . . c19759_2mk7 1 . 8 . 1400 . 2 2 1 A2G O7 O 4.568 -15.777 12.905 . . . 1.0 . . . . . . . . . . . . A . 101 A2G O7 . . . . . . . . . c19759_2mk7 1 . 9 . 1401 . 1 1 1 ACE C C 1.386 -23.986 4.634 . . . 1.0 . . . . . . . . . . . . A . 1 ACE C . . . . . . . . . c19759_2mk7 1 . 9 . 1402 . 1 1 1 ACE CH3 C 2.024 -24.685 3.439 . . . 1.0 . . . . . . . . . . . . A . 1 ACE CH3 . . . . . . . . . c19759_2mk7 1 . 9 . 1403 . 1 1 1 ACE H1 H 2.078 -23.999 2.606 . . . 1.0 . . . . . . . . . . . . A . 1 ACE H1 . . . . . . . . . c19759_2mk7 1 . 9 . 1404 . 1 1 1 ACE H2 H 1.427 -25.541 3.162 . . . 1.0 . . . . . . . . . . . . A . 1 ACE H2 . . . . . . . . . c19759_2mk7 1 . 9 . 1405 . 1 1 1 ACE H3 H 3.019 -25.011 3.700 . . . 1.0 . . . . . . . . . . . . A . 1 ACE H3 . . . . . . . . . c19759_2mk7 1 . 9 . 1406 . 1 1 1 ACE O O 1.242 -22.763 4.649 . . . 1.0 . . . . . . . . . . . . A . 1 ACE O . . . . . . . . . c19759_2mk7 1 . 9 . 1407 . 1 1 2 PRO C C 1.107 -22.976 7.396 . . . 1.0 . . . . . . . . . . . . A . 2 PRO C . . . . . . . . . c19759_2mk7 1 . 9 . 1408 . 1 1 2 PRO CA C 0.369 -24.201 6.860 . . . 1.0 . . . . . . . . . . . . A . 2 PRO CA . . . . . . . . . c19759_2mk7 1 . 9 . 1409 . 1 1 2 PRO CB C 0.434 -25.357 7.869 . . . 1.0 . . . . . . . . . . . . A . 2 PRO CB . . . . . . . . . c19759_2mk7 1 . 9 . 1410 . 1 1 2 PRO CD C 1.143 -26.196 5.684 . . . 1.0 . . . . . . . . . . . . A . 2 PRO CD . . . . . . . . . c19759_2mk7 1 . 9 . 1411 . 1 1 2 PRO CG C 1.108 -26.507 7.180 . . . 1.0 . . . . . . . . . . . . A . 2 PRO CG . . . . . . . . . c19759_2mk7 1 . 9 . 1412 . 1 1 2 PRO HA H -0.662 -23.955 6.665 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HA . . . . . . . . . c19759_2mk7 1 . 9 . 1413 . 1 1 2 PRO HB2 H 1.007 -25.058 8.736 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HB2 . . . . . . . . . c19759_2mk7 1 . 9 . 1414 . 1 1 2 PRO HB3 H -0.562 -25.644 8.166 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HB3 . . . . . . . . . c19759_2mk7 1 . 9 . 1415 . 1 1 2 PRO HD2 H 2.085 -26.510 5.254 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HD2 . . . . . . . . . c19759_2mk7 1 . 9 . 1416 . 1 1 2 PRO HD3 H 0.315 -26.669 5.179 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HD3 . . . . . . . . . c19759_2mk7 1 . 9 . 1417 . 1 1 2 PRO HG2 H 2.115 -26.619 7.557 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HG2 . . . . . . . . . c19759_2mk7 1 . 9 . 1418 . 1 1 2 PRO HG3 H 0.550 -27.414 7.347 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HG3 . . . . . . . . . c19759_2mk7 1 . 9 . 1419 . 1 1 2 PRO N N 1.007 -24.742 5.628 . . . 1.0 . . . . . . . . . . . . A . 2 PRO N . . . . . . . . . c19759_2mk7 1 . 9 . 1420 . 1 1 2 PRO O O 0.506 -21.924 7.615 . . . 1.0 . . . . . . . . . . . . A . 2 PRO O . . . . . . . . . c19759_2mk7 1 . 9 . 1421 . 1 1 3 PRO C C 2.904 -20.657 7.498 . . . 1.0 . . . . . . . . . . . . A . 3 PRO C . . . . . . . . . c19759_2mk7 1 . 9 . 1422 . 1 1 3 PRO CA C 3.233 -21.999 8.145 . . . 1.0 . . . . . . . . . . . . A . 3 PRO CA . . . . . . . . . c19759_2mk7 1 . 9 . 1423 . 1 1 3 PRO CB C 4.672 -22.431 7.820 . . . 1.0 . . . . . . . . . . . . A . 3 PRO CB . . . . . . . . . c19759_2mk7 1 . 9 . 1424 . 1 1 3 PRO CD C 3.179 -24.305 7.367 . . . 1.0 . . . . . . . . . . . . A . 3 PRO CD . . . . . . . . . c19759_2mk7 1 . 9 . 1425 . 1 1 3 PRO CG C 4.581 -23.755 7.120 . . . 1.0 . . . . . . . . . . . . A . 3 PRO CG . . . . . . . . . c19759_2mk7 1 . 9 . 1426 . 1 1 3 PRO HA H 3.114 -21.930 9.214 . . . 1.0 . . . . . . . . . . . . A . 3 PRO HA . . . . . . . . . c19759_2mk7 1 . 9 . 1427 . 1 1 3 PRO HB2 H 5.139 -21.700 7.176 . . . 1.0 . . . . . . . . . . . . A . 3 PRO HB2 . . . . . . . . . c19759_2mk7 1 . 9 . 1428 . 1 1 3 PRO HB3 H 5.241 -22.538 8.732 . . . 1.0 . . . . . . . . . . . . A . 3 PRO HB3 . . . . . . . . . c19759_2mk7 1 . 9 . 1429 . 1 1 3 PRO HD2 H 2.818 -24.832 6.495 . . . 1.0 . . . . . . . . . . . . A . 3 PRO HD2 . . . . . . . . . c19759_2mk7 1 . 9 . 1430 . 1 1 3 PRO HD3 H 3.166 -24.944 8.235 . . . 1.0 . . . . . . . . . . . . A . 3 PRO HD3 . . . . . . . . . c19759_2mk7 1 . 9 . 1431 . 1 1 3 PRO HG2 H 4.747 -23.621 6.059 . . . 1.0 . . . . . . . . . . . . A . 3 PRO HG2 . . . . . . . . . c19759_2mk7 1 . 9 . 1432 . 1 1 3 PRO HG3 H 5.312 -24.437 7.525 . . . 1.0 . . . . . . . . . . . . A . 3 PRO HG3 . . . . . . . . . c19759_2mk7 1 . 9 . 1433 . 1 1 3 PRO N N 2.388 -23.101 7.611 . . . 1.0 . . . . . . . . . . . . A . 3 PRO N . . . . . . . . . c19759_2mk7 1 . 9 . 1434 . 1 1 3 PRO O O 2.373 -20.603 6.388 . . . 1.0 . . . . . . . . . . . . A . 3 PRO O . . . . . . . . . c19759_2mk7 1 . 9 . 1435 . 1 1 4 THR C C 4.080 -17.279 8.109 . . . 1.0 . . . . . . . . . . . . A . 4 THR C . . . . . . . . . c19759_2mk7 1 . 9 . 1436 . 1 1 4 THR CA C 2.965 -18.234 7.690 . . . 1.0 . . . . . . . . . . . . A . 4 THR CA . . . . . . . . . c19759_2mk7 1 . 9 . 1437 . 1 1 4 THR CB C 1.627 -17.721 8.231 . . . 1.0 . . . . . . . . . . . . A . 4 THR CB . . . . . . . . . c19759_2mk7 1 . 9 . 1438 . 1 1 4 THR CG2 C 0.503 -18.675 7.826 . . . 1.0 . . . . . . . . . . . . A . 4 THR CG2 . . . . . . . . . c19759_2mk7 1 . 9 . 1439 . 1 1 4 THR H H 3.651 -19.681 9.077 . . . 1.0 . . . . . . . . . . . . A . 4 THR H . . . . . . . . . c19759_2mk7 1 . 9 . 1440 . 1 1 4 THR HA H 2.917 -18.270 6.612 . . . 1.0 . . . . . . . . . . . . A . 4 THR HA . . . . . . . . . c19759_2mk7 1 . 9 . 1441 . 1 1 4 THR HB H 1.427 -16.742 7.831 . . . 1.0 . . . . . . . . . . . . A . 4 THR HB . . . . . . . . . c19759_2mk7 1 . 9 . 1442 . 1 1 4 THR HG21 H 0.457 -19.494 8.528 . . . 1.0 . . . . . . . . . . . . A . 4 THR HG21 . . . . . . . . . c19759_2mk7 1 . 9 . 1443 . 1 1 4 THR HG22 H 0.697 -19.059 6.837 . . . 1.0 . . . . . . . . . . . . A . 4 THR HG22 . . . . . . . . . c19759_2mk7 1 . 9 . 1444 . 1 1 4 THR HG23 H -0.438 -18.145 7.829 . . . 1.0 . . . . . . . . . . . . A . 4 THR HG23 . . . . . . . . . c19759_2mk7 1 . 9 . 1445 . 1 1 4 THR N N 3.226 -19.576 8.200 . . . 1.0 . . . . . . . . . . . . A . 4 THR N . . . . . . . . . c19759_2mk7 1 . 9 . 1446 . 1 1 4 THR O O 4.563 -17.333 9.239 . . . 1.0 . . . . . . . . . . . . A . 4 THR O . . . . . . . . . c19759_2mk7 1 . 9 . 1447 . 1 1 4 THR OG1 O 1.693 -17.671 9.639 . . . 1.0 . . . . . . . . . . . . A . 4 THR OG1 . . . . . . . . . c19759_2mk7 1 . 9 . 1448 . 1 1 5 THR C C 4.982 -14.049 7.677 . . . 1.0 . . . . . . . . . . . . A . 5 THR C . . . . . . . . . c19759_2mk7 1 . 9 . 1449 . 1 1 5 THR CA C 5.552 -15.451 7.479 . . . 1.0 . . . . . . . . . . . . A . 5 THR CA . . . . . . . . . c19759_2mk7 1 . 9 . 1450 . 1 1 5 THR CB C 6.567 -15.433 6.333 . . . 1.0 . . . . . . . . . . . . A . 5 THR CB . . . . . . . . . c19759_2mk7 1 . 9 . 1451 . 1 1 5 THR CG2 C 7.137 -16.836 6.122 . . . 1.0 . . . . . . . . . . . . A . 5 THR CG2 . . . . . . . . . c19759_2mk7 1 . 9 . 1452 . 1 1 5 THR H H 4.073 -16.413 6.302 . . . 1.0 . . . . . . . . . . . . A . 5 THR H . . . . . . . . . c19759_2mk7 1 . 9 . 1453 . 1 1 5 THR HA H 6.057 -15.754 8.384 . . . 1.0 . . . . . . . . . . . . A . 5 THR HA . . . . . . . . . c19759_2mk7 1 . 9 . 1454 . 1 1 5 THR HB H 7.369 -14.750 6.565 . . . 1.0 . . . . . . . . . . . . A . 5 THR HB . . . . . . . . . c19759_2mk7 1 . 9 . 1455 . 1 1 5 THR HG21 H 7.117 -17.376 7.057 . . . 1.0 . . . . . . . . . . . . A . 5 THR HG21 . . . . . . . . . c19759_2mk7 1 . 9 . 1456 . 1 1 5 THR HG22 H 8.155 -16.763 5.770 . . . 1.0 . . . . . . . . . . . . A . 5 THR HG22 . . . . . . . . . c19759_2mk7 1 . 9 . 1457 . 1 1 5 THR HG23 H 6.540 -17.361 5.391 . . . 1.0 . . . . . . . . . . . . A . 5 THR HG23 . . . . . . . . . c19759_2mk7 1 . 9 . 1458 . 1 1 5 THR N N 4.489 -16.409 7.190 . . . 1.0 . . . . . . . . . . . . A . 5 THR N . . . . . . . . . c19759_2mk7 1 . 9 . 1459 . 1 1 5 THR O O 4.061 -13.636 6.975 . . . 1.0 . . . . . . . . . . . . A . 5 THR O . . . . . . . . . c19759_2mk7 1 . 9 . 1460 . 1 1 5 THR OG1 O 5.908 -15.030 5.151 . . . 1.0 . . . . . . . . . . . . A . 5 THR OG1 . . . . . . . . . c19759_2mk7 1 . 9 . 1461 . 1 1 6 THR C C 6.089 -10.946 8.370 . . . 1.0 . . . . . . . . . . . . A . 6 THR C . . . . . . . . . c19759_2mk7 1 . 9 . 1462 . 1 1 6 THR CA C 5.093 -11.964 8.925 . . . 1.0 . . . . . . . . . . . . A . 6 THR CA . . . . . . . . . c19759_2mk7 1 . 9 . 1463 . 1 1 6 THR CB C 4.945 -11.772 10.441 . . . 1.0 . . . . . . . . . . . . A . 6 THR CB . . . . . . . . . c19759_2mk7 1 . 9 . 1464 . 1 1 6 THR CG2 C 3.974 -12.811 11.014 . . . 1.0 . . . . . . . . . . . . A . 6 THR CG2 . . . . . . . . . c19759_2mk7 1 . 9 . 1465 . 1 1 6 THR H H 6.280 -13.703 9.163 . . . 1.0 . . . . . . . . . . . . A . 6 THR H . . . . . . . . . c19759_2mk7 1 . 9 . 1466 . 1 1 6 THR HA H 4.132 -11.808 8.457 . . . 1.0 . . . . . . . . . . . . A . 6 THR HA . . . . . . . . . c19759_2mk7 1 . 9 . 1467 . 1 1 6 THR HB H 4.577 -10.780 10.649 . . . 1.0 . . . . . . . . . . . . A . 6 THR HB . . . . . . . . . c19759_2mk7 1 . 9 . 1468 . 1 1 6 THR HG21 H 4.521 -13.695 11.308 . . . 1.0 . . . . . . . . . . . . A . 6 THR HG21 . . . . . . . . . c19759_2mk7 1 . 9 . 1469 . 1 1 6 THR HG22 H 3.243 -13.074 10.265 . . . 1.0 . . . . . . . . . . . . A . 6 THR HG22 . . . . . . . . . c19759_2mk7 1 . 9 . 1470 . 1 1 6 THR HG23 H 3.473 -12.396 11.877 . . . 1.0 . . . . . . . . . . . . A . 6 THR HG23 . . . . . . . . . c19759_2mk7 1 . 9 . 1471 . 1 1 6 THR N N 5.545 -13.321 8.638 . . . 1.0 . . . . . . . . . . . . A . 6 THR N . . . . . . . . . c19759_2mk7 1 . 9 . 1472 . 1 1 6 THR O O 7.291 -11.215 8.298 . . . 1.0 . . . . . . . . . . . . A . 6 THR O . . . . . . . . . c19759_2mk7 1 . 9 . 1473 . 1 1 6 THR OG1 O 6.209 -11.959 11.040 . . . 1.0 . . . . . . . . . . . . A . 6 THR OG1 . . . . . . . . . c19759_2mk7 1 . 9 . 1474 . 1 1 7 THR C C 6.730 -7.676 8.498 . . . 1.0 . . . . . . . . . . . . A . 7 THR C . . . . . . . . . c19759_2mk7 1 . 9 . 1475 . 1 1 7 THR CA C 6.442 -8.731 7.432 . . . 1.0 . . . . . . . . . . . . A . 7 THR CA . . . . . . . . . c19759_2mk7 1 . 9 . 1476 . 1 1 7 THR CB C 5.772 -8.074 6.218 . . . 1.0 . . . . . . . . . . . . A . 7 THR CB . . . . . . . . . c19759_2mk7 1 . 9 . 1477 . 1 1 7 THR CG2 C 5.461 -9.137 5.163 . . . 1.0 . . . . . . . . . . . . A . 7 THR CG2 . . . . . . . . . c19759_2mk7 1 . 9 . 1478 . 1 1 7 THR H H 4.621 -9.616 8.058 . . . 1.0 . . . . . . . . . . . . A . 7 THR H . . . . . . . . . c19759_2mk7 1 . 9 . 1479 . 1 1 7 THR HA H 7.375 -9.173 7.117 . . . 1.0 . . . . . . . . . . . . A . 7 THR HA . . . . . . . . . c19759_2mk7 1 . 9 . 1480 . 1 1 7 THR HB H 6.428 -7.328 5.796 . . . 1.0 . . . . . . . . . . . . A . 7 THR HB . . . . . . . . . c19759_2mk7 1 . 9 . 1481 . 1 1 7 THR HG21 H 5.503 -8.690 4.180 . . . 1.0 . . . . . . . . . . . . A . 7 THR HG21 . . . . . . . . . c19759_2mk7 1 . 9 . 1482 . 1 1 7 THR HG22 H 4.472 -9.538 5.333 . . . 1.0 . . . . . . . . . . . . A . 7 THR HG22 . . . . . . . . . c19759_2mk7 1 . 9 . 1483 . 1 1 7 THR HG23 H 6.188 -9.932 5.227 . . . 1.0 . . . . . . . . . . . . A . 7 THR HG23 . . . . . . . . . c19759_2mk7 1 . 9 . 1484 . 1 1 7 THR N N 5.584 -9.777 7.978 . . . 1.0 . . . . . . . . . . . . A . 7 THR N . . . . . . . . . c19759_2mk7 1 . 9 . 1485 . 1 1 7 THR O O 5.820 -7.196 9.174 . . . 1.0 . . . . . . . . . . . . A . 7 THR O . . . . . . . . . c19759_2mk7 1 . 9 . 1486 . 1 1 7 THR OG1 O 4.554 -7.483 6.631 . . . 1.0 . . . . . . . . . . . . A . 7 THR OG1 . . . . . . . . . c19759_2mk7 1 . 9 . 1487 . 1 1 8 LYS C C 8.189 -4.914 9.117 . . . 1.0 . . . . . . . . . . . . A . 8 LYS C . . . . . . . . . c19759_2mk7 1 . 9 . 1488 . 1 1 8 LYS CA C 8.419 -6.335 9.627 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CA . . . . . . . . . c19759_2mk7 1 . 9 . 1489 . 1 1 8 LYS CB C 9.899 -6.523 9.963 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CB . . . . . . . . . c19759_2mk7 1 . 9 . 1490 . 1 1 8 LYS CD C 11.411 -6.012 11.888 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CD . . . . . . . . . c19759_2mk7 1 . 9 . 1491 . 1 1 8 LYS CE C 10.743 -6.766 13.038 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CE . . . . . . . . . c19759_2mk7 1 . 9 . 1492 . 1 1 8 LYS CG C 10.336 -5.445 10.957 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CG . . . . . . . . . c19759_2mk7 1 . 9 . 1493 . 1 1 8 LYS H H 8.682 -7.753 8.076 . . . 1.0 . . . . . . . . . . . . A . 8 LYS H . . . . . . . . . c19759_2mk7 1 . 9 . 1494 . 1 1 8 LYS HA H 7.841 -6.477 10.528 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HA . . . . . . . . . c19759_2mk7 1 . 9 . 1495 . 1 1 8 LYS HB2 H 10.048 -7.499 10.401 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HB2 . . . . . . . . . c19759_2mk7 1 . 9 . 1496 . 1 1 8 LYS HB3 H 10.487 -6.439 9.062 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HB3 . . . . . . . . . c19759_2mk7 1 . 9 . 1497 . 1 1 8 LYS HD2 H 12.047 -6.687 11.333 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HD2 . . . . . . . . . c19759_2mk7 1 . 9 . 1498 . 1 1 8 LYS HD3 H 12.004 -5.203 12.287 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HD3 . . . . . . . . . c19759_2mk7 1 . 9 . 1499 . 1 1 8 LYS HE2 H 10.596 -6.096 13.871 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HE2 . . . . . . . . . c19759_2mk7 1 . 9 . 1500 . 1 1 8 LYS HE3 H 9.787 -7.149 12.710 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HE3 . . . . . . . . . c19759_2mk7 1 . 9 . 1501 . 1 1 8 LYS HG2 H 10.737 -4.600 10.416 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HG2 . . . . . . . . . c19759_2mk7 1 . 9 . 1502 . 1 1 8 LYS HG3 H 9.486 -5.129 11.542 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HG3 . . . . . . . . . c19759_2mk7 1 . 9 . 1503 . 1 1 8 LYS HZ1 H 11.342 -8.208 14.416 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ1 . . . . . . . . . c19759_2mk7 1 . 9 . 1504 . 1 1 8 LYS HZ2 H 12.606 -7.592 13.463 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ2 . . . . . . . . . c19759_2mk7 1 . 9 . 1505 . 1 1 8 LYS HZ3 H 11.495 -8.693 12.797 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ3 . . . . . . . . . c19759_2mk7 1 . 9 . 1506 . 1 1 8 LYS N N 8.004 -7.329 8.642 . . . 1.0 . . . . . . . . . . . . A . 8 LYS N . . . . . . . . . c19759_2mk7 1 . 9 . 1507 . 1 1 8 LYS NZ N 11.612 -7.900 13.460 . . . 1.0 . . . . . . . . . . . . A . 8 LYS NZ . . . . . . . . . c19759_2mk7 1 . 9 . 1508 . 1 1 8 LYS O O 8.423 -4.622 7.944 . . . 1.0 . . . . . . . . . . . . A . 8 LYS O . . . . . . . . . c19759_2mk7 1 . 9 . 1509 . 1 1 9 LYS C C 8.785 -1.943 9.194 . . . 1.0 . . . . . . . . . . . . A . 9 LYS C . . . . . . . . . c19759_2mk7 1 . 9 . 1510 . 1 1 9 LYS CA C 7.497 -2.639 9.630 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CA . . . . . . . . . c19759_2mk7 1 . 9 . 1511 . 1 1 9 LYS CB C 6.884 -1.883 10.809 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CB . . . . . . . . . c19759_2mk7 1 . 9 . 1512 . 1 1 9 LYS CD C 4.746 -1.292 11.962 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CD . . . . . . . . . c19759_2mk7 1 . 9 . 1513 . 1 1 9 LYS CE C 3.896 -0.111 11.491 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CE . . . . . . . . . c19759_2mk7 1 . 9 . 1514 . 1 1 9 LYS CG C 5.359 -1.993 10.748 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CG . . . . . . . . . c19759_2mk7 1 . 9 . 1515 . 1 1 9 LYS H H 7.586 -4.314 10.930 . . . 1.0 . . . . . . . . . . . . A . 9 LYS H . . . . . . . . . c19759_2mk7 1 . 9 . 1516 . 1 1 9 LYS HA H 6.798 -2.621 8.808 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HA . . . . . . . . . c19759_2mk7 1 . 9 . 1517 . 1 1 9 LYS HB2 H 7.240 -2.311 11.735 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HB2 . . . . . . . . . c19759_2mk7 1 . 9 . 1518 . 1 1 9 LYS HB3 H 7.170 -0.843 10.759 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HB3 . . . . . . . . . c19759_2mk7 1 . 9 . 1519 . 1 1 9 LYS HD2 H 4.125 -1.990 12.505 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HD2 . . . . . . . . . c19759_2mk7 1 . 9 . 1520 . 1 1 9 LYS HD3 H 5.534 -0.932 12.606 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HD3 . . . . . . . . . c19759_2mk7 1 . 9 . 1521 . 1 1 9 LYS HE2 H 3.113 -0.467 10.838 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HE2 . . . . . . . . . c19759_2mk7 1 . 9 . 1522 . 1 1 9 LYS HE3 H 3.454 0.379 12.348 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HE3 . . . . . . . . . c19759_2mk7 1 . 9 . 1523 . 1 1 9 LYS HG2 H 5.001 -1.526 9.842 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HG2 . . . . . . . . . c19759_2mk7 1 . 9 . 1524 . 1 1 9 LYS HG3 H 5.073 -3.035 10.754 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HG3 . . . . . . . . . c19759_2mk7 1 . 9 . 1525 . 1 1 9 LYS HZ1 H 4.862 1.725 11.319 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HZ1 . . . . . . . . . c19759_2mk7 1 . 9 . 1526 . 1 1 9 LYS HZ2 H 4.311 1.090 9.843 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HZ2 . . . . . . . . . c19759_2mk7 1 . 9 . 1527 . 1 1 9 LYS HZ3 H 5.690 0.437 10.589 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HZ3 . . . . . . . . . c19759_2mk7 1 . 9 . 1528 . 1 1 9 LYS N N 7.743 -4.030 10.006 . . . 1.0 . . . . . . . . . . . . A . 9 LYS N . . . . . . . . . c19759_2mk7 1 . 9 . 1529 . 1 1 9 LYS NZ N 4.755 0.859 10.755 . . . 1.0 . . . . . . . . . . . . A . 9 LYS NZ . . . . . . . . . c19759_2mk7 1 . 9 . 1530 . 1 1 9 LYS O O 9.880 -2.343 9.588 . . . 1.0 . . . . . . . . . . . . A . 9 LYS O . . . . . . . . . c19759_2mk7 1 . 9 . 1531 . 1 1 10 PRO C C 10.881 0.093 8.969 . . . 1.0 . . . . . . . . . . . . A . 10 PRO C . . . . . . . . . c19759_2mk7 1 . 9 . 1532 . 1 1 10 PRO CA C 9.845 -0.161 7.878 . . . 1.0 . . . . . . . . . . . . A . 10 PRO CA . . . . . . . . . c19759_2mk7 1 . 9 . 1533 . 1 1 10 PRO CB C 9.245 1.161 7.372 . . . 1.0 . . . . . . . . . . . . A . 10 PRO CB . . . . . . . . . c19759_2mk7 1 . 9 . 1534 . 1 1 10 PRO CD C 7.422 -0.376 7.874 . . . 1.0 . . . . . . . . . . . . A . 10 PRO CD . . . . . . . . . c19759_2mk7 1 . 9 . 1535 . 1 1 10 PRO CG C 7.768 1.089 7.623 . . . 1.0 . . . . . . . . . . . . A . 10 PRO CG . . . . . . . . . c19759_2mk7 1 . 9 . 1536 . 1 1 10 PRO HA H 10.298 -0.687 7.053 . . . 1.0 . . . . . . . . . . . . A . 10 PRO HA . . . . . . . . . c19759_2mk7 1 . 9 . 1537 . 1 1 10 PRO HB2 H 9.675 1.992 7.913 . . . 1.0 . . . . . . . . . . . . A . 10 PRO HB2 . . . . . . . . . c19759_2mk7 1 . 9 . 1538 . 1 1 10 PRO HB3 H 9.432 1.271 6.315 . . . 1.0 . . . . . . . . . . . . A . 10 PRO HB3 . . . . . . . . . c19759_2mk7 1 . 9 . 1539 . 1 1 10 PRO HD2 H 6.634 -0.459 8.608 . . . 1.0 . . . . . . . . . . . . A . 10 PRO HD2 . . . . . . . . . c19759_2mk7 1 . 9 . 1540 . 1 1 10 PRO HD3 H 7.146 -0.868 6.955 . . . 1.0 . . . . . . . . . . . . A . 10 PRO HD3 . . . . . . . . . c19759_2mk7 1 . 9 . 1541 . 1 1 10 PRO HG2 H 7.516 1.683 8.490 . . . 1.0 . . . . . . . . . . . . A . 10 PRO HG2 . . . . . . . . . c19759_2mk7 1 . 9 . 1542 . 1 1 10 PRO HG3 H 7.228 1.446 6.760 . . . 1.0 . . . . . . . . . . . . A . 10 PRO HG3 . . . . . . . . . c19759_2mk7 1 . 9 . 1543 . 1 1 10 PRO N N 8.673 -0.924 8.388 . . . 1.0 . . . . . . . . . . . . A . 10 PRO N . . . . . . . . . c19759_2mk7 1 . 9 . 1544 . 1 1 10 PRO O O 12.079 0.146 8.689 . . . 1.0 . . . . . . . . . . . . A . 10 PRO O . . . . . . . . . c19759_2mk7 1 . 9 . 1545 . 1 1 11 NH2 HN1 H 10.134 -0.466 10.720 . . . 1.0 . . . . . . . . . . . . A . 11 NH2 HN1 . . . . . . . . . c19759_2mk7 1 . 9 . 1546 . 1 1 11 NH2 HN2 H 10.571 1.169 10.609 . . . 1.0 . . . . . . . . . . . . A . 11 NH2 HN2 . . . . . . . . . c19759_2mk7 1 . 9 . 1547 . 1 1 11 NH2 N N 10.487 0.284 10.198 . . . 1.0 . . . . . . . . . . . . A . 11 NH2 N . . . . . . . . . c19759_2mk7 1 . 9 . 1548 . 2 2 1 A2G C1 C 1.521 -16.367 10.155 . . . 1.0 . . . . . . . . . . . . A . 101 A2G C1 . . . . . . . . . c19759_2mk7 1 . 9 . 1549 . 2 2 1 A2G C2 C 1.796 -16.404 11.664 . . . 1.0 . . . . . . . . . . . . A . 101 A2G C2 . . . . . . . . . c19759_2mk7 1 . 9 . 1550 . 2 2 1 A2G C3 C 0.743 -17.271 12.354 . . . 1.0 . . . . . . . . . . . . A . 101 A2G C3 . . . . . . . . . c19759_2mk7 1 . 9 . 1551 . 2 2 1 A2G C4 C -0.647 -16.748 12.003 . . . 1.0 . . . . . . . . . . . . A . 101 A2G C4 . . . . . . . . . c19759_2mk7 1 . 9 . 1552 . 2 2 1 A2G C5 C -0.796 -16.709 10.485 . . . 1.0 . . . . . . . . . . . . A . 101 A2G C5 . . . . . . . . . c19759_2mk7 1 . 9 . 1553 . 2 2 1 A2G C6 C -2.161 -16.125 10.115 . . . 1.0 . . . . . . . . . . . . A . 101 A2G C6 . . . . . . . . . c19759_2mk7 1 . 9 . 1554 . 2 2 1 A2G C7 C 4.032 -16.241 12.597 . . . 1.0 . . . . . . . . . . . . A . 101 A2G C7 . . . . . . . . . c19759_2mk7 1 . 9 . 1555 . 2 2 1 A2G C8 C 5.343 -16.958 12.904 . . . 1.0 . . . . . . . . . . . . A . 101 A2G C8 . . . . . . . . . c19759_2mk7 1 . 9 . 1556 . 2 2 1 A2G H1 H 2.231 -15.702 9.688 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H1 . . . . . . . . . c19759_2mk7 1 . 9 . 1557 . 2 2 1 A2G H14 H -2.483 -16.533 9.169 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H14 . . . . . . . . . c19759_2mk7 1 . 9 . 1558 . 2 2 1 A2G H15 H -3.673 -17.151 10.777 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H15 . . . . . . . . . c19759_2mk7 1 . 9 . 1559 . 2 2 1 A2G H2 H 1.739 -15.401 12.058 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H2 . . . . . . . . . c19759_2mk7 1 . 9 . 1560 . 2 2 1 A2G H3 H 0.841 -18.293 12.017 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H3 . . . . . . . . . c19759_2mk7 1 . 9 . 1561 . 2 2 1 A2G H4 H -1.397 -17.404 12.423 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H4 . . . . . . . . . c19759_2mk7 1 . 9 . 1562 . 2 2 1 A2G H5 H -0.708 -17.708 10.087 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H5 . . . . . . . . . c19759_2mk7 1 . 9 . 1563 . 2 2 1 A2G H6 H -2.082 -15.050 10.035 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H6 . . . . . . . . . c19759_2mk7 1 . 9 . 1564 . 2 2 1 A2G H8 H 5.226 -17.554 13.795 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H8 . . . . . . . . . c19759_2mk7 1 . 9 . 1565 . 2 2 1 A2G H8A H 6.125 -16.228 13.058 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H8A . . . . . . . . . c19759_2mk7 1 . 9 . 1566 . 2 2 1 A2G H8B H 5.607 -17.596 12.074 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H8B . . . . . . . . . c19759_2mk7 1 . 9 . 1567 . 2 2 1 A2G HN2 H 3.349 -17.846 11.613 . . . 1.0 . . . . . . . . . . . . A . 101 A2G HN2 . . . . . . . . . c19759_2mk7 1 . 9 . 1568 . 2 2 1 A2G HO3 H 0.678 -18.069 14.126 . . . 1.0 . . . . . . . . . . . . A . 101 A2G HO3 . . . . . . . . . c19759_2mk7 1 . 9 . 1569 . 2 2 1 A2G HO4 H -1.326 -14.929 11.903 . . . 1.0 . . . . . . . . . . . . A . 101 A2G HO4 . . . . . . . . . c19759_2mk7 1 . 9 . 1570 . 2 2 1 A2G N2 N 3.128 -16.941 11.918 . . . 1.0 . . . . . . . . . . . . A . 101 A2G N2 . . . . . . . . . c19759_2mk7 1 . 9 . 1571 . 2 2 1 A2G O O 0.211 -15.875 9.948 . . . 1.0 . . . . . . . . . . . . A . 101 A2G O . . . . . . . . . c19759_2mk7 1 . 9 . 1572 . 2 2 1 A2G O3 O 0.929 -17.217 13.761 . . . 1.0 . . . . . . . . . . . . A . 101 A2G O3 . . . . . . . . . c19759_2mk7 1 . 9 . 1573 . 2 2 1 A2G O4 O -0.810 -15.441 12.532 . . . 1.0 . . . . . . . . . . . . A . 101 A2G O4 . . . . . . . . . c19759_2mk7 1 . 9 . 1574 . 2 2 1 A2G O6 O -3.107 -16.456 11.120 . . . 1.0 . . . . . . . . . . . . A . 101 A2G O6 . . . . . . . . . c19759_2mk7 1 . 9 . 1575 . 2 2 1 A2G O7 O 3.809 -15.118 13.046 . . . 1.0 . . . . . . . . . . . . A . 101 A2G O7 . . . . . . . . . c19759_2mk7 1 . 10 . 1576 . 1 1 1 ACE C C -0.129 -23.302 4.858 . . . 1.0 . . . . . . . . . . . . A . 1 ACE C . . . . . . . . . c19759_2mk7 1 . 10 . 1577 . 1 1 1 ACE CH3 C 0.240 -24.125 3.628 . . . 1.0 . . . . . . . . . . . . A . 1 ACE CH3 . . . . . . . . . c19759_2mk7 1 . 10 . 1578 . 1 1 1 ACE H1 H 1.169 -24.647 3.809 . . . 1.0 . . . . . . . . . . . . A . 1 ACE H1 . . . . . . . . . c19759_2mk7 1 . 10 . 1579 . 1 1 1 ACE H2 H 0.356 -23.470 2.778 . . . 1.0 . . . . . . . . . . . . A . 1 ACE H2 . . . . . . . . . c19759_2mk7 1 . 10 . 1580 . 1 1 1 ACE H3 H -0.541 -24.842 3.425 . . . 1.0 . . . . . . . . . . . . A . 1 ACE H3 . . . . . . . . . c19759_2mk7 1 . 10 . 1581 . 1 1 1 ACE O O -0.013 -22.076 4.858 . . . 1.0 . . . . . . . . . . . . A . 1 ACE O . . . . . . . . . c19759_2mk7 1 . 10 . 1582 . 1 1 2 PRO C C 0.042 -22.232 7.602 . . . 1.0 . . . . . . . . . . . . A . 2 PRO C . . . . . . . . . c19759_2mk7 1 . 10 . 1583 . 1 1 2 PRO CA C -0.971 -23.288 7.164 . . . 1.0 . . . . . . . . . . . . A . 2 PRO CA . . . . . . . . . c19759_2mk7 1 . 10 . 1584 . 1 1 2 PRO CB C -1.046 -24.428 8.192 . . . 1.0 . . . . . . . . . . . . A . 2 PRO CB . . . . . . . . . c19759_2mk7 1 . 10 . 1585 . 1 1 2 PRO CD C -0.738 -25.406 5.975 . . . 1.0 . . . . . . . . . . . . A . 2 PRO CD . . . . . . . . . c19759_2mk7 1 . 10 . 1586 . 1 1 2 PRO CG C -0.683 -25.694 7.474 . . . 1.0 . . . . . . . . . . . . A . 2 PRO CG . . . . . . . . . c19759_2mk7 1 . 10 . 1587 . 1 1 2 PRO HA H -1.945 -22.841 7.054 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HA . . . . . . . . . c19759_2mk7 1 . 10 . 1588 . 1 1 2 PRO HB2 H -0.347 -24.244 8.996 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HB2 . . . . . . . . . c19759_2mk7 1 . 10 . 1589 . 1 1 2 PRO HB3 H -2.049 -24.504 8.584 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HB3 . . . . . . . . . c19759_2mk7 1 . 10 . 1590 . 1 1 2 PRO HD2 H 0.068 -25.913 5.461 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HD2 . . . . . . . . . c19759_2mk7 1 . 10 . 1591 . 1 1 2 PRO HD3 H -1.694 -25.694 5.566 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HD3 . . . . . . . . . c19759_2mk7 1 . 10 . 1592 . 1 1 2 PRO HG2 H 0.316 -26.000 7.755 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HG2 . . . . . . . . . c19759_2mk7 1 . 10 . 1593 . 1 1 2 PRO HG3 H -1.389 -26.471 7.718 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HG3 . . . . . . . . . c19759_2mk7 1 . 10 . 1594 . 1 1 2 PRO N N -0.570 -23.955 5.897 . . . 1.0 . . . . . . . . . . . . A . 2 PRO N . . . . . . . . . c19759_2mk7 1 . 10 . 1595 . 1 1 2 PRO O O -0.317 -21.079 7.847 . . . 1.0 . . . . . . . . . . . . A . 2 PRO O . . . . . . . . . c19759_2mk7 1 . 10 . 1596 . 1 1 3 PRO C C 2.305 -20.335 7.460 . . . 1.0 . . . . . . . . . . . . A . 3 PRO C . . . . . . . . . c19759_2mk7 1 . 10 . 1597 . 1 1 3 PRO CA C 2.392 -21.701 8.136 . . . 1.0 . . . . . . . . . . . . A . 3 PRO CA . . . . . . . . . c19759_2mk7 1 . 10 . 1598 . 1 1 3 PRO CB C 3.679 -22.434 7.726 . . . 1.0 . . . . . . . . . . . . A . 3 PRO CB . . . . . . . . . c19759_2mk7 1 . 10 . 1599 . 1 1 3 PRO CD C 1.792 -23.956 7.426 . . . 1.0 . . . . . . . . . . . . A . 3 PRO CD . . . . . . . . . c19759_2mk7 1 . 10 . 1600 . 1 1 3 PRO CG C 3.261 -23.723 7.079 . . . 1.0 . . . . . . . . . . . . A . 3 PRO CG . . . . . . . . . c19759_2mk7 1 . 10 . 1601 . 1 1 3 PRO HA H 2.375 -21.583 9.207 . . . 1.0 . . . . . . . . . . . . A . 3 PRO HA . . . . . . . . . c19759_2mk7 1 . 10 . 1602 . 1 1 3 PRO HB2 H 4.238 -21.832 7.023 . . . 1.0 . . . . . . . . . . . . A . 3 PRO HB2 . . . . . . . . . c19759_2mk7 1 . 10 . 1603 . 1 1 3 PRO HB3 H 4.281 -22.640 8.597 . . . 1.0 . . . . . . . . . . . . A . 3 PRO HB3 . . . . . . . . . c19759_2mk7 1 . 10 . 1604 . 1 1 3 PRO HD2 H 1.269 -24.393 6.586 . . . 1.0 . . . . . . . . . . . . A . 3 PRO HD2 . . . . . . . . . c19759_2mk7 1 . 10 . 1605 . 1 1 3 PRO HD3 H 1.700 -24.579 8.301 . . . 1.0 . . . . . . . . . . . . A . 3 PRO HD3 . . . . . . . . . c19759_2mk7 1 . 10 . 1606 . 1 1 3 PRO HG2 H 3.382 -23.652 6.008 . . . 1.0 . . . . . . . . . . . . A . 3 PRO HG2 . . . . . . . . . c19759_2mk7 1 . 10 . 1607 . 1 1 3 PRO HG3 H 3.857 -24.537 7.464 . . . 1.0 . . . . . . . . . . . . A . 3 PRO HG3 . . . . . . . . . c19759_2mk7 1 . 10 . 1608 . 1 1 3 PRO N N 1.291 -22.613 7.707 . . . 1.0 . . . . . . . . . . . . A . 3 PRO N . . . . . . . . . c19759_2mk7 1 . 10 . 1609 . 1 1 3 PRO O O 1.733 -20.202 6.378 . . . 1.0 . . . . . . . . . . . . A . 3 PRO O . . . . . . . . . c19759_2mk7 1 . 10 . 1610 . 1 1 4 THR C C 4.149 -17.242 7.911 . . . 1.0 . . . . . . . . . . . . A . 4 THR C . . . . . . . . . c19759_2mk7 1 . 10 . 1611 . 1 1 4 THR CA C 2.851 -17.971 7.575 . . . 1.0 . . . . . . . . . . . . A . 4 THR CA . . . . . . . . . c19759_2mk7 1 . 10 . 1612 . 1 1 4 THR CB C 1.665 -17.202 8.162 . . . 1.0 . . . . . . . . . . . . A . 4 THR CB . . . . . . . . . c19759_2mk7 1 . 10 . 1613 . 1 1 4 THR CG2 C 0.363 -17.940 7.848 . . . 1.0 . . . . . . . . . . . . A . 4 THR CG2 . . . . . . . . . c19759_2mk7 1 . 10 . 1614 . 1 1 4 THR H H 3.307 -19.493 8.973 . . . 1.0 . . . . . . . . . . . . A . 4 THR H . . . . . . . . . c19759_2mk7 1 . 10 . 1615 . 1 1 4 THR HA H 2.741 -18.018 6.502 . . . 1.0 . . . . . . . . . . . . A . 4 THR HA . . . . . . . . . c19759_2mk7 1 . 10 . 1616 . 1 1 4 THR HB H 1.628 -16.211 7.738 . . . 1.0 . . . . . . . . . . . . A . 4 THR HB . . . . . . . . . c19759_2mk7 1 . 10 . 1617 . 1 1 4 THR HG21 H 0.407 -18.338 6.845 . . . 1.0 . . . . . . . . . . . . A . 4 THR HG21 . . . . . . . . . c19759_2mk7 1 . 10 . 1618 . 1 1 4 THR HG22 H -0.468 -17.254 7.927 . . . 1.0 . . . . . . . . . . . . A . 4 THR HG22 . . . . . . . . . c19759_2mk7 1 . 10 . 1619 . 1 1 4 THR HG23 H 0.229 -18.749 8.551 . . . 1.0 . . . . . . . . . . . . A . 4 THR HG23 . . . . . . . . . c19759_2mk7 1 . 10 . 1620 . 1 1 4 THR N N 2.872 -19.325 8.112 . . . 1.0 . . . . . . . . . . . . A . 4 THR N . . . . . . . . . c19759_2mk7 1 . 10 . 1621 . 1 1 4 THR O O 4.952 -17.721 8.711 . . . 1.0 . . . . . . . . . . . . A . 4 THR O . . . . . . . . . c19759_2mk7 1 . 10 . 1622 . 1 1 4 THR OG1 O 1.822 -17.130 9.563 . . . 1.0 . . . . . . . . . . . . A . 4 THR OG1 . . . . . . . . . c19759_2mk7 1 . 10 . 1623 . 1 1 5 THR C C 5.201 -13.829 7.742 . . . 1.0 . . . . . . . . . . . . A . 5 THR C . . . . . . . . . c19759_2mk7 1 . 10 . 1624 . 1 1 5 THR CA C 5.554 -15.298 7.535 . . . 1.0 . . . . . . . . . . . . A . 5 THR CA . . . . . . . . . c19759_2mk7 1 . 10 . 1625 . 1 1 5 THR CB C 6.516 -15.440 6.353 . . . 1.0 . . . . . . . . . . . . A . 5 THR CB . . . . . . . . . c19759_2mk7 1 . 10 . 1626 . 1 1 5 THR CG2 C 6.747 -16.921 6.047 . . . 1.0 . . . . . . . . . . . . A . 5 THR CG2 . . . . . . . . . c19759_2mk7 1 . 10 . 1627 . 1 1 5 THR H H 3.675 -15.750 6.663 . . . 1.0 . . . . . . . . . . . . A . 5 THR H . . . . . . . . . c19759_2mk7 1 . 10 . 1628 . 1 1 5 THR HA H 6.039 -15.670 8.424 . . . 1.0 . . . . . . . . . . . . A . 5 THR HA . . . . . . . . . c19759_2mk7 1 . 10 . 1629 . 1 1 5 THR HB H 7.459 -14.970 6.587 . . . 1.0 . . . . . . . . . . . . A . 5 THR HB . . . . . . . . . c19759_2mk7 1 . 10 . 1630 . 1 1 5 THR HG21 H 6.625 -17.499 6.951 . . . 1.0 . . . . . . . . . . . . A . 5 THR HG21 . . . . . . . . . c19759_2mk7 1 . 10 . 1631 . 1 1 5 THR HG22 H 7.749 -17.058 5.666 . . . 1.0 . . . . . . . . . . . . A . 5 THR HG22 . . . . . . . . . c19759_2mk7 1 . 10 . 1632 . 1 1 5 THR HG23 H 6.032 -17.252 5.309 . . . 1.0 . . . . . . . . . . . . A . 5 THR HG23 . . . . . . . . . c19759_2mk7 1 . 10 . 1633 . 1 1 5 THR N N 4.348 -16.082 7.293 . . . 1.0 . . . . . . . . . . . . A . 5 THR N . . . . . . . . . c19759_2mk7 1 . 10 . 1634 . 1 1 5 THR O O 4.308 -13.293 7.086 . . . 1.0 . . . . . . . . . . . . A . 5 THR O . . . . . . . . . c19759_2mk7 1 . 10 . 1635 . 1 1 5 THR OG1 O 5.930 -14.828 5.224 . . . 1.0 . . . . . . . . . . . . A . 5 THR OG1 . . . . . . . . . c19759_2mk7 1 . 10 . 1636 . 1 1 6 THR C C 6.763 -10.901 8.348 . . . 1.0 . . . . . . . . . . . . A . 6 THR C . . . . . . . . . c19759_2mk7 1 . 10 . 1637 . 1 1 6 THR CA C 5.673 -11.775 8.959 . . . 1.0 . . . . . . . . . . . . A . 6 THR CA . . . . . . . . . c19759_2mk7 1 . 10 . 1638 . 1 1 6 THR CB C 5.630 -11.560 10.473 . . . 1.0 . . . . . . . . . . . . A . 6 THR CB . . . . . . . . . c19759_2mk7 1 . 10 . 1639 . 1 1 6 THR CG2 C 4.657 -12.553 11.110 . . . 1.0 . . . . . . . . . . . . A . 6 THR CG2 . . . . . . . . . c19759_2mk7 1 . 10 . 1640 . 1 1 6 THR H H 6.609 -13.666 9.155 . . . 1.0 . . . . . . . . . . . . A . 6 THR H . . . . . . . . . c19759_2mk7 1 . 10 . 1641 . 1 1 6 THR HA H 4.720 -11.488 8.541 . . . 1.0 . . . . . . . . . . . . A . 6 THR HA . . . . . . . . . c19759_2mk7 1 . 10 . 1642 . 1 1 6 THR HB H 5.310 -10.552 10.690 . . . 1.0 . . . . . . . . . . . . A . 6 THR HB . . . . . . . . . c19759_2mk7 1 . 10 . 1643 . 1 1 6 THR HG21 H 5.168 -13.483 11.304 . . . 1.0 . . . . . . . . . . . . A . 6 THR HG21 . . . . . . . . . c19759_2mk7 1 . 10 . 1644 . 1 1 6 THR HG22 H 3.830 -12.729 10.437 . . . 1.0 . . . . . . . . . . . . A . 6 THR HG22 . . . . . . . . . c19759_2mk7 1 . 10 . 1645 . 1 1 6 THR HG23 H 4.283 -12.146 12.038 . . . 1.0 . . . . . . . . . . . . A . 6 THR HG23 . . . . . . . . . c19759_2mk7 1 . 10 . 1646 . 1 1 6 THR N N 5.911 -13.184 8.664 . . . 1.0 . . . . . . . . . . . . A . 6 THR N . . . . . . . . . c19759_2mk7 1 . 10 . 1647 . 1 1 6 THR O O 7.751 -11.405 7.813 . . . 1.0 . . . . . . . . . . . . A . 6 THR O . . . . . . . . . c19759_2mk7 1 . 10 . 1648 . 1 1 6 THR OG1 O 6.920 -11.789 10.997 . . . 1.0 . . . . . . . . . . . . A . 6 THR OG1 . . . . . . . . . c19759_2mk7 1 . 10 . 1649 . 1 1 7 THR C C 7.740 -7.469 8.830 . . . 1.0 . . . . . . . . . . . . A . 7 THR C . . . . . . . . . c19759_2mk7 1 . 10 . 1650 . 1 1 7 THR CA C 7.542 -8.647 7.882 . . . 1.0 . . . . . . . . . . . . A . 7 THR CA . . . . . . . . . c19759_2mk7 1 . 10 . 1651 . 1 1 7 THR CB C 7.066 -8.141 6.518 . . . 1.0 . . . . . . . . . . . . A . 7 THR CB . . . . . . . . . c19759_2mk7 1 . 10 . 1652 . 1 1 7 THR CG2 C 7.365 -9.188 5.443 . . . 1.0 . . . . . . . . . . . . A . 7 THR CG2 . . . . . . . . . c19759_2mk7 1 . 10 . 1653 . 1 1 7 THR H H 5.764 -9.247 8.866 . . . 1.0 . . . . . . . . . . . . A . 7 THR H . . . . . . . . . c19759_2mk7 1 . 10 . 1654 . 1 1 7 THR HA H 8.485 -9.154 7.753 . . . 1.0 . . . . . . . . . . . . A . 7 THR HA . . . . . . . . . c19759_2mk7 1 . 10 . 1655 . 1 1 7 THR HB H 7.566 -7.221 6.271 . . . 1.0 . . . . . . . . . . . . A . 7 THR HB . . . . . . . . . c19759_2mk7 1 . 10 . 1656 . 1 1 7 THR HG21 H 6.788 -8.971 4.558 . . . 1.0 . . . . . . . . . . . . A . 7 THR HG21 . . . . . . . . . c19759_2mk7 1 . 10 . 1657 . 1 1 7 THR HG22 H 7.103 -10.169 5.813 . . . 1.0 . . . . . . . . . . . . A . 7 THR HG22 . . . . . . . . . c19759_2mk7 1 . 10 . 1658 . 1 1 7 THR HG23 H 8.418 -9.164 5.201 . . . 1.0 . . . . . . . . . . . . A . 7 THR HG23 . . . . . . . . . c19759_2mk7 1 . 10 . 1659 . 1 1 7 THR N N 6.571 -9.588 8.430 . . . 1.0 . . . . . . . . . . . . A . 7 THR N . . . . . . . . . c19759_2mk7 1 . 10 . 1660 . 1 1 7 THR O O 6.846 -7.120 9.601 . . . 1.0 . . . . . . . . . . . . A . 7 THR O . . . . . . . . . c19759_2mk7 1 . 10 . 1661 . 1 1 7 THR OG1 O 5.672 -7.941 6.580 . . . 1.0 . . . . . . . . . . . . A . 7 THR OG1 . . . . . . . . . c19759_2mk7 1 . 10 . 1662 . 1 1 8 LYS C C 8.631 -4.445 9.042 . . . 1.0 . . . . . . . . . . . . A . 8 LYS C . . . . . . . . . c19759_2mk7 1 . 10 . 1663 . 1 1 8 LYS CA C 9.234 -5.722 9.617 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CA . . . . . . . . . c19759_2mk7 1 . 10 . 1664 . 1 1 8 LYS CB C 10.751 -5.563 9.741 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CB . . . . . . . . . c19759_2mk7 1 . 10 . 1665 . 1 1 8 LYS CD C 11.885 -6.322 11.833 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CD . . . . . . . . . c19759_2mk7 1 . 10 . 1666 . 1 1 8 LYS CE C 13.115 -5.438 11.615 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CE . . . . . . . . . c19759_2mk7 1 . 10 . 1667 . 1 1 8 LYS CG C 11.332 -6.771 10.480 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CG . . . . . . . . . c19759_2mk7 1 . 10 . 1668 . 1 1 8 LYS H H 9.593 -7.184 8.127 . . . 1.0 . . . . . . . . . . . . A . 8 LYS H . . . . . . . . . c19759_2mk7 1 . 10 . 1669 . 1 1 8 LYS HA H 8.820 -5.894 10.599 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HA . . . . . . . . . c19759_2mk7 1 . 10 . 1670 . 1 1 8 LYS HB2 H 11.188 -5.499 8.755 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HB2 . . . . . . . . . c19759_2mk7 1 . 10 . 1671 . 1 1 8 LYS HB3 H 10.975 -4.664 10.293 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HB3 . . . . . . . . . c19759_2mk7 1 . 10 . 1672 . 1 1 8 LYS HD2 H 11.128 -5.763 12.363 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HD2 . . . . . . . . . c19759_2mk7 1 . 10 . 1673 . 1 1 8 LYS HD3 H 12.165 -7.188 12.414 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HD3 . . . . . . . . . c19759_2mk7 1 . 10 . 1674 . 1 1 8 LYS HE2 H 13.994 -5.945 11.988 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HE2 . . . . . . . . . c19759_2mk7 1 . 10 . 1675 . 1 1 8 LYS HE3 H 13.235 -5.242 10.559 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HE3 . . . . . . . . . c19759_2mk7 1 . 10 . 1676 . 1 1 8 LYS HG2 H 10.555 -7.506 10.633 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HG2 . . . . . . . . . c19759_2mk7 1 . 10 . 1677 . 1 1 8 LYS HG3 H 12.128 -7.203 9.894 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HG3 . . . . . . . . . c19759_2mk7 1 . 10 . 1678 . 1 1 8 LYS HZ1 H 12.580 -4.338 13.299 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ1 . . . . . . . . . c19759_2mk7 1 . 10 . 1679 . 1 1 8 LYS HZ2 H 12.262 -3.551 11.828 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ2 . . . . . . . . . c19759_2mk7 1 . 10 . 1680 . 1 1 8 LYS HZ3 H 13.854 -3.660 12.409 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ3 . . . . . . . . . c19759_2mk7 1 . 10 . 1681 . 1 1 8 LYS N N 8.921 -6.862 8.763 . . . 1.0 . . . . . . . . . . . . A . 8 LYS N . . . . . . . . . c19759_2mk7 1 . 10 . 1682 . 1 1 8 LYS NZ N 12.940 -4.150 12.342 . . . 1.0 . . . . . . . . . . . . A . 8 LYS NZ . . . . . . . . . c19759_2mk7 1 . 10 . 1683 . 1 1 8 LYS O O 9.193 -3.838 8.130 . . . 1.0 . . . . . . . . . . . . A . 8 LYS O . . . . . . . . . c19759_2mk7 1 . 10 . 1684 . 1 1 9 LYS C C 5.578 -2.542 9.956 . . . 1.0 . . . . . . . . . . . . A . 9 LYS C . . . . . . . . . c19759_2mk7 1 . 10 . 1685 . 1 1 9 LYS CA C 6.813 -2.836 9.110 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CA . . . . . . . . . c19759_2mk7 1 . 10 . 1686 . 1 1 9 LYS CB C 6.402 -3.003 7.646 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CB . . . . . . . . . c19759_2mk7 1 . 10 . 1687 . 1 1 9 LYS CD C 5.966 -1.798 5.500 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CD . . . . . . . . . c19759_2mk7 1 . 10 . 1688 . 1 1 9 LYS CE C 7.124 -1.474 4.554 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CE . . . . . . . . . c19759_2mk7 1 . 10 . 1689 . 1 1 9 LYS CG C 6.431 -1.641 6.948 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CG . . . . . . . . . c19759_2mk7 1 . 10 . 1690 . 1 1 9 LYS H H 7.082 -4.566 10.304 . . . 1.0 . . . . . . . . . . . . A . 9 LYS H . . . . . . . . . c19759_2mk7 1 . 10 . 1691 . 1 1 9 LYS HA H 7.495 -2.003 9.186 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HA . . . . . . . . . c19759_2mk7 1 . 10 . 1692 . 1 1 9 LYS HB2 H 7.091 -3.675 7.153 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HB2 . . . . . . . . . c19759_2mk7 1 . 10 . 1693 . 1 1 9 LYS HB3 H 5.404 -3.410 7.595 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HB3 . . . . . . . . . c19759_2mk7 1 . 10 . 1694 . 1 1 9 LYS HD2 H 5.639 -2.815 5.335 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HD2 . . . . . . . . . c19759_2mk7 1 . 10 . 1695 . 1 1 9 LYS HD3 H 5.147 -1.121 5.309 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HD3 . . . . . . . . . c19759_2mk7 1 . 10 . 1696 . 1 1 9 LYS HE2 H 6.812 -1.639 3.533 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HE2 . . . . . . . . . c19759_2mk7 1 . 10 . 1697 . 1 1 9 LYS HE3 H 7.412 -0.441 4.679 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HE3 . . . . . . . . . c19759_2mk7 1 . 10 . 1698 . 1 1 9 LYS HG2 H 5.774 -0.958 7.467 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HG2 . . . . . . . . . c19759_2mk7 1 . 10 . 1699 . 1 1 9 LYS HG3 H 7.438 -1.251 6.961 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HG3 . . . . . . . . . c19759_2mk7 1 . 10 . 1700 . 1 1 9 LYS HZ1 H 8.925 -2.389 4.050 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HZ1 . . . . . . . . . c19759_2mk7 1 . 10 . 1701 . 1 1 9 LYS HZ2 H 7.940 -3.316 5.079 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HZ2 . . . . . . . . . c19759_2mk7 1 . 10 . 1702 . 1 1 9 LYS HZ3 H 8.794 -1.979 5.690 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HZ3 . . . . . . . . . c19759_2mk7 1 . 10 . 1703 . 1 1 9 LYS N N 7.484 -4.042 9.580 . . . 1.0 . . . . . . . . . . . . A . 9 LYS N . . . . . . . . . c19759_2mk7 1 . 10 . 1704 . 1 1 9 LYS NZ N 8.284 -2.356 4.867 . . . 1.0 . . . . . . . . . . . . A . 9 LYS NZ . . . . . . . . . c19759_2mk7 1 . 10 . 1705 . 1 1 9 LYS O O 4.504 -2.255 9.429 . . . 1.0 . . . . . . . . . . . . A . 9 LYS O . . . . . . . . . c19759_2mk7 1 . 10 . 1706 . 1 1 10 PRO C C 3.801 -1.113 11.819 . . . 1.0 . . . . . . . . . . . . A . 10 PRO C . . . . . . . . . c19759_2mk7 1 . 10 . 1707 . 1 1 10 PRO CA C 4.604 -2.353 12.203 . . . 1.0 . . . . . . . . . . . . A . 10 PRO CA . . . . . . . . . c19759_2mk7 1 . 10 . 1708 . 1 1 10 PRO CB C 5.298 -2.154 13.561 . . . 1.0 . . . . . . . . . . . . A . 10 PRO CB . . . . . . . . . c19759_2mk7 1 . 10 . 1709 . 1 1 10 PRO CD C 6.957 -2.944 11.952 . . . 1.0 . . . . . . . . . . . . A . 10 PRO CD . . . . . . . . . c19759_2mk7 1 . 10 . 1710 . 1 1 10 PRO CG C 6.773 -2.303 13.326 . . . 1.0 . . . . . . . . . . . . A . 10 PRO CG . . . . . . . . . c19759_2mk7 1 . 10 . 1711 . 1 1 10 PRO HA H 3.956 -3.212 12.255 . . . 1.0 . . . . . . . . . . . . A . 10 PRO HA . . . . . . . . . c19759_2mk7 1 . 10 . 1712 . 1 1 10 PRO HB2 H 5.082 -1.166 13.943 . . . 1.0 . . . . . . . . . . . . A . 10 PRO HB2 . . . . . . . . . c19759_2mk7 1 . 10 . 1713 . 1 1 10 PRO HB3 H 4.961 -2.903 14.261 . . . 1.0 . . . . . . . . . . . . A . 10 PRO HB3 . . . . . . . . . c19759_2mk7 1 . 10 . 1714 . 1 1 10 PRO HD2 H 7.812 -2.516 11.446 . . . 1.0 . . . . . . . . . . . . A . 10 PRO HD2 . . . . . . . . . c19759_2mk7 1 . 10 . 1715 . 1 1 10 PRO HD3 H 7.061 -4.014 12.042 . . . 1.0 . . . . . . . . . . . . A . 10 PRO HD3 . . . . . . . . . c19759_2mk7 1 . 10 . 1716 . 1 1 10 PRO HG2 H 7.248 -1.332 13.348 . . . 1.0 . . . . . . . . . . . . A . 10 PRO HG2 . . . . . . . . . c19759_2mk7 1 . 10 . 1717 . 1 1 10 PRO HG3 H 7.202 -2.941 14.083 . . . 1.0 . . . . . . . . . . . . A . 10 PRO HG3 . . . . . . . . . c19759_2mk7 1 . 10 . 1718 . 1 1 10 PRO N N 5.718 -2.611 11.251 . . . 1.0 . . . . . . . . . . . . A . 10 PRO N . . . . . . . . . c19759_2mk7 1 . 10 . 1719 . 1 1 10 PRO O O 4.333 -0.198 11.189 . . . 1.0 . . . . . . . . . . . . A . 10 PRO O . . . . . . . . . c19759_2mk7 1 . 10 . 1720 . 1 1 11 NH2 HN1 H 1.916 -0.527 11.607 . . . 1.0 . . . . . . . . . . . . A . 11 NH2 HN1 . . . . . . . . . c19759_2mk7 1 . 10 . 1721 . 1 1 11 NH2 HN2 H 2.232 -1.472 12.982 . . . 1.0 . . . . . . . . . . . . A . 11 NH2 HN2 . . . . . . . . . c19759_2mk7 1 . 10 . 1722 . 1 1 11 NH2 N N 2.547 -1.026 12.167 . . . 1.0 . . . . . . . . . . . . A . 11 NH2 N . . . . . . . . . c19759_2mk7 1 . 10 . 1723 . 2 2 1 A2G C1 C 2.152 -15.832 10.012 . . . 1.0 . . . . . . . . . . . . A . 101 A2G C1 . . . . . . . . . c19759_2mk7 1 . 10 . 1724 . 2 2 1 A2G C2 C 2.563 -15.926 11.480 . . . 1.0 . . . . . . . . . . . . A . 101 A2G C2 . . . . . . . . . c19759_2mk7 1 . 10 . 1725 . 2 2 1 A2G C3 C 1.391 -16.496 12.282 . . . 1.0 . . . . . . . . . . . . A . 101 A2G C3 . . . . . . . . . c19759_2mk7 1 . 10 . 1726 . 2 2 1 A2G C4 C 0.139 -15.647 12.038 . . . 1.0 . . . . . . . . . . . . A . 101 A2G C4 . . . . . . . . . c19759_2mk7 1 . 10 . 1727 . 2 2 1 A2G C5 C -0.107 -15.505 10.532 . . . 1.0 . . . . . . . . . . . . A . 101 A2G C5 . . . . . . . . . c19759_2mk7 1 . 10 . 1728 . 2 2 1 A2G C6 C -1.280 -14.553 10.288 . . . 1.0 . . . . . . . . . . . . A . 101 A2G C6 . . . . . . . . . c19759_2mk7 1 . 10 . 1729 . 2 2 1 A2G C7 C 4.826 -16.383 12.276 . . . 1.0 . . . . . . . . . . . . A . 101 A2G C7 . . . . . . . . . c19759_2mk7 1 . 10 . 1730 . 2 2 1 A2G C8 C 5.961 -17.398 12.373 . . . 1.0 . . . . . . . . . . . . A . 101 A2G C8 . . . . . . . . . c19759_2mk7 1 . 10 . 1731 . 2 2 1 A2G H1 H 2.973 -15.440 9.433 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H1 . . . . . . . . . c19759_2mk7 1 . 10 . 1732 . 2 2 1 A2G H14 H -1.759 -14.804 9.354 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H14 . . . . . . . . . c19759_2mk7 1 . 10 . 1733 . 2 2 1 A2G H15 H -1.960 -14.065 12.044 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H15 . . . . . . . . . c19759_2mk7 1 . 10 . 1734 . 2 2 1 A2G H2 H 2.794 -14.938 11.850 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H2 . . . . . . . . . c19759_2mk7 1 . 10 . 1735 . 2 2 1 A2G H3 H 1.202 -17.511 11.968 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H3 . . . . . . . . . c19759_2mk7 1 . 10 . 1736 . 2 2 1 A2G H4 H -0.713 -16.125 12.497 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H4 . . . . . . . . . c19759_2mk7 1 . 10 . 1737 . 2 2 1 A2G H5 H -0.329 -16.473 10.107 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H5 . . . . . . . . . c19759_2mk7 1 . 10 . 1738 . 2 2 1 A2G H6 H -0.916 -13.537 10.246 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H6 . . . . . . . . . c19759_2mk7 1 . 10 . 1739 . 2 2 1 A2G H8 H 5.818 -18.014 13.249 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H8 . . . . . . . . . c19759_2mk7 1 . 10 . 1740 . 2 2 1 A2G H8A H 6.904 -16.877 12.450 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H8A . . . . . . . . . c19759_2mk7 1 . 10 . 1741 . 2 2 1 A2G H8B H 5.964 -18.020 11.490 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H8B . . . . . . . . . c19759_2mk7 1 . 10 . 1742 . 2 2 1 A2G HN2 H 3.684 -17.713 11.313 . . . 1.0 . . . . . . . . . . . . A . 101 A2G HN2 . . . . . . . . . c19759_2mk7 1 . 10 . 1743 . 2 2 1 A2G HO3 H 1.125 -15.853 14.097 . . . 1.0 . . . . . . . . . . . . A . 101 A2G HO3 . . . . . . . . . c19759_2mk7 1 . 10 . 1744 . 2 2 1 A2G HO4 H -0.401 -14.205 13.224 . . . 1.0 . . . . . . . . . . . . A . 101 A2G HO4 . . . . . . . . . c19759_2mk7 1 . 10 . 1745 . 2 2 1 A2G N2 N 3.738 -16.784 11.618 . . . 1.0 . . . . . . . . . . . . A . 101 A2G N2 . . . . . . . . . c19759_2mk7 1 . 10 . 1746 . 2 2 1 A2G O O 1.048 -14.962 9.929 . . . 1.0 . . . . . . . . . . . . A . 101 A2G O . . . . . . . . . c19759_2mk7 1 . 10 . 1747 . 2 2 1 A2G O3 O 1.710 -16.480 13.664 . . . 1.0 . . . . . . . . . . . . A . 101 A2G O3 . . . . . . . . . c19759_2mk7 1 . 10 . 1748 . 2 2 1 A2G O4 O 0.321 -14.361 12.611 . . . 1.0 . . . . . . . . . . . . A . 101 A2G O4 . . . . . . . . . c19759_2mk7 1 . 10 . 1749 . 2 2 1 A2G O6 O -2.216 -14.676 11.349 . . . 1.0 . . . . . . . . . . . . A . 101 A2G O6 . . . . . . . . . c19759_2mk7 1 . 10 . 1750 . 2 2 1 A2G O7 O 4.925 -15.278 12.810 . . . 1.0 . . . . . . . . . . . . A . 101 A2G O7 . . . . . . . . . c19759_2mk7 1 . 11 . 1751 . 1 1 1 ACE C C 0.453 -20.531 11.708 . . . 1.0 . . . . . . . . . . . . A . 1 ACE C . . . . . . . . . c19759_2mk7 1 . 11 . 1752 . 1 1 1 ACE CH3 C -0.133 -19.668 12.821 . . . 1.0 . . . . . . . . . . . . A . 1 ACE CH3 . . . . . . . . . c19759_2mk7 1 . 11 . 1753 . 1 1 1 ACE H1 H -0.981 -20.173 13.258 . . . 1.0 . . . . . . . . . . . . A . 1 ACE H1 . . . . . . . . . c19759_2mk7 1 . 11 . 1754 . 1 1 1 ACE H2 H -0.448 -18.719 12.414 . . . 1.0 . . . . . . . . . . . . A . 1 ACE H2 . . . . . . . . . c19759_2mk7 1 . 11 . 1755 . 1 1 1 ACE H3 H 0.618 -19.503 13.581 . . . 1.0 . . . . . . . . . . . . A . 1 ACE H3 . . . . . . . . . c19759_2mk7 1 . 11 . 1756 . 1 1 1 ACE O O 1.661 -20.761 11.656 . . . 1.0 . . . . . . . . . . . . A . 1 ACE O . . . . . . . . . c19759_2mk7 1 . 11 . 1757 . 1 1 2 PRO C C 1.297 -21.331 9.005 . . . 1.0 . . . . . . . . . . . . A . 2 PRO C . . . . . . . . . c19759_2mk7 1 . 11 . 1758 . 1 1 2 PRO CA C 0.042 -21.867 9.689 . . . 1.0 . . . . . . . . . . . . A . 2 PRO CA . . . . . . . . . c19759_2mk7 1 . 11 . 1759 . 1 1 2 PRO CB C -1.155 -21.848 8.725 . . . 1.0 . . . . . . . . . . . . A . 2 PRO CB . . . . . . . . . c19759_2mk7 1 . 11 . 1760 . 1 1 2 PRO CD C -1.826 -20.774 10.813 . . . 1.0 . . . . . . . . . . . . A . 2 PRO CD . . . . . . . . . c19759_2mk7 1 . 11 . 1761 . 1 1 2 PRO CG C -2.206 -20.975 9.348 . . . 1.0 . . . . . . . . . . . . A . 2 PRO CG . . . . . . . . . c19759_2mk7 1 . 11 . 1762 . 1 1 2 PRO HA H 0.208 -22.875 10.032 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HA . . . . . . . . . c19759_2mk7 1 . 11 . 1763 . 1 1 2 PRO HB2 H -0.853 -21.440 7.770 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HB2 . . . . . . . . . c19759_2mk7 1 . 11 . 1764 . 1 1 2 PRO HB3 H -1.541 -22.848 8.595 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HB3 . . . . . . . . . c19759_2mk7 1 . 11 . 1765 . 1 1 2 PRO HD2 H -2.055 -19.765 11.128 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HD2 . . . . . . . . . c19759_2mk7 1 . 11 . 1766 . 1 1 2 PRO HD3 H -2.326 -21.495 11.440 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HD3 . . . . . . . . . c19759_2mk7 1 . 11 . 1767 . 1 1 2 PRO HG2 H -2.239 -20.023 8.839 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HG2 . . . . . . . . . c19759_2mk7 1 . 11 . 1768 . 1 1 2 PRO HG3 H -3.169 -21.460 9.288 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HG3 . . . . . . . . . c19759_2mk7 1 . 11 . 1769 . 1 1 2 PRO N N -0.383 -21.006 10.825 . . . 1.0 . . . . . . . . . . . . A . 2 PRO N . . . . . . . . . c19759_2mk7 1 . 11 . 1770 . 1 1 2 PRO O O 1.647 -20.161 9.155 . . . 1.0 . . . . . . . . . . . . A . 2 PRO O . . . . . . . . . c19759_2mk7 1 . 11 . 1771 . 1 1 3 PRO C C 3.066 -20.438 6.831 . . . 1.0 . . . . . . . . . . . . A . 3 PRO C . . . . . . . . . c19759_2mk7 1 . 11 . 1772 . 1 1 3 PRO CA C 3.210 -21.784 7.536 . . . 1.0 . . . . . . . . . . . . A . 3 PRO CA . . . . . . . . . c19759_2mk7 1 . 11 . 1773 . 1 1 3 PRO CB C 3.423 -22.916 6.518 . . . 1.0 . . . . . . . . . . . . A . 3 PRO CB . . . . . . . . . c19759_2mk7 1 . 11 . 1774 . 1 1 3 PRO CD C 1.625 -23.569 8.036 . . . 1.0 . . . . . . . . . . . . A . 3 PRO CD . . . . . . . . . c19759_2mk7 1 . 11 . 1775 . 1 1 3 PRO CG C 2.299 -23.892 6.704 . . . 1.0 . . . . . . . . . . . . A . 3 PRO CG . . . . . . . . . c19759_2mk7 1 . 11 . 1776 . 1 1 3 PRO HA H 4.044 -21.757 8.217 . . . 1.0 . . . . . . . . . . . . A . 3 PRO HA . . . . . . . . . c19759_2mk7 1 . 11 . 1777 . 1 1 3 PRO HB2 H 3.404 -22.516 5.513 . . . 1.0 . . . . . . . . . . . . A . 3 PRO HB2 . . . . . . . . . c19759_2mk7 1 . 11 . 1778 . 1 1 3 PRO HB3 H 4.367 -23.406 6.702 . . . 1.0 . . . . . . . . . . . . A . 3 PRO HB3 . . . . . . . . . c19759_2mk7 1 . 11 . 1779 . 1 1 3 PRO HD2 H 0.554 -23.691 7.958 . . . 1.0 . . . . . . . . . . . . A . 3 PRO HD2 . . . . . . . . . c19759_2mk7 1 . 11 . 1780 . 1 1 3 PRO HD3 H 2.026 -24.186 8.826 . . . 1.0 . . . . . . . . . . . . A . 3 PRO HD3 . . . . . . . . . c19759_2mk7 1 . 11 . 1781 . 1 1 3 PRO HG2 H 1.588 -23.792 5.896 . . . 1.0 . . . . . . . . . . . . A . 3 PRO HG2 . . . . . . . . . c19759_2mk7 1 . 11 . 1782 . 1 1 3 PRO HG3 H 2.687 -24.898 6.730 . . . 1.0 . . . . . . . . . . . . A . 3 PRO HG3 . . . . . . . . . c19759_2mk7 1 . 11 . 1783 . 1 1 3 PRO N N 1.971 -22.167 8.263 . . . 1.0 . . . . . . . . . . . . A . 3 PRO N . . . . . . . . . c19759_2mk7 1 . 11 . 1784 . 1 1 3 PRO O O 2.555 -20.362 5.714 . . . 1.0 . . . . . . . . . . . . A . 3 PRO O . . . . . . . . . c19759_2mk7 1 . 11 . 1785 . 1 1 4 THR C C 4.666 -17.212 7.340 . . . 1.0 . . . . . . . . . . . . A . 4 THR C . . . . . . . . . c19759_2mk7 1 . 11 . 1786 . 1 1 4 THR CA C 3.459 -18.042 6.914 . . . 1.0 . . . . . . . . . . . . A . 4 THR CA . . . . . . . . . c19759_2mk7 1 . 11 . 1787 . 1 1 4 THR CB C 2.174 -17.341 7.361 . . . 1.0 . . . . . . . . . . . . A . 4 THR CB . . . . . . . . . c19759_2mk7 1 . 11 . 1788 . 1 1 4 THR CG2 C 0.957 -18.119 6.856 . . . 1.0 . . . . . . . . . . . . A . 4 THR CG2 . . . . . . . . . c19759_2mk7 1 . 11 . 1789 . 1 1 4 THR H H 3.912 -19.501 8.383 . . . 1.0 . . . . . . . . . . . . A . 4 THR H . . . . . . . . . c19759_2mk7 1 . 11 . 1790 . 1 1 4 THR HA H 3.453 -18.125 5.838 . . . 1.0 . . . . . . . . . . . . A . 4 THR HA . . . . . . . . . c19759_2mk7 1 . 11 . 1791 . 1 1 4 THR HB H 2.149 -16.338 6.967 . . . 1.0 . . . . . . . . . . . . A . 4 THR HB . . . . . . . . . c19759_2mk7 1 . 11 . 1792 . 1 1 4 THR HG21 H 0.101 -17.461 6.814 . . . 1.0 . . . . . . . . . . . . A . 4 THR HG21 . . . . . . . . . c19759_2mk7 1 . 11 . 1793 . 1 1 4 THR HG22 H 0.749 -18.938 7.528 . . . 1.0 . . . . . . . . . . . . A . 4 THR HG22 . . . . . . . . . c19759_2mk7 1 . 11 . 1794 . 1 1 4 THR HG23 H 1.162 -18.507 5.869 . . . 1.0 . . . . . . . . . . . . A . 4 THR HG23 . . . . . . . . . c19759_2mk7 1 . 11 . 1795 . 1 1 4 THR N N 3.524 -19.380 7.492 . . . 1.0 . . . . . . . . . . . . A . 4 THR N . . . . . . . . . c19759_2mk7 1 . 11 . 1796 . 1 1 4 THR O O 5.433 -17.615 8.213 . . . 1.0 . . . . . . . . . . . . A . 4 THR O . . . . . . . . . c19759_2mk7 1 . 11 . 1797 . 1 1 4 THR OG1 O 2.142 -17.314 8.772 . . . 1.0 . . . . . . . . . . . . A . 4 THR OG1 . . . . . . . . . c19759_2mk7 1 . 11 . 1798 . 1 1 5 THR C C 5.460 -13.725 7.177 . . . 1.0 . . . . . . . . . . . . A . 5 THR C . . . . . . . . . c19759_2mk7 1 . 11 . 1799 . 1 1 5 THR CA C 5.941 -15.166 7.034 . . . 1.0 . . . . . . . . . . . . A . 5 THR CA . . . . . . . . . c19759_2mk7 1 . 11 . 1800 . 1 1 5 THR CB C 7.010 -15.259 5.941 . . . 1.0 . . . . . . . . . . . . A . 5 THR CB . . . . . . . . . c19759_2mk7 1 . 11 . 1801 . 1 1 5 THR CG2 C 7.381 -16.724 5.703 . . . 1.0 . . . . . . . . . . . . A . 5 THR CG2 . . . . . . . . . c19759_2mk7 1 . 11 . 1802 . 1 1 5 THR H H 4.181 -15.781 6.028 . . . 1.0 . . . . . . . . . . . . A . 5 THR H . . . . . . . . . c19759_2mk7 1 . 11 . 1803 . 1 1 5 THR HA H 6.376 -15.482 7.971 . . . 1.0 . . . . . . . . . . . . A . 5 THR HA . . . . . . . . . c19759_2mk7 1 . 11 . 1804 . 1 1 5 THR HB H 7.885 -14.708 6.236 . . . 1.0 . . . . . . . . . . . . A . 5 THR HB . . . . . . . . . c19759_2mk7 1 . 11 . 1805 . 1 1 5 THR HG21 H 7.189 -17.294 6.600 . . . 1.0 . . . . . . . . . . . . A . 5 THR HG21 . . . . . . . . . c19759_2mk7 1 . 11 . 1806 . 1 1 5 THR HG22 H 8.428 -16.793 5.450 . . . 1.0 . . . . . . . . . . . . A . 5 THR HG22 . . . . . . . . . c19759_2mk7 1 . 11 . 1807 . 1 1 5 THR HG23 H 6.788 -17.119 4.892 . . . 1.0 . . . . . . . . . . . . A . 5 THR HG23 . . . . . . . . . c19759_2mk7 1 . 11 . 1808 . 1 1 5 THR N N 4.825 -16.050 6.715 . . . 1.0 . . . . . . . . . . . . A . 5 THR N . . . . . . . . . c19759_2mk7 1 . 11 . 1809 . 1 1 5 THR O O 4.600 -13.269 6.422 . . . 1.0 . . . . . . . . . . . . A . 5 THR O . . . . . . . . . c19759_2mk7 1 . 11 . 1810 . 1 1 5 THR OG1 O 6.470 -14.729 4.749 . . . 1.0 . . . . . . . . . . . . A . 5 THR OG1 . . . . . . . . . c19759_2mk7 1 . 11 . 1811 . 1 1 6 THR C C 6.740 -10.674 7.860 . . . 1.0 . . . . . . . . . . . . A . 6 THR C . . . . . . . . . c19759_2mk7 1 . 11 . 1812 . 1 1 6 THR CA C 5.662 -11.618 8.382 . . . 1.0 . . . . . . . . . . . . A . 6 THR CA . . . . . . . . . c19759_2mk7 1 . 11 . 1813 . 1 1 6 THR CB C 5.456 -11.381 9.880 . . . 1.0 . . . . . . . . . . . . A . 6 THR CB . . . . . . . . . c19759_2mk7 1 . 11 . 1814 . 1 1 6 THR CG2 C 4.502 -12.434 10.446 . . . 1.0 . . . . . . . . . . . . A . 6 THR CG2 . . . . . . . . . c19759_2mk7 1 . 11 . 1815 . 1 1 6 THR H H 6.713 -13.430 8.710 . . . 1.0 . . . . . . . . . . . . A . 6 THR H . . . . . . . . . c19759_2mk7 1 . 11 . 1816 . 1 1 6 THR HA H 4.736 -11.408 7.868 . . . 1.0 . . . . . . . . . . . . A . 6 THR HA . . . . . . . . . c19759_2mk7 1 . 11 . 1817 . 1 1 6 THR HB H 5.044 -10.398 10.041 . . . 1.0 . . . . . . . . . . . . A . 6 THR HB . . . . . . . . . c19759_2mk7 1 . 11 . 1818 . 1 1 6 THR HG21 H 3.747 -12.667 9.710 . . . 1.0 . . . . . . . . . . . . A . 6 THR HG21 . . . . . . . . . c19759_2mk7 1 . 11 . 1819 . 1 1 6 THR HG22 H 4.029 -12.048 11.337 . . . 1.0 . . . . . . . . . . . . A . 6 THR HG22 . . . . . . . . . c19759_2mk7 1 . 11 . 1820 . 1 1 6 THR HG23 H 5.056 -13.328 10.690 . . . 1.0 . . . . . . . . . . . . A . 6 THR HG23 . . . . . . . . . c19759_2mk7 1 . 11 . 1821 . 1 1 6 THR N N 6.029 -13.012 8.146 . . . 1.0 . . . . . . . . . . . . A . 6 THR N . . . . . . . . . c19759_2mk7 1 . 11 . 1822 . 1 1 6 THR O O 7.889 -11.074 7.669 . . . 1.0 . . . . . . . . . . . . A . 6 THR O . . . . . . . . . c19759_2mk7 1 . 11 . 1823 . 1 1 6 THR OG1 O 6.703 -11.501 10.530 . . . 1.0 . . . . . . . . . . . . A . 6 THR OG1 . . . . . . . . . c19759_2mk7 1 . 11 . 1824 . 1 1 7 THR C C 7.093 -7.087 7.835 . . . 1.0 . . . . . . . . . . . . A . 7 THR C . . . . . . . . . c19759_2mk7 1 . 11 . 1825 . 1 1 7 THR CA C 7.304 -8.424 7.132 . . . 1.0 . . . . . . . . . . . . A . 7 THR CA . . . . . . . . . c19759_2mk7 1 . 11 . 1826 . 1 1 7 THR CB C 7.122 -8.243 5.623 . . . 1.0 . . . . . . . . . . . . A . 7 THR CB . . . . . . . . . c19759_2mk7 1 . 11 . 1827 . 1 1 7 THR CG2 C 7.347 -9.577 4.908 . . . 1.0 . . . . . . . . . . . . A . 7 THR CG2 . . . . . . . . . c19759_2mk7 1 . 11 . 1828 . 1 1 7 THR H H 5.433 -9.160 7.803 . . . 1.0 . . . . . . . . . . . . A . 7 THR H . . . . . . . . . c19759_2mk7 1 . 11 . 1829 . 1 1 7 THR HA H 8.311 -8.766 7.323 . . . 1.0 . . . . . . . . . . . . A . 7 THR HA . . . . . . . . . c19759_2mk7 1 . 11 . 1830 . 1 1 7 THR HB H 7.827 -7.515 5.254 . . . 1.0 . . . . . . . . . . . . A . 7 THR HB . . . . . . . . . c19759_2mk7 1 . 11 . 1831 . 1 1 7 THR HG21 H 8.082 -10.155 5.447 . . . 1.0 . . . . . . . . . . . . A . 7 THR HG21 . . . . . . . . . c19759_2mk7 1 . 11 . 1832 . 1 1 7 THR HG22 H 7.699 -9.392 3.904 . . . 1.0 . . . . . . . . . . . . A . 7 THR HG22 . . . . . . . . . c19759_2mk7 1 . 11 . 1833 . 1 1 7 THR HG23 H 6.417 -10.124 4.866 . . . 1.0 . . . . . . . . . . . . A . 7 THR HG23 . . . . . . . . . c19759_2mk7 1 . 11 . 1834 . 1 1 7 THR N N 6.363 -9.420 7.632 . . . 1.0 . . . . . . . . . . . . A . 7 THR N . . . . . . . . . c19759_2mk7 1 . 11 . 1835 . 1 1 7 THR O O 5.978 -6.755 8.238 . . . 1.0 . . . . . . . . . . . . A . 7 THR O . . . . . . . . . c19759_2mk7 1 . 11 . 1836 . 1 1 7 THR OG1 O 5.801 -7.813 5.376 . . . 1.0 . . . . . . . . . . . . A . 7 THR OG1 . . . . . . . . . c19759_2mk7 1 . 11 . 1837 . 1 1 8 LYS C C 7.299 -5.119 9.929 . . . 1.0 . . . . . . . . . . . . A . 8 LYS C . . . . . . . . . c19759_2mk7 1 . 11 . 1838 . 1 1 8 LYS CA C 8.095 -5.023 8.631 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CA . . . . . . . . . c19759_2mk7 1 . 11 . 1839 . 1 1 8 LYS CB C 7.430 -4.008 7.698 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CB . . . . . . . . . c19759_2mk7 1 . 11 . 1840 . 1 1 8 LYS CD C 9.220 -2.324 7.237 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CD . . . . . . . . . c19759_2mk7 1 . 11 . 1841 . 1 1 8 LYS CE C 8.863 -1.718 5.879 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CE . . . . . . . . . c19759_2mk7 1 . 11 . 1842 . 1 1 8 LYS CG C 7.938 -2.602 8.025 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CG . . . . . . . . . c19759_2mk7 1 . 11 . 1843 . 1 1 8 LYS H H 9.033 -6.639 7.633 . . . 1.0 . . . . . . . . . . . . A . 8 LYS H . . . . . . . . . c19759_2mk7 1 . 11 . 1844 . 1 1 8 LYS HA H 9.096 -4.684 8.857 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HA . . . . . . . . . c19759_2mk7 1 . 11 . 1845 . 1 1 8 LYS HB2 H 7.674 -4.250 6.673 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HB2 . . . . . . . . . c19759_2mk7 1 . 11 . 1846 . 1 1 8 LYS HB3 H 6.360 -4.042 7.832 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HB3 . . . . . . . . . c19759_2mk7 1 . 11 . 1847 . 1 1 8 LYS HD2 H 9.840 -1.633 7.790 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HD2 . . . . . . . . . c19759_2mk7 1 . 11 . 1848 . 1 1 8 LYS HD3 H 9.757 -3.248 7.086 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HD3 . . . . . . . . . c19759_2mk7 1 . 11 . 1849 . 1 1 8 LYS HE2 H 8.104 -2.322 5.404 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HE2 . . . . . . . . . c19759_2mk7 1 . 11 . 1850 . 1 1 8 LYS HE3 H 8.490 -0.715 6.019 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HE3 . . . . . . . . . c19759_2mk7 1 . 11 . 1851 . 1 1 8 LYS HG2 H 7.184 -1.876 7.756 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HG2 . . . . . . . . . c19759_2mk7 1 . 11 . 1852 . 1 1 8 LYS HG3 H 8.145 -2.531 9.082 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HG3 . . . . . . . . . c19759_2mk7 1 . 11 . 1853 . 1 1 8 LYS HZ1 H 10.657 -2.525 5.195 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ1 . . . . . . . . . c19759_2mk7 1 . 11 . 1854 . 1 1 8 LYS HZ2 H 10.633 -0.827 5.239 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ2 . . . . . . . . . c19759_2mk7 1 . 11 . 1855 . 1 1 8 LYS HZ3 H 9.796 -1.659 4.018 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ3 . . . . . . . . . c19759_2mk7 1 . 11 . 1856 . 1 1 8 LYS N N 8.171 -6.323 7.977 . . . 1.0 . . . . . . . . . . . . A . 8 LYS N . . . . . . . . . c19759_2mk7 1 . 11 . 1857 . 1 1 8 LYS NZ N 10.079 -1.679 5.018 . . . 1.0 . . . . . . . . . . . . A . 8 LYS NZ . . . . . . . . . c19759_2mk7 1 . 11 . 1858 . 1 1 8 LYS O O 7.331 -6.142 10.613 . . . 1.0 . . . . . . . . . . . . A . 8 LYS O . . . . . . . . . c19759_2mk7 1 . 11 . 1859 . 1 1 9 LYS C C 6.293 -5.064 12.475 . . . 1.0 . . . . . . . . . . . . A . 9 LYS C . . . . . . . . . c19759_2mk7 1 . 11 . 1860 . 1 1 9 LYS CA C 5.786 -4.024 11.481 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CA . . . . . . . . . c19759_2mk7 1 . 11 . 1861 . 1 1 9 LYS CB C 4.319 -4.305 11.149 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CB . . . . . . . . . c19759_2mk7 1 . 11 . 1862 . 1 1 9 LYS CD C 1.967 -4.100 11.967 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CD . . . . . . . . . c19759_2mk7 1 . 11 . 1863 . 1 1 9 LYS CE C 1.360 -4.855 13.150 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CE . . . . . . . . . c19759_2mk7 1 . 11 . 1864 . 1 1 9 LYS CG C 3.429 -3.765 12.270 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CG . . . . . . . . . c19759_2mk7 1 . 11 . 1865 . 1 1 9 LYS H H 6.596 -3.261 9.677 . . . 1.0 . . . . . . . . . . . . A . 9 LYS H . . . . . . . . . c19759_2mk7 1 . 11 . 1866 . 1 1 9 LYS HA H 5.860 -3.046 11.930 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HA . . . . . . . . . c19759_2mk7 1 . 11 . 1867 . 1 1 9 LYS HB2 H 4.063 -3.819 10.218 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HB2 . . . . . . . . . c19759_2mk7 1 . 11 . 1868 . 1 1 9 LYS HB3 H 4.169 -5.369 11.053 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HB3 . . . . . . . . . c19759_2mk7 1 . 11 . 1869 . 1 1 9 LYS HD2 H 1.416 -3.185 11.801 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HD2 . . . . . . . . . c19759_2mk7 1 . 11 . 1870 . 1 1 9 LYS HD3 H 1.914 -4.717 11.083 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HD3 . . . . . . . . . c19759_2mk7 1 . 11 . 1871 . 1 1 9 LYS HE2 H 0.339 -5.123 12.921 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HE2 . . . . . . . . . c19759_2mk7 1 . 11 . 1872 . 1 1 9 LYS HE3 H 1.934 -5.750 13.338 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HE3 . . . . . . . . . c19759_2mk7 1 . 11 . 1873 . 1 1 9 LYS HG2 H 3.717 -4.220 13.207 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HG2 . . . . . . . . . c19759_2mk7 1 . 11 . 1874 . 1 1 9 LYS HG3 H 3.545 -2.695 12.338 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HG3 . . . . . . . . . c19759_2mk7 1 . 11 . 1875 . 1 1 9 LYS HZ1 H 1.802 -3.065 14.118 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HZ1 . . . . . . . . . c19759_2mk7 1 . 11 . 1876 . 1 1 9 LYS HZ2 H 1.955 -4.442 15.102 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HZ2 . . . . . . . . . c19759_2mk7 1 . 11 . 1877 . 1 1 9 LYS HZ3 H 0.415 -3.843 14.705 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HZ3 . . . . . . . . . c19759_2mk7 1 . 11 . 1878 . 1 1 9 LYS N N 6.586 -4.049 10.262 . . . 1.0 . . . . . . . . . . . . A . 9 LYS N . . . . . . . . . c19759_2mk7 1 . 11 . 1879 . 1 1 9 LYS NZ N 1.385 -3.986 14.360 . . . 1.0 . . . . . . . . . . . . A . 9 LYS NZ . . . . . . . . . c19759_2mk7 1 . 11 . 1880 . 1 1 9 LYS O O 5.567 -5.985 12.852 . . . 1.0 . . . . . . . . . . . . A . 9 LYS O . . . . . . . . . c19759_2mk7 1 . 11 . 1881 . 1 1 10 PRO C C 7.215 -6.201 15.029 . . . 1.0 . . . . . . . . . . . . A . 10 PRO C . . . . . . . . . c19759_2mk7 1 . 11 . 1882 . 1 1 10 PRO CA C 8.149 -5.867 13.869 . . . 1.0 . . . . . . . . . . . . A . 10 PRO CA . . . . . . . . . c19759_2mk7 1 . 11 . 1883 . 1 1 10 PRO CB C 9.396 -5.123 14.369 . . . 1.0 . . . . . . . . . . . . A . 10 PRO CB . . . . . . . . . c19759_2mk7 1 . 11 . 1884 . 1 1 10 PRO CD C 8.441 -3.868 12.505 . . . 1.0 . . . . . . . . . . . . A . 10 PRO CD . . . . . . . . . c19759_2mk7 1 . 11 . 1885 . 1 1 10 PRO CG C 9.425 -3.795 13.670 . . . 1.0 . . . . . . . . . . . . A . 10 PRO CG . . . . . . . . . c19759_2mk7 1 . 11 . 1886 . 1 1 10 PRO HA H 8.449 -6.772 13.365 . . . 1.0 . . . . . . . . . . . . A . 10 PRO HA . . . . . . . . . c19759_2mk7 1 . 11 . 1887 . 1 1 10 PRO HB2 H 9.334 -4.977 15.439 . . . 1.0 . . . . . . . . . . . . A . 10 PRO HB2 . . . . . . . . . c19759_2mk7 1 . 11 . 1888 . 1 1 10 PRO HB3 H 10.284 -5.684 14.124 . . . 1.0 . . . . . . . . . . . . A . 10 PRO HB3 . . . . . . . . . c19759_2mk7 1 . 11 . 1889 . 1 1 10 PRO HD2 H 7.918 -2.927 12.392 . . . 1.0 . . . . . . . . . . . . A . 10 PRO HD2 . . . . . . . . . c19759_2mk7 1 . 11 . 1890 . 1 1 10 PRO HD3 H 8.950 -4.135 11.593 . . . 1.0 . . . . . . . . . . . . A . 10 PRO HD3 . . . . . . . . . c19759_2mk7 1 . 11 . 1891 . 1 1 10 PRO HG2 H 9.129 -3.014 14.357 . . . 1.0 . . . . . . . . . . . . A . 10 PRO HG2 . . . . . . . . . c19759_2mk7 1 . 11 . 1892 . 1 1 10 PRO HG3 H 10.416 -3.599 13.295 . . . 1.0 . . . . . . . . . . . . A . 10 PRO HG3 . . . . . . . . . c19759_2mk7 1 . 11 . 1893 . 1 1 10 PRO N N 7.519 -4.930 12.901 . . . 1.0 . . . . . . . . . . . . A . 10 PRO N . . . . . . . . . c19759_2mk7 1 . 11 . 1894 . 1 1 10 PRO O O 6.767 -7.340 15.159 . . . 1.0 . . . . . . . . . . . . A . 10 PRO O . . . . . . . . . c19759_2mk7 1 . 11 . 1895 . 1 1 11 NH2 HN1 H 7.566 -4.943 16.526 . . . 1.0 . . . . . . . . . . . . A . 11 NH2 HN1 . . . . . . . . . c19759_2mk7 1 . 11 . 1896 . 1 1 11 NH2 HN2 H 5.984 -4.917 15.911 . . . 1.0 . . . . . . . . . . . . A . 11 NH2 HN2 . . . . . . . . . c19759_2mk7 1 . 11 . 1897 . 1 1 11 NH2 N N 6.897 -5.270 15.887 . . . 1.0 . . . . . . . . . . . . A . 11 NH2 N . . . . . . . . . c19759_2mk7 1 . 11 . 1898 . 2 2 1 A2G C1 C 2.208 -16.003 9.286 . . . 1.0 . . . . . . . . . . . . A . 101 A2G C1 . . . . . . . . . c19759_2mk7 1 . 11 . 1899 . 2 2 1 A2G C2 C 2.436 -16.091 10.797 . . . 1.0 . . . . . . . . . . . . A . 101 A2G C2 . . . . . . . . . c19759_2mk7 1 . 11 . 1900 . 2 2 1 A2G C3 C 1.249 -16.811 11.441 . . . 1.0 . . . . . . . . . . . . A . 101 A2G C3 . . . . . . . . . c19759_2mk7 1 . 11 . 1901 . 2 2 1 A2G C4 C -0.051 -16.107 11.045 . . . 1.0 . . . . . . . . . . . . A . 101 A2G C4 . . . . . . . . . c19759_2mk7 1 . 11 . 1902 . 2 2 1 A2G C5 C -0.125 -15.995 9.521 . . . 1.0 . . . . . . . . . . . . A . 101 A2G C5 . . . . . . . . . c19759_2mk7 1 . 11 . 1903 . 2 2 1 A2G C6 C -1.380 -15.214 9.122 . . . 1.0 . . . . . . . . . . . . A . 101 A2G C6 . . . . . . . . . c19759_2mk7 1 . 11 . 1904 . 2 2 1 A2G C7 C 4.664 -16.239 11.748 . . . 1.0 . . . . . . . . . . . . A . 101 A2G C7 . . . . . . . . . c19759_2mk7 1 . 11 . 1905 . 2 2 1 A2G C8 C 5.881 -17.114 12.028 . . . 1.0 . . . . . . . . . . . . A . 101 A2G C8 . . . . . . . . . c19759_2mk7 1 . 11 . 1906 . 2 2 1 A2G H1 H 3.033 -15.474 8.832 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H1 . . . . . . . . . c19759_2mk7 1 . 11 . 1907 . 2 2 1 A2G H14 H -1.754 -15.593 8.181 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H14 . . . . . . . . . c19759_2mk7 1 . 11 . 1908 . 2 2 1 A2G H15 H -2.982 -16.053 9.835 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H15 . . . . . . . . . c19759_2mk7 1 . 11 . 1909 . 2 2 1 A2G H2 H 2.508 -15.094 11.203 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H2 . . . . . . . . . c19759_2mk7 1 . 11 . 1910 . 2 2 1 A2G H3 H 1.221 -17.836 11.102 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H3 . . . . . . . . . c19759_2mk7 1 . 11 . 1911 . 2 2 1 A2G H4 H -0.894 -16.678 11.406 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H4 . . . . . . . . . c19759_2mk7 1 . 11 . 1912 . 2 2 1 A2G H5 H -0.156 -16.982 9.084 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H5 . . . . . . . . . c19759_2mk7 1 . 11 . 1913 . 2 2 1 A2G H6 H -1.134 -14.169 9.017 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H6 . . . . . . . . . c19759_2mk7 1 . 11 . 1914 . 2 2 1 A2G H8 H 5.720 -17.675 12.936 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H8 . . . . . . . . . c19759_2mk7 1 . 11 . 1915 . 2 2 1 A2G H8A H 6.755 -16.490 12.142 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H8A . . . . . . . . . c19759_2mk7 1 . 11 . 1916 . 2 2 1 A2G H8B H 6.031 -17.797 11.205 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H8B . . . . . . . . . c19759_2mk7 1 . 11 . 1917 . 2 2 1 A2G HN2 H 3.771 -17.736 10.765 . . . 1.0 . . . . . . . . . . . . A . 101 A2G HN2 . . . . . . . . . c19759_2mk7 1 . 11 . 1918 . 2 2 1 A2G HO3 H 0.513 -16.846 13.240 . . . 1.0 . . . . . . . . . . . . A . 101 A2G HO3 . . . . . . . . . c19759_2mk7 1 . 11 . 1919 . 2 2 1 A2G HO4 H 0.520 -14.801 12.367 . . . 1.0 . . . . . . . . . . . . A . 101 A2G HO4 . . . . . . . . . c19759_2mk7 1 . 11 . 1920 . 2 2 1 A2G N2 N 3.672 -16.812 11.076 . . . 1.0 . . . . . . . . . . . . A . 101 A2G N2 . . . . . . . . . c19759_2mk7 1 . 11 . 1921 . 2 2 1 A2G O O 1.010 -15.294 9.062 . . . 1.0 . . . . . . . . . . . . A . 101 A2G O . . . . . . . . . c19759_2mk7 1 . 11 . 1922 . 2 2 1 A2G O3 O 1.390 -16.783 12.854 . . . 1.0 . . . . . . . . . . . . A . 101 A2G O3 . . . . . . . . . c19759_2mk7 1 . 11 . 1923 . 2 2 1 A2G O4 O -0.078 -14.807 11.617 . . . 1.0 . . . . . . . . . . . . A . 101 A2G O4 . . . . . . . . . c19759_2mk7 1 . 11 . 1924 . 2 2 1 A2G O6 O -2.372 -15.370 10.124 . . . 1.0 . . . . . . . . . . . . A . 101 A2G O6 . . . . . . . . . c19759_2mk7 1 . 11 . 1925 . 2 2 1 A2G O7 O 4.608 -15.084 12.172 . . . 1.0 . . . . . . . . . . . . A . 101 A2G O7 . . . . . . . . . c19759_2mk7 1 . 12 . 1926 . 1 1 1 ACE C C -1.373 -21.719 7.953 . . . 1.0 . . . . . . . . . . . . A . 1 ACE C . . . . . . . . . c19759_2mk7 1 . 12 . 1927 . 1 1 1 ACE CH3 C -2.364 -22.501 7.099 . . . 1.0 . . . . . . . . . . . . A . 1 ACE CH3 . . . . . . . . . c19759_2mk7 1 . 12 . 1928 . 1 1 1 ACE H1 H -1.882 -23.383 6.702 . . . 1.0 . . . . . . . . . . . . A . 1 ACE H1 . . . . . . . . . c19759_2mk7 1 . 12 . 1929 . 1 1 1 ACE H2 H -2.704 -21.880 6.282 . . . 1.0 . . . . . . . . . . . . A . 1 ACE H2 . . . . . . . . . c19759_2mk7 1 . 12 . 1930 . 1 1 1 ACE H3 H -3.209 -22.795 7.703 . . . 1.0 . . . . . . . . . . . . A . 1 ACE H3 . . . . . . . . . c19759_2mk7 1 . 12 . 1931 . 1 1 1 ACE O O -0.878 -20.669 7.546 . . . 1.0 . . . . . . . . . . . . A . 1 ACE O . . . . . . . . . c19759_2mk7 1 . 12 . 1932 . 1 1 2 PRO C C 1.133 -21.080 9.361 . . . 1.0 . . . . . . . . . . . . A . 2 PRO C . . . . . . . . . c19759_2mk7 1 . 12 . 1933 . 1 1 2 PRO CA C -0.130 -21.565 10.066 . . . 1.0 . . . . . . . . . . . . A . 2 PRO CA . . . . . . . . . c19759_2mk7 1 . 12 . 1934 . 1 1 2 PRO CB C 0.204 -22.660 11.091 . . . 1.0 . . . . . . . . . . . . A . 2 PRO CB . . . . . . . . . c19759_2mk7 1 . 12 . 1935 . 1 1 2 PRO CD C -1.621 -23.456 9.678 . . . 1.0 . . . . . . . . . . . . A . 2 PRO CD . . . . . . . . . c19759_2mk7 1 . 12 . 1936 . 1 1 2 PRO CG C -0.562 -23.886 10.690 . . . 1.0 . . . . . . . . . . . . A . 2 PRO CG . . . . . . . . . c19759_2mk7 1 . 12 . 1937 . 1 1 2 PRO HA H -0.613 -20.742 10.567 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HA . . . . . . . . . c19759_2mk7 1 . 12 . 1938 . 1 1 2 PRO HB2 H 1.266 -22.865 11.078 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HB2 . . . . . . . . . c19759_2mk7 1 . 12 . 1939 . 1 1 2 PRO HB3 H -0.099 -22.347 12.078 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HB3 . . . . . . . . . c19759_2mk7 1 . 12 . 1940 . 1 1 2 PRO HD2 H -1.733 -24.205 8.906 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HD2 . . . . . . . . . c19759_2mk7 1 . 12 . 1941 . 1 1 2 PRO HD3 H -2.563 -23.266 10.169 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HD3 . . . . . . . . . c19759_2mk7 1 . 12 . 1942 . 1 1 2 PRO HG2 H 0.109 -24.606 10.241 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HG2 . . . . . . . . . c19759_2mk7 1 . 12 . 1943 . 1 1 2 PRO HG3 H -1.042 -24.319 11.554 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HG3 . . . . . . . . . c19759_2mk7 1 . 12 . 1944 . 1 1 2 PRO N N -1.080 -22.217 9.124 . . . 1.0 . . . . . . . . . . . . A . 2 PRO N . . . . . . . . . c19759_2mk7 1 . 12 . 1945 . 1 1 2 PRO O O 1.510 -19.913 9.471 . . . 1.0 . . . . . . . . . . . . A . 2 PRO O . . . . . . . . . c19759_2mk7 1 . 12 . 1946 . 1 1 3 PRO C C 2.930 -20.299 7.162 . . . 1.0 . . . . . . . . . . . . A . 3 PRO C . . . . . . . . . c19759_2mk7 1 . 12 . 1947 . 1 1 3 PRO CA C 3.035 -21.628 7.906 . . . 1.0 . . . . . . . . . . . . A . 3 PRO CA . . . . . . . . . c19759_2mk7 1 . 12 . 1948 . 1 1 3 PRO CB C 3.213 -22.793 6.920 . . . 1.0 . . . . . . . . . . . . A . 3 PRO CB . . . . . . . . . c19759_2mk7 1 . 12 . 1949 . 1 1 3 PRO CD C 1.400 -23.352 8.456 . . . 1.0 . . . . . . . . . . . . A . 3 PRO CD . . . . . . . . . c19759_2mk7 1 . 12 . 1950 . 1 1 3 PRO CG C 2.059 -23.729 7.131 . . . 1.0 . . . . . . . . . . . . A . 3 PRO CG . . . . . . . . . c19759_2mk7 1 . 12 . 1951 . 1 1 3 PRO HA H 3.870 -21.605 8.587 . . . 1.0 . . . . . . . . . . . . A . 3 PRO HA . . . . . . . . . c19759_2mk7 1 . 12 . 1952 . 1 1 3 PRO HB2 H 3.207 -22.420 5.905 . . . 1.0 . . . . . . . . . . . . A . 3 PRO HB2 . . . . . . . . . c19759_2mk7 1 . 12 . 1953 . 1 1 3 PRO HB3 H 4.141 -23.306 7.118 . . . 1.0 . . . . . . . . . . . . A . 3 PRO HB3 . . . . . . . . . c19759_2mk7 1 . 12 . 1954 . 1 1 3 PRO HD2 H 0.324 -23.447 8.384 . . . 1.0 . . . . . . . . . . . . A . 3 PRO HD2 . . . . . . . . . c19759_2mk7 1 . 12 . 1955 . 1 1 3 PRO HD3 H 1.786 -23.957 9.261 . . . 1.0 . . . . . . . . . . . . A . 3 PRO HD3 . . . . . . . . . c19759_2mk7 1 . 12 . 1956 . 1 1 3 PRO HG2 H 1.350 -23.625 6.321 . . . 1.0 . . . . . . . . . . . . A . 3 PRO HG2 . . . . . . . . . c19759_2mk7 1 . 12 . 1957 . 1 1 3 PRO HG3 H 2.416 -24.746 7.183 . . . 1.0 . . . . . . . . . . . . A . 3 PRO HG3 . . . . . . . . . c19759_2mk7 1 . 12 . 1958 . 1 1 3 PRO N N 1.785 -21.953 8.643 . . . 1.0 . . . . . . . . . . . . A . 3 PRO N . . . . . . . . . c19759_2mk7 1 . 12 . 1959 . 1 1 3 PRO O O 2.489 -20.253 6.013 . . . 1.0 . . . . . . . . . . . . A . 3 PRO O . . . . . . . . . c19759_2mk7 1 . 12 . 1960 . 1 1 4 THR C C 4.464 -17.048 7.682 . . . 1.0 . . . . . . . . . . . . A . 4 THR C . . . . . . . . . c19759_2mk7 1 . 12 . 1961 . 1 1 4 THR CA C 3.286 -17.898 7.216 . . . 1.0 . . . . . . . . . . . . A . 4 THR CA . . . . . . . . . c19759_2mk7 1 . 12 . 1962 . 1 1 4 THR CB C 1.974 -17.202 7.585 . . . 1.0 . . . . . . . . . . . . A . 4 THR CB . . . . . . . . . c19759_2mk7 1 . 12 . 1963 . 1 1 4 THR CG2 C 0.792 -17.985 7.009 . . . 1.0 . . . . . . . . . . . . A . 4 THR CG2 . . . . . . . . . c19759_2mk7 1 . 12 . 1964 . 1 1 4 THR H H 3.676 -19.319 8.739 . . . 1.0 . . . . . . . . . . . . A . 4 THR H . . . . . . . . . c19759_2mk7 1 . 12 . 1965 . 1 1 4 THR HA H 3.334 -18.004 6.142 . . . 1.0 . . . . . . . . . . . . A . 4 THR HA . . . . . . . . . c19759_2mk7 1 . 12 . 1966 . 1 1 4 THR HB H 1.968 -16.199 7.188 . . . 1.0 . . . . . . . . . . . . A . 4 THR HB . . . . . . . . . c19759_2mk7 1 . 12 . 1967 . 1 1 4 THR HG21 H -0.055 -17.324 6.895 . . . 1.0 . . . . . . . . . . . . A . 4 THR HG21 . . . . . . . . . c19759_2mk7 1 . 12 . 1968 . 1 1 4 THR HG22 H 0.533 -18.790 7.680 . . . 1.0 . . . . . . . . . . . . A . 4 THR HG22 . . . . . . . . . c19759_2mk7 1 . 12 . 1969 . 1 1 4 THR HG23 H 1.065 -18.391 6.046 . . . 1.0 . . . . . . . . . . . . A . 4 THR HG23 . . . . . . . . . c19759_2mk7 1 . 12 . 1970 . 1 1 4 THR N N 3.337 -19.222 7.825 . . . 1.0 . . . . . . . . . . . . A . 4 THR N . . . . . . . . . c19759_2mk7 1 . 12 . 1971 . 1 1 4 THR O O 4.896 -17.146 8.830 . . . 1.0 . . . . . . . . . . . . A . 4 THR O . . . . . . . . . c19759_2mk7 1 . 12 . 1972 . 1 1 4 THR OG1 O 1.860 -17.173 8.990 . . . 1.0 . . . . . . . . . . . . A . 4 THR OG1 . . . . . . . . . c19759_2mk7 1 . 12 . 1973 . 1 1 5 THR C C 5.643 -13.911 7.298 . . . 1.0 . . . . . . . . . . . . A . 5 THR C . . . . . . . . . c19759_2mk7 1 . 12 . 1974 . 1 1 5 THR CA C 6.107 -15.352 7.114 . . . 1.0 . . . . . . . . . . . . A . 5 THR CA . . . . . . . . . c19759_2mk7 1 . 12 . 1975 . 1 1 5 THR CB C 7.157 -15.415 6.003 . . . 1.0 . . . . . . . . . . . . A . 5 THR CB . . . . . . . . . c19759_2mk7 1 . 12 . 1976 . 1 1 5 THR CG2 C 7.664 -16.850 5.849 . . . 1.0 . . . . . . . . . . . . A . 5 THR CG2 . . . . . . . . . c19759_2mk7 1 . 12 . 1977 . 1 1 5 THR H H 4.593 -16.180 5.883 . . . 1.0 . . . . . . . . . . . . A . 5 THR H . . . . . . . . . c19759_2mk7 1 . 12 . 1978 . 1 1 5 THR HA H 6.553 -15.697 8.035 . . . 1.0 . . . . . . . . . . . . A . 5 THR HA . . . . . . . . . c19759_2mk7 1 . 12 . 1979 . 1 1 5 THR HB H 7.983 -14.765 6.244 . . . 1.0 . . . . . . . . . . . . A . 5 THR HB . . . . . . . . . c19759_2mk7 1 . 12 . 1980 . 1 1 5 THR HG21 H 8.744 -16.853 5.859 . . . 1.0 . . . . . . . . . . . . A . 5 THR HG21 . . . . . . . . . c19759_2mk7 1 . 12 . 1981 . 1 1 5 THR HG22 H 7.311 -17.259 4.914 . . . 1.0 . . . . . . . . . . . . A . 5 THR HG22 . . . . . . . . . c19759_2mk7 1 . 12 . 1982 . 1 1 5 THR HG23 H 7.296 -17.451 6.667 . . . 1.0 . . . . . . . . . . . . A . 5 THR HG23 . . . . . . . . . c19759_2mk7 1 . 12 . 1983 . 1 1 5 THR N N 4.978 -16.214 6.783 . . . 1.0 . . . . . . . . . . . . A . 5 THR N . . . . . . . . . c19759_2mk7 1 . 12 . 1984 . 1 1 5 THR O O 4.781 -13.427 6.565 . . . 1.0 . . . . . . . . . . . . A . 5 THR O . . . . . . . . . c19759_2mk7 1 . 12 . 1985 . 1 1 5 THR OG1 O 6.555 -15.013 4.792 . . . 1.0 . . . . . . . . . . . . A . 5 THR OG1 . . . . . . . . . c19759_2mk7 1 . 12 . 1986 . 1 1 6 THR C C 6.945 -10.896 8.043 . . . 1.0 . . . . . . . . . . . . A . 6 THR C . . . . . . . . . c19759_2mk7 1 . 12 . 1987 . 1 1 6 THR CA C 5.862 -11.843 8.552 . . . 1.0 . . . . . . . . . . . . A . 6 THR CA . . . . . . . . . c19759_2mk7 1 . 12 . 1988 . 1 1 6 THR CB C 5.668 -11.637 10.056 . . . 1.0 . . . . . . . . . . . . A . 6 THR CB . . . . . . . . . c19759_2mk7 1 . 12 . 1989 . 1 1 6 THR CG2 C 4.621 -12.620 10.584 . . . 1.0 . . . . . . . . . . . . A . 6 THR CG2 . . . . . . . . . c19759_2mk7 1 . 12 . 1990 . 1 1 6 THR H H 6.904 -13.666 8.834 . . . 1.0 . . . . . . . . . . . . A . 6 THR H . . . . . . . . . c19759_2mk7 1 . 12 . 1991 . 1 1 6 THR HA H 4.934 -11.616 8.048 . . . 1.0 . . . . . . . . . . . . A . 6 THR HA . . . . . . . . . c19759_2mk7 1 . 12 . 1992 . 1 1 6 THR HB H 5.341 -10.627 10.248 . . . 1.0 . . . . . . . . . . . . A . 6 THR HB . . . . . . . . . c19759_2mk7 1 . 12 . 1993 . 1 1 6 THR HG21 H 4.044 -12.146 11.364 . . . 1.0 . . . . . . . . . . . . A . 6 THR HG21 . . . . . . . . . c19759_2mk7 1 . 12 . 1994 . 1 1 6 THR HG22 H 5.116 -13.493 10.981 . . . 1.0 . . . . . . . . . . . . A . 6 THR HG22 . . . . . . . . . c19759_2mk7 1 . 12 . 1995 . 1 1 6 THR HG23 H 3.965 -12.913 9.778 . . . 1.0 . . . . . . . . . . . . A . 6 THR HG23 . . . . . . . . . c19759_2mk7 1 . 12 . 1996 . 1 1 6 THR N N 6.222 -13.228 8.281 . . . 1.0 . . . . . . . . . . . . A . 6 THR N . . . . . . . . . c19759_2mk7 1 . 12 . 1997 . 1 1 6 THR O O 8.127 -11.079 8.334 . . . 1.0 . . . . . . . . . . . . A . 6 THR O . . . . . . . . . c19759_2mk7 1 . 12 . 1998 . 1 1 6 THR OG1 O 6.895 -11.886 10.707 . . . 1.0 . . . . . . . . . . . . A . 6 THR OG1 . . . . . . . . . c19759_2mk7 1 . 12 . 1999 . 1 1 7 THR C C 7.465 -7.636 7.560 . . . 1.0 . . . . . . . . . . . . A . 7 THR C . . . . . . . . . c19759_2mk7 1 . 12 . 2000 . 1 1 7 THR CA C 7.479 -8.920 6.737 . . . 1.0 . . . . . . . . . . . . A . 7 THR CA . . . . . . . . . c19759_2mk7 1 . 12 . 2001 . 1 1 7 THR CB C 7.121 -8.601 5.284 . . . 1.0 . . . . . . . . . . . . A . 7 THR CB . . . . . . . . . c19759_2mk7 1 . 12 . 2002 . 1 1 7 THR CG2 C 7.041 -9.895 4.472 . . . 1.0 . . . . . . . . . . . . A . 7 THR CG2 . . . . . . . . . c19759_2mk7 1 . 12 . 2003 . 1 1 7 THR H H 5.579 -9.793 7.083 . . . 1.0 . . . . . . . . . . . . A . 7 THR H . . . . . . . . . c19759_2mk7 1 . 12 . 2004 . 1 1 7 THR HA H 8.471 -9.345 6.766 . . . 1.0 . . . . . . . . . . . . A . 7 THR HA . . . . . . . . . c19759_2mk7 1 . 12 . 2005 . 1 1 7 THR HB H 7.870 -7.954 4.856 . . . 1.0 . . . . . . . . . . . . A . 7 THR HB . . . . . . . . . c19759_2mk7 1 . 12 . 2006 . 1 1 7 THR HG21 H 7.850 -10.550 4.761 . . . 1.0 . . . . . . . . . . . . A . 7 THR HG21 . . . . . . . . . c19759_2mk7 1 . 12 . 2007 . 1 1 7 THR HG22 H 7.122 -9.666 3.420 . . . 1.0 . . . . . . . . . . . . A . 7 THR HG22 . . . . . . . . . c19759_2mk7 1 . 12 . 2008 . 1 1 7 THR HG23 H 6.097 -10.383 4.663 . . . 1.0 . . . . . . . . . . . . A . 7 THR HG23 . . . . . . . . . c19759_2mk7 1 . 12 . 2009 . 1 1 7 THR N N 6.534 -9.889 7.282 . . . 1.0 . . . . . . . . . . . . A . 7 THR N . . . . . . . . . c19759_2mk7 1 . 12 . 2010 . 1 1 7 THR O O 6.415 -7.022 7.752 . . . 1.0 . . . . . . . . . . . . A . 7 THR O . . . . . . . . . c19759_2mk7 1 . 12 . 2011 . 1 1 7 THR OG1 O 5.858 -7.970 5.259 . . . 1.0 . . . . . . . . . . . . A . 7 THR OG1 . . . . . . . . . c19759_2mk7 1 . 12 . 2012 . 1 1 8 LYS C C 7.666 -5.991 9.921 . . . 1.0 . . . . . . . . . . . . A . 8 LYS C . . . . . . . . . c19759_2mk7 1 . 12 . 2013 . 1 1 8 LYS CA C 8.747 -6.025 8.846 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CA . . . . . . . . . c19759_2mk7 1 . 12 . 2014 . 1 1 8 LYS CB C 8.616 -4.792 7.950 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CB . . . . . . . . . c19759_2mk7 1 . 12 . 2015 . 1 1 8 LYS CD C 9.593 -2.556 7.412 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CD . . . . . . . . . c19759_2mk7 1 . 12 . 2016 . 1 1 8 LYS CE C 10.610 -1.513 7.879 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CE . . . . . . . . . c19759_2mk7 1 . 12 . 2017 . 1 1 8 LYS CG C 9.803 -3.857 8.189 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CG . . . . . . . . . c19759_2mk7 1 . 12 . 2018 . 1 1 8 LYS H H 9.440 -7.768 7.860 . . . 1.0 . . . . . . . . . . . . A . 8 LYS H . . . . . . . . . c19759_2mk7 1 . 12 . 2019 . 1 1 8 LYS HA H 9.715 -6.006 9.323 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HA . . . . . . . . . c19759_2mk7 1 . 12 . 2020 . 1 1 8 LYS HB2 H 8.602 -5.101 6.914 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HB2 . . . . . . . . . c19759_2mk7 1 . 12 . 2021 . 1 1 8 LYS HB3 H 7.699 -4.273 8.183 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HB3 . . . . . . . . . c19759_2mk7 1 . 12 . 2022 . 1 1 8 LYS HD2 H 9.725 -2.742 6.356 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HD2 . . . . . . . . . c19759_2mk7 1 . 12 . 2023 . 1 1 8 LYS HD3 H 8.594 -2.187 7.591 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HD3 . . . . . . . . . c19759_2mk7 1 . 12 . 2024 . 1 1 8 LYS HE2 H 10.402 -0.567 7.400 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HE2 . . . . . . . . . c19759_2mk7 1 . 12 . 2025 . 1 1 8 LYS HE3 H 10.542 -1.397 8.951 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HE3 . . . . . . . . . c19759_2mk7 1 . 12 . 2026 . 1 1 8 LYS HG2 H 9.883 -3.639 9.244 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HG2 . . . . . . . . . c19759_2mk7 1 . 12 . 2027 . 1 1 8 LYS HG3 H 10.710 -4.333 7.850 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HG3 . . . . . . . . . c19759_2mk7 1 . 12 . 2028 . 1 1 8 LYS HZ1 H 12.488 -1.185 7.042 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ1 . . . . . . . . . c19759_2mk7 1 . 12 . 2029 . 1 1 8 LYS HZ2 H 11.922 -2.779 6.873 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ2 . . . . . . . . . c19759_2mk7 1 . 12 . 2030 . 1 1 8 LYS HZ3 H 12.500 -2.233 8.375 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ3 . . . . . . . . . c19759_2mk7 1 . 12 . 2031 . 1 1 8 LYS N N 8.636 -7.238 8.045 . . . 1.0 . . . . . . . . . . . . A . 8 LYS N . . . . . . . . . c19759_2mk7 1 . 12 . 2032 . 1 1 8 LYS NZ N 11.984 -1.961 7.515 . . . 1.0 . . . . . . . . . . . . A . 8 LYS NZ . . . . . . . . . c19759_2mk7 1 . 12 . 2033 . 1 1 8 LYS O O 6.886 -6.934 10.060 . . . 1.0 . . . . . . . . . . . . A . 8 LYS O . . . . . . . . . c19759_2mk7 1 . 12 . 2034 . 1 1 9 LYS C C 6.751 -3.387 12.400 . . . 1.0 . . . . . . . . . . . . A . 9 LYS C . . . . . . . . . c19759_2mk7 1 . 12 . 2035 . 1 1 9 LYS CA C 6.633 -4.757 11.740 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CA . . . . . . . . . c19759_2mk7 1 . 12 . 2036 . 1 1 9 LYS CB C 6.831 -5.850 12.791 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CB . . . . . . . . . c19759_2mk7 1 . 12 . 2037 . 1 1 9 LYS CD C 4.451 -5.599 13.511 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CD . . . . . . . . . c19759_2mk7 1 . 12 . 2038 . 1 1 9 LYS CE C 3.609 -6.258 14.606 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CE . . . . . . . . . c19759_2mk7 1 . 12 . 2039 . 1 1 9 LYS CG C 5.509 -6.586 13.016 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CG . . . . . . . . . c19759_2mk7 1 . 12 . 2040 . 1 1 9 LYS H H 8.272 -4.181 10.523 . . . 1.0 . . . . . . . . . . . . A . 9 LYS H . . . . . . . . . c19759_2mk7 1 . 12 . 2041 . 1 1 9 LYS HA H 5.647 -4.857 11.313 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HA . . . . . . . . . c19759_2mk7 1 . 12 . 2042 . 1 1 9 LYS HB2 H 7.579 -6.549 12.447 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HB2 . . . . . . . . . c19759_2mk7 1 . 12 . 2043 . 1 1 9 LYS HB3 H 7.154 -5.403 13.719 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HB3 . . . . . . . . . c19759_2mk7 1 . 12 . 2044 . 1 1 9 LYS HD2 H 4.938 -4.721 13.910 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HD2 . . . . . . . . . c19759_2mk7 1 . 12 . 2045 . 1 1 9 LYS HD3 H 3.811 -5.314 12.690 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HD3 . . . . . . . . . c19759_2mk7 1 . 12 . 2046 . 1 1 9 LYS HE2 H 4.241 -6.512 15.443 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HE2 . . . . . . . . . c19759_2mk7 1 . 12 . 2047 . 1 1 9 LYS HE3 H 2.840 -5.573 14.930 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HE3 . . . . . . . . . c19759_2mk7 1 . 12 . 2048 . 1 1 9 LYS HG2 H 5.182 -7.030 12.087 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HG2 . . . . . . . . . c19759_2mk7 1 . 12 . 2049 . 1 1 9 LYS HG3 H 5.650 -7.361 13.754 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HG3 . . . . . . . . . c19759_2mk7 1 . 12 . 2050 . 1 1 9 LYS HZ1 H 2.518 -8.016 14.842 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HZ1 . . . . . . . . . c19759_2mk7 1 . 12 . 2051 . 1 1 9 LYS HZ2 H 3.707 -8.095 13.630 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HZ2 . . . . . . . . . c19759_2mk7 1 . 12 . 2052 . 1 1 9 LYS HZ3 H 2.264 -7.241 13.355 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HZ3 . . . . . . . . . c19759_2mk7 1 . 12 . 2053 . 1 1 9 LYS N N 7.624 -4.901 10.679 . . . 1.0 . . . . . . . . . . . . A . 9 LYS N . . . . . . . . . c19759_2mk7 1 . 12 . 2054 . 1 1 9 LYS NZ N 2.977 -7.496 14.067 . . . 1.0 . . . . . . . . . . . . A . 9 LYS NZ . . . . . . . . . c19759_2mk7 1 . 12 . 2055 . 1 1 9 LYS O O 6.749 -3.273 13.625 . . . 1.0 . . . . . . . . . . . . A . 9 LYS O . . . . . . . . . c19759_2mk7 1 . 12 . 2056 . 1 1 10 PRO C C 5.993 -0.668 13.238 . . . 1.0 . . . . . . . . . . . . A . 10 PRO C . . . . . . . . . c19759_2mk7 1 . 12 . 2057 . 1 1 10 PRO CA C 6.975 -0.958 12.108 . . . 1.0 . . . . . . . . . . . . A . 10 PRO CA . . . . . . . . . c19759_2mk7 1 . 12 . 2058 . 1 1 10 PRO CB C 6.669 -0.083 10.881 . . . 1.0 . . . . . . . . . . . . A . 10 PRO CB . . . . . . . . . c19759_2mk7 1 . 12 . 2059 . 1 1 10 PRO CD C 6.863 -2.404 10.147 . . . 1.0 . . . . . . . . . . . . A . 10 PRO CD . . . . . . . . . c19759_2mk7 1 . 12 . 2060 . 1 1 10 PRO CG C 6.382 -1.014 9.739 . . . 1.0 . . . . . . . . . . . . A . 10 PRO CG . . . . . . . . . c19759_2mk7 1 . 12 . 2061 . 1 1 10 PRO HA H 7.984 -0.770 12.436 . . . 1.0 . . . . . . . . . . . . A . 10 PRO HA . . . . . . . . . c19759_2mk7 1 . 12 . 2062 . 1 1 10 PRO HB2 H 5.806 0.538 11.079 . . . 1.0 . . . . . . . . . . . . A . 10 PRO HB2 . . . . . . . . . c19759_2mk7 1 . 12 . 2063 . 1 1 10 PRO HB3 H 7.522 0.532 10.644 . . . 1.0 . . . . . . . . . . . . A . 10 PRO HB3 . . . . . . . . . c19759_2mk7 1 . 12 . 2064 . 1 1 10 PRO HD2 H 6.181 -3.163 9.785 . . . 1.0 . . . . . . . . . . . . A . 10 PRO HD2 . . . . . . . . . c19759_2mk7 1 . 12 . 2065 . 1 1 10 PRO HD3 H 7.862 -2.583 9.785 . . . 1.0 . . . . . . . . . . . . A . 10 PRO HD3 . . . . . . . . . c19759_2mk7 1 . 12 . 2066 . 1 1 10 PRO HG2 H 5.318 -1.033 9.541 . . . 1.0 . . . . . . . . . . . . A . 10 PRO HG2 . . . . . . . . . c19759_2mk7 1 . 12 . 2067 . 1 1 10 PRO HG3 H 6.914 -0.691 8.858 . . . 1.0 . . . . . . . . . . . . A . 10 PRO HG3 . . . . . . . . . c19759_2mk7 1 . 12 . 2068 . 1 1 10 PRO N N 6.852 -2.355 11.608 . . . 1.0 . . . . . . . . . . . . A . 10 PRO N . . . . . . . . . c19759_2mk7 1 . 12 . 2069 . 1 1 10 PRO O O 6.396 -0.547 14.396 . . . 1.0 . . . . . . . . . . . . A . 10 PRO O . . . . . . . . . c19759_2mk7 1 . 12 . 2070 . 1 1 11 NH2 HN1 H 4.127 -1.324 13.060 . . . 1.0 . . . . . . . . . . . . A . 11 NH2 HN1 . . . . . . . . . c19759_2mk7 1 . 12 . 2071 . 1 1 11 NH2 HN2 H 4.359 0.315 12.685 . . . 1.0 . . . . . . . . . . . . A . 11 NH2 HN2 . . . . . . . . . c19759_2mk7 1 . 12 . 2072 . 1 1 11 NH2 N N 4.721 -0.549 12.972 . . . 1.0 . . . . . . . . . . . . A . 11 NH2 N . . . . . . . . . c19759_2mk7 1 . 12 . 2073 . 2 2 1 A2G C1 C 1.901 -15.861 9.508 . . . 1.0 . . . . . . . . . . . . A . 101 A2G C1 . . . . . . . . . c19759_2mk7 1 . 12 . 2074 . 2 2 1 A2G C2 C 2.020 -15.952 11.030 . . . 1.0 . . . . . . . . . . . . A . 101 A2G C2 . . . . . . . . . c19759_2mk7 1 . 12 . 2075 . 2 2 1 A2G C3 C 0.783 -16.660 11.589 . . . 1.0 . . . . . . . . . . . . A . 101 A2G C3 . . . . . . . . . c19759_2mk7 1 . 12 . 2076 . 2 2 1 A2G C4 C -0.478 -15.943 11.101 . . . 1.0 . . . . . . . . . . . . A . 101 A2G C4 . . . . . . . . . c19759_2mk7 1 . 12 . 2077 . 2 2 1 A2G C5 C -0.443 -15.832 9.575 . . . 1.0 . . . . . . . . . . . . A . 101 A2G C5 . . . . . . . . . c19759_2mk7 1 . 12 . 2078 . 2 2 1 A2G C6 C -1.657 -15.040 9.088 . . . 1.0 . . . . . . . . . . . . A . 101 A2G C6 . . . . . . . . . c19759_2mk7 1 . 12 . 2079 . 2 2 1 A2G C7 C 4.180 -16.115 12.125 . . . 1.0 . . . . . . . . . . . . A . 101 A2G C7 . . . . . . . . . c19759_2mk7 1 . 12 . 2080 . 2 2 1 A2G C8 C 5.408 -16.972 12.413 . . . 1.0 . . . . . . . . . . . . A . 101 A2G C8 . . . . . . . . . c19759_2mk7 1 . 12 . 2081 . 2 2 1 A2G H1 H 2.761 -15.341 9.114 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H1 . . . . . . . . . c19759_2mk7 1 . 12 . 2082 . 2 2 1 A2G H14 H -1.919 -15.360 8.089 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H14 . . . . . . . . . c19759_2mk7 1 . 12 . 2083 . 2 2 1 A2G H15 H -2.489 -15.007 10.845 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H15 . . . . . . . . . c19759_2mk7 1 . 12 . 2084 . 2 2 1 A2G H2 H 2.073 -14.954 11.440 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H2 . . . . . . . . . c19759_2mk7 1 . 12 . 2085 . 2 2 1 A2G H3 H 0.770 -17.684 11.248 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H3 . . . . . . . . . c19759_2mk7 1 . 12 . 2086 . 2 2 1 A2G H4 H -1.350 -16.506 11.401 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H4 . . . . . . . . . c19759_2mk7 1 . 12 . 2087 . 2 2 1 A2G H5 H -0.452 -16.819 9.137 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H5 . . . . . . . . . c19759_2mk7 1 . 12 . 2088 . 2 2 1 A2G H6 H -1.420 -13.986 9.077 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H6 . . . . . . . . . c19759_2mk7 1 . 12 . 2089 . 2 2 1 A2G H8 H 5.105 -17.881 12.911 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H8 . . . . . . . . . c19759_2mk7 1 . 12 . 2090 . 2 2 1 A2G H8A H 6.089 -16.424 13.047 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H8A . . . . . . . . . c19759_2mk7 1 . 12 . 2091 . 2 2 1 A2G H8B H 5.901 -17.219 11.484 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H8B . . . . . . . . . c19759_2mk7 1 . 12 . 2092 . 2 2 1 A2G HN2 H 3.333 -17.613 11.102 . . . 1.0 . . . . . . . . . . . . A . 101 A2G HN2 . . . . . . . . . c19759_2mk7 1 . 12 . 2093 . 2 2 1 A2G HO3 H 0.726 -17.534 13.324 . . . 1.0 . . . . . . . . . . . . A . 101 A2G HO3 . . . . . . . . . c19759_2mk7 1 . 12 . 2094 . 2 2 1 A2G HO4 H -1.456 -14.374 11.702 . . . 1.0 . . . . . . . . . . . . A . 101 A2G HO4 . . . . . . . . . c19759_2mk7 1 . 12 . 2095 . 2 2 1 A2G N2 N 3.226 -16.685 11.397 . . . 1.0 . . . . . . . . . . . . A . 101 A2G N2 . . . . . . . . . c19759_2mk7 1 . 12 . 2096 . 2 2 1 A2G O O 0.727 -15.143 9.199 . . . 1.0 . . . . . . . . . . . . A . 101 A2G O . . . . . . . . . c19759_2mk7 1 . 12 . 2097 . 2 2 1 A2G O3 O 0.823 -16.632 13.007 . . . 1.0 . . . . . . . . . . . . A . 101 A2G O3 . . . . . . . . . c19759_2mk7 1 . 12 . 2098 . 2 2 1 A2G O4 O -0.535 -14.644 11.669 . . . 1.0 . . . . . . . . . . . . A . 101 A2G O4 . . . . . . . . . c19759_2mk7 1 . 12 . 2099 . 2 2 1 A2G O6 O -2.755 -15.269 9.960 . . . 1.0 . . . . . . . . . . . . A . 101 A2G O6 . . . . . . . . . c19759_2mk7 1 . 12 . 2100 . 2 2 1 A2G O7 O 4.113 -14.955 12.531 . . . 1.0 . . . . . . . . . . . . A . 101 A2G O7 . . . . . . . . . c19759_2mk7 1 . 13 . 2101 . 1 1 1 ACE C C -0.052 -21.212 10.860 . . . 1.0 . . . . . . . . . . . . A . 1 ACE C . . . . . . . . . c19759_2mk7 1 . 13 . 2102 . 1 1 1 ACE CH3 C -0.833 -20.456 11.930 . . . 1.0 . . . . . . . . . . . . A . 1 ACE CH3 . . . . . . . . . c19759_2mk7 1 . 13 . 2103 . 1 1 1 ACE H1 H -1.117 -19.485 11.550 . . . 1.0 . . . . . . . . . . . . A . 1 ACE H1 . . . . . . . . . c19759_2mk7 1 . 13 . 2104 . 1 1 1 ACE H2 H -0.217 -20.334 12.807 . . . 1.0 . . . . . . . . . . . . A . 1 ACE H2 . . . . . . . . . c19759_2mk7 1 . 13 . 2105 . 1 1 1 ACE H3 H -1.721 -21.013 12.188 . . . 1.0 . . . . . . . . . . . . A . 1 ACE H3 . . . . . . . . . c19759_2mk7 1 . 13 . 2106 . 1 1 1 ACE O O 1.162 -21.383 10.968 . . . 1.0 . . . . . . . . . . . . A . 1 ACE O . . . . . . . . . c19759_2mk7 1 . 13 . 2107 . 1 1 2 PRO C C 1.218 -21.803 8.274 . . . 1.0 . . . . . . . . . . . . A . 2 PRO C . . . . . . . . . c19759_2mk7 1 . 13 . 2108 . 1 1 2 PRO CA C -0.105 -22.421 8.721 . . . 1.0 . . . . . . . . . . . . A . 2 PRO CA . . . . . . . . . c19759_2mk7 1 . 13 . 2109 . 1 1 2 PRO CB C -1.147 -22.357 7.591 . . . 1.0 . . . . . . . . . . . . A . 2 PRO CB . . . . . . . . . c19759_2mk7 1 . 13 . 2110 . 1 1 2 PRO CD C -2.164 -21.495 9.633 . . . 1.0 . . . . . . . . . . . . A . 2 PRO CD . . . . . . . . . c19759_2mk7 1 . 13 . 2111 . 1 1 2 PRO CG C -2.310 -21.567 8.115 . . . 1.0 . . . . . . . . . . . . A . 2 PRO CG . . . . . . . . . c19759_2mk7 1 . 13 . 2112 . 1 1 2 PRO HA H 0.046 -23.447 9.010 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HA . . . . . . . . . c19759_2mk7 1 . 13 . 2113 . 1 1 2 PRO HB2 H -0.723 -21.865 6.727 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HB2 . . . . . . . . . c19759_2mk7 1 . 13 . 2114 . 1 1 2 PRO HB3 H -1.470 -23.352 7.329 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HB3 . . . . . . . . . c19759_2mk7 1 . 13 . 2115 . 1 1 2 PRO HD2 H -2.497 -20.534 10.002 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HD2 . . . . . . . . . c19759_2mk7 1 . 13 . 2116 . 1 1 2 PRO HD3 H -2.706 -22.297 10.108 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HD3 . . . . . . . . . c19759_2mk7 1 . 13 . 2117 . 1 1 2 PRO HG2 H -2.297 -20.570 7.693 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HG2 . . . . . . . . . c19759_2mk7 1 . 13 . 2118 . 1 1 2 PRO HG3 H -3.235 -22.061 7.864 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HG3 . . . . . . . . . c19759_2mk7 1 . 13 . 2119 . 1 1 2 PRO N N -0.728 -21.661 9.839 . . . 1.0 . . . . . . . . . . . . A . 2 PRO N . . . . . . . . . c19759_2mk7 1 . 13 . 2120 . 1 1 2 PRO O O 1.509 -20.645 8.575 . . . 1.0 . . . . . . . . . . . . A . 2 PRO O . . . . . . . . . c19759_2mk7 1 . 13 . 2121 . 1 1 3 PRO C C 3.242 -20.702 6.427 . . . 1.0 . . . . . . . . . . . . A . 3 PRO C . . . . . . . . . c19759_2mk7 1 . 13 . 2122 . 1 1 3 PRO CA C 3.334 -22.087 7.062 . . . 1.0 . . . . . . . . . . . . A . 3 PRO CA . . . . . . . . . c19759_2mk7 1 . 13 . 2123 . 1 1 3 PRO CB C 3.746 -23.136 6.017 . . . 1.0 . . . . . . . . . . . . A . 3 PRO CB . . . . . . . . . c19759_2mk7 1 . 13 . 2124 . 1 1 3 PRO CD C 1.745 -23.938 7.172 . . . 1.0 . . . . . . . . . . . . A . 3 PRO CD . . . . . . . . . c19759_2mk7 1 . 13 . 2125 . 1 1 3 PRO CG C 2.647 -24.156 5.959 . . . 1.0 . . . . . . . . . . . . A . 3 PRO CG . . . . . . . . . c19759_2mk7 1 . 13 . 2126 . 1 1 3 PRO HA H 4.055 -22.079 7.863 . . . 1.0 . . . . . . . . . . . . A . 3 PRO HA . . . . . . . . . c19759_2mk7 1 . 13 . 2127 . 1 1 3 PRO HB2 H 3.864 -22.665 5.051 . . . 1.0 . . . . . . . . . . . . A . 3 PRO HB2 . . . . . . . . . c19759_2mk7 1 . 13 . 2128 . 1 1 3 PRO HB3 H 4.668 -23.608 6.314 . . . 1.0 . . . . . . . . . . . . A . 3 PRO HB3 . . . . . . . . . c19759_2mk7 1 . 13 . 2129 . 1 1 3 PRO HD2 H 0.706 -24.062 6.896 . . . 1.0 . . . . . . . . . . . . A . 3 PRO HD2 . . . . . . . . . c19759_2mk7 1 . 13 . 2130 . 1 1 3 PRO HD3 H 2.010 -24.614 7.969 . . . 1.0 . . . . . . . . . . . . A . 3 PRO HD3 . . . . . . . . . c19759_2mk7 1 . 13 . 2131 . 1 1 3 PRO HG2 H 2.079 -24.031 5.048 . . . 1.0 . . . . . . . . . . . . A . 3 PRO HG2 . . . . . . . . . c19759_2mk7 1 . 13 . 2132 . 1 1 3 PRO HG3 H 3.068 -25.149 5.996 . . . 1.0 . . . . . . . . . . . . A . 3 PRO HG3 . . . . . . . . . c19759_2mk7 1 . 13 . 2133 . 1 1 3 PRO N N 2.015 -22.555 7.566 . . . 1.0 . . . . . . . . . . . . A . 3 PRO N . . . . . . . . . c19759_2mk7 1 . 13 . 2134 . 1 1 3 PRO O O 2.847 -20.566 5.270 . . . 1.0 . . . . . . . . . . . . A . 3 PRO O . . . . . . . . . c19759_2mk7 1 . 13 . 2135 . 1 1 4 THR C C 4.721 -17.492 7.271 . . . 1.0 . . . . . . . . . . . . A . 4 THR C . . . . . . . . . c19759_2mk7 1 . 13 . 2136 . 1 1 4 THR CA C 3.575 -18.311 6.686 . . . 1.0 . . . . . . . . . . . . A . 4 THR CA . . . . . . . . . c19759_2mk7 1 . 13 . 2137 . 1 1 4 THR CB C 2.243 -17.650 7.052 . . . 1.0 . . . . . . . . . . . . A . 4 THR CB . . . . . . . . . c19759_2mk7 1 . 13 . 2138 . 1 1 4 THR CG2 C 1.094 -18.379 6.354 . . . 1.0 . . . . . . . . . . . . A . 4 THR CG2 . . . . . . . . . c19759_2mk7 1 . 13 . 2139 . 1 1 4 THR H H 3.911 -19.846 8.109 . . . 1.0 . . . . . . . . . . . . A . 4 THR H . . . . . . . . . c19759_2mk7 1 . 13 . 2140 . 1 1 4 THR HA H 3.670 -18.330 5.611 . . . 1.0 . . . . . . . . . . . . A . 4 THR HA . . . . . . . . . c19759_2mk7 1 . 13 . 2141 . 1 1 4 THR HB H 2.255 -16.621 6.745 . . . 1.0 . . . . . . . . . . . . A . 4 THR HB . . . . . . . . . c19759_2mk7 1 . 13 . 2142 . 1 1 4 THR HG21 H 1.421 -18.714 5.381 . . . 1.0 . . . . . . . . . . . . A . 4 THR HG21 . . . . . . . . . c19759_2mk7 1 . 13 . 2143 . 1 1 4 THR HG22 H 0.257 -17.707 6.241 . . . 1.0 . . . . . . . . . . . . A . 4 THR HG22 . . . . . . . . . c19759_2mk7 1 . 13 . 2144 . 1 1 4 THR HG23 H 0.796 -19.231 6.946 . . . 1.0 . . . . . . . . . . . . A . 4 THR HG23 . . . . . . . . . c19759_2mk7 1 . 13 . 2145 . 1 1 4 THR N N 3.611 -19.679 7.192 . . . 1.0 . . . . . . . . . . . . A . 4 THR N . . . . . . . . . c19759_2mk7 1 . 13 . 2146 . 1 1 4 THR O O 5.188 -17.762 8.377 . . . 1.0 . . . . . . . . . . . . A . 4 THR O . . . . . . . . . c19759_2mk7 1 . 13 . 2147 . 1 1 4 THR OG1 O 2.057 -17.743 8.448 . . . 1.0 . . . . . . . . . . . . A . 4 THR OG1 . . . . . . . . . c19759_2mk7 1 . 13 . 2148 . 1 1 5 THR C C 5.724 -14.272 7.427 . . . 1.0 . . . . . . . . . . . . A . 5 THR C . . . . . . . . . c19759_2mk7 1 . 13 . 2149 . 1 1 5 THR CA C 6.254 -15.632 6.983 . . . 1.0 . . . . . . . . . . . . A . 5 THR CA . . . . . . . . . c19759_2mk7 1 . 13 . 2150 . 1 1 5 THR CB C 7.281 -15.442 5.863 . . . 1.0 . . . . . . . . . . . . A . 5 THR CB . . . . . . . . . c19759_2mk7 1 . 13 . 2151 . 1 1 5 THR CG2 C 7.848 -16.800 5.447 . . . 1.0 . . . . . . . . . . . . A . 5 THR CG2 . . . . . . . . . c19759_2mk7 1 . 13 . 2152 . 1 1 5 THR H H 4.750 -16.312 5.654 . . . 1.0 . . . . . . . . . . . . A . 5 THR H . . . . . . . . . c19759_2mk7 1 . 13 . 2153 . 1 1 5 THR HA H 6.741 -16.107 7.821 . . . 1.0 . . . . . . . . . . . . A . 5 THR HA . . . . . . . . . c19759_2mk7 1 . 13 . 2154 . 1 1 5 THR HB H 8.082 -14.805 6.205 . . . 1.0 . . . . . . . . . . . . A . 5 THR HB . . . . . . . . . c19759_2mk7 1 . 13 . 2155 . 1 1 5 THR HG21 H 7.520 -17.555 6.146 . . . 1.0 . . . . . . . . . . . . A . 5 THR HG21 . . . . . . . . . c19759_2mk7 1 . 13 . 2156 . 1 1 5 THR HG22 H 8.927 -16.755 5.448 . . . 1.0 . . . . . . . . . . . . A . 5 THR HG22 . . . . . . . . . c19759_2mk7 1 . 13 . 2157 . 1 1 5 THR HG23 H 7.498 -17.049 4.456 . . . 1.0 . . . . . . . . . . . . A . 5 THR HG23 . . . . . . . . . c19759_2mk7 1 . 13 . 2158 . 1 1 5 THR N N 5.165 -16.486 6.524 . . . 1.0 . . . . . . . . . . . . A . 5 THR N . . . . . . . . . c19759_2mk7 1 . 13 . 2159 . 1 1 5 THR O O 4.819 -13.715 6.805 . . . 1.0 . . . . . . . . . . . . A . 5 THR O . . . . . . . . . c19759_2mk7 1 . 13 . 2160 . 1 1 5 THR OG1 O 6.632 -14.861 4.753 . . . 1.0 . . . . . . . . . . . . A . 5 THR OG1 . . . . . . . . . c19759_2mk7 1 . 13 . 2161 . 1 1 6 THR C C 6.888 -11.365 8.657 . . . 1.0 . . . . . . . . . . . . A . 6 THR C . . . . . . . . . c19759_2mk7 1 . 13 . 2162 . 1 1 6 THR CA C 5.871 -12.443 9.022 . . . 1.0 . . . . . . . . . . . . A . 6 THR CA . . . . . . . . . c19759_2mk7 1 . 13 . 2163 . 1 1 6 THR CB C 5.713 -12.509 10.554 . . . 1.0 . . . . . . . . . . . . A . 6 THR CB . . . . . . . . . c19759_2mk7 1 . 13 . 2164 . 1 1 6 THR CG2 C 4.823 -13.695 10.940 . . . 1.0 . . . . . . . . . . . . A . 6 THR CG2 . . . . . . . . . c19759_2mk7 1 . 13 . 2165 . 1 1 6 THR H H 7.012 -14.230 8.959 . . . 1.0 . . . . . . . . . . . . A . 6 THR H . . . . . . . . . c19759_2mk7 1 . 13 . 2166 . 1 1 6 THR HA H 4.919 -12.187 8.582 . . . 1.0 . . . . . . . . . . . . A . 6 THR HA . . . . . . . . . c19759_2mk7 1 . 13 . 2167 . 1 1 6 THR HB H 5.269 -11.593 10.919 . . . 1.0 . . . . . . . . . . . . A . 6 THR HB . . . . . . . . . c19759_2mk7 1 . 13 . 2168 . 1 1 6 THR HG21 H 4.332 -13.487 11.879 . . . 1.0 . . . . . . . . . . . . A . 6 THR HG21 . . . . . . . . . c19759_2mk7 1 . 13 . 2169 . 1 1 6 THR HG22 H 5.429 -14.584 11.039 . . . 1.0 . . . . . . . . . . . . A . 6 THR HG22 . . . . . . . . . c19759_2mk7 1 . 13 . 2170 . 1 1 6 THR HG23 H 4.079 -13.851 10.172 . . . 1.0 . . . . . . . . . . . . A . 6 THR HG23 . . . . . . . . . c19759_2mk7 1 . 13 . 2171 . 1 1 6 THR N N 6.294 -13.741 8.504 . . . 1.0 . . . . . . . . . . . . A . 6 THR N . . . . . . . . . c19759_2mk7 1 . 13 . 2172 . 1 1 6 THR O O 8.083 -11.526 8.885 . . . 1.0 . . . . . . . . . . . . A . 6 THR O . . . . . . . . . c19759_2mk7 1 . 13 . 2173 . 1 1 6 THR OG1 O 6.988 -12.694 11.128 . . . 1.0 . . . . . . . . . . . . A . 6 THR OG1 . . . . . . . . . c19759_2mk7 1 . 13 . 2174 . 1 1 7 THR C C 7.265 -8.058 8.744 . . . 1.0 . . . . . . . . . . . . A . 7 THR C . . . . . . . . . c19759_2mk7 1 . 13 . 2175 . 1 1 7 THR CA C 7.303 -9.179 7.709 . . . 1.0 . . . . . . . . . . . . A . 7 THR CA . . . . . . . . . c19759_2mk7 1 . 13 . 2176 . 1 1 7 THR CB C 6.894 -8.631 6.338 . . . 1.0 . . . . . . . . . . . . A . 7 THR CB . . . . . . . . . c19759_2mk7 1 . 13 . 2177 . 1 1 7 THR CG2 C 6.981 -9.740 5.289 . . . 1.0 . . . . . . . . . . . . A . 7 THR CG2 . . . . . . . . . c19759_2mk7 1 . 13 . 2178 . 1 1 7 THR H H 5.446 -10.181 7.932 . . . 1.0 . . . . . . . . . . . . A . 7 THR H . . . . . . . . . c19759_2mk7 1 . 13 . 2179 . 1 1 7 THR HA H 8.310 -9.561 7.644 . . . 1.0 . . . . . . . . . . . . A . 7 THR HA . . . . . . . . . c19759_2mk7 1 . 13 . 2180 . 1 1 7 THR HB H 7.549 -7.821 6.059 . . . 1.0 . . . . . . . . . . . . A . 7 THR HB . . . . . . . . . c19759_2mk7 1 . 13 . 2181 . 1 1 7 THR HG21 H 6.093 -10.352 5.339 . . . 1.0 . . . . . . . . . . . . A . 7 THR HG21 . . . . . . . . . c19759_2mk7 1 . 13 . 2182 . 1 1 7 THR HG22 H 7.850 -10.351 5.483 . . . 1.0 . . . . . . . . . . . . A . 7 THR HG22 . . . . . . . . . c19759_2mk7 1 . 13 . 2183 . 1 1 7 THR HG23 H 7.061 -9.301 4.307 . . . 1.0 . . . . . . . . . . . . A . 7 THR HG23 . . . . . . . . . c19759_2mk7 1 . 13 . 2184 . 1 1 7 THR N N 6.410 -10.264 8.092 . . . 1.0 . . . . . . . . . . . . A . 7 THR N . . . . . . . . . c19759_2mk7 1 . 13 . 2185 . 1 1 7 THR O O 6.270 -7.883 9.449 . . . 1.0 . . . . . . . . . . . . A . 7 THR O . . . . . . . . . c19759_2mk7 1 . 13 . 2186 . 1 1 7 THR OG1 O 5.557 -8.177 6.413 . . . 1.0 . . . . . . . . . . . . A . 7 THR OG1 . . . . . . . . . c19759_2mk7 1 . 13 . 2187 . 1 1 8 LYS C C 7.720 -4.970 9.231 . . . 1.0 . . . . . . . . . . . . A . 8 LYS C . . . . . . . . . c19759_2mk7 1 . 13 . 2188 . 1 1 8 LYS CA C 8.437 -6.199 9.778 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CA . . . . . . . . . c19759_2mk7 1 . 13 . 2189 . 1 1 8 LYS CB C 9.902 -5.857 10.056 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CB . . . . . . . . . c19759_2mk7 1 . 13 . 2190 . 1 1 8 LYS CD C 9.671 -5.493 12.518 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CD . . . . . . . . . c19759_2mk7 1 . 13 . 2191 . 1 1 8 LYS CE C 9.032 -6.371 13.595 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CE . . . . . . . . . c19759_2mk7 1 . 13 . 2192 . 1 1 8 LYS CG C 10.296 -6.381 11.440 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CG . . . . . . . . . c19759_2mk7 1 . 13 . 2193 . 1 1 8 LYS H H 9.116 -7.489 8.239 . . . 1.0 . . . . . . . . . . . . A . 8 LYS H . . . . . . . . . c19759_2mk7 1 . 13 . 2194 . 1 1 8 LYS HA H 7.967 -6.497 10.704 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HA . . . . . . . . . c19759_2mk7 1 . 13 . 2195 . 1 1 8 LYS HB2 H 10.528 -6.317 9.305 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HB2 . . . . . . . . . c19759_2mk7 1 . 13 . 2196 . 1 1 8 LYS HB3 H 10.034 -4.787 10.029 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HB3 . . . . . . . . . c19759_2mk7 1 . 13 . 2197 . 1 1 8 LYS HD2 H 10.438 -4.875 12.963 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HD2 . . . . . . . . . c19759_2mk7 1 . 13 . 2198 . 1 1 8 LYS HD3 H 8.915 -4.864 12.073 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HD3 . . . . . . . . . c19759_2mk7 1 . 13 . 2199 . 1 1 8 LYS HE2 H 9.724 -7.150 13.881 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HE2 . . . . . . . . . c19759_2mk7 1 . 13 . 2200 . 1 1 8 LYS HE3 H 8.795 -5.766 14.458 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HE3 . . . . . . . . . c19759_2mk7 1 . 13 . 2201 . 1 1 8 LYS HG2 H 9.940 -7.394 11.555 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HG2 . . . . . . . . . c19759_2mk7 1 . 13 . 2202 . 1 1 8 LYS HG3 H 11.371 -6.362 11.539 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HG3 . . . . . . . . . c19759_2mk7 1 . 13 . 2203 . 1 1 8 LYS HZ1 H 7.376 -7.619 13.774 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ1 . . . . . . . . . c19759_2mk7 1 . 13 . 2204 . 1 1 8 LYS HZ2 H 8.006 -7.525 12.200 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ2 . . . . . . . . . c19759_2mk7 1 . 13 . 2205 . 1 1 8 LYS HZ3 H 7.099 -6.235 12.834 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ3 . . . . . . . . . c19759_2mk7 1 . 13 . 2206 . 1 1 8 LYS N N 8.355 -7.302 8.828 . . . 1.0 . . . . . . . . . . . . A . 8 LYS N . . . . . . . . . c19759_2mk7 1 . 13 . 2207 . 1 1 8 LYS NZ N 7.784 -6.983 13.060 . . . 1.0 . . . . . . . . . . . . A . 8 LYS NZ . . . . . . . . . c19759_2mk7 1 . 13 . 2208 . 1 1 8 LYS O O 7.977 -4.538 8.107 . . . 1.0 . . . . . . . . . . . . A . 8 LYS O . . . . . . . . . c19759_2mk7 1 . 13 . 2209 . 1 1 9 LYS C C 7.006 -2.052 9.400 . . . 1.0 . . . . . . . . . . . . A . 9 LYS C . . . . . . . . . c19759_2mk7 1 . 13 . 2210 . 1 1 9 LYS CA C 6.066 -3.234 9.620 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CA . . . . . . . . . c19759_2mk7 1 . 13 . 2211 . 1 1 9 LYS CB C 5.031 -2.873 10.686 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CB . . . . . . . . . c19759_2mk7 1 . 13 . 2212 . 1 1 9 LYS CD C 4.408 -1.206 12.441 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CD . . . . . . . . . c19759_2mk7 1 . 13 . 2213 . 1 1 9 LYS CE C 3.181 -0.492 11.873 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CE . . . . . . . . . c19759_2mk7 1 . 13 . 2214 . 1 1 9 LYS CG C 5.386 -1.521 11.308 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CG . . . . . . . . . c19759_2mk7 1 . 13 . 2215 . 1 1 9 LYS H H 6.654 -4.803 10.917 . . . 1.0 . . . . . . . . . . . . A . 9 LYS H . . . . . . . . . c19759_2mk7 1 . 13 . 2216 . 1 1 9 LYS HA H 5.554 -3.450 8.695 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HA . . . . . . . . . c19759_2mk7 1 . 13 . 2217 . 1 1 9 LYS HB2 H 4.052 -2.816 10.232 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HB2 . . . . . . . . . c19759_2mk7 1 . 13 . 2218 . 1 1 9 LYS HB3 H 5.028 -3.630 11.455 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HB3 . . . . . . . . . c19759_2mk7 1 . 13 . 2219 . 1 1 9 LYS HD2 H 4.101 -2.127 12.918 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HD2 . . . . . . . . . c19759_2mk7 1 . 13 . 2220 . 1 1 9 LYS HD3 H 4.889 -0.569 13.166 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HD3 . . . . . . . . . c19759_2mk7 1 . 13 . 2221 . 1 1 9 LYS HE2 H 2.710 -1.119 11.130 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HE2 . . . . . . . . . c19759_2mk7 1 . 13 . 2222 . 1 1 9 LYS HE3 H 2.480 -0.291 12.670 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HE3 . . . . . . . . . c19759_2mk7 1 . 13 . 2223 . 1 1 9 LYS HG2 H 6.393 -1.558 11.700 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HG2 . . . . . . . . . c19759_2mk7 1 . 13 . 2224 . 1 1 9 LYS HG3 H 5.322 -0.750 10.555 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HG3 . . . . . . . . . c19759_2mk7 1 . 13 . 2225 . 1 1 9 LYS HZ1 H 2.760 1.369 11.038 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HZ1 . . . . . . . . . c19759_2mk7 1 . 13 . 2226 . 1 1 9 LYS HZ2 H 4.112 0.595 10.361 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HZ2 . . . . . . . . . c19759_2mk7 1 . 13 . 2227 . 1 1 9 LYS HZ3 H 4.222 1.312 11.897 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HZ3 . . . . . . . . . c19759_2mk7 1 . 13 . 2228 . 1 1 9 LYS N N 6.818 -4.413 10.033 . . . 1.0 . . . . . . . . . . . . A . 9 LYS N . . . . . . . . . c19759_2mk7 1 . 13 . 2229 . 1 1 9 LYS NZ N 3.601 0.793 11.245 . . . 1.0 . . . . . . . . . . . . A . 9 LYS NZ . . . . . . . . . c19759_2mk7 1 . 13 . 2230 . 1 1 9 LYS O O 8.092 -1.994 9.976 . . . 1.0 . . . . . . . . . . . . A . 9 LYS O . . . . . . . . . c19759_2mk7 1 . 13 . 2231 . 1 1 10 PRO C C 8.034 0.704 9.521 . . . 1.0 . . . . . . . . . . . . A . 10 PRO C . . . . . . . . . c19759_2mk7 1 . 13 . 2232 . 1 1 10 PRO CA C 7.418 0.087 8.267 . . . 1.0 . . . . . . . . . . . . A . 10 PRO CA . . . . . . . . . c19759_2mk7 1 . 13 . 2233 . 1 1 10 PRO CB C 6.424 1.061 7.612 . . . 1.0 . . . . . . . . . . . . A . 10 PRO CB . . . . . . . . . c19759_2mk7 1 . 13 . 2234 . 1 1 10 PRO CD C 5.330 -1.108 7.866 . . . 1.0 . . . . . . . . . . . . A . 10 PRO CD . . . . . . . . . c19759_2mk7 1 . 13 . 2235 . 1 1 10 PRO CG C 5.091 0.373 7.584 . . . 1.0 . . . . . . . . . . . . A . 10 PRO CG . . . . . . . . . c19759_2mk7 1 . 13 . 2236 . 1 1 10 PRO HA H 8.191 -0.164 7.560 . . . 1.0 . . . . . . . . . . . . A . 10 PRO HA . . . . . . . . . c19759_2mk7 1 . 13 . 2237 . 1 1 10 PRO HB2 H 6.362 1.970 8.194 . . . 1.0 . . . . . . . . . . . . A . 10 PRO HB2 . . . . . . . . . c19759_2mk7 1 . 13 . 2238 . 1 1 10 PRO HB3 H 6.741 1.287 6.605 . . . 1.0 . . . . . . . . . . . . A . 10 PRO HB3 . . . . . . . . . c19759_2mk7 1 . 13 . 2239 . 1 1 10 PRO HD2 H 4.539 -1.508 8.486 . . . 1.0 . . . . . . . . . . . . A . 10 PRO HD2 . . . . . . . . . c19759_2mk7 1 . 13 . 2240 . 1 1 10 PRO HD3 H 5.413 -1.663 6.946 . . . 1.0 . . . . . . . . . . . . A . 10 PRO HD3 . . . . . . . . . c19759_2mk7 1 . 13 . 2241 . 1 1 10 PRO HG2 H 4.446 0.796 8.343 . . . 1.0 . . . . . . . . . . . . A . 10 PRO HG2 . . . . . . . . . c19759_2mk7 1 . 13 . 2242 . 1 1 10 PRO HG3 H 4.640 0.488 6.610 . . . 1.0 . . . . . . . . . . . . A . 10 PRO HG3 . . . . . . . . . c19759_2mk7 1 . 13 . 2243 . 1 1 10 PRO N N 6.604 -1.118 8.582 . . . 1.0 . . . . . . . . . . . . A . 10 PRO N . . . . . . . . . c19759_2mk7 1 . 13 . 2244 . 1 1 10 PRO O O 7.521 0.512 10.624 . . . 1.0 . . . . . . . . . . . . A . 10 PRO O . . . . . . . . . c19759_2mk7 1 . 13 . 2245 . 1 1 11 NH2 HN1 H 9.957 1.117 9.788 . . . 1.0 . . . . . . . . . . . . A . 11 NH2 HN1 . . . . . . . . . c19759_2mk7 1 . 13 . 2246 . 1 1 11 NH2 HN2 H 9.070 2.299 8.952 . . . 1.0 . . . . . . . . . . . . A . 11 NH2 HN2 . . . . . . . . . c19759_2mk7 1 . 13 . 2247 . 1 1 11 NH2 N N 9.108 1.436 9.416 . . . 1.0 . . . . . . . . . . . . A . 11 NH2 N . . . . . . . . . c19759_2mk7 1 . 13 . 2248 . 2 2 1 A2G C1 C 1.931 -16.482 9.073 . . . 1.0 . . . . . . . . . . . . A . 101 A2G C1 . . . . . . . . . c19759_2mk7 1 . 13 . 2249 . 2 2 1 A2G C2 C 1.922 -16.694 10.592 . . . 1.0 . . . . . . . . . . . . A . 101 A2G C2 . . . . . . . . . c19759_2mk7 1 . 13 . 2250 . 2 2 1 A2G C3 C 0.674 -17.480 10.991 . . . 1.0 . . . . . . . . . . . . A . 101 A2G C3 . . . . . . . . . c19759_2mk7 1 . 13 . 2251 . 2 2 1 A2G C4 C -0.565 -16.752 10.477 . . . 1.0 . . . . . . . . . . . . A . 101 A2G C4 . . . . . . . . . c19759_2mk7 1 . 13 . 2252 . 2 2 1 A2G C5 C -0.436 -16.554 8.968 . . . 1.0 . . . . . . . . . . . . A . 101 A2G C5 . . . . . . . . . c19759_2mk7 1 . 13 . 2253 . 2 2 1 A2G C6 C -1.637 -15.763 8.447 . . . 1.0 . . . . . . . . . . . . A . 101 A2G C6 . . . . . . . . . c19759_2mk7 1 . 13 . 2254 . 2 2 1 A2G C7 C 3.990 -16.871 11.852 . . . 1.0 . . . . . . . . . . . . A . 101 A2G C7 . . . . . . . . . c19759_2mk7 1 . 13 . 2255 . 2 2 1 A2G C8 C 5.210 -17.717 12.199 . . . 1.0 . . . . . . . . . . . . A . 101 A2G C8 . . . . . . . . . c19759_2mk7 1 . 13 . 2256 . 2 2 1 A2G H1 H 2.780 -15.869 8.813 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H1 . . . . . . . . . c19759_2mk7 1 . 13 . 2257 . 2 2 1 A2G H14 H -1.861 -16.072 7.437 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H14 . . . . . . . . . c19759_2mk7 1 . 13 . 2258 . 2 2 1 A2G H15 H -2.819 -15.298 9.919 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H15 . . . . . . . . . c19759_2mk7 1 . 13 . 2259 . 2 2 1 A2G H2 H 1.903 -15.731 11.081 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H2 . . . . . . . . . c19759_2mk7 1 . 13 . 2260 . 2 2 1 A2G H3 H 0.717 -18.469 10.558 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H3 . . . . . . . . . c19759_2mk7 1 . 13 . 2261 . 2 2 1 A2G H4 H -1.445 -17.340 10.689 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H4 . . . . . . . . . c19759_2mk7 1 . 13 . 2262 . 2 2 1 A2G H5 H -0.394 -17.514 8.479 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H5 . . . . . . . . . c19759_2mk7 1 . 13 . 2263 . 2 2 1 A2G H6 H -1.406 -14.708 8.458 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H6 . . . . . . . . . c19759_2mk7 1 . 13 . 2264 . 2 2 1 A2G H8 H 4.973 -18.366 13.030 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H8 . . . . . . . . . c19759_2mk7 1 . 13 . 2265 . 2 2 1 A2G H8A H 6.031 -17.070 12.470 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H8A . . . . . . . . . c19759_2mk7 1 . 13 . 2266 . 2 2 1 A2G H8B H 5.489 -18.314 11.343 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H8B . . . . . . . . . c19759_2mk7 1 . 13 . 2267 . 2 2 1 A2G HN2 H 3.287 -18.313 10.655 . . . 1.0 . . . . . . . . . . . . A . 101 A2G HN2 . . . . . . . . . c19759_2mk7 1 . 13 . 2268 . 2 2 1 A2G HO3 H -0.108 -18.184 12.626 . . . 1.0 . . . . . . . . . . . . A . 101 A2G HO3 . . . . . . . . . c19759_2mk7 1 . 13 . 2269 . 2 2 1 A2G HO4 H 0.122 -15.350 11.636 . . . 1.0 . . . . . . . . . . . . A . 101 A2G HO4 . . . . . . . . . c19759_2mk7 1 . 13 . 2270 . 2 2 1 A2G N2 N 3.121 -17.414 11.006 . . . 1.0 . . . . . . . . . . . . A . 101 A2G N2 . . . . . . . . . c19759_2mk7 1 . 13 . 2271 . 2 2 1 A2G O O 0.739 -15.814 8.701 . . . 1.0 . . . . . . . . . . . . A . 101 A2G O . . . . . . . . . c19759_2mk7 1 . 13 . 2272 . 2 2 1 A2G O3 O 0.608 -17.584 12.406 . . . 1.0 . . . . . . . . . . . . A . 101 A2G O3 . . . . . . . . . c19759_2mk7 1 . 13 . 2273 . 2 2 1 A2G O4 O -0.672 -15.488 11.115 . . . 1.0 . . . . . . . . . . . . A . 101 A2G O4 . . . . . . . . . c19759_2mk7 1 . 13 . 2274 . 2 2 1 A2G O6 O -2.763 -16.009 9.277 . . . 1.0 . . . . . . . . . . . . A . 101 A2G O6 . . . . . . . . . c19759_2mk7 1 . 13 . 2275 . 2 2 1 A2G O7 O 3.845 -15.747 12.333 . . . 1.0 . . . . . . . . . . . . A . 101 A2G O7 . . . . . . . . . c19759_2mk7 1 . 14 . 2276 . 1 1 1 ACE C C -2.238 -23.148 8.562 . . . 1.0 . . . . . . . . . . . . A . 1 ACE C . . . . . . . . . c19759_2mk7 1 . 14 . 2277 . 1 1 1 ACE CH3 C -3.728 -22.823 8.590 . . . 1.0 . . . . . . . . . . . . A . 1 ACE CH3 . . . . . . . . . c19759_2mk7 1 . 14 . 2278 . 1 1 1 ACE H1 H -4.283 -23.644 8.161 . . . 1.0 . . . . . . . . . . . . A . 1 ACE H1 . . . . . . . . . c19759_2mk7 1 . 14 . 2279 . 1 1 1 ACE H2 H -3.911 -21.926 8.016 . . . 1.0 . . . . . . . . . . . . A . 1 ACE H2 . . . . . . . . . c19759_2mk7 1 . 14 . 2280 . 1 1 1 ACE H3 H -4.043 -22.669 9.610 . . . 1.0 . . . . . . . . . . . . A . 1 ACE H3 . . . . . . . . . c19759_2mk7 1 . 14 . 2281 . 1 1 1 ACE O O -1.638 -23.455 9.593 . . . 1.0 . . . . . . . . . . . . A . 1 ACE O . . . . . . . . . c19759_2mk7 1 . 14 . 2282 . 1 1 2 PRO C C 0.689 -22.229 7.716 . . . 1.0 . . . . . . . . . . . . A . 2 PRO C . . . . . . . . . c19759_2mk7 1 . 14 . 2283 . 1 1 2 PRO CA C -0.192 -23.375 7.222 . . . 1.0 . . . . . . . . . . . . A . 2 PRO CA . . . . . . . . . c19759_2mk7 1 . 14 . 2284 . 1 1 2 PRO CB C -0.026 -23.572 5.707 . . . 1.0 . . . . . . . . . . . . A . 2 PRO CB . . . . . . . . . c19759_2mk7 1 . 14 . 2285 . 1 1 2 PRO CD C -2.279 -22.733 6.138 . . . 1.0 . . . . . . . . . . . . A . 2 PRO CD . . . . . . . . . c19759_2mk7 1 . 14 . 2286 . 1 1 2 PRO CG C -1.384 -23.391 5.091 . . . 1.0 . . . . . . . . . . . . A . 2 PRO CG . . . . . . . . . c19759_2mk7 1 . 14 . 2287 . 1 1 2 PRO HA H 0.070 -24.288 7.731 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HA . . . . . . . . . c19759_2mk7 1 . 14 . 2288 . 1 1 2 PRO HB2 H 0.660 -22.837 5.312 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HB2 . . . . . . . . . c19759_2mk7 1 . 14 . 2289 . 1 1 2 PRO HB3 H 0.338 -24.567 5.501 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HB3 . . . . . . . . . c19759_2mk7 1 . 14 . 2290 . 1 1 2 PRO HD2 H -2.296 -21.660 6.003 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HD2 . . . . . . . . . c19759_2mk7 1 . 14 . 2291 . 1 1 2 PRO HD3 H -3.277 -23.141 6.096 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HD3 . . . . . . . . . c19759_2mk7 1 . 14 . 2292 . 1 1 2 PRO HG2 H -1.308 -22.757 4.217 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HG2 . . . . . . . . . c19759_2mk7 1 . 14 . 2293 . 1 1 2 PRO HG3 H -1.793 -24.350 4.816 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HG3 . . . . . . . . . c19759_2mk7 1 . 14 . 2294 . 1 1 2 PRO N N -1.639 -23.086 7.404 . . . 1.0 . . . . . . . . . . . . A . 2 PRO N . . . . . . . . . c19759_2mk7 1 . 14 . 2295 . 1 1 2 PRO O O 0.219 -21.107 7.906 . . . 1.0 . . . . . . . . . . . . A . 2 PRO O . . . . . . . . . c19759_2mk7 1 . 14 . 2296 . 1 1 3 PRO C C 2.780 -20.145 7.690 . . . 1.0 . . . . . . . . . . . . A . 3 PRO C . . . . . . . . . c19759_2mk7 1 . 14 . 2297 . 1 1 3 PRO CA C 2.930 -21.481 8.412 . . . 1.0 . . . . . . . . . . . . A . 3 PRO CA . . . . . . . . . c19759_2mk7 1 . 14 . 2298 . 1 1 3 PRO CB C 4.305 -22.106 8.121 . . . 1.0 . . . . . . . . . . . . A . 3 PRO CB . . . . . . . . . c19759_2mk7 1 . 14 . 2299 . 1 1 3 PRO CD C 2.591 -23.800 7.722 . . . 1.0 . . . . . . . . . . . . A . 3 PRO CD . . . . . . . . . c19759_2mk7 1 . 14 . 2300 . 1 1 3 PRO CG C 4.056 -23.443 7.483 . . . 1.0 . . . . . . . . . . . . A . 3 PRO CG . . . . . . . . . c19759_2mk7 1 . 14 . 2301 . 1 1 3 PRO HA H 2.819 -21.342 9.475 . . . 1.0 . . . . . . . . . . . . A . 3 PRO HA . . . . . . . . . c19759_2mk7 1 . 14 . 2302 . 1 1 3 PRO HB2 H 4.863 -21.472 7.448 . . . 1.0 . . . . . . . . . . . . A . 3 PRO HB2 . . . . . . . . . c19759_2mk7 1 . 14 . 2303 . 1 1 3 PRO HB3 H 4.852 -22.239 9.043 . . . 1.0 . . . . . . . . . . . . A . 3 PRO HB3 . . . . . . . . . c19759_2mk7 1 . 14 . 2304 . 1 1 3 PRO HD2 H 2.177 -24.301 6.857 . . . 1.0 . . . . . . . . . . . . A . 3 PRO HD2 . . . . . . . . . c19759_2mk7 1 . 14 . 2305 . 1 1 3 PRO HD3 H 2.486 -24.411 8.606 . . . 1.0 . . . . . . . . . . . . A . 3 PRO HD3 . . . . . . . . . c19759_2mk7 1 . 14 . 2306 . 1 1 3 PRO HG2 H 4.254 -23.383 6.421 . . . 1.0 . . . . . . . . . . . . A . 3 PRO HG2 . . . . . . . . . c19759_2mk7 1 . 14 . 2307 . 1 1 3 PRO HG3 H 4.689 -24.191 7.935 . . . 1.0 . . . . . . . . . . . . A . 3 PRO HG3 . . . . . . . . . c19759_2mk7 1 . 14 . 2308 . 1 1 3 PRO N N 1.952 -22.497 7.925 . . . 1.0 . . . . . . . . . . . . A . 3 PRO N . . . . . . . . . c19759_2mk7 1 . 14 . 2309 . 1 1 3 PRO O O 2.286 -20.089 6.566 . . . 1.0 . . . . . . . . . . . . A . 3 PRO O . . . . . . . . . c19759_2mk7 1 . 14 . 2310 . 1 1 4 THR C C 4.329 -16.894 8.160 . . . 1.0 . . . . . . . . . . . . A . 4 THR C . . . . . . . . . c19759_2mk7 1 . 14 . 2311 . 1 1 4 THR CA C 3.124 -17.738 7.755 . . . 1.0 . . . . . . . . . . . . A . 4 THR CA . . . . . . . . . c19759_2mk7 1 . 14 . 2312 . 1 1 4 THR CB C 1.838 -17.042 8.211 . . . 1.0 . . . . . . . . . . . . A . 4 THR CB . . . . . . . . . c19759_2mk7 1 . 14 . 2313 . 1 1 4 THR CG2 C 0.622 -17.839 7.737 . . . 1.0 . . . . . . . . . . . . A . 4 THR CG2 . . . . . . . . . c19759_2mk7 1 . 14 . 2314 . 1 1 4 THR H H 3.602 -19.178 9.237 . . . 1.0 . . . . . . . . . . . . A . 4 THR H . . . . . . . . . c19759_2mk7 1 . 14 . 2315 . 1 1 4 THR HA H 3.107 -17.832 6.680 . . . 1.0 . . . . . . . . . . . . A . 4 THR HA . . . . . . . . . c19759_2mk7 1 . 14 . 2316 . 1 1 4 THR HB H 1.797 -16.047 7.797 . . . 1.0 . . . . . . . . . . . . A . 4 THR HB . . . . . . . . . c19759_2mk7 1 . 14 . 2317 . 1 1 4 THR HG21 H 0.830 -18.274 6.770 . . . 1.0 . . . . . . . . . . . . A . 4 THR HG21 . . . . . . . . . c19759_2mk7 1 . 14 . 2318 . 1 1 4 THR HG22 H -0.232 -17.182 7.660 . . . 1.0 . . . . . . . . . . . . A . 4 THR HG22 . . . . . . . . . c19759_2mk7 1 . 14 . 2319 . 1 1 4 THR HG23 H 0.409 -18.625 8.446 . . . 1.0 . . . . . . . . . . . . A . 4 THR HG23 . . . . . . . . . c19759_2mk7 1 . 14 . 2320 . 1 1 4 THR N N 3.213 -19.072 8.344 . . . 1.0 . . . . . . . . . . . . A . 4 THR N . . . . . . . . . c19759_2mk7 1 . 14 . 2321 . 1 1 4 THR O O 4.743 -16.902 9.318 . . . 1.0 . . . . . . . . . . . . A . 4 THR O . . . . . . . . . c19759_2mk7 1 . 14 . 2322 . 1 1 4 THR OG1 O 1.824 -16.986 9.620 . . . 1.0 . . . . . . . . . . . . A . 4 THR OG1 . . . . . . . . . c19759_2mk7 1 . 14 . 2323 . 1 1 5 THR C C 5.635 -13.851 7.509 . . . 1.0 . . . . . . . . . . . . A . 5 THR C . . . . . . . . . c19759_2mk7 1 . 14 . 2324 . 1 1 5 THR CA C 6.043 -15.320 7.467 . . . 1.0 . . . . . . . . . . . . A . 5 THR CA . . . . . . . . . c19759_2mk7 1 . 14 . 2325 . 1 1 5 THR CB C 7.105 -15.526 6.385 . . . 1.0 . . . . . . . . . . . . A . 5 THR CB . . . . . . . . . c19759_2mk7 1 . 14 . 2326 . 1 1 5 THR CG2 C 7.418 -17.016 6.242 . . . 1.0 . . . . . . . . . . . . A . 5 THR CG2 . . . . . . . . . c19759_2mk7 1 . 14 . 2327 . 1 1 5 THR H H 4.513 -16.198 6.292 . . . 1.0 . . . . . . . . . . . . A . 5 THR H . . . . . . . . . c19759_2mk7 1 . 14 . 2328 . 1 1 5 THR HA H 6.462 -15.594 8.423 . . . 1.0 . . . . . . . . . . . . A . 5 THR HA . . . . . . . . . c19759_2mk7 1 . 14 . 2329 . 1 1 5 THR HB H 8.005 -14.993 6.651 . . . 1.0 . . . . . . . . . . . . A . 5 THR HB . . . . . . . . . c19759_2mk7 1 . 14 . 2330 . 1 1 5 THR HG21 H 8.485 -17.168 6.318 . . . 1.0 . . . . . . . . . . . . A . 5 THR HG21 . . . . . . . . . c19759_2mk7 1 . 14 . 2331 . 1 1 5 THR HG22 H 7.071 -17.366 5.281 . . . 1.0 . . . . . . . . . . . . A . 5 THR HG22 . . . . . . . . . c19759_2mk7 1 . 14 . 2332 . 1 1 5 THR HG23 H 6.919 -17.566 7.027 . . . 1.0 . . . . . . . . . . . . A . 5 THR HG23 . . . . . . . . . c19759_2mk7 1 . 14 . 2333 . 1 1 5 THR N N 4.886 -16.166 7.197 . . . 1.0 . . . . . . . . . . . . A . 5 THR N . . . . . . . . . c19759_2mk7 1 . 14 . 2334 . 1 1 5 THR O O 4.793 -13.407 6.727 . . . 1.0 . . . . . . . . . . . . A . 5 THR O . . . . . . . . . c19759_2mk7 1 . 14 . 2335 . 1 1 5 THR OG1 O 6.597 -15.048 5.159 . . . 1.0 . . . . . . . . . . . . A . 5 THR OG1 . . . . . . . . . c19759_2mk7 1 . 14 . 2336 . 1 1 6 THR C C 7.052 -10.832 7.987 . . . 1.0 . . . . . . . . . . . . A . 6 THR C . . . . . . . . . c19759_2mk7 1 . 14 . 2337 . 1 1 6 THR CA C 5.925 -11.683 8.564 . . . 1.0 . . . . . . . . . . . . A . 6 THR CA . . . . . . . . . c19759_2mk7 1 . 14 . 2338 . 1 1 6 THR CB C 5.720 -11.332 10.039 . . . 1.0 . . . . . . . . . . . . A . 6 THR CB . . . . . . . . . c19759_2mk7 1 . 14 . 2339 . 1 1 6 THR CG2 C 4.682 -12.269 10.657 . . . 1.0 . . . . . . . . . . . . A . 6 THR CG2 . . . . . . . . . c19759_2mk7 1 . 14 . 2340 . 1 1 6 THR H H 6.895 -13.510 9.026 . . . 1.0 . . . . . . . . . . . . A . 6 THR H . . . . . . . . . c19759_2mk7 1 . 14 . 2341 . 1 1 6 THR HA H 5.015 -11.470 8.026 . . . 1.0 . . . . . . . . . . . . A . 6 THR HA . . . . . . . . . c19759_2mk7 1 . 14 . 2342 . 1 1 6 THR HB H 5.381 -10.311 10.128 . . . 1.0 . . . . . . . . . . . . A . 6 THR HB . . . . . . . . . c19759_2mk7 1 . 14 . 2343 . 1 1 6 THR HG21 H 4.283 -11.822 11.555 . . . 1.0 . . . . . . . . . . . . A . 6 THR HG21 . . . . . . . . . c19759_2mk7 1 . 14 . 2344 . 1 1 6 THR HG22 H 5.148 -13.212 10.899 . . . 1.0 . . . . . . . . . . . . A . 6 THR HG22 . . . . . . . . . c19759_2mk7 1 . 14 . 2345 . 1 1 6 THR HG23 H 3.881 -12.434 9.951 . . . 1.0 . . . . . . . . . . . . A . 6 THR HG23 . . . . . . . . . c19759_2mk7 1 . 14 . 2346 . 1 1 6 THR N N 6.234 -13.102 8.429 . . . 1.0 . . . . . . . . . . . . A . 6 THR N . . . . . . . . . c19759_2mk7 1 . 14 . 2347 . 1 1 6 THR O O 8.195 -11.279 7.893 . . . 1.0 . . . . . . . . . . . . A . 6 THR O . . . . . . . . . c19759_2mk7 1 . 14 . 2348 . 1 1 6 THR OG1 O 6.946 -11.501 10.717 . . . 1.0 . . . . . . . . . . . . A . 6 THR OG1 . . . . . . . . . c19759_2mk7 1 . 14 . 2349 . 1 1 7 THR C C 7.519 -7.284 7.574 . . . 1.0 . . . . . . . . . . . . A . 7 THR C . . . . . . . . . c19759_2mk7 1 . 14 . 2350 . 1 1 7 THR CA C 7.714 -8.697 7.036 . . . 1.0 . . . . . . . . . . . . A . 7 THR CA . . . . . . . . . c19759_2mk7 1 . 14 . 2351 . 1 1 7 THR CB C 7.602 -8.687 5.510 . . . 1.0 . . . . . . . . . . . . A . 7 THR CB . . . . . . . . . c19759_2mk7 1 . 14 . 2352 . 1 1 7 THR CG2 C 7.734 -10.111 4.969 . . . 1.0 . . . . . . . . . . . . A . 7 THR CG2 . . . . . . . . . c19759_2mk7 1 . 14 . 2353 . 1 1 7 THR H H 5.795 -9.301 7.700 . . . 1.0 . . . . . . . . . . . . A . 7 THR H . . . . . . . . . c19759_2mk7 1 . 14 . 2354 . 1 1 7 THR HA H 8.700 -9.043 7.309 . . . 1.0 . . . . . . . . . . . . A . 7 THR HA . . . . . . . . . c19759_2mk7 1 . 14 . 2355 . 1 1 7 THR HB H 8.381 -8.069 5.090 . . . 1.0 . . . . . . . . . . . . A . 7 THR HB . . . . . . . . . c19759_2mk7 1 . 14 . 2356 . 1 1 7 THR HG21 H 6.850 -10.676 5.223 . . . 1.0 . . . . . . . . . . . . A . 7 THR HG21 . . . . . . . . . c19759_2mk7 1 . 14 . 2357 . 1 1 7 THR HG22 H 8.602 -10.583 5.406 . . . 1.0 . . . . . . . . . . . . A . 7 THR HG22 . . . . . . . . . c19759_2mk7 1 . 14 . 2358 . 1 1 7 THR HG23 H 7.844 -10.079 3.895 . . . 1.0 . . . . . . . . . . . . A . 7 THR HG23 . . . . . . . . . c19759_2mk7 1 . 14 . 2359 . 1 1 7 THR N N 6.722 -9.603 7.603 . . . 1.0 . . . . . . . . . . . . A . 7 THR N . . . . . . . . . c19759_2mk7 1 . 14 . 2360 . 1 1 7 THR O O 6.440 -6.704 7.445 . . . 1.0 . . . . . . . . . . . . A . 7 THR O . . . . . . . . . c19759_2mk7 1 . 14 . 2361 . 1 1 7 THR OG1 O 6.334 -8.182 5.156 . . . 1.0 . . . . . . . . . . . . A . 7 THR OG1 . . . . . . . . . c19759_2mk7 1 . 14 . 2362 . 1 1 8 LYS C C 7.663 -5.375 10.005 . . . 1.0 . . . . . . . . . . . . A . 8 LYS C . . . . . . . . . c19759_2mk7 1 . 14 . 2363 . 1 1 8 LYS CA C 8.500 -5.388 8.731 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CA . . . . . . . . . c19759_2mk7 1 . 14 . 2364 . 1 1 8 LYS CB C 7.888 -4.432 7.705 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CB . . . . . . . . . c19759_2mk7 1 . 14 . 2365 . 1 1 8 LYS CD C 7.852 -2.072 6.885 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CD . . . . . . . . . c19759_2mk7 1 . 14 . 2366 . 1 1 8 LYS CE C 8.126 -0.631 7.322 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CE . . . . . . . . . c19759_2mk7 1 . 14 . 2367 . 1 1 8 LYS CG C 8.498 -3.039 7.878 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CG . . . . . . . . . c19759_2mk7 1 . 14 . 2368 . 1 1 8 LYS H H 9.402 -7.244 8.250 . . . 1.0 . . . . . . . . . . . . A . 8 LYS H . . . . . . . . . c19759_2mk7 1 . 14 . 2369 . 1 1 8 LYS HA H 9.500 -5.054 8.965 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HA . . . . . . . . . c19759_2mk7 1 . 14 . 2370 . 1 1 8 LYS HB2 H 8.094 -4.794 6.708 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HB2 . . . . . . . . . c19759_2mk7 1 . 14 . 2371 . 1 1 8 LYS HB3 H 6.821 -4.377 7.856 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HB3 . . . . . . . . . c19759_2mk7 1 . 14 . 2372 . 1 1 8 LYS HD2 H 8.268 -2.235 5.901 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HD2 . . . . . . . . . c19759_2mk7 1 . 14 . 2373 . 1 1 8 LYS HD3 H 6.786 -2.241 6.858 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HD3 . . . . . . . . . c19759_2mk7 1 . 14 . 2374 . 1 1 8 LYS HE2 H 8.155 0.009 6.453 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HE2 . . . . . . . . . c19759_2mk7 1 . 14 . 2375 . 1 1 8 LYS HE3 H 7.341 -0.301 7.986 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HE3 . . . . . . . . . c19759_2mk7 1 . 14 . 2376 . 1 1 8 LYS HG2 H 8.322 -2.692 8.887 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HG2 . . . . . . . . . c19759_2mk7 1 . 14 . 2377 . 1 1 8 LYS HG3 H 9.560 -3.085 7.694 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HG3 . . . . . . . . . c19759_2mk7 1 . 14 . 2378 . 1 1 8 LYS HZ1 H 10.051 -1.333 7.691 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ1 . . . . . . . . . c19759_2mk7 1 . 14 . 2379 . 1 1 8 LYS HZ2 H 9.281 -0.675 9.054 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ2 . . . . . . . . . c19759_2mk7 1 . 14 . 2380 . 1 1 8 LYS HZ3 H 9.889 0.349 7.842 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ3 . . . . . . . . . c19759_2mk7 1 . 14 . 2381 . 1 1 8 LYS N N 8.568 -6.735 8.176 . . . 1.0 . . . . . . . . . . . . A . 8 LYS N . . . . . . . . . c19759_2mk7 1 . 14 . 2382 . 1 1 8 LYS NZ N 9.436 -0.568 8.030 . . . 1.0 . . . . . . . . . . . . A . 8 LYS NZ . . . . . . . . . c19759_2mk7 1 . 14 . 2383 . 1 1 8 LYS O O 6.949 -6.333 10.300 . . . 1.0 . . . . . . . . . . . . A . 8 LYS O . . . . . . . . . c19759_2mk7 1 . 14 . 2384 . 1 1 9 LYS C C 5.502 -4.170 11.719 . . . 1.0 . . . . . . . . . . . . A . 9 LYS C . . . . . . . . . c19759_2mk7 1 . 14 . 2385 . 1 1 9 LYS CA C 7.000 -4.157 11.999 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CA . . . . . . . . . c19759_2mk7 1 . 14 . 2386 . 1 1 9 LYS CB C 7.377 -2.855 12.708 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CB . . . . . . . . . c19759_2mk7 1 . 14 . 2387 . 1 1 9 LYS CD C 8.951 -1.801 14.339 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CD . . . . . . . . . c19759_2mk7 1 . 14 . 2388 . 1 1 9 LYS CE C 10.219 -2.024 15.165 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CE . . . . . . . . . c19759_2mk7 1 . 14 . 2389 . 1 1 9 LYS CG C 8.542 -3.113 13.666 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CG . . . . . . . . . c19759_2mk7 1 . 14 . 2390 . 1 1 9 LYS H H 8.341 -3.551 10.473 . . . 1.0 . . . . . . . . . . . . A . 9 LYS H . . . . . . . . . c19759_2mk7 1 . 14 . 2391 . 1 1 9 LYS HA H 7.245 -4.988 12.643 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HA . . . . . . . . . c19759_2mk7 1 . 14 . 2392 . 1 1 9 LYS HB2 H 7.669 -2.117 11.975 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HB2 . . . . . . . . . c19759_2mk7 1 . 14 . 2393 . 1 1 9 LYS HB3 H 6.528 -2.491 13.268 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HB3 . . . . . . . . . c19759_2mk7 1 . 14 . 2394 . 1 1 9 LYS HD2 H 9.140 -1.053 13.583 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HD2 . . . . . . . . . c19759_2mk7 1 . 14 . 2395 . 1 1 9 LYS HD3 H 8.156 -1.466 14.987 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HD3 . . . . . . . . . c19759_2mk7 1 . 14 . 2396 . 1 1 9 LYS HE2 H 11.002 -2.409 14.528 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HE2 . . . . . . . . . c19759_2mk7 1 . 14 . 2397 . 1 1 9 LYS HE3 H 10.536 -1.087 15.598 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HE3 . . . . . . . . . c19759_2mk7 1 . 14 . 2398 . 1 1 9 LYS HG2 H 8.238 -3.826 14.420 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HG2 . . . . . . . . . c19759_2mk7 1 . 14 . 2399 . 1 1 9 LYS HG3 H 9.381 -3.509 13.114 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HG3 . . . . . . . . . c19759_2mk7 1 . 14 . 2400 . 1 1 9 LYS HZ1 H 8.980 -3.391 16.132 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HZ1 . . . . . . . . . c19759_2mk7 1 . 14 . 2401 . 1 1 9 LYS HZ2 H 10.008 -2.528 17.174 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HZ2 . . . . . . . . . c19759_2mk7 1 . 14 . 2402 . 1 1 9 LYS HZ3 H 10.629 -3.780 16.208 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HZ3 . . . . . . . . . c19759_2mk7 1 . 14 . 2403 . 1 1 9 LYS N N 7.755 -4.283 10.757 . . . 1.0 . . . . . . . . . . . . A . 9 LYS N . . . . . . . . . c19759_2mk7 1 . 14 . 2404 . 1 1 9 LYS NZ N 9.938 -3.005 16.251 . . . 1.0 . . . . . . . . . . . . A . 9 LYS NZ . . . . . . . . . c19759_2mk7 1 . 14 . 2405 . 1 1 9 LYS O O 5.060 -3.821 10.625 . . . 1.0 . . . . . . . . . . . . A . 9 LYS O . . . . . . . . . c19759_2mk7 1 . 14 . 2406 . 1 1 10 PRO C C 2.666 -3.393 11.885 . . . 1.0 . . . . . . . . . . . . A . 10 PRO C . . . . . . . . . c19759_2mk7 1 . 14 . 2407 . 1 1 10 PRO CA C 3.241 -4.637 12.558 . . . 1.0 . . . . . . . . . . . . A . 10 PRO CA . . . . . . . . . c19759_2mk7 1 . 14 . 2408 . 1 1 10 PRO CB C 2.734 -4.758 14.005 . . . 1.0 . . . . . . . . . . . . A . 10 PRO CB . . . . . . . . . c19759_2mk7 1 . 14 . 2409 . 1 1 10 PRO CD C 5.166 -4.991 14.013 . . . 1.0 . . . . . . . . . . . . A . 10 PRO CD . . . . . . . . . c19759_2mk7 1 . 14 . 2410 . 1 1 10 PRO CG C 3.943 -4.748 14.895 . . . 1.0 . . . . . . . . . . . . A . 10 PRO CG . . . . . . . . . c19759_2mk7 1 . 14 . 2411 . 1 1 10 PRO HA H 2.960 -5.519 12.006 . . . 1.0 . . . . . . . . . . . . A . 10 PRO HA . . . . . . . . . c19759_2mk7 1 . 14 . 2412 . 1 1 10 PRO HB2 H 2.093 -3.921 14.241 . . . 1.0 . . . . . . . . . . . . A . 10 PRO HB2 . . . . . . . . . c19759_2mk7 1 . 14 . 2413 . 1 1 10 PRO HB3 H 2.196 -5.684 14.130 . . . 1.0 . . . . . . . . . . . . A . 10 PRO HB3 . . . . . . . . . c19759_2mk7 1 . 14 . 2414 . 1 1 10 PRO HD2 H 6.001 -4.390 14.348 . . . 1.0 . . . . . . . . . . . . A . 10 PRO HD2 . . . . . . . . . c19759_2mk7 1 . 14 . 2415 . 1 1 10 PRO HD3 H 5.427 -6.038 14.003 . . . 1.0 . . . . . . . . . . . . A . 10 PRO HD3 . . . . . . . . . c19759_2mk7 1 . 14 . 2416 . 1 1 10 PRO HG2 H 4.027 -3.788 15.388 . . . 1.0 . . . . . . . . . . . . A . 10 PRO HG2 . . . . . . . . . c19759_2mk7 1 . 14 . 2417 . 1 1 10 PRO HG3 H 3.865 -5.534 15.630 . . . 1.0 . . . . . . . . . . . . A . 10 PRO HG3 . . . . . . . . . c19759_2mk7 1 . 14 . 2418 . 1 1 10 PRO N N 4.721 -4.566 12.687 . . . 1.0 . . . . . . . . . . . . A . 10 PRO N . . . . . . . . . c19759_2mk7 1 . 14 . 2419 . 1 1 10 PRO O O 2.547 -2.343 12.517 . . . 1.0 . . . . . . . . . . . . A . 10 PRO O . . . . . . . . . c19759_2mk7 1 . 14 . 2420 . 1 1 11 NH2 HN1 H 1.563 -2.891 10.313 . . . 1.0 . . . . . . . . . . . . A . 11 NH2 HN1 . . . . . . . . . c19759_2mk7 1 . 14 . 2421 . 1 1 11 NH2 HN2 H 2.773 -4.042 10.012 . . . 1.0 . . . . . . . . . . . . A . 11 NH2 HN2 . . . . . . . . . c19759_2mk7 1 . 14 . 2422 . 1 1 11 NH2 N N 2.302 -3.449 10.634 . . . 1.0 . . . . . . . . . . . . A . 11 NH2 N . . . . . . . . . c19759_2mk7 1 . 14 . 2423 . 2 2 1 A2G C1 C 1.923 -15.665 10.106 . . . 1.0 . . . . . . . . . . . . A . 101 A2G C1 . . . . . . . . . c19759_2mk7 1 . 14 . 2424 . 2 2 1 A2G C2 C 2.109 -15.724 11.625 . . . 1.0 . . . . . . . . . . . . A . 101 A2G C2 . . . . . . . . . c19759_2mk7 1 . 14 . 2425 . 2 2 1 A2G C3 C 0.870 -16.359 12.263 . . . 1.0 . . . . . . . . . . . . A . 101 A2G C3 . . . . . . . . . c19759_2mk7 1 . 14 . 2426 . 2 2 1 A2G C4 C -0.382 -15.607 11.808 . . . 1.0 . . . . . . . . . . . . A . 101 A2G C4 . . . . . . . . . c19759_2mk7 1 . 14 . 2427 . 2 2 1 A2G C5 C -0.414 -15.550 10.281 . . . 1.0 . . . . . . . . . . . . A . 101 A2G C5 . . . . . . . . . c19759_2mk7 1 . 14 . 2428 . 2 2 1 A2G C6 C -1.621 -14.732 9.820 . . . 1.0 . . . . . . . . . . . . A . 101 A2G C6 . . . . . . . . . c19759_2mk7 1 . 14 . 2429 . 2 2 1 A2G C7 C 4.394 -15.911 12.416 . . . 1.0 . . . . . . . . . . . . A . 101 A2G C7 . . . . . . . . . c19759_2mk7 1 . 14 . 2430 . 2 2 1 A2G C8 C 5.615 -16.810 12.634 . . . 1.0 . . . . . . . . . . . . A . 101 A2G C8 . . . . . . . . . c19759_2mk7 1 . 14 . 2431 . 2 2 1 A2G H1 H 2.781 -15.180 9.663 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H1 . . . . . . . . . c19759_2mk7 1 . 14 . 2432 . 2 2 1 A2G H14 H -1.954 -15.092 8.858 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H14 . . . . . . . . . c19759_2mk7 1 . 14 . 2433 . 2 2 1 A2G H15 H -3.011 -13.989 10.958 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H15 . . . . . . . . . c19759_2mk7 1 . 14 . 2434 . 2 2 1 A2G H2 H 2.229 -14.720 12.003 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H2 . . . . . . . . . c19759_2mk7 1 . 14 . 2435 . 2 2 1 A2G H3 H 0.799 -17.393 11.959 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H3 . . . . . . . . . c19759_2mk7 1 . 14 . 2436 . 2 2 1 A2G H4 H -1.260 -16.120 12.168 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H4 . . . . . . . . . c19759_2mk7 1 . 14 . 2437 . 2 2 1 A2G H5 H -0.476 -16.551 9.879 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H5 . . . . . . . . . c19759_2mk7 1 . 14 . 2438 . 2 2 1 A2G H6 H -1.342 -13.692 9.738 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H6 . . . . . . . . . c19759_2mk7 1 . 14 . 2439 . 2 2 1 A2G H8 H 5.351 -17.623 13.295 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H8 . . . . . . . . . c19759_2mk7 1 . 14 . 2440 . 2 2 1 A2G H8A H 6.412 -16.231 13.078 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H8A . . . . . . . . . c19759_2mk7 1 . 14 . 2441 . 2 2 1 A2G H8B H 5.947 -17.209 11.686 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H8B . . . . . . . . . c19759_2mk7 1 . 14 . 2442 . 2 2 1 A2G HN2 H 3.339 -17.445 11.687 . . . 1.0 . . . . . . . . . . . . A . 101 A2G HN2 . . . . . . . . . c19759_2mk7 1 . 14 . 2443 . 2 2 1 A2G HO3 H 0.440 -15.553 13.978 . . . 1.0 . . . . . . . . . . . . A . 101 A2G HO3 . . . . . . . . . c19759_2mk7 1 . 14 . 2444 . 2 2 1 A2G HO4 H 0.562 -14.017 12.413 . . . 1.0 . . . . . . . . . . . . A . 101 A2G HO4 . . . . . . . . . c19759_2mk7 1 . 14 . 2445 . 2 2 1 A2G N2 N 3.297 -16.503 11.954 . . . 1.0 . . . . . . . . . . . . A . 101 A2G N2 . . . . . . . . . c19759_2mk7 1 . 14 . 2446 . 2 2 1 A2G O O 0.761 -14.915 9.828 . . . 1.0 . . . . . . . . . . . . A . 101 A2G O . . . . . . . . . c19759_2mk7 1 . 14 . 2447 . 2 2 1 A2G O3 O 0.978 -16.289 13.676 . . . 1.0 . . . . . . . . . . . . A . 101 A2G O3 . . . . . . . . . c19759_2mk7 1 . 14 . 2448 . 2 2 1 A2G O4 O -0.356 -14.287 12.332 . . . 1.0 . . . . . . . . . . . . A . 101 A2G O4 . . . . . . . . . c19759_2mk7 1 . 14 . 2449 . 2 2 1 A2G O6 O -2.673 -14.866 10.765 . . . 1.0 . . . . . . . . . . . . A . 101 A2G O6 . . . . . . . . . c19759_2mk7 1 . 14 . 2450 . 2 2 1 A2G O7 O 4.472 -14.695 12.588 . . . 1.0 . . . . . . . . . . . . A . 101 A2G O7 . . . . . . . . . c19759_2mk7 1 . 15 . 2451 . 1 1 1 ACE C C -0.087 -24.704 6.265 . . . 1.0 . . . . . . . . . . . . A . 1 ACE C . . . . . . . . . c19759_2mk7 1 . 15 . 2452 . 1 1 1 ACE CH3 C -1.562 -24.986 5.999 . . . 1.0 . . . . . . . . . . . . A . 1 ACE CH3 . . . . . . . . . c19759_2mk7 1 . 15 . 2453 . 1 1 1 ACE H1 H -1.651 -25.746 5.236 . . . 1.0 . . . . . . . . . . . . A . 1 ACE H1 . . . . . . . . . c19759_2mk7 1 . 15 . 2454 . 1 1 1 ACE H2 H -2.047 -24.081 5.665 . . . 1.0 . . . . . . . . . . . . A . 1 ACE H2 . . . . . . . . . c19759_2mk7 1 . 15 . 2455 . 1 1 1 ACE H3 H -2.032 -25.332 6.908 . . . 1.0 . . . . . . . . . . . . A . 1 ACE H3 . . . . . . . . . c19759_2mk7 1 . 15 . 2456 . 1 1 1 ACE O O 0.345 -24.629 7.415 . . . 1.0 . . . . . . . . . . . . A . 1 ACE O . . . . . . . . . c19759_2mk7 1 . 15 . 2457 . 1 1 2 PRO C C 2.445 -23.203 6.380 . . . 1.0 . . . . . . . . . . . . A . 2 PRO C . . . . . . . . . c19759_2mk7 1 . 15 . 2458 . 1 1 2 PRO CA C 2.141 -24.268 5.328 . . . 1.0 . . . . . . . . . . . . A . 2 PRO CA . . . . . . . . . c19759_2mk7 1 . 15 . 2459 . 1 1 2 PRO CB C 2.539 -23.778 3.926 . . . 1.0 . . . . . . . . . . . . A . 2 PRO CB . . . . . . . . . c19759_2mk7 1 . 15 . 2460 . 1 1 2 PRO CD C 0.250 -24.623 3.830 . . . 1.0 . . . . . . . . . . . . A . 2 PRO CD . . . . . . . . . c19759_2mk7 1 . 15 . 2461 . 1 1 2 PRO CG C 1.295 -23.796 3.086 . . . 1.0 . . . . . . . . . . . . A . 2 PRO CG . . . . . . . . . c19759_2mk7 1 . 15 . 2462 . 1 1 2 PRO HA H 2.677 -25.174 5.554 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HA . . . . . . . . . c19759_2mk7 1 . 15 . 2463 . 1 1 2 PRO HB2 H 2.931 -22.771 3.986 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HB2 . . . . . . . . . c19759_2mk7 1 . 15 . 2464 . 1 1 2 PRO HB3 H 3.277 -24.438 3.500 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HB3 . . . . . . . . . c19759_2mk7 1 . 15 . 2465 . 1 1 2 PRO HD2 H -0.733 -24.188 3.709 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HD2 . . . . . . . . . c19759_2mk7 1 . 15 . 2466 . 1 1 2 PRO HD3 H 0.259 -25.646 3.489 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HD3 . . . . . . . . . c19759_2mk7 1 . 15 . 2467 . 1 1 2 PRO HG2 H 0.936 -22.785 2.943 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HG2 . . . . . . . . . c19759_2mk7 1 . 15 . 2468 . 1 1 2 PRO HG3 H 1.504 -24.251 2.130 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HG3 . . . . . . . . . c19759_2mk7 1 . 15 . 2469 . 1 1 2 PRO N N 0.684 -24.548 5.224 . . . 1.0 . . . . . . . . . . . . A . 2 PRO N . . . . . . . . . c19759_2mk7 1 . 15 . 2470 . 1 1 2 PRO O O 1.537 -22.674 7.023 . . . 1.0 . . . . . . . . . . . . A . 2 PRO O . . . . . . . . . c19759_2mk7 1 . 15 . 2471 . 1 1 3 PRO C C 3.872 -20.448 7.065 . . . 1.0 . . . . . . . . . . . . A . 3 PRO C . . . . . . . . . c19759_2mk7 1 . 15 . 2472 . 1 1 3 PRO CA C 4.144 -21.870 7.547 . . . 1.0 . . . . . . . . . . . . A . 3 PRO CA . . . . . . . . . c19759_2mk7 1 . 15 . 2473 . 1 1 3 PRO CB C 5.654 -22.116 7.696 . . . 1.0 . . . . . . . . . . . . A . 3 PRO CB . . . . . . . . . c19759_2mk7 1 . 15 . 2474 . 1 1 3 PRO CD C 4.830 -23.471 5.840 . . . 1.0 . . . . . . . . . . . . A . 3 PRO CD . . . . . . . . . c19759_2mk7 1 . 15 . 2475 . 1 1 3 PRO CG C 6.003 -23.262 6.794 . . . 1.0 . . . . . . . . . . . . A . 3 PRO CG . . . . . . . . . c19759_2mk7 1 . 15 . 2476 . 1 1 3 PRO HA H 3.660 -22.038 8.495 . . . 1.0 . . . . . . . . . . . . A . 3 PRO HA . . . . . . . . . c19759_2mk7 1 . 15 . 2477 . 1 1 3 PRO HB2 H 6.202 -21.232 7.402 . . . 1.0 . . . . . . . . . . . . A . 3 PRO HB2 . . . . . . . . . c19759_2mk7 1 . 15 . 2478 . 1 1 3 PRO HB3 H 5.887 -22.372 8.719 . . . 1.0 . . . . . . . . . . . . A . 3 PRO HB3 . . . . . . . . . c19759_2mk7 1 . 15 . 2479 . 1 1 3 PRO HD2 H 5.001 -22.948 4.908 . . . 1.0 . . . . . . . . . . . . A . 3 PRO HD2 . . . . . . . . . c19759_2mk7 1 . 15 . 2480 . 1 1 3 PRO HD3 H 4.660 -24.521 5.664 . . . 1.0 . . . . . . . . . . . . A . 3 PRO HD3 . . . . . . . . . c19759_2mk7 1 . 15 . 2481 . 1 1 3 PRO HG2 H 6.899 -23.028 6.234 . . . 1.0 . . . . . . . . . . . . A . 3 PRO HG2 . . . . . . . . . c19759_2mk7 1 . 15 . 2482 . 1 1 3 PRO HG3 H 6.157 -24.157 7.376 . . . 1.0 . . . . . . . . . . . . A . 3 PRO HG3 . . . . . . . . . c19759_2mk7 1 . 15 . 2483 . 1 1 3 PRO N N 3.698 -22.889 6.559 . . . 1.0 . . . . . . . . . . . . A . 3 PRO N . . . . . . . . . c19759_2mk7 1 . 15 . 2484 . 1 1 3 PRO O O 4.219 -20.087 5.940 . . . 1.0 . . . . . . . . . . . . A . 3 PRO O . . . . . . . . . c19759_2mk7 1 . 15 . 2485 . 1 1 4 THR C C 4.030 -17.325 8.075 . . . 1.0 . . . . . . . . . . . . A . 4 THR C . . . . . . . . . c19759_2mk7 1 . 15 . 2486 . 1 1 4 THR CA C 2.938 -18.265 7.573 . . . 1.0 . . . . . . . . . . . . A . 4 THR CA . . . . . . . . . c19759_2mk7 1 . 15 . 2487 . 1 1 4 THR CB C 1.594 -17.862 8.186 . . . 1.0 . . . . . . . . . . . . A . 4 THR CB . . . . . . . . . c19759_2mk7 1 . 15 . 2488 . 1 1 4 THR CG2 C 0.501 -18.822 7.714 . . . 1.0 . . . . . . . . . . . . A . 4 THR CG2 . . . . . . . . . c19759_2mk7 1 . 15 . 2489 . 1 1 4 THR H H 2.999 -19.988 8.806 . . . 1.0 . . . . . . . . . . . . A . 4 THR H . . . . . . . . . c19759_2mk7 1 . 15 . 2490 . 1 1 4 THR HA H 2.870 -18.182 6.500 . . . 1.0 . . . . . . . . . . . . A . 4 THR HA . . . . . . . . . c19759_2mk7 1 . 15 . 2491 . 1 1 4 THR HB H 1.344 -16.857 7.886 . . . 1.0 . . . . . . . . . . . . A . 4 THR HB . . . . . . . . . c19759_2mk7 1 . 15 . 2492 . 1 1 4 THR HG21 H -0.423 -18.279 7.579 . . . 1.0 . . . . . . . . . . . . A . 4 THR HG21 . . . . . . . . . c19759_2mk7 1 . 15 . 2493 . 1 1 4 THR HG22 H 0.358 -19.597 8.453 . . . 1.0 . . . . . . . . . . . . A . 4 THR HG22 . . . . . . . . . c19759_2mk7 1 . 15 . 2494 . 1 1 4 THR HG23 H 0.796 -19.270 6.776 . . . 1.0 . . . . . . . . . . . . A . 4 THR HG23 . . . . . . . . . c19759_2mk7 1 . 15 . 2495 . 1 1 4 THR N N 3.251 -19.646 7.923 . . . 1.0 . . . . . . . . . . . . A . 4 THR N . . . . . . . . . c19759_2mk7 1 . 15 . 2496 . 1 1 4 THR O O 4.545 -17.490 9.180 . . . 1.0 . . . . . . . . . . . . A . 4 THR O . . . . . . . . . c19759_2mk7 1 . 15 . 2497 . 1 1 4 THR OG1 O 1.697 -17.944 9.591 . . . 1.0 . . . . . . . . . . . . A . 4 THR OG1 . . . . . . . . . c19759_2mk7 1 . 15 . 2498 . 1 1 5 THR C C 4.783 -14.034 7.993 . . . 1.0 . . . . . . . . . . . . A . 5 THR C . . . . . . . . . c19759_2mk7 1 . 15 . 2499 . 1 1 5 THR CA C 5.408 -15.377 7.625 . . . 1.0 . . . . . . . . . . . . A . 5 THR CA . . . . . . . . . c19759_2mk7 1 . 15 . 2500 . 1 1 5 THR CB C 6.386 -15.186 6.464 . . . 1.0 . . . . . . . . . . . . A . 5 THR CB . . . . . . . . . c19759_2mk7 1 . 15 . 2501 . 1 1 5 THR CG2 C 6.910 -16.544 5.998 . . . 1.0 . . . . . . . . . . . . A . 5 THR CG2 . . . . . . . . . c19759_2mk7 1 . 15 . 2502 . 1 1 5 THR H H 3.929 -16.255 6.386 . . . 1.0 . . . . . . . . . . . . A . 5 THR H . . . . . . . . . c19759_2mk7 1 . 15 . 2503 . 1 1 5 THR HA H 5.950 -15.755 8.478 . . . 1.0 . . . . . . . . . . . . A . 5 THR HA . . . . . . . . . c19759_2mk7 1 . 15 . 2504 . 1 1 5 THR HB H 7.213 -14.571 6.781 . . . 1.0 . . . . . . . . . . . . A . 5 THR HB . . . . . . . . . c19759_2mk7 1 . 15 . 2505 . 1 1 5 THR HG21 H 6.287 -16.916 5.198 . . . 1.0 . . . . . . . . . . . . A . 5 THR HG21 . . . . . . . . . c19759_2mk7 1 . 15 . 2506 . 1 1 5 THR HG22 H 6.888 -17.241 6.824 . . . 1.0 . . . . . . . . . . . . A . 5 THR HG22 . . . . . . . . . c19759_2mk7 1 . 15 . 2507 . 1 1 5 THR HG23 H 7.924 -16.438 5.644 . . . 1.0 . . . . . . . . . . . . A . 5 THR HG23 . . . . . . . . . c19759_2mk7 1 . 15 . 2508 . 1 1 5 THR N N 4.376 -16.338 7.254 . . . 1.0 . . . . . . . . . . . . A . 5 THR N . . . . . . . . . c19759_2mk7 1 . 15 . 2509 . 1 1 5 THR O O 3.817 -13.597 7.367 . . . 1.0 . . . . . . . . . . . . A . 5 THR O . . . . . . . . . c19759_2mk7 1 . 15 . 2510 . 1 1 5 THR OG1 O 5.701 -14.571 5.394 . . . 1.0 . . . . . . . . . . . . A . 5 THR OG1 . . . . . . . . . c19759_2mk7 1 . 15 . 2511 . 1 1 6 THR C C 5.759 -10.969 9.007 . . . 1.0 . . . . . . . . . . . . A . 6 THR C . . . . . . . . . c19759_2mk7 1 . 15 . 2512 . 1 1 6 THR CA C 4.829 -12.094 9.452 . . . 1.0 . . . . . . . . . . . . A . 6 THR CA . . . . . . . . . c19759_2mk7 1 . 15 . 2513 . 1 1 6 THR CB C 4.697 -12.078 10.976 . . . 1.0 . . . . . . . . . . . . A . 6 THR CB . . . . . . . . . c19759_2mk7 1 . 15 . 2514 . 1 1 6 THR CG2 C 3.924 -13.312 11.444 . . . 1.0 . . . . . . . . . . . . A . 6 THR CG2 . . . . . . . . . c19759_2mk7 1 . 15 . 2515 . 1 1 6 THR H H 6.108 -13.783 9.471 . . . 1.0 . . . . . . . . . . . . A . 6 THR H . . . . . . . . . c19759_2mk7 1 . 15 . 2516 . 1 1 6 THR HA H 3.854 -11.935 9.016 . . . 1.0 . . . . . . . . . . . . A . 6 THR HA . . . . . . . . . c19759_2mk7 1 . 15 . 2517 . 1 1 6 THR HB H 4.174 -11.187 11.288 . . . 1.0 . . . . . . . . . . . . A . 6 THR HB . . . . . . . . . c19759_2mk7 1 . 15 . 2518 . 1 1 6 THR HG21 H 3.081 -13.478 10.791 . . . 1.0 . . . . . . . . . . . . A . 6 THR HG21 . . . . . . . . . c19759_2mk7 1 . 15 . 2519 . 1 1 6 THR HG22 H 3.574 -13.157 12.454 . . . 1.0 . . . . . . . . . . . . A . 6 THR HG22 . . . . . . . . . c19759_2mk7 1 . 15 . 2520 . 1 1 6 THR HG23 H 4.574 -14.175 11.417 . . . 1.0 . . . . . . . . . . . . A . 6 THR HG23 . . . . . . . . . c19759_2mk7 1 . 15 . 2521 . 1 1 6 THR N N 5.340 -13.386 9.009 . . . 1.0 . . . . . . . . . . . . A . 6 THR N . . . . . . . . . c19759_2mk7 1 . 15 . 2522 . 1 1 6 THR O O 6.920 -11.206 8.676 . . . 1.0 . . . . . . . . . . . . A . 6 THR O . . . . . . . . . c19759_2mk7 1 . 15 . 2523 . 1 1 6 THR OG1 O 5.990 -12.108 11.540 . . . 1.0 . . . . . . . . . . . . A . 6 THR OG1 . . . . . . . . . c19759_2mk7 1 . 15 . 2524 . 1 1 7 THR C C 5.756 -7.403 9.514 . . . 1.0 . . . . . . . . . . . . A . 7 THR C . . . . . . . . . c19759_2mk7 1 . 15 . 2525 . 1 1 7 THR CA C 6.033 -8.591 8.599 . . . 1.0 . . . . . . . . . . . . A . 7 THR CA . . . . . . . . . c19759_2mk7 1 . 15 . 2526 . 1 1 7 THR CB C 5.704 -8.213 7.153 . . . 1.0 . . . . . . . . . . . . A . 7 THR CB . . . . . . . . . c19759_2mk7 1 . 15 . 2527 . 1 1 7 THR CG2 C 5.795 -9.450 6.259 . . . 1.0 . . . . . . . . . . . . A . 7 THR CG2 . . . . . . . . . c19759_2mk7 1 . 15 . 2528 . 1 1 7 THR H H 4.307 -9.617 9.279 . . . 1.0 . . . . . . . . . . . . A . 7 THR H . . . . . . . . . c19759_2mk7 1 . 15 . 2529 . 1 1 7 THR HA H 7.080 -8.846 8.663 . . . 1.0 . . . . . . . . . . . . A . 7 THR HA . . . . . . . . . c19759_2mk7 1 . 15 . 2530 . 1 1 7 THR HB H 6.401 -7.465 6.805 . . . 1.0 . . . . . . . . . . . . A . 7 THR HB . . . . . . . . . c19759_2mk7 1 . 15 . 2531 . 1 1 7 THR HG21 H 6.731 -9.958 6.442 . . . 1.0 . . . . . . . . . . . . A . 7 THR HG21 . . . . . . . . . c19759_2mk7 1 . 15 . 2532 . 1 1 7 THR HG22 H 5.744 -9.150 5.223 . . . 1.0 . . . . . . . . . . . . A . 7 THR HG22 . . . . . . . . . c19759_2mk7 1 . 15 . 2533 . 1 1 7 THR HG23 H 4.975 -10.116 6.483 . . . 1.0 . . . . . . . . . . . . A . 7 THR HG23 . . . . . . . . . c19759_2mk7 1 . 15 . 2534 . 1 1 7 THR N N 5.239 -9.746 9.004 . . . 1.0 . . . . . . . . . . . . A . 7 THR N . . . . . . . . . c19759_2mk7 1 . 15 . 2535 . 1 1 7 THR O O 4.718 -7.344 10.173 . . . 1.0 . . . . . . . . . . . . A . 7 THR O . . . . . . . . . c19759_2mk7 1 . 15 . 2536 . 1 1 7 THR OG1 O 4.386 -7.713 7.107 . . . 1.0 . . . . . . . . . . . . A . 7 THR OG1 . . . . . . . . . c19759_2mk7 1 . 15 . 2537 . 1 1 8 LYS C C 7.430 -4.145 9.889 . . . 1.0 . . . . . . . . . . . . A . 8 LYS C . . . . . . . . . c19759_2mk7 1 . 15 . 2538 . 1 1 8 LYS CA C 6.535 -5.275 10.386 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CA . . . . . . . . . c19759_2mk7 1 . 15 . 2539 . 1 1 8 LYS CB C 6.890 -5.610 11.835 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CB . . . . . . . . . c19759_2mk7 1 . 15 . 2540 . 1 1 8 LYS CD C 9.230 -4.965 12.428 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CD . . . . . . . . . c19759_2mk7 1 . 15 . 2541 . 1 1 8 LYS CE C 9.188 -4.946 13.958 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CE . . . . . . . . . c19759_2mk7 1 . 15 . 2542 . 1 1 8 LYS CG C 8.340 -6.094 11.907 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CG . . . . . . . . . c19759_2mk7 1 . 15 . 2543 . 1 1 8 LYS H H 7.496 -6.558 9.001 . . . 1.0 . . . . . . . . . . . . A . 8 LYS H . . . . . . . . . c19759_2mk7 1 . 15 . 2544 . 1 1 8 LYS HA H 5.506 -4.949 10.346 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HA . . . . . . . . . c19759_2mk7 1 . 15 . 2545 . 1 1 8 LYS HB2 H 6.774 -4.728 12.448 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HB2 . . . . . . . . . c19759_2mk7 1 . 15 . 2546 . 1 1 8 LYS HB3 H 6.235 -6.389 12.196 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HB3 . . . . . . . . . c19759_2mk7 1 . 15 . 2547 . 1 1 8 LYS HD2 H 10.247 -5.126 12.098 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HD2 . . . . . . . . . c19759_2mk7 1 . 15 . 2548 . 1 1 8 LYS HD3 H 8.874 -4.020 12.048 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HD3 . . . . . . . . . c19759_2mk7 1 . 15 . 2549 . 1 1 8 LYS HE2 H 8.173 -4.775 14.287 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HE2 . . . . . . . . . c19759_2mk7 1 . 15 . 2550 . 1 1 8 LYS HE3 H 9.535 -5.893 14.339 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HE3 . . . . . . . . . c19759_2mk7 1 . 15 . 2551 . 1 1 8 LYS HG2 H 8.404 -6.942 12.574 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HG2 . . . . . . . . . c19759_2mk7 1 . 15 . 2552 . 1 1 8 LYS HG3 H 8.671 -6.386 10.922 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HG3 . . . . . . . . . c19759_2mk7 1 . 15 . 2553 . 1 1 8 LYS HZ1 H 10.232 -3.986 15.482 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ1 . . . . . . . . . c19759_2mk7 1 . 15 . 2554 . 1 1 8 LYS HZ2 H 9.602 -2.934 14.305 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ2 . . . . . . . . . c19759_2mk7 1 . 15 . 2555 . 1 1 8 LYS HZ3 H 10.974 -3.876 13.962 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ3 . . . . . . . . . c19759_2mk7 1 . 15 . 2556 . 1 1 8 LYS N N 6.689 -6.457 9.548 . . . 1.0 . . . . . . . . . . . . A . 8 LYS N . . . . . . . . . c19759_2mk7 1 . 15 . 2557 . 1 1 8 LYS NZ N 10.065 -3.854 14.465 . . . 1.0 . . . . . . . . . . . . A . 8 LYS NZ . . . . . . . . . c19759_2mk7 1 . 15 . 2558 . 1 1 8 LYS O O 8.614 -4.350 9.619 . . . 1.0 . . . . . . . . . . . . A . 8 LYS O . . . . . . . . . c19759_2mk7 1 . 15 . 2559 . 1 1 9 LYS C C 8.865 -2.242 8.551 . . . 1.0 . . . . . . . . . . . . A . 9 LYS C . . . . . . . . . c19759_2mk7 1 . 15 . 2560 . 1 1 9 LYS CA C 7.616 -1.795 9.303 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CA . . . . . . . . . c19759_2mk7 1 . 15 . 2561 . 1 1 9 LYS CB C 8.018 -0.918 10.491 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CB . . . . . . . . . c19759_2mk7 1 . 15 . 2562 . 1 1 9 LYS CD C 9.060 1.253 11.156 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CD . . . . . . . . . c19759_2mk7 1 . 15 . 2563 . 1 1 9 LYS CE C 10.577 1.086 11.256 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CE . . . . . . . . . c19759_2mk7 1 . 15 . 2564 . 1 1 9 LYS CG C 8.532 0.429 9.980 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CG . . . . . . . . . c19759_2mk7 1 . 15 . 2565 . 1 1 9 LYS H H 5.913 -2.845 10.002 . . . 1.0 . . . . . . . . . . . . A . 9 LYS H . . . . . . . . . c19759_2mk7 1 . 15 . 2566 . 1 1 9 LYS HA H 6.994 -1.215 8.637 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HA . . . . . . . . . c19759_2mk7 1 . 15 . 2567 . 1 1 9 LYS HB2 H 7.160 -0.760 11.128 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HB2 . . . . . . . . . c19759_2mk7 1 . 15 . 2568 . 1 1 9 LYS HB3 H 8.798 -1.410 11.053 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HB3 . . . . . . . . . c19759_2mk7 1 . 15 . 2569 . 1 1 9 LYS HD2 H 8.820 2.295 11.001 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HD2 . . . . . . . . . c19759_2mk7 1 . 15 . 2570 . 1 1 9 LYS HD3 H 8.601 0.910 12.072 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HD3 . . . . . . . . . c19759_2mk7 1 . 15 . 2571 . 1 1 9 LYS HE2 H 10.819 0.039 11.356 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HE2 . . . . . . . . . c19759_2mk7 1 . 15 . 2572 . 1 1 9 LYS HE3 H 11.042 1.479 10.363 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HE3 . . . . . . . . . c19759_2mk7 1 . 15 . 2573 . 1 1 9 LYS HG2 H 9.327 0.264 9.268 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HG2 . . . . . . . . . c19759_2mk7 1 . 15 . 2574 . 1 1 9 LYS HG3 H 7.725 0.965 9.503 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HG3 . . . . . . . . . c19759_2mk7 1 . 15 . 2575 . 1 1 9 LYS HZ1 H 11.108 1.191 13.267 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HZ1 . . . . . . . . . c19759_2mk7 1 . 15 . 2576 . 1 1 9 LYS HZ2 H 10.448 2.630 12.647 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HZ2 . . . . . . . . . c19759_2mk7 1 . 15 . 2577 . 1 1 9 LYS HZ3 H 12.039 2.184 12.253 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HZ3 . . . . . . . . . c19759_2mk7 1 . 15 . 2578 . 1 1 9 LYS N N 6.859 -2.951 9.771 . . . 1.0 . . . . . . . . . . . . A . 9 LYS N . . . . . . . . . c19759_2mk7 1 . 15 . 2579 . 1 1 9 LYS NZ N 11.082 1.829 12.446 . . . 1.0 . . . . . . . . . . . . A . 9 LYS NZ . . . . . . . . . c19759_2mk7 1 . 15 . 2580 . 1 1 9 LYS O O 9.981 -2.142 9.064 . . . 1.0 . . . . . . . . . . . . A . 9 LYS O . . . . . . . . . c19759_2mk7 1 . 15 . 2581 . 1 1 10 PRO C C 10.609 -2.043 5.903 . . . 1.0 . . . . . . . . . . . . A . 10 PRO C . . . . . . . . . c19759_2mk7 1 . 15 . 2582 . 1 1 10 PRO CA C 9.818 -3.202 6.502 . . . 1.0 . . . . . . . . . . . . A . 10 PRO CA . . . . . . . . . c19759_2mk7 1 . 15 . 2583 . 1 1 10 PRO CB C 9.141 -4.030 5.398 . . . 1.0 . . . . . . . . . . . . A . 10 PRO CB . . . . . . . . . c19759_2mk7 1 . 15 . 2584 . 1 1 10 PRO CD C 7.407 -2.881 6.676 . . . 1.0 . . . . . . . . . . . . A . 10 PRO CD . . . . . . . . . c19759_2mk7 1 . 15 . 2585 . 1 1 10 PRO CG C 7.665 -3.996 5.666 . . . 1.0 . . . . . . . . . . . . A . 10 PRO CG . . . . . . . . . c19759_2mk7 1 . 15 . 2586 . 1 1 10 PRO HA H 10.473 -3.839 7.075 . . . 1.0 . . . . . . . . . . . . A . 10 PRO HA . . . . . . . . . c19759_2mk7 1 . 15 . 2587 . 1 1 10 PRO HB2 H 9.353 -3.595 4.430 . . . 1.0 . . . . . . . . . . . . A . 10 PRO HB2 . . . . . . . . . c19759_2mk7 1 . 15 . 2588 . 1 1 10 PRO HB3 H 9.495 -5.049 5.430 . . . 1.0 . . . . . . . . . . . . A . 10 PRO HB3 . . . . . . . . . c19759_2mk7 1 . 15 . 2589 . 1 1 10 PRO HD2 H 7.129 -1.966 6.169 . . . 1.0 . . . . . . . . . . . . A . 10 PRO HD2 . . . . . . . . . c19759_2mk7 1 . 15 . 2590 . 1 1 10 PRO HD3 H 6.646 -3.174 7.383 . . . 1.0 . . . . . . . . . . . . A . 10 PRO HD3 . . . . . . . . . c19759_2mk7 1 . 15 . 2591 . 1 1 10 PRO HG2 H 7.131 -3.795 4.748 . . . 1.0 . . . . . . . . . . . . A . 10 PRO HG2 . . . . . . . . . c19759_2mk7 1 . 15 . 2592 . 1 1 10 PRO HG3 H 7.346 -4.940 6.080 . . . 1.0 . . . . . . . . . . . . A . 10 PRO HG3 . . . . . . . . . c19759_2mk7 1 . 15 . 2593 . 1 1 10 PRO N N 8.695 -2.728 7.353 . . . 1.0 . . . . . . . . . . . . A . 10 PRO N . . . . . . . . . c19759_2mk7 1 . 15 . 2594 . 1 1 10 PRO O O 11.224 -2.191 4.845 . . . 1.0 . . . . . . . . . . . . A . 10 PRO O . . . . . . . . . c19759_2mk7 1 . 15 . 2595 . 1 1 11 NH2 HN1 H 9.871 -0.619 7.072 . . . 1.0 . . . . . . . . . . . . A . 11 NH2 HN1 . . . . . . . . . c19759_2mk7 1 . 15 . 2596 . 1 1 11 NH2 HN2 H 11.409 -0.304 6.429 . . . 1.0 . . . . . . . . . . . . A . 11 NH2 HN2 . . . . . . . . . c19759_2mk7 1 . 15 . 2597 . 1 1 11 NH2 N N 10.631 -0.892 6.518 . . . 1.0 . . . . . . . . . . . . A . 11 NH2 N . . . . . . . . . c19759_2mk7 1 . 15 . 2598 . 2 2 1 A2G C1 C 1.691 -16.675 10.207 . . . 1.0 . . . . . . . . . . . . A . 101 A2G C1 . . . . . . . . . c19759_2mk7 1 . 15 . 2599 . 2 2 1 A2G C2 C 1.951 -16.869 11.701 . . . 1.0 . . . . . . . . . . . . A . 101 A2G C2 . . . . . . . . . c19759_2mk7 1 . 15 . 2600 . 2 2 1 A2G C3 C 0.824 -17.710 12.302 . . . 1.0 . . . . . . . . . . . . A . 101 A2G C3 . . . . . . . . . c19759_2mk7 1 . 15 . 2601 . 2 2 1 A2G C4 C -0.525 -17.061 11.981 . . . 1.0 . . . . . . . . . . . . A . 101 A2G C4 . . . . . . . . . c19759_2mk7 1 . 15 . 2602 . 2 2 1 A2G C5 C -0.634 -16.834 10.472 . . . 1.0 . . . . . . . . . . . . A . 101 A2G C5 . . . . . . . . . c19759_2mk7 1 . 15 . 2603 . 2 2 1 A2G C6 C -1.941 -16.104 10.153 . . . 1.0 . . . . . . . . . . . . A . 101 A2G C6 . . . . . . . . . c19759_2mk7 1 . 15 . 2604 . 2 2 1 A2G C7 C 4.216 -16.932 12.575 . . . 1.0 . . . . . . . . . . . . A . 101 A2G C7 . . . . . . . . . c19759_2mk7 1 . 15 . 2605 . 2 2 1 A2G C8 C 5.550 -17.671 12.614 . . . 1.0 . . . . . . . . . . . . A . 101 A2G C8 . . . . . . . . . c19759_2mk7 1 . 15 . 2606 . 2 2 1 A2G H1 H 2.473 -16.062 9.784 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H1 . . . . . . . . . c19759_2mk7 1 . 15 . 2607 . 2 2 1 A2G H14 H -2.194 -16.258 9.115 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H14 . . . . . . . . . c19759_2mk7 1 . 15 . 2608 . 2 2 1 A2G H15 H -2.790 -17.539 11.154 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H15 . . . . . . . . . c19759_2mk7 1 . 15 . 2609 . 2 2 1 A2G H2 H 1.968 -15.903 12.185 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H2 . . . . . . . . . c19759_2mk7 1 . 15 . 2610 . 2 2 1 A2G H3 H 0.853 -18.704 11.882 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H3 . . . . . . . . . c19759_2mk7 1 . 15 . 2611 . 2 2 1 A2G H4 H -1.323 -17.711 12.306 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H4 . . . . . . . . . c19759_2mk7 1 . 15 . 2612 . 2 2 1 A2G H5 H -0.612 -17.783 9.958 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H5 . . . . . . . . . c19759_2mk7 1 . 15 . 2613 . 2 2 1 A2G H6 H -1.818 -15.047 10.342 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H6 . . . . . . . . . c19759_2mk7 1 . 15 . 2614 . 2 2 1 A2G H8 H 5.457 -18.546 13.240 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H8 . . . . . . . . . c19759_2mk7 1 . 15 . 2615 . 2 2 1 A2G H8A H 6.310 -17.019 13.015 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H8A . . . . . . . . . c19759_2mk7 1 . 15 . 2616 . 2 2 1 A2G H8B H 5.823 -17.971 11.613 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H8B . . . . . . . . . c19759_2mk7 1 . 15 . 2617 . 2 2 1 A2G HN2 H 3.381 -18.424 11.535 . . . 1.0 . . . . . . . . . . . . A . 101 A2G HN2 . . . . . . . . . c19759_2mk7 1 . 15 . 2618 . 2 2 1 A2G HO3 H 1.449 -16.995 13.998 . . . 1.0 . . . . . . . . . . . . A . 101 A2G HO3 . . . . . . . . . c19759_2mk7 1 . 15 . 2619 . 2 2 1 A2G HO4 H -1.172 -15.941 13.433 . . . 1.0 . . . . . . . . . . . . A . 101 A2G HO4 . . . . . . . . . c19759_2mk7 1 . 15 . 2620 . 2 2 1 A2G N2 N 3.235 -17.529 11.906 . . . 1.0 . . . . . . . . . . . . A . 101 A2G N2 . . . . . . . . . c19759_2mk7 1 . 15 . 2621 . 2 2 1 A2G O O 0.447 -16.028 10.056 . . . 1.0 . . . . . . . . . . . . A . 101 A2G O . . . . . . . . . c19759_2mk7 1 . 15 . 2622 . 2 2 1 A2G O3 O 0.988 -17.786 13.711 . . . 1.0 . . . . . . . . . . . . A . 101 A2G O3 . . . . . . . . . c19759_2mk7 1 . 15 . 2623 . 2 2 1 A2G O4 O -0.623 -15.815 12.656 . . . 1.0 . . . . . . . . . . . . A . 101 A2G O4 . . . . . . . . . c19759_2mk7 1 . 15 . 2624 . 2 2 1 A2G O6 O -2.980 -16.615 10.975 . . . 1.0 . . . . . . . . . . . . A . 101 A2G O6 . . . . . . . . . c19759_2mk7 1 . 15 . 2625 . 2 2 1 A2G O7 O 4.107 -15.805 13.058 . . . 1.0 . . . . . . . . . . . . A . 101 A2G O7 . . . . . . . . . c19759_2mk7 1 . 16 . 2626 . 1 1 1 ACE C C -0.020 -23.861 4.972 . . . 1.0 . . . . . . . . . . . . A . 1 ACE C . . . . . . . . . c19759_2mk7 1 . 16 . 2627 . 1 1 1 ACE CH3 C -1.331 -23.978 4.201 . . . 1.0 . . . . . . . . . . . . A . 1 ACE CH3 . . . . . . . . . c19759_2mk7 1 . 16 . 2628 . 1 1 1 ACE H1 H -1.254 -24.776 3.478 . . . 1.0 . . . . . . . . . . . . A . 1 ACE H1 . . . . . . . . . c19759_2mk7 1 . 16 . 2629 . 1 1 1 ACE H2 H -1.532 -23.047 3.690 . . . 1.0 . . . . . . . . . . . . A . 1 ACE H2 . . . . . . . . . c19759_2mk7 1 . 16 . 2630 . 1 1 1 ACE H3 H -2.135 -24.192 4.889 . . . 1.0 . . . . . . . . . . . . A . 1 ACE H3 . . . . . . . . . c19759_2mk7 1 . 16 . 2631 . 1 1 1 ACE O O -0.015 -23.755 6.199 . . . 1.0 . . . . . . . . . . . . A . 1 ACE O . . . . . . . . . c19759_2mk7 1 . 16 . 2632 . 1 1 2 PRO C C 2.495 -22.684 5.952 . . . 1.0 . . . . . . . . . . . . A . 2 PRO C . . . . . . . . . c19759_2mk7 1 . 16 . 2633 . 1 1 2 PRO CA C 2.433 -23.775 4.886 . . . 1.0 . . . . . . . . . . . . A . 2 PRO CA . . . . . . . . . c19759_2mk7 1 . 16 . 2634 . 1 1 2 PRO CB C 3.365 -23.442 3.710 . . . 1.0 . . . . . . . . . . . . A . 2 PRO CB . . . . . . . . . c19759_2mk7 1 . 16 . 2635 . 1 1 2 PRO CD C 1.161 -24.000 2.819 . . . 1.0 . . . . . . . . . . . . A . 2 PRO CD . . . . . . . . . c19759_2mk7 1 . 16 . 2636 . 1 1 2 PRO CG C 2.508 -23.367 2.480 . . . 1.0 . . . . . . . . . . . . A . 2 PRO CG . . . . . . . . . c19759_2mk7 1 . 16 . 2637 . 1 1 2 PRO HA H 2.719 -24.724 5.312 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HA . . . . . . . . . c19759_2mk7 1 . 16 . 2638 . 1 1 2 PRO HB2 H 3.850 -22.493 3.883 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HB2 . . . . . . . . . c19759_2mk7 1 . 16 . 2639 . 1 1 2 PRO HB3 H 4.104 -24.220 3.593 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HB3 . . . . . . . . . c19759_2mk7 1 . 16 . 2640 . 1 1 2 PRO HD2 H 0.356 -23.456 2.343 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HD2 . . . . . . . . . c19759_2mk7 1 . 16 . 2641 . 1 1 2 PRO HD3 H 1.144 -25.040 2.529 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HD3 . . . . . . . . . c19759_2mk7 1 . 16 . 2642 . 1 1 2 PRO HG2 H 2.370 -22.333 2.193 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HG2 . . . . . . . . . c19759_2mk7 1 . 16 . 2643 . 1 1 2 PRO HG3 H 2.972 -23.913 1.674 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HG3 . . . . . . . . . c19759_2mk7 1 . 16 . 2644 . 1 1 2 PRO N N 1.082 -23.879 4.273 . . . 1.0 . . . . . . . . . . . . A . 2 PRO N . . . . . . . . . c19759_2mk7 1 . 16 . 2645 . 1 1 2 PRO O O 1.631 -21.809 6.012 . . . 1.0 . . . . . . . . . . . . A . 2 PRO O . . . . . . . . . c19759_2mk7 1 . 16 . 2646 . 1 1 3 PRO C C 3.452 -20.303 7.397 . . . 1.0 . . . . . . . . . . . . A . 3 PRO C . . . . . . . . . c19759_2mk7 1 . 16 . 2647 . 1 1 3 PRO CA C 3.688 -21.733 7.877 . . . 1.0 . . . . . . . . . . . . A . 3 PRO CA . . . . . . . . . c19759_2mk7 1 . 16 . 2648 . 1 1 3 PRO CB C 5.146 -21.926 8.323 . . . 1.0 . . . . . . . . . . . . A . 3 PRO CB . . . . . . . . . c19759_2mk7 1 . 16 . 2649 . 1 1 3 PRO CD C 4.564 -23.726 6.778 . . . 1.0 . . . . . . . . . . . . A . 3 PRO CD . . . . . . . . . c19759_2mk7 1 . 16 . 2650 . 1 1 3 PRO CG C 5.726 -23.014 7.467 . . . 1.0 . . . . . . . . . . . . A . 3 PRO CG . . . . . . . . . c19759_2mk7 1 . 16 . 2651 . 1 1 3 PRO HA H 3.030 -21.960 8.700 . . . 1.0 . . . . . . . . . . . . A . 3 PRO HA . . . . . . . . . c19759_2mk7 1 . 16 . 2652 . 1 1 3 PRO HB2 H 5.699 -21.007 8.180 . . . 1.0 . . . . . . . . . . . . A . 3 PRO HB2 . . . . . . . . . c19759_2mk7 1 . 16 . 2653 . 1 1 3 PRO HB3 H 5.179 -22.220 9.359 . . . 1.0 . . . . . . . . . . . . A . 3 PRO HB3 . . . . . . . . . c19759_2mk7 1 . 16 . 2654 . 1 1 3 PRO HD2 H 4.831 -23.995 5.765 . . . 1.0 . . . . . . . . . . . . A . 3 PRO HD2 . . . . . . . . . c19759_2mk7 1 . 16 . 2655 . 1 1 3 PRO HD3 H 4.264 -24.596 7.340 . . . 1.0 . . . . . . . . . . . . A . 3 PRO HD3 . . . . . . . . . c19759_2mk7 1 . 16 . 2656 . 1 1 3 PRO HG2 H 6.387 -22.583 6.727 . . . 1.0 . . . . . . . . . . . . A . 3 PRO HG2 . . . . . . . . . c19759_2mk7 1 . 16 . 2657 . 1 1 3 PRO HG3 H 6.268 -23.715 8.080 . . . 1.0 . . . . . . . . . . . . A . 3 PRO HG3 . . . . . . . . . c19759_2mk7 1 . 16 . 2658 . 1 1 3 PRO N N 3.498 -22.726 6.786 . . . 1.0 . . . . . . . . . . . . A . 3 PRO N . . . . . . . . . c19759_2mk7 1 . 16 . 2659 . 1 1 3 PRO O O 3.741 -19.968 6.248 . . . 1.0 . . . . . . . . . . . . A . 3 PRO O . . . . . . . . . c19759_2mk7 1 . 16 . 2660 . 1 1 4 THR C C 3.820 -17.182 8.358 . . . 1.0 . . . . . . . . . . . . A . 4 THR C . . . . . . . . . c19759_2mk7 1 . 16 . 2661 . 1 1 4 THR CA C 2.656 -18.075 7.939 . . . 1.0 . . . . . . . . . . . . A . 4 THR CA . . . . . . . . . c19759_2mk7 1 . 16 . 2662 . 1 1 4 THR CB C 1.375 -17.603 8.630 . . . 1.0 . . . . . . . . . . . . A . 4 THR CB . . . . . . . . . c19759_2mk7 1 . 16 . 2663 . 1 1 4 THR CG2 C 0.220 -18.542 8.277 . . . 1.0 . . . . . . . . . . . . A . 4 THR CG2 . . . . . . . . . c19759_2mk7 1 . 16 . 2664 . 1 1 4 THR H H 2.716 -19.788 9.184 . . . 1.0 . . . . . . . . . . . . A . 4 THR H . . . . . . . . . c19759_2mk7 1 . 16 . 2665 . 1 1 4 THR HA H 2.523 -17.998 6.871 . . . 1.0 . . . . . . . . . . . . A . 4 THR HA . . . . . . . . . c19759_2mk7 1 . 16 . 2666 . 1 1 4 THR HB H 1.135 -16.601 8.311 . . . 1.0 . . . . . . . . . . . . A . 4 THR HB . . . . . . . . . c19759_2mk7 1 . 16 . 2667 . 1 1 4 THR HG21 H 0.176 -19.345 8.998 . . . 1.0 . . . . . . . . . . . . A . 4 THR HG21 . . . . . . . . . c19759_2mk7 1 . 16 . 2668 . 1 1 4 THR HG22 H 0.377 -18.950 7.291 . . . 1.0 . . . . . . . . . . . . A . 4 THR HG22 . . . . . . . . . c19759_2mk7 1 . 16 . 2669 . 1 1 4 THR HG23 H -0.710 -17.992 8.295 . . . 1.0 . . . . . . . . . . . . A . 4 THR HG23 . . . . . . . . . c19759_2mk7 1 . 16 . 2670 . 1 1 4 THR N N 2.925 -19.465 8.283 . . . 1.0 . . . . . . . . . . . . A . 4 THR N . . . . . . . . . c19759_2mk7 1 . 16 . 2671 . 1 1 4 THR O O 4.344 -17.310 9.465 . . . 1.0 . . . . . . . . . . . . A . 4 THR O . . . . . . . . . c19759_2mk7 1 . 16 . 2672 . 1 1 4 THR OG1 O 1.578 -17.636 10.026 . . . 1.0 . . . . . . . . . . . . A . 4 THR OG1 . . . . . . . . . c19759_2mk7 1 . 16 . 2673 . 1 1 5 THR C C 4.801 -13.969 8.044 . . . 1.0 . . . . . . . . . . . . A . 5 THR C . . . . . . . . . c19759_2mk7 1 . 16 . 2674 . 1 1 5 THR CA C 5.323 -15.373 7.757 . . . 1.0 . . . . . . . . . . . . A . 5 THR CA . . . . . . . . . c19759_2mk7 1 . 16 . 2675 . 1 1 5 THR CB C 6.289 -15.329 6.570 . . . 1.0 . . . . . . . . . . . . A . 5 THR CB . . . . . . . . . c19759_2mk7 1 . 16 . 2676 . 1 1 5 THR CG2 C 6.794 -16.738 6.259 . . . 1.0 . . . . . . . . . . . . A . 5 THR CG2 . . . . . . . . . c19759_2mk7 1 . 16 . 2677 . 1 1 5 THR H H 3.765 -16.225 6.602 . . . 1.0 . . . . . . . . . . . . A . 5 THR H . . . . . . . . . c19759_2mk7 1 . 16 . 2678 . 1 1 5 THR HA H 5.855 -15.733 8.625 . . . 1.0 . . . . . . . . . . . . A . 5 THR HA . . . . . . . . . c19759_2mk7 1 . 16 . 2679 . 1 1 5 THR HB H 7.126 -14.690 6.804 . . . 1.0 . . . . . . . . . . . . A . 5 THR HB . . . . . . . . . c19759_2mk7 1 . 16 . 2680 . 1 1 5 THR HG21 H 6.212 -17.159 5.453 . . . 1.0 . . . . . . . . . . . . A . 5 THR HG21 . . . . . . . . . c19759_2mk7 1 . 16 . 2681 . 1 1 5 THR HG22 H 6.694 -17.358 7.137 . . . 1.0 . . . . . . . . . . . . A . 5 THR HG22 . . . . . . . . . c19759_2mk7 1 . 16 . 2682 . 1 1 5 THR HG23 H 7.832 -16.693 5.968 . . . 1.0 . . . . . . . . . . . . A . 5 THR HG23 . . . . . . . . . c19759_2mk7 1 . 16 . 2683 . 1 1 5 THR N N 4.219 -16.281 7.468 . . . 1.0 . . . . . . . . . . . . A . 5 THR N . . . . . . . . . c19759_2mk7 1 . 16 . 2684 . 1 1 5 THR O O 3.854 -13.507 7.407 . . . 1.0 . . . . . . . . . . . . A . 5 THR O . . . . . . . . . c19759_2mk7 1 . 16 . 2685 . 1 1 5 THR OG1 O 5.596 -14.835 5.445 . . . 1.0 . . . . . . . . . . . . A . 5 THR OG1 . . . . . . . . . c19759_2mk7 1 . 16 . 2686 . 1 1 6 THR C C 5.996 -10.918 8.810 . . . 1.0 . . . . . . . . . . . . A . 6 THR C . . . . . . . . . c19759_2mk7 1 . 16 . 2687 . 1 1 6 THR CA C 5.015 -11.944 9.367 . . . 1.0 . . . . . . . . . . . . A . 6 THR CA . . . . . . . . . c19759_2mk7 1 . 16 . 2688 . 1 1 6 THR CB C 4.943 -11.810 10.890 . . . 1.0 . . . . . . . . . . . . A . 6 THR CB . . . . . . . . . c19759_2mk7 1 . 16 . 2689 . 1 1 6 THR CG2 C 3.958 -12.834 11.455 . . . 1.0 . . . . . . . . . . . . A . 6 THR CG2 . . . . . . . . . c19759_2mk7 1 . 16 . 2690 . 1 1 6 THR H H 6.174 -13.714 9.478 . . . 1.0 . . . . . . . . . . . . A . 6 THR H . . . . . . . . . c19759_2mk7 1 . 16 . 2691 . 1 1 6 THR HA H 4.035 -11.753 8.954 . . . 1.0 . . . . . . . . . . . . A . 6 THR HA . . . . . . . . . c19759_2mk7 1 . 16 . 2692 . 1 1 6 THR HB H 4.619 -10.816 11.155 . . . 1.0 . . . . . . . . . . . . A . 6 THR HB . . . . . . . . . c19759_2mk7 1 . 16 . 2693 . 1 1 6 THR HG21 H 4.476 -13.761 11.650 . . . 1.0 . . . . . . . . . . . . A . 6 THR HG21 . . . . . . . . . c19759_2mk7 1 . 16 . 2694 . 1 1 6 THR HG22 H 3.168 -13.006 10.739 . . . 1.0 . . . . . . . . . . . . A . 6 THR HG22 . . . . . . . . . c19759_2mk7 1 . 16 . 2695 . 1 1 6 THR HG23 H 3.535 -12.457 12.374 . . . 1.0 . . . . . . . . . . . . A . 6 THR HG23 . . . . . . . . . c19759_2mk7 1 . 16 . 2696 . 1 1 6 THR N N 5.426 -13.296 9.005 . . . 1.0 . . . . . . . . . . . . A . 6 THR N . . . . . . . . . c19759_2mk7 1 . 16 . 2697 . 1 1 6 THR O O 7.195 -11.181 8.714 . . . 1.0 . . . . . . . . . . . . A . 6 THR O . . . . . . . . . c19759_2mk7 1 . 16 . 2698 . 1 1 6 THR OG1 O 6.223 -12.066 11.425 . . . 1.0 . . . . . . . . . . . . A . 6 THR OG1 . . . . . . . . . c19759_2mk7 1 . 16 . 2699 . 1 1 7 THR C C 6.628 -7.646 8.966 . . . 1.0 . . . . . . . . . . . . A . 7 THR C . . . . . . . . . c19759_2mk7 1 . 16 . 2700 . 1 1 7 THR CA C 6.321 -8.691 7.898 . . . 1.0 . . . . . . . . . . . . A . 7 THR CA . . . . . . . . . c19759_2mk7 1 . 16 . 2701 . 1 1 7 THR CB C 5.617 -8.022 6.714 . . . 1.0 . . . . . . . . . . . . A . 7 THR CB . . . . . . . . . c19759_2mk7 1 . 16 . 2702 . 1 1 7 THR CG2 C 5.218 -9.080 5.684 . . . 1.0 . . . . . . . . . . . . A . 7 THR CG2 . . . . . . . . . c19759_2mk7 1 . 16 . 2703 . 1 1 7 THR H H 4.517 -9.597 8.544 . . . 1.0 . . . . . . . . . . . . A . 7 THR H . . . . . . . . . c19759_2mk7 1 . 16 . 2704 . 1 1 7 THR HA H 7.248 -9.122 7.553 . . . 1.0 . . . . . . . . . . . . A . 7 THR HA . . . . . . . . . c19759_2mk7 1 . 16 . 2705 . 1 1 7 THR HB H 6.277 -7.304 6.255 . . . 1.0 . . . . . . . . . . . . A . 7 THR HB . . . . . . . . . c19759_2mk7 1 . 16 . 2706 . 1 1 7 THR HG21 H 4.246 -9.479 5.935 . . . 1.0 . . . . . . . . . . . . A . 7 THR HG21 . . . . . . . . . c19759_2mk7 1 . 16 . 2707 . 1 1 7 THR HG22 H 5.945 -9.878 5.687 . . . 1.0 . . . . . . . . . . . . A . 7 THR HG22 . . . . . . . . . c19759_2mk7 1 . 16 . 2708 . 1 1 7 THR HG23 H 5.179 -8.630 4.703 . . . 1.0 . . . . . . . . . . . . A . 7 THR HG23 . . . . . . . . . c19759_2mk7 1 . 16 . 2709 . 1 1 7 THR N N 5.479 -9.750 8.444 . . . 1.0 . . . . . . . . . . . . A . 7 THR N . . . . . . . . . c19759_2mk7 1 . 16 . 2710 . 1 1 7 THR O O 5.720 -7.083 9.577 . . . 1.0 . . . . . . . . . . . . A . 7 THR O . . . . . . . . . c19759_2mk7 1 . 16 . 2711 . 1 1 7 THR OG1 O 4.451 -7.383 7.187 . . . 1.0 . . . . . . . . . . . . A . 7 THR OG1 . . . . . . . . . c19759_2mk7 1 . 16 . 2712 . 1 1 8 LYS C C 8.229 -4.997 9.617 . . . 1.0 . . . . . . . . . . . . A . 8 LYS C . . . . . . . . . c19759_2mk7 1 . 16 . 2713 . 1 1 8 LYS CA C 8.330 -6.411 10.180 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CA . . . . . . . . . c19759_2mk7 1 . 16 . 2714 . 1 1 8 LYS CB C 9.770 -6.686 10.615 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CB . . . . . . . . . c19759_2mk7 1 . 16 . 2715 . 1 1 8 LYS CD C 9.278 -6.463 13.055 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CD . . . . . . . . . c19759_2mk7 1 . 16 . 2716 . 1 1 8 LYS CE C 10.177 -6.574 14.287 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CE . . . . . . . . . c19759_2mk7 1 . 16 . 2717 . 1 1 8 LYS CG C 10.083 -5.893 11.885 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CG . . . . . . . . . c19759_2mk7 1 . 16 . 2718 . 1 1 8 LYS H H 8.595 -7.870 8.667 . . . 1.0 . . . . . . . . . . . . A . 8 LYS H . . . . . . . . . c19759_2mk7 1 . 16 . 2719 . 1 1 8 LYS HA H 7.685 -6.491 11.042 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HA . . . . . . . . . c19759_2mk7 1 . 16 . 2720 . 1 1 8 LYS HB2 H 9.892 -7.742 10.811 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HB2 . . . . . . . . . c19759_2mk7 1 . 16 . 2721 . 1 1 8 LYS HB3 H 10.447 -6.385 9.830 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HB3 . . . . . . . . . c19759_2mk7 1 . 16 . 2722 . 1 1 8 LYS HD2 H 8.446 -5.808 13.272 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HD2 . . . . . . . . . c19759_2mk7 1 . 16 . 2723 . 1 1 8 LYS HD3 H 8.907 -7.443 12.793 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HD3 . . . . . . . . . c19759_2mk7 1 . 16 . 2724 . 1 1 8 LYS HE2 H 9.599 -6.940 15.123 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HE2 . . . . . . . . . c19759_2mk7 1 . 16 . 2725 . 1 1 8 LYS HE3 H 10.986 -7.259 14.082 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HE3 . . . . . . . . . c19759_2mk7 1 . 16 . 2726 . 1 1 8 LYS HG2 H 11.138 -5.964 12.104 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HG2 . . . . . . . . . c19759_2mk7 1 . 16 . 2727 . 1 1 8 LYS HG3 H 9.814 -4.858 11.737 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HG3 . . . . . . . . . c19759_2mk7 1 . 16 . 2728 . 1 1 8 LYS HZ1 H 10.196 -4.817 15.406 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ1 . . . . . . . . . c19759_2mk7 1 . 16 . 2729 . 1 1 8 LYS HZ2 H 10.663 -4.613 13.785 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ2 . . . . . . . . . c19759_2mk7 1 . 16 . 2730 . 1 1 8 LYS HZ3 H 11.731 -5.329 14.897 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ3 . . . . . . . . . c19759_2mk7 1 . 16 . 2731 . 1 1 8 LYS N N 7.914 -7.391 9.184 . . . 1.0 . . . . . . . . . . . . A . 8 LYS N . . . . . . . . . c19759_2mk7 1 . 16 . 2732 . 1 1 8 LYS NZ N 10.734 -5.232 14.618 . . . 1.0 . . . . . . . . . . . . A . 8 LYS NZ . . . . . . . . . c19759_2mk7 1 . 16 . 2733 . 1 1 8 LYS O O 9.224 -4.278 9.535 . . . 1.0 . . . . . . . . . . . . A . 8 LYS O . . . . . . . . . c19759_2mk7 1 . 16 . 2734 . 1 1 9 LYS C C 8.105 -2.696 8.138 . . . 1.0 . . . . . . . . . . . . A . 9 LYS C . . . . . . . . . c19759_2mk7 1 . 16 . 2735 . 1 1 9 LYS CA C 6.799 -3.276 8.674 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CA . . . . . . . . . c19759_2mk7 1 . 16 . 2736 . 1 1 9 LYS CB C 6.229 -2.347 9.748 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CB . . . . . . . . . c19759_2mk7 1 . 16 . 2737 . 1 1 9 LYS CD C 4.941 -0.244 10.154 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CD . . . . . . . . . c19759_2mk7 1 . 16 . 2738 . 1 1 9 LYS CE C 5.631 1.117 10.071 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CE . . . . . . . . . c19759_2mk7 1 . 16 . 2739 . 1 1 9 LYS CG C 5.512 -1.172 9.080 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CG . . . . . . . . . c19759_2mk7 1 . 16 . 2740 . 1 1 9 LYS H H 6.261 -5.221 9.321 . . . 1.0 . . . . . . . . . . . . A . 9 LYS H . . . . . . . . . c19759_2mk7 1 . 16 . 2741 . 1 1 9 LYS HA H 6.089 -3.348 7.863 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HA . . . . . . . . . c19759_2mk7 1 . 16 . 2742 . 1 1 9 LYS HB2 H 5.529 -2.895 10.362 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HB2 . . . . . . . . . c19759_2mk7 1 . 16 . 2743 . 1 1 9 LYS HB3 H 7.032 -1.972 10.363 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HB3 . . . . . . . . . c19759_2mk7 1 . 16 . 2744 . 1 1 9 LYS HD2 H 3.879 -0.122 9.996 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HD2 . . . . . . . . . c19759_2mk7 1 . 16 . 2745 . 1 1 9 LYS HD3 H 5.113 -0.675 11.129 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HD3 . . . . . . . . . c19759_2mk7 1 . 16 . 2746 . 1 1 9 LYS HE2 H 6.702 0.982 10.114 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HE2 . . . . . . . . . c19759_2mk7 1 . 16 . 2747 . 1 1 9 LYS HE3 H 5.366 1.600 9.143 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HE3 . . . . . . . . . c19759_2mk7 1 . 16 . 2748 . 1 1 9 LYS HG2 H 6.212 -0.626 8.466 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HG2 . . . . . . . . . c19759_2mk7 1 . 16 . 2749 . 1 1 9 LYS HG3 H 4.706 -1.546 8.465 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HG3 . . . . . . . . . c19759_2mk7 1 . 16 . 2750 . 1 1 9 LYS HZ1 H 4.255 2.364 11.013 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HZ1 . . . . . . . . . c19759_2mk7 1 . 16 . 2751 . 1 1 9 LYS HZ2 H 5.876 2.740 11.354 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HZ2 . . . . . . . . . c19759_2mk7 1 . 16 . 2752 . 1 1 9 LYS HZ3 H 5.144 1.389 12.078 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HZ3 . . . . . . . . . c19759_2mk7 1 . 16 . 2753 . 1 1 9 LYS N N 7.018 -4.606 9.230 . . . 1.0 . . . . . . . . . . . . A . 9 LYS N . . . . . . . . . c19759_2mk7 1 . 16 . 2754 . 1 1 9 LYS NZ N 5.194 1.967 11.216 . . . 1.0 . . . . . . . . . . . . A . 9 LYS NZ . . . . . . . . . c19759_2mk7 1 . 16 . 2755 . 1 1 9 LYS O O 8.574 -1.658 8.606 . . . 1.0 . . . . . . . . . . . . A . 9 LYS O . . . . . . . . . c19759_2mk7 1 . 16 . 2756 . 1 1 10 PRO C C 9.975 -1.407 6.265 . . . 1.0 . . . . . . . . . . . . A . 10 PRO C . . . . . . . . . c19759_2mk7 1 . 16 . 2757 . 1 1 10 PRO CA C 9.968 -2.907 6.554 . . . 1.0 . . . . . . . . . . . . A . 10 PRO CA . . . . . . . . . c19759_2mk7 1 . 16 . 2758 . 1 1 10 PRO CB C 10.063 -3.714 5.249 . . . 1.0 . . . . . . . . . . . . A . 10 PRO CB . . . . . . . . . c19759_2mk7 1 . 16 . 2759 . 1 1 10 PRO CD C 8.198 -4.584 6.564 . . . 1.0 . . . . . . . . . . . . A . 10 PRO CD . . . . . . . . . c19759_2mk7 1 . 16 . 2760 . 1 1 10 PRO CG C 8.838 -4.577 5.177 . . . 1.0 . . . . . . . . . . . . A . 10 PRO CG . . . . . . . . . c19759_2mk7 1 . 16 . 2761 . 1 1 10 PRO HA H 10.797 -3.162 7.193 . . . 1.0 . . . . . . . . . . . . A . 10 PRO HA . . . . . . . . . c19759_2mk7 1 . 16 . 2762 . 1 1 10 PRO HB2 H 10.094 -3.042 4.402 . . . 1.0 . . . . . . . . . . . . A . 10 PRO HB2 . . . . . . . . . c19759_2mk7 1 . 16 . 2763 . 1 1 10 PRO HB3 H 10.946 -4.334 5.262 . . . 1.0 . . . . . . . . . . . . A . 10 PRO HB3 . . . . . . . . . c19759_2mk7 1 . 16 . 2764 . 1 1 10 PRO HD2 H 7.119 -4.568 6.484 . . . 1.0 . . . . . . . . . . . . A . 10 PRO HD2 . . . . . . . . . c19759_2mk7 1 . 16 . 2765 . 1 1 10 PRO HD3 H 8.529 -5.439 7.132 . . . 1.0 . . . . . . . . . . . . A . 10 PRO HD3 . . . . . . . . . c19759_2mk7 1 . 16 . 2766 . 1 1 10 PRO HG2 H 8.146 -4.171 4.452 . . . 1.0 . . . . . . . . . . . . A . 10 PRO HG2 . . . . . . . . . c19759_2mk7 1 . 16 . 2767 . 1 1 10 PRO HG3 H 9.112 -5.583 4.901 . . . 1.0 . . . . . . . . . . . . A . 10 PRO HG3 . . . . . . . . . c19759_2mk7 1 . 16 . 2768 . 1 1 10 PRO N N 8.691 -3.349 7.172 . . . 1.0 . . . . . . . . . . . . A . 10 PRO N . . . . . . . . . c19759_2mk7 1 . 16 . 2769 . 1 1 10 PRO O O 8.933 -0.757 6.335 . . . 1.0 . . . . . . . . . . . . A . 10 PRO O . . . . . . . . . c19759_2mk7 1 . 16 . 2770 . 1 1 11 NH2 HN1 H 11.729 -1.268 5.345 . . . 1.0 . . . . . . . . . . . . A . 11 NH2 HN1 . . . . . . . . . c19759_2mk7 1 . 16 . 2771 . 1 1 11 NH2 HN2 H 11.296 0.074 6.289 . . . 1.0 . . . . . . . . . . . . A . 11 NH2 HN2 . . . . . . . . . c19759_2mk7 1 . 16 . 2772 . 1 1 11 NH2 N N 11.094 -0.820 5.941 . . . 1.0 . . . . . . . . . . . . A . 11 NH2 N . . . . . . . . . c19759_2mk7 1 . 16 . 2773 . 2 2 1 A2G C1 C 1.671 -16.348 10.592 . . . 1.0 . . . . . . . . . . . . A . 101 A2G C1 . . . . . . . . . c19759_2mk7 1 . 16 . 2774 . 2 2 1 A2G C2 C 2.057 -16.496 12.065 . . . 1.0 . . . . . . . . . . . . A . 101 A2G C2 . . . . . . . . . c19759_2mk7 1 . 16 . 2775 . 2 2 1 A2G C3 C 0.957 -17.264 12.803 . . . 1.0 . . . . . . . . . . . . A . 101 A2G C3 . . . . . . . . . c19759_2mk7 1 . 16 . 2776 . 2 2 1 A2G C4 C -0.393 -16.582 12.567 . . . 1.0 . . . . . . . . . . . . A . 101 A2G C4 . . . . . . . . . c19759_2mk7 1 . 16 . 2777 . 2 2 1 A2G C5 C -0.626 -16.402 11.064 . . . 1.0 . . . . . . . . . . . . A . 101 A2G C5 . . . . . . . . . c19759_2mk7 1 . 16 . 2778 . 2 2 1 A2G C6 C -1.926 -15.630 10.833 . . . 1.0 . . . . . . . . . . . . A . 101 A2G C6 . . . . . . . . . c19759_2mk7 1 . 16 . 2779 . 2 2 1 A2G C7 C 4.377 -16.638 12.766 . . . 1.0 . . . . . . . . . . . . A . 101 A2G C7 . . . . . . . . . c19759_2mk7 1 . 16 . 2780 . 2 2 1 A2G C8 C 5.656 -17.468 12.803 . . . 1.0 . . . . . . . . . . . . A . 101 A2G C8 . . . . . . . . . c19759_2mk7 1 . 16 . 2781 . 2 2 1 A2G H1 H 2.434 -15.780 10.081 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H1 . . . . . . . . . c19759_2mk7 1 . 16 . 2782 . 2 2 1 A2G H14 H -2.554 -16.178 10.146 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H14 . . . . . . . . . c19759_2mk7 1 . 16 . 2783 . 2 2 1 A2G H15 H -2.702 -16.334 12.471 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H15 . . . . . . . . . c19759_2mk7 1 . 16 . 2784 . 2 2 1 A2G H2 H 2.157 -15.514 12.505 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H2 . . . . . . . . . c19759_2mk7 1 . 16 . 2785 . 2 2 1 A2G H3 H 0.919 -18.278 12.435 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H3 . . . . . . . . . c19759_2mk7 1 . 16 . 2786 . 2 2 1 A2G H4 H -1.181 -17.191 12.981 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H4 . . . . . . . . . c19759_2mk7 1 . 16 . 2787 . 2 2 1 A2G H5 H -0.687 -17.368 10.586 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H5 . . . . . . . . . c19759_2mk7 1 . 16 . 2788 . 2 2 1 A2G H6 H -1.699 -14.659 10.417 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H6 . . . . . . . . . c19759_2mk7 1 . 16 . 2789 . 2 2 1 A2G H8 H 5.670 -18.067 13.701 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H8 . . . . . . . . . c19759_2mk7 1 . 16 . 2790 . 2 2 1 A2G H8A H 6.512 -16.810 12.794 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H8A . . . . . . . . . c19759_2mk7 1 . 16 . 2791 . 2 2 1 A2G H8B H 5.690 -18.114 11.938 . . . 1.0 . . . . . . . . . . . . A . 101 A2G H8B . . . . . . . . . c19759_2mk7 1 . 16 . 2792 . 2 2 1 A2G HN2 H 3.406 -18.111 11.823 . . . 1.0 . . . . . . . . . . . . A . 101 A2G HN2 . . . . . . . . . c19759_2mk7 1 . 16 . 2793 . 2 2 1 A2G HO3 H 1.450 -16.379 14.462 . . . 1.0 . . . . . . . . . . . . A . 101 A2G HO3 . . . . . . . . . c19759_2mk7 1 . 16 . 2794 . 2 2 1 A2G HO4 H -0.068 -14.665 12.570 . . . 1.0 . . . . . . . . . . . . A . 101 A2G HO4 . . . . . . . . . c19759_2mk7 1 . 16 . 2795 . 2 2 1 A2G N2 N 3.326 -17.203 12.182 . . . 1.0 . . . . . . . . . . . . A . 101 A2G N2 . . . . . . . . . c19759_2mk7 1 . 16 . 2796 . 2 2 1 A2G O O 0.443 -15.657 10.525 . . . 1.0 . . . . . . . . . . . . A . 101 A2G O . . . . . . . . . c19759_2mk7 1 . 16 . 2797 . 2 2 1 A2G O3 O 1.243 -17.277 14.193 . . . 1.0 . . . . . . . . . . . . A . 101 A2G O3 . . . . . . . . . c19759_2mk7 1 . 16 . 2798 . 2 2 1 A2G O4 O -0.397 -15.311 13.200 . . . 1.0 . . . . . . . . . . . . A . 101 A2G O4 . . . . . . . . . c19759_2mk7 1 . 16 . 2799 . 2 2 1 A2G O6 O -2.606 -15.468 12.069 . . . 1.0 . . . . . . . . . . . . A . 101 A2G O6 . . . . . . . . . c19759_2mk7 1 . 16 . 2800 . 2 2 1 A2G O7 O 4.350 -15.501 13.239 . . . 1.0 . . . . . . . . . . . . A . 101 A2G O7 . . . . . . . . . c19759_2mk7 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 c19759_2mk7 _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 2mk7.mr . . 'MR format' 1 comment 'Not applicable' 'Not applicable' 0 c19759_2mk7 1 1 2mk7.mr . . XPLOR/CNS 2 'dihedral angle' 'Not applicable' 'Not applicable' 4 c19759_2mk7 1 1 2mk7.mr . . XPLOR/CNS 3 'coupling constant' 'Not applicable' 'Not applicable' 0 c19759_2mk7 1 1 2mk7.mr . . XPLOR/CNS 4 distance NOE simple 175 c19759_2mk7 1 1 2mk7.mr . . 'MR format' 5 'nomenclature mapping' 'Not applicable' 'Not applicable' 0 c19759_2mk7 1 stop_ save_ save_CNS/XPLOR_distance_constraints_4 _Gen_dist_constraint_list.Sf_category general_distance_constraints _Gen_dist_constraint_list.Sf_framecode CNS/XPLOR_distance_constraints_4 _Gen_dist_constraint_list.Entry_ID c19759_2mk7 _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 4 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 . . . . c19759_2mk7 1 stop_ loop_ _Gen_dist_constraint.ID _Gen_dist_constraint.Member_ID _Gen_dist_constraint.Member_logic_code _Gen_dist_constraint.Assembly_atom_ID_1 _Gen_dist_constraint.Entity_assembly_ID_1 _Gen_dist_constraint.Entity_ID_1 _Gen_dist_constraint.Comp_index_ID_1 _Gen_dist_constraint.Seq_ID_1 _Gen_dist_constraint.Comp_ID_1 _Gen_dist_constraint.Atom_ID_1 _Gen_dist_constraint.Atom_type_1 _Gen_dist_constraint.Atom_isotope_number_1 _Gen_dist_constraint.Resonance_ID_1 _Gen_dist_constraint.Assembly_atom_ID_2 _Gen_dist_constraint.Entity_assembly_ID_2 _Gen_dist_constraint.Entity_ID_2 _Gen_dist_constraint.Comp_index_ID_2 _Gen_dist_constraint.Seq_ID_2 _Gen_dist_constraint.Comp_ID_2 _Gen_dist_constraint.Atom_ID_2 _Gen_dist_constraint.Atom_type_2 _Gen_dist_constraint.Atom_isotope_number_2 _Gen_dist_constraint.Resonance_ID_2 _Gen_dist_constraint.Intensity_val _Gen_dist_constraint.Intensity_lower_val_err _Gen_dist_constraint.Intensity_upper_val_err _Gen_dist_constraint.Distance_val _Gen_dist_constraint.Distance_lower_bound_val _Gen_dist_constraint.Distance_upper_bound_val _Gen_dist_constraint.Contribution_fractional_val _Gen_dist_constraint.Spectral_peak_ID _Gen_dist_constraint.Spectral_peak_list_ID _Gen_dist_constraint.PDB_record_ID_1 _Gen_dist_constraint.PDB_model_num_1 _Gen_dist_constraint.PDB_strand_ID_1 _Gen_dist_constraint.PDB_ins_code_1 _Gen_dist_constraint.PDB_residue_no_1 _Gen_dist_constraint.PDB_residue_name_1 _Gen_dist_constraint.PDB_atom_name_1 _Gen_dist_constraint.PDB_record_ID_2 _Gen_dist_constraint.PDB_model_num_2 _Gen_dist_constraint.PDB_strand_ID_2 _Gen_dist_constraint.PDB_ins_code_2 _Gen_dist_constraint.PDB_residue_no_2 _Gen_dist_constraint.PDB_residue_name_2 _Gen_dist_constraint.PDB_atom_name_2 _Gen_dist_constraint.Auth_entity_assembly_ID_1 _Gen_dist_constraint.Auth_asym_ID_1 _Gen_dist_constraint.Auth_chain_ID_1 _Gen_dist_constraint.Auth_seq_ID_1 _Gen_dist_constraint.Auth_comp_ID_1 _Gen_dist_constraint.Auth_atom_ID_1 _Gen_dist_constraint.Auth_alt_ID_1 _Gen_dist_constraint.Auth_atom_name_1 _Gen_dist_constraint.Auth_entity_assembly_ID_2 _Gen_dist_constraint.Auth_asym_ID_2 _Gen_dist_constraint.Auth_chain_ID_2 _Gen_dist_constraint.Auth_seq_ID_2 _Gen_dist_constraint.Auth_comp_ID_2 _Gen_dist_constraint.Auth_atom_ID_2 _Gen_dist_constraint.Auth_alt_ID_2 _Gen_dist_constraint.Auth_atom_name_2 _Gen_dist_constraint.Entry_ID _Gen_dist_constraint.Gen_dist_constraint_list_ID 1 1 . . 1 1 7 7 THR HA H . . . 1 1 8 8 LYS HA H . . . . . 3.4 1.8 5.0 . . . . . A . 7 THR HA . . A . 8 LYS HA . . . 7 THR HA . . . . . 8 THR HA . . c19759_2mk7 1 2 1 . . 1 1 4 4 THR HA H . . . 1 1 5 5 THR HA H . . . . . 3.4 1.8 5.0 . . . . . A . 4 THR HA . . A . 5 THR HA . . . 4 THR HA . . . . . 5 THR HA . . c19759_2mk7 1 3 1 . . 1 1 7 7 THR HA H . . . 1 1 6 6 THR HA H . . . . . 3.4 1.8 5.0 . . . . . A . 7 THR HA . . A . 6 THR HA . . . 7 THR HA . . . . . 6 THR HA . . c19759_2mk7 1 4 1 . . 1 1 5 5 THR HA H . . . 1 1 5 5 THR HB H . . . . . 3.4 1.8 5.0 . . . . . A . 5 THR HA . . A . 5 THR HB . . . 5 THR HA . . . . . 5 THR HB . . c19759_2mk7 1 5 1 . . 1 1 4 4 THR HA H . . . 1 1 4 4 THR HB H . . . . . 3.4 1.8 5.0 . . . . . A . 4 THR HA . . A . 4 THR HB . . . 4 THR HA . . . . . 4 THR HB . . c19759_2mk7 1 6 1 . . 1 1 2 2 PRO HA H . . . 1 1 3 3 PRO HD2 H . . . . . 2.9 1.8 4.0 . . . . . A . 2 PRO HA . . A . 3 PRO HD2 . . . 2 PRO HA . . . . . 3 PRO HD2 . . c19759_2mk7 1 7 1 . . 1 1 7 7 THR HA H . . . 1 1 7 7 THR HB H . . . . . 3.4 1.8 5.0 . . . . . A . 7 THR HA . . A . 7 THR HB . . . 7 THR HA . . . . . 7 THR HB . . c19759_2mk7 1 8 1 . . 1 1 9 9 LYS HA H . . . 1 1 10 10 PRO HD2 H . . . . . 2.4 1.8 3.0 . . . . . A . 9 LYS HA . . A . 10 PRO HD2 . . . 9 LYS HA . . . . . 10 PRO HD2 . . c19759_2mk7 1 9 1 . . 1 1 2 2 PRO HA H . . . 1 1 2 2 PRO HB2 H . . . . . 2.9 1.8 4.0 . . . . . A . 2 PRO HA . . A . 2 PRO HB2 . . . 2 PRO HA . . . . . 2 PRO HB2 . . c19759_2mk7 1 10 1 . . 1 1 3 3 PRO HA H . . . 1 1 3 3 PRO HB2 H . . . . . 3.4 1.8 5.0 . . . . . A . 3 PRO HA . . A . 3 PRO HB2 . . . 3 PRO HA . . . . . 3 PRO HB2 . . c19759_2mk7 1 11 1 . . 1 1 10 10 PRO HA H . . . 1 1 10 10 PRO HB2 H . . . . . 3.4 1.8 5.0 . . . . . A . 10 PRO HA . . A . 10 PRO HB2 . . . 10 PRO HA . . . . . 10 PRO HB2 . . c19759_2mk7 1 12 1 . . 1 1 5 5 THR HA H . . . 1 1 5 5 THR MG H . . . . . 3.4 1.8 5.0 . . . . . A . 5 THR HA . . A . 5 THR MG . . . 5 THR HA . . . . . 5 THR HG2# . . c19759_2mk7 1 13 1 . . 1 1 6 6 THR HA H . . . 1 1 6 6 THR MG H . . . . . 3.4 1.8 5.0 . . . . . A . 6 THR HA . . A . 6 THR MG . . . 6 THR HA . . . . . 6 THR HG2# . . c19759_2mk7 1 14 1 OR . 1 1 2 2 PRO HA H . . . 1 1 2 2 PRO HG2 H . . . . . 3.4 1.8 5.0 . . . . . A . 2 PRO HA . . A . 2 PRO HG2 . . . 2 PRO HA . . . . . 2 PRO HG# . . c19759_2mk7 1 14 2 OR . 1 1 2 2 PRO HA H . . . 1 1 2 2 PRO HG3 H . . . . . 3.4 1.8 5.0 . . . . . A . 2 PRO HA . . A . 2 PRO HG3 . . . 2 PRO HA . . . . . 2 PRO HG# . . c19759_2mk7 1 15 1 . . 1 1 4 4 THR HA H . . . 1 1 4 4 THR MG H . . . . . 3.4 1.8 5.0 . . . . . A . 4 THR HA . . A . 4 THR MG . . . 4 THR HA . . . . . 4 THR HG2# . . c19759_2mk7 1 16 1 . . 1 1 3 3 PRO HA H . . . 1 1 4 4 THR MG H . . . . . 3.4 1.8 5.0 . . . . . A . 3 PRO HA . . A . 4 THR MG . . . 3 PRO HA . . . . . 4 THR HG2# . . c19759_2mk7 1 17 1 . . 1 1 6 6 THR HA H . . . 1 1 7 7 THR MG H . . . . . 3.4 1.8 5.0 . . . . . A . 6 THR HA . . A . 7 THR MG . . . 6 THR HA . . . . . 7 THR HG2# . . c19759_2mk7 1 18 1 . . 1 1 7 7 THR HA H . . . 1 1 7 7 THR MG H . . . . . 3.4 1.8 5.0 . . . . . A . 7 THR HA . . A . 7 THR MG . . . 7 THR HA . . . . . 7 THR HG2# . . c19759_2mk7 1 19 1 . . 1 1 5 5 THR HB H . . . 1 1 5 5 THR MG H . . . . . 3.4 1.8 5.0 . . . . . A . 5 THR HB . . A . 5 THR MG . . . 5 THR HB . . . . . 5 THR HG2# . . c19759_2mk7 1 20 1 . . 1 1 6 6 THR HB H . . . 1 1 6 6 THR MG H . . . . . 3.4 1.8 5.0 . . . . . A . 6 THR HB . . A . 6 THR MG . . . 6 THR HB . . . . . 6 THR HG2# . . c19759_2mk7 1 21 1 . . 1 1 4 4 THR HB H . . . 1 1 4 4 THR MG H . . . . . 3.4 1.8 5.0 . . . . . A . 4 THR HB . . A . 4 THR MG . . . 4 THR HB . . . . . 4 THR HG2# . . c19759_2mk7 1 22 1 OR . 1 1 9 9 LYS HA H . . . 1 1 9 9 LYS HB2 H . . . . . 3.4 1.8 5.0 . . . . . A . 9 LYS HA . . A . 9 LYS HB2 . . . 9 LYS HA . . . . . 9 LYS HB# . . c19759_2mk7 1 22 2 OR . 1 1 9 9 LYS HA H . . . 1 1 9 9 LYS HB3 H . . . . . 3.4 1.8 5.0 . . . . . A . 9 LYS HA . . A . 9 LYS HB3 . . . 9 LYS HA . . . . . 9 LYS HB# . . c19759_2mk7 1 23 1 OR . 1 1 9 9 LYS HA H . . . 1 1 9 9 LYS HG2 H . . . . . 3.4 1.8 5.0 . . . . . A . 9 LYS HA . . A . 9 LYS HG2 . . . 9 LYS HA . . . . . 9 LYS HG# . . c19759_2mk7 1 23 2 OR . 1 1 9 9 LYS HA H . . . 1 1 9 9 LYS HG3 H . . . . . 3.4 1.8 5.0 . . . . . A . 9 LYS HA . . A . 9 LYS HG3 . . . 9 LYS HA . . . . . 9 LYS HG# . . c19759_2mk7 1 24 1 . . 1 1 7 7 THR HB H . . . 1 1 7 7 THR MG H . . . . . 3.4 1.8 5.0 . . . . . A . 7 THR HB . . A . 7 THR MG . . . 7 THR HB . . . . . 7 THR HG2# . . c19759_2mk7 1 25 1 OR . 1 1 8 8 LYS HA H . . . 1 1 8 8 LYS HB2 H . . . . . 3.4 1.8 5.0 . . . . . A . 8 LYS HA . . A . 8 LYS HB2 . . . 8 LYS HA . . . . . 8 LYS HB# . . c19759_2mk7 1 25 2 OR . 1 1 8 8 LYS HA H . . . 1 1 8 8 LYS HB3 H . . . . . 3.4 1.8 5.0 . . . . . A . 8 LYS HA . . A . 8 LYS HB3 . . . 8 LYS HA . . . . . 8 LYS HB# . . c19759_2mk7 1 26 1 OR . 1 1 2 2 PRO HD3 H . . . 1 1 2 2 PRO HG2 H . . . . . 2.9 1.8 4.0 . . . . . A . 2 PRO HD3 . . A . 2 PRO HG2 . . . 2 PRO HD# . . . . . 2 PRO HG# . . c19759_2mk7 1 26 2 OR . 1 1 2 2 PRO HG3 H . . . 1 1 2 2 PRO HD2 H . . . . . 2.9 1.8 4.0 . . . . . A . 2 PRO HG3 . . A . 2 PRO HD2 . . . 2 PRO HG# . . . . . 2 PRO HD# . . c19759_2mk7 1 26 3 OR . 1 1 2 2 PRO HG3 H . . . 1 1 2 2 PRO HD3 H . . . . . 2.9 1.8 4.0 . . . . . A . 2 PRO HG3 . . A . 2 PRO HD3 . . . 2 PRO HG# . . . . . 2 PRO HD# . . c19759_2mk7 1 26 4 OR . 1 1 2 2 PRO HD2 H . . . 1 1 2 2 PRO HG2 H . . . . . 2.9 1.8 4.0 . . . . . A . 2 PRO HD2 . . A . 2 PRO HG2 . . . 2 PRO HD# . . . . . 2 PRO HG# . . c19759_2mk7 1 27 1 OR . 1 1 2 2 PRO HB2 H . . . 1 1 2 2 PRO HG2 H . . . . . 3.4 1.8 5.0 . . . . . A . 2 PRO HB2 . . A . 2 PRO HG2 . . . 2 PRO HB2 . . . . . 2 PRO HG# . . c19759_2mk7 1 27 2 OR . 1 1 2 2 PRO HB2 H . . . 1 1 2 2 PRO HG3 H . . . . . 3.4 1.8 5.0 . . . . . A . 2 PRO HB2 . . A . 2 PRO HG3 . . . 2 PRO HB2 . . . . . 2 PRO HG# . . c19759_2mk7 1 28 1 OR . 1 1 9 9 LYS HD2 H . . . 1 1 9 9 LYS HE2 H . . . . . 3.4 1.8 5.0 . . . . . A . 9 LYS HD2 . . A . 9 LYS HE2 . . . 9 LYS HD# . . . . . 9 LYS HE# . . c19759_2mk7 1 28 2 OR . 1 1 9 9 LYS HD3 H . . . 1 1 9 9 LYS HE2 H . . . . . 3.4 1.8 5.0 . . . . . A . 9 LYS HD3 . . A . 9 LYS HE2 . . . 9 LYS HD# . . . . . 9 LYS HE# . . c19759_2mk7 1 28 3 OR . 1 1 9 9 LYS HE3 H . . . 1 1 9 9 LYS HD2 H . . . . . 3.4 1.8 5.0 . . . . . A . 9 LYS HE3 . . A . 9 LYS HD2 . . . 9 LYS HE# . . . . . 9 LYS HD# . . c19759_2mk7 1 28 4 OR . 1 1 9 9 LYS HD3 H . . . 1 1 9 9 LYS HE3 H . . . . . 3.4 1.8 5.0 . . . . . A . 9 LYS HD3 . . A . 9 LYS HE3 . . . 9 LYS HD# . . . . . 9 LYS HE# . . c19759_2mk7 1 29 1 OR . 1 1 8 8 LYS HD3 H . . . 1 1 8 8 LYS HE2 H . . . . . 3.4 1.8 5.0 . . . . . A . 8 LYS HD3 . . A . 8 LYS HE2 . . . 8 LYS HD# . . . . . 8 LYS HE# . . c19759_2mk7 1 29 2 OR . 1 1 8 8 LYS HD2 H . . . 1 1 8 8 LYS HE2 H . . . . . 3.4 1.8 5.0 . . . . . A . 8 LYS HD2 . . A . 8 LYS HE2 . . . 8 LYS HD# . . . . . 8 LYS HE# . . c19759_2mk7 1 29 3 OR . 1 1 8 8 LYS HE3 H . . . 1 1 8 8 LYS HD2 H . . . . . 3.4 1.8 5.0 . . . . . A . 8 LYS HE3 . . A . 8 LYS HD2 . . . 8 LYS HE# . . . . . 8 LYS HD# . . c19759_2mk7 1 29 4 OR . 1 1 8 8 LYS HD3 H . . . 1 1 8 8 LYS HE3 H . . . . . 3.4 1.8 5.0 . . . . . A . 8 LYS HD3 . . A . 8 LYS HE3 . . . 8 LYS HD# . . . . . 8 LYS HE# . . c19759_2mk7 1 30 1 OR . 1 1 9 9 LYS HB2 H . . . 1 1 9 9 LYS HG2 H . . . . . 2.9 1.8 4.0 . . . . . A . 9 LYS HB2 . . A . 9 LYS HG2 . . . 9 LYS HB# . . . . . 9 LYS HG# . . c19759_2mk7 1 30 2 OR . 1 1 9 9 LYS HB3 H . . . 1 1 9 9 LYS HG2 H . . . . . 2.9 1.8 4.0 . . . . . A . 9 LYS HB3 . . A . 9 LYS HG2 . . . 9 LYS HB# . . . . . 9 LYS HG# . . c19759_2mk7 1 30 3 OR . 1 1 9 9 LYS HG3 H . . . 1 1 9 9 LYS HB2 H . . . . . 2.9 1.8 4.0 . . . . . A . 9 LYS HG3 . . A . 9 LYS HB2 . . . 9 LYS HG# . . . . . 9 LYS HB# . . c19759_2mk7 1 30 4 OR . 1 1 9 9 LYS HB3 H . . . 1 1 9 9 LYS HG3 H . . . . . 2.9 1.8 4.0 . . . . . A . 9 LYS HB3 . . A . 9 LYS HG3 . . . 9 LYS HB# . . . . . 9 LYS HG# . . c19759_2mk7 1 31 1 OR . 1 1 9 9 LYS HD2 H . . . 1 1 9 9 LYS HG2 H . . . . . 2.4 1.8 3.0 . . . . . A . 9 LYS HD2 . . A . 9 LYS HG2 . . . 9 LYS HD# . . . . . 9 LYS HG# . . c19759_2mk7 1 31 2 OR . 1 1 9 9 LYS HD3 H . . . 1 1 9 9 LYS HG2 H . . . . . 2.4 1.8 3.0 . . . . . A . 9 LYS HD3 . . A . 9 LYS HG2 . . . 9 LYS HD# . . . . . 9 LYS HG# . . c19759_2mk7 1 31 3 OR . 1 1 9 9 LYS HG3 H . . . 1 1 9 9 LYS HD2 H . . . . . 2.4 1.8 3.0 . . . . . A . 9 LYS HG3 . . A . 9 LYS HD2 . . . 9 LYS HG# . . . . . 9 LYS HD# . . c19759_2mk7 1 31 4 OR . 1 1 9 9 LYS HG3 H . . . 1 1 9 9 LYS HD3 H . . . . . 2.4 1.8 3.0 . . . . . A . 9 LYS HG3 . . A . 9 LYS HD3 . . . 9 LYS HG# . . . . . 9 LYS HD# . . c19759_2mk7 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 W 2 59 2 62 c19759_2mk7 1 2 W 4 59 4 62 c19759_2mk7 1 3 W 6 59 6 62 c19759_2mk7 1 4 W 9 59 9 62 c19759_2mk7 1 5 W 11 59 11 62 c19759_2mk7 1 6 W 13 59 13 62 c19759_2mk7 1 7 W 15 59 15 62 c19759_2mk7 1 8 W 17 59 17 62 c19759_2mk7 1 9 W 19 59 19 62 c19759_2mk7 1 10 W 21 59 21 62 c19759_2mk7 1 11 W 23 59 23 62 c19759_2mk7 1 12 W 25 59 25 62 c19759_2mk7 1 13 W 27 59 27 62 c19759_2mk7 1 14 W 30 59 30 62 c19759_2mk7 1 15 W 33 59 33 62 c19759_2mk7 1 16 W 36 59 36 62 c19759_2mk7 1 17 W 38 59 38 62 c19759_2mk7 1 18 S 40 59 40 62 c19759_2mk7 1 19 S 42 59 42 62 c19759_2mk7 1 20 W 44 59 44 62 c19759_2mk7 1 21 W 47 59 47 62 c19759_2mk7 1 22 W 50 59 50 62 c19759_2mk7 1 23 W 53 59 53 62 c19759_2mk7 1 24 S 56 59 56 62 c19759_2mk7 1 25 W 58 59 58 62 c19759_2mk7 1 26 W 60 59 60 62 c19759_2mk7 1 27 S 62 59 62 62 c19759_2mk7 1 28 W 64 59 64 62 c19759_2mk7 1 29 S 66 59 66 62 c19759_2mk7 1 30 S 68 59 68 62 c19759_2mk7 1 31 M 70 59 70 62 c19759_2mk7 1 32 M 72 59 72 62 c19759_2mk7 1 33 W 74 59 74 62 c19759_2mk7 1 34 W 76 59 76 62 c19759_2mk7 1 35 W 78 59 78 62 c19759_2mk7 1 36 W 80 59 80 62 c19759_2mk7 1 37 M 82 59 82 62 c19759_2mk7 1 38 M 84 59 84 62 c19759_2mk7 1 39 S 86 59 86 62 c19759_2mk7 1 40 W 88 59 88 62 c19759_2mk7 1 41 W 90 59 90 62 c19759_2mk7 1 42 W 92 59 92 62 c19759_2mk7 1 43 W 94 59 94 62 c19759_2mk7 1 44 W 96 59 96 62 c19759_2mk7 1 45 W 98 59 98 62 c19759_2mk7 1 46 W 100 59 100 62 c19759_2mk7 1 47 W 102 59 102 62 c19759_2mk7 1 48 W 104 59 104 62 c19759_2mk7 1 49 W 106 59 106 62 c19759_2mk7 1 50 W 108 59 108 62 c19759_2mk7 1 51 W 110 59 110 62 c19759_2mk7 1 52 W 112 59 112 62 c19759_2mk7 1 53 W 115 59 115 62 c19759_2mk7 1 54 W 117 59 117 62 c19759_2mk7 1 55 W 119 59 119 62 c19759_2mk7 1 56 W 122 59 122 62 c19759_2mk7 1 57 W 124 59 124 62 c19759_2mk7 1 58 W 126 59 126 62 c19759_2mk7 1 59 W 128 59 128 62 c19759_2mk7 1 60 W 130 59 130 62 c19759_2mk7 1 61 W 133 59 133 62 c19759_2mk7 1 62 S 135 59 135 62 c19759_2mk7 1 63 S 137 59 137 62 c19759_2mk7 1 64 M 139 59 139 62 c19759_2mk7 1 65 S 141 59 141 62 c19759_2mk7 1 66 W 143 59 143 62 c19759_2mk7 1 67 W 145 59 145 62 c19759_2mk7 1 68 W 147 59 147 62 c19759_2mk7 1 69 W 149 59 149 62 c19759_2mk7 1 70 S 151 59 151 62 c19759_2mk7 1 71 W 153 59 153 62 c19759_2mk7 1 72 W 155 59 155 62 c19759_2mk7 1 73 W 157 59 157 62 c19759_2mk7 1 74 S 159 59 159 62 c19759_2mk7 1 75 W 162 59 162 62 c19759_2mk7 1 76 W 165 59 165 62 c19759_2mk7 1 77 M 167 59 167 62 c19759_2mk7 1 78 W 169 59 169 62 c19759_2mk7 1 79 M 171 59 171 62 c19759_2mk7 1 80 S 173 59 173 62 c19759_2mk7 1 81 W 175 59 175 62 c19759_2mk7 1 82 W 177 59 177 62 c19759_2mk7 1 83 M 179 59 179 62 c19759_2mk7 1 84 W 181 59 181 62 c19759_2mk7 1 85 W 183 59 183 62 c19759_2mk7 1 86 W 185 60 185 63 c19759_2mk7 1 87 W 187 60 187 63 c19759_2mk7 1 88 W 189 60 189 63 c19759_2mk7 1 89 W 191 59 191 62 c19759_2mk7 1 90 W 193 60 193 63 c19759_2mk7 1 91 W 196 60 196 63 c19759_2mk7 1 92 W 200 60 200 63 c19759_2mk7 1 93 W 202 59 202 62 c19759_2mk7 1 94 W 205 60 205 63 c19759_2mk7 1 95 W 208 60 208 63 c19759_2mk7 1 96 W 210 59 210 62 c19759_2mk7 1 97 W 212 60 212 63 c19759_2mk7 1 98 W 214 60 214 63 c19759_2mk7 1 99 W 216 60 216 63 c19759_2mk7 1 100 W 218 60 218 63 c19759_2mk7 1 101 W 220 59 220 62 c19759_2mk7 1 102 W 222 59 222 62 c19759_2mk7 1 103 W 224 59 224 62 c19759_2mk7 1 104 W 226 60 226 63 c19759_2mk7 1 105 W 228 59 228 62 c19759_2mk7 1 106 W 230 60 230 63 c19759_2mk7 1 107 W 232 60 232 63 c19759_2mk7 1 108 W 234 60 234 63 c19759_2mk7 1 109 W 236 60 236 63 c19759_2mk7 1 110 W 239 60 239 63 c19759_2mk7 1 111 W 243 60 243 63 c19759_2mk7 1 112 W 247 60 247 63 c19759_2mk7 1 113 W 251 60 251 63 c19759_2mk7 1 114 W 255 60 255 63 c19759_2mk7 1 115 W 259 60 259 63 c19759_2mk7 1 116 W 262 59 262 62 c19759_2mk7 1 117 W 265 59 265 62 c19759_2mk7 1 118 W 268 59 268 62 c19759_2mk7 1 119 W 271 59 271 62 c19759_2mk7 1 120 W 274 60 274 63 c19759_2mk7 1 121 W 277 60 277 63 c19759_2mk7 1 122 W 280 60 280 63 c19759_2mk7 1 123 W 283 60 283 63 c19759_2mk7 1 124 M 286 59 286 62 c19759_2mk7 1 125 M 288 59 288 62 c19759_2mk7 1 126 W 291 59 291 62 c19759_2mk7 1 127 M 294 59 294 62 c19759_2mk7 1 128 W 296 59 296 62 c19759_2mk7 1 129 W 298 60 298 63 c19759_2mk7 1 130 W 300 60 300 63 c19759_2mk7 1 131 W 303 59 303 62 c19759_2mk7 1 132 W 305 59 305 62 c19759_2mk7 1 133 W 307 59 307 62 c19759_2mk7 1 134 W 309 59 309 62 c19759_2mk7 1 135 W 311 59 311 62 c19759_2mk7 1 136 W 313 59 313 62 c19759_2mk7 1 137 W 315 59 315 62 c19759_2mk7 1 138 M 317 59 317 62 c19759_2mk7 1 139 W 319 59 319 62 c19759_2mk7 1 140 W 321 59 321 62 c19759_2mk7 1 141 W 323 59 323 62 c19759_2mk7 1 142 W 325 59 325 62 c19759_2mk7 1 143 W 327 59 327 62 c19759_2mk7 1 144 W 330 59 330 62 c19759_2mk7 1 145 W 333 59 333 62 c19759_2mk7 1 146 W 335 59 335 62 c19759_2mk7 1 147 W 337 59 337 62 c19759_2mk7 1 148 W 339 59 339 62 c19759_2mk7 1 149 W 342 59 342 62 c19759_2mk7 1 150 W 345 59 345 62 c19759_2mk7 1 151 W 347 59 347 62 c19759_2mk7 1 152 W 349 59 349 62 c19759_2mk7 1 153 W 351 59 351 62 c19759_2mk7 1 154 W 354 59 354 62 c19759_2mk7 1 155 W 358 59 358 62 c19759_2mk7 1 156 W 362 59 362 62 c19759_2mk7 1 157 W 366 59 366 62 c19759_2mk7 1 158 W 369 59 369 62 c19759_2mk7 1 159 W 372 59 372 62 c19759_2mk7 1 160 W 375 59 375 62 c19759_2mk7 1 161 W 377 59 377 62 c19759_2mk7 1 162 W 379 59 379 62 c19759_2mk7 1 163 W 382 59 382 62 c19759_2mk7 1 164 W 385 59 385 62 c19759_2mk7 1 165 W 387 59 387 62 c19759_2mk7 1 166 S 389 59 389 62 c19759_2mk7 1 167 S 391 59 391 62 c19759_2mk7 1 168 W 393 59 393 62 c19759_2mk7 1 169 W 395 59 395 62 c19759_2mk7 1 170 W 398 60 398 63 c19759_2mk7 1 171 W 400 60 400 63 c19759_2mk7 1 172 M 403 59 403 62 c19759_2mk7 1 173 S 405 59 405 62 c19759_2mk7 1 174 S 407 59 407 62 c19759_2mk7 1 175 S 409 59 409 62 c19759_2mk7 1 stop_ loop_ _Gen_dist_constraint_conv_err.ID _Gen_dist_constraint_conv_err.Gen_dist_constraint_parse_file_ID _Gen_dist_constraint_conv_err.Parse_file_constraint_ID _Gen_dist_constraint_conv_err.Conv_error_type _Gen_dist_constraint_conv_err.Conv_error_note _Gen_dist_constraint_conv_err.Entry_ID _Gen_dist_constraint_conv_err.Gen_dist_constraint_list_ID 1 4 1 1 "Not handling restraint 1, item 1, resonance(s) ' .7.H' (nmrStar names),' .6.H' (nmrStar names) not linked" c19759_2mk7 1 2 4 4 1 "Not handling restraint 4, item 1, resonance(s) ' .15.H1' (nmrStar names) not linked" c19759_2mk7 1 3 4 5 1 "Not handling restraint 5, item 1, resonance(s) ' .14.H1' (nmrStar names) not linked" c19759_2mk7 1 4 4 6 1 "Not handling restraint 6, item 1, resonance(s) ' .13.H1' (nmrStar names) not linked" c19759_2mk7 1 5 4 7 1 "Not handling restraint 7, item 1, resonance(s) ' .13.H1' (nmrStar names) not linked" c19759_2mk7 1 6 4 8 1 "Not handling restraint 8, item 1, resonance(s) ' .12.H1' (nmrStar names) not linked" c19759_2mk7 1 7 4 9 1 "Not handling restraint 9, item 1, resonance(s) ' .12.H1' (nmrStar names) not linked" c19759_2mk7 1 8 4 10 1 "Not handling restraint 10, item 1, resonance(s) ' .14.H1' (nmrStar names) not linked" c19759_2mk7 1 9 4 11 1 "Not handling restraint 11, item 1, resonance(s) ' .13.H1' (nmrStar names) not linked" c19759_2mk7 1 10 4 13 1 "Not handling restraint 13, item 1, resonance(s) ' .15.H1' (nmrStar names),' .8.H' (nmrStar names) not linked" c19759_2mk7 1 11 4 14 1 "Not handling restraint 14, item 1, resonance(s) ' .15.H1' (nmrStar names),' .15.HN2' (nmrStar names) not linked" c19759_2mk7 1 12 4 15 1 "Not handling restraint 15, item 1, resonance(s) ' .7.H' (nmrStar names),' .14.H1' (nmrStar names) not linked" c19759_2mk7 1 13 4 16 1 "Not handling restraint 16, item 1, resonance(s) ' .14.H1' (nmrStar names),' .14.HN2' (nmrStar names) not linked" c19759_2mk7 1 14 4 17 1 "Not handling restraint 17, item 1, resonance(s) ' .5.H' (nmrStar names) not linked" c19759_2mk7 1 15 4 18 1 "Not handling restraint 18, item 1, resonance(s) ' .6.H' (nmrStar names) not linked" c19759_2mk7 1 16 4 19 1 "Not handling restraint 19, item 1, resonance(s) ' .7.H' (nmrStar names) not linked" c19759_2mk7 1 17 4 20 1 "Not handling restraint 20, item 1, resonance(s) ' .6.H' (nmrStar names) not linked" c19759_2mk7 1 18 4 21 1 "Not handling restraint 21, item 1, resonance(s) ' .12.H1' (nmrStar names),' .5.H' (nmrStar names) not linked" c19759_2mk7 1 19 4 22 1 "Not handling restraint 22, item 1, resonance(s) ' .12.H1' (nmrStar names),' .12.HN2' (nmrStar names) not linked" c19759_2mk7 1 20 4 23 1 "Not handling restraint 23, item 1, resonance(s) ' .6.H' (nmrStar names),' .13.H1' (nmrStar names) not linked" c19759_2mk7 1 21 4 24 1 "Not handling restraint 24, item 1, resonance(s) ' .5.H' (nmrStar names) not linked" c19759_2mk7 1 22 4 25 1 "Not handling restraint 25, item 1, resonance(s) ' .4.H' (nmrStar names) not linked" c19759_2mk7 1 23 4 26 1 "Not handling restraint 26, item 1, resonance(s) ' .13.H1' (nmrStar names),' .13.HN2' (nmrStar names) not linked" c19759_2mk7 1 24 4 27 1 "Not handling restraint 27, item 1, resonance(s) ' .4.H' (nmrStar names) not linked" c19759_2mk7 1 25 4 28 1 "Not handling restraint 28, item 1, resonance(s) ' .7.H' (nmrStar names) not linked" c19759_2mk7 1 26 4 29 1 "Not handling restraint 29, item 1, resonance(s) ' .8.H' (nmrStar names) not linked" c19759_2mk7 1 27 4 30 1 "Not handling restraint 30, item 1, resonance(s) ' .6.H' (nmrStar names) not linked" c19759_2mk7 1 28 4 31 1 "Not handling restraint 31, item 1, resonance(s) ' .7.H' (nmrStar names) not linked" c19759_2mk7 1 29 4 32 1 "Not handling restraint 32, item 1, resonance(s) ' .5.H' (nmrStar names) not linked" c19759_2mk7 1 30 4 33 1 "Not handling restraint 33, item 1, resonance(s) ' .4.H' (nmrStar names) not linked" c19759_2mk7 1 31 4 34 1 "Not handling restraint 34, item 1, resonance(s) ' .5.H' (nmrStar names) not linked" c19759_2mk7 1 32 4 35 1 "Not handling restraint 35, item 1, resonance(s) ' .7.H' (nmrStar names) not linked" c19759_2mk7 1 33 4 36 1 "Not handling restraint 36, item 1, resonance(s) ' .9.H' (nmrStar names) not linked" c19759_2mk7 1 34 4 37 1 "Not handling restraint 37, item 1, resonance(s) ' .11.HN#' (nmrStar names) not linked" c19759_2mk7 1 35 4 38 1 "Not handling restraint 38, item 1, resonance(s) ' .8.H' (nmrStar names) not linked" c19759_2mk7 1 36 4 39 1 "Not handling restraint 39, item 1, resonance(s) ' .9.H' (nmrStar names) not linked" c19759_2mk7 1 37 4 40 1 "Not handling restraint 40, item 1, resonance(s) ' .8.H' (nmrStar names) not linked" c19759_2mk7 1 38 4 41 1 "Not handling restraint 41, item 1, resonance(s) ' .7.H' (nmrStar names),' .15.H3' (nmrStar names) not linked" c19759_2mk7 1 39 4 42 1 "Not handling restraint 42, item 1, resonance(s) ' .6.H' (nmrStar names),' .14.H3' (nmrStar names) not linked" c19759_2mk7 1 40 4 43 1 "Not handling restraint 43, item 1, resonance(s) ' .5.H' (nmrStar names),' .13.H3' (nmrStar names) not linked" c19759_2mk7 1 41 4 44 1 "Not handling restraint 44, item 1, resonance(s) ' .4.H' (nmrStar names),' .12.H3' (nmrStar names) not linked" c19759_2mk7 1 42 4 45 1 "Not handling restraint 45, item 1, resonance(s) ' .7.H' (nmrStar names),' .15.H5' (nmrStar names) not linked" c19759_2mk7 1 43 4 46 1 "Not handling restraint 46, item 1, resonance(s) ' .6.H' (nmrStar names),' .14.H5' (nmrStar names) not linked" c19759_2mk7 1 44 4 47 1 "Not handling restraint 47, item 1, resonance(s) ' .5.H' (nmrStar names),' .13.H5' (nmrStar names) not linked" c19759_2mk7 1 45 4 48 1 "Not handling restraint 48, item 1, resonance(s) ' .4.H' (nmrStar names),' .12.H5' (nmrStar names) not linked" c19759_2mk7 1 46 4 49 1 "Not handling restraint 49, item 1, resonance(s) ' .15.HN2' (nmrStar names) not linked" c19759_2mk7 1 47 4 50 1 "Not handling restraint 50, item 1, resonance(s) ' .15.HN2' (nmrStar names) not linked" c19759_2mk7 1 48 4 51 1 "Not handling restraint 51, item 1, resonance(s) ' .15.HN2' (nmrStar names) not linked" c19759_2mk7 1 49 4 52 1 "Not handling restraint 52, item 1, resonance(s) ' .15.HN2' (nmrStar names) not linked" c19759_2mk7 1 50 4 53 1 "Not handling restraint 53, item 1, resonance(s) ' .14.HN2' (nmrStar names) not linked" c19759_2mk7 1 51 4 54 1 "Not handling restraint 54, item 1, resonance(s) ' .14.HN2' (nmrStar names) not linked" c19759_2mk7 1 52 4 55 1 "Not handling restraint 55, item 1, resonance(s) ' .14.HN2' (nmrStar names) not linked" c19759_2mk7 1 53 4 56 1 "Not handling restraint 56, item 1, resonance(s) ' .13.HN2' (nmrStar names) not linked" c19759_2mk7 1 54 4 57 1 "Not handling restraint 57, item 1, resonance(s) ' .13.HN2' (nmrStar names) not linked" c19759_2mk7 1 55 4 58 1 "Not handling restraint 58, item 1, resonance(s) ' .12.HN2' (nmrStar names) not linked" c19759_2mk7 1 56 4 59 1 "Not handling restraint 59, item 1, resonance(s) ' .12.HN2' (nmrStar names) not linked" c19759_2mk7 1 57 4 60 1 "Not handling restraint 60, item 1, resonance(s) ' .12.HN2' (nmrStar names) not linked" c19759_2mk7 1 58 4 61 1 "Not handling restraint 61, item 1, resonance(s) ' .15.H1' (nmrStar names),' .15.H3' (nmrStar names) not linked" c19759_2mk7 1 59 4 62 1 "Not handling restraint 62, item 1, resonance(s) ' .15.H1' (nmrStar names) not linked" c19759_2mk7 1 60 4 63 1 "Not handling restraint 63, item 1, resonance(s) ' .15.H1' (nmrStar names),' .15.H2' (nmrStar names) not linked" c19759_2mk7 1 61 4 64 1 "Not handling restraint 64, item 1, resonance(s) ' .14.H1' (nmrStar names) not linked" c19759_2mk7 1 62 4 65 1 "Not handling restraint 65, item 1, resonance(s) ' .14.H1' (nmrStar names),' .14.H2' (nmrStar names) not linked" c19759_2mk7 1 63 4 66 1 "Not handling restraint 66, item 1, resonance(s) ' .14.H1' (nmrStar names),' .14.H4' (nmrStar names) not linked" c19759_2mk7 1 64 4 67 1 "Not handling restraint 67, item 1, resonance(s) ' .14.H1' (nmrStar names),' .14.H3' (nmrStar names) not linked" c19759_2mk7 1 65 4 69 1 "Not handling restraint 69, item 1, resonance(s) ' .12.H1' (nmrStar names) not linked" c19759_2mk7 1 66 4 70 1 "Not handling restraint 70, item 1, resonance(s) ' .12.H1' (nmrStar names),' .12.H2' (nmrStar names) not linked" c19759_2mk7 1 67 4 71 1 "Not handling restraint 71, item 1, resonance(s) ' .12.H1' (nmrStar names),' .12.H3' (nmrStar names) not linked" c19759_2mk7 1 68 4 72 1 "Not handling restraint 72, item 1, resonance(s) ' .13.H1' (nmrStar names) not linked" c19759_2mk7 1 69 4 74 1 "Not handling restraint 74, item 1, resonance(s) ' .13.H1' (nmrStar names),' .13.H2' (nmrStar names) not linked" c19759_2mk7 1 70 4 75 1 "Not handling restraint 75, item 1, resonance(s) ' .13.H1' (nmrStar names),' .13.H4' (nmrStar names) not linked" c19759_2mk7 1 71 4 76 1 "Not handling restraint 76, item 1, resonance(s) ' .13.H1' (nmrStar names),' .13.H3' (nmrStar names) not linked" c19759_2mk7 1 72 4 79 1 "Not handling restraint 79, item 1, resonance(s) ' .10.HD3' (nmrStar names) not linked" c19759_2mk7 1 73 4 81 1 "Not handling restraint 81, item 1, resonance(s) ' .13.H2' (nmrStar names) not linked" c19759_2mk7 1 74 4 82 1 "Not handling restraint 82, item 1, resonance(s) ' .12.H2' (nmrStar names) not linked" c19759_2mk7 1 75 4 86 1 "Not handling restraint 86, item 1, resonance(s) ' .15.H1' (nmrStar names) not linked" c19759_2mk7 1 76 4 91 1 "Not handling restraint 91, item 1, resonance(s) ' .13.H1' (nmrStar names) not linked" c19759_2mk7 1 77 4 92 1 "Not handling restraint 92, item 1, resonance(s) ' .13.H1' (nmrStar names) not linked" c19759_2mk7 1 78 4 93 1 "Not handling restraint 93, item 1, resonance(s) ' .2.HB3' (nmrStar names) not linked" c19759_2mk7 1 79 4 96 1 "Not handling restraint 96, item 1, resonance(s) ' .3.HB3' (nmrStar names) not linked" c19759_2mk7 1 80 4 103 1 "Not handling restraint 103, item 1, resonance(s) ' .10.HB3' (nmrStar names) not linked" c19759_2mk7 1 81 4 106 1 "Not handling restraint 106, item 1, resonance(s) ' .12.H5' (nmrStar names) not linked" c19759_2mk7 1 82 4 107 1 "Not handling restraint 107, item 1, resonance(s) ' .13.H5' (nmrStar names) not linked" c19759_2mk7 1 83 4 108 1 "Not handling restraint 108, item 1, resonance(s) ' .14.H5' (nmrStar names) not linked" c19759_2mk7 1 84 4 109 1 "Not handling restraint 109, item 1, resonance(s) ' .15.H5' (nmrStar names) not linked" c19759_2mk7 1 85 4 110 1 "Not handling restraint 110, item 1, resonance(s) ' .12.H4' (nmrStar names) not linked" c19759_2mk7 1 86 4 111 1 "Not handling restraint 111, item 1, resonance(s) ' .13.H4' (nmrStar names) not linked" c19759_2mk7 1 87 4 112 1 "Not handling restraint 112, item 1, resonance(s) ' .12.H3' (nmrStar names) not linked" c19759_2mk7 1 88 4 113 1 "Not handling restraint 113, item 1, resonance(s) ' .13.H3' (nmrStar names) not linked" c19759_2mk7 1 89 4 114 1 "Not handling restraint 114, item 1, resonance(s) ' .14.H3' (nmrStar names) not linked" c19759_2mk7 1 90 4 115 1 "Not handling restraint 115, item 1, resonance(s) ' .15.H3' (nmrStar names) not linked" c19759_2mk7 1 91 4 116 1 "Not handling restraint 116, item 1, resonance(s) ' .4.H' (nmrStar names),' .12.H8#' (nmrStar names) not linked" c19759_2mk7 1 92 4 117 1 "Not handling restraint 117, item 1, resonance(s) ' .5.H' (nmrStar names),' .13.H8#' (nmrStar names) not linked" c19759_2mk7 1 93 4 118 1 "Not handling restraint 118, item 1, resonance(s) ' .6.H' (nmrStar names),' .14.H8#' (nmrStar names) not linked" c19759_2mk7 1 94 4 119 1 "Not handling restraint 119, item 1, resonance(s) ' .7.H' (nmrStar names),' .15.H8#' (nmrStar names) not linked" c19759_2mk7 1 95 4 120 1 "Not handling restraint 120, item 1, resonance(s) ' .15.H14' (nmrStar names) not linked" c19759_2mk7 1 96 4 120 1 "Not handling restraint 120, item 1, resonance(s) ' .15.H6' (nmrStar names) not linked" c19759_2mk7 1 97 4 121 1 "Not handling restraint 121, item 1, resonance(s) ' .14.H14' (nmrStar names) not linked" c19759_2mk7 1 98 4 121 1 "Not handling restraint 121, item 1, resonance(s) ' .14.H6' (nmrStar names) not linked" c19759_2mk7 1 99 4 122 1 "Not handling restraint 122, item 1, resonance(s) ' .13.H14' (nmrStar names) not linked" c19759_2mk7 1 100 4 122 1 "Not handling restraint 122, item 1, resonance(s) ' .13.H6' (nmrStar names) not linked" c19759_2mk7 1 101 4 123 1 "Not handling restraint 123, item 1, resonance(s) ' .12.H14' (nmrStar names) not linked" c19759_2mk7 1 102 4 123 1 "Not handling restraint 123, item 1, resonance(s) ' .12.H6' (nmrStar names) not linked" c19759_2mk7 1 103 4 125 1 "Not handling restraint 125, item 1, resonance(s) ' .3.HB3' (nmrStar names),' .3.HD3' (nmrStar names) not linked" c19759_2mk7 1 104 4 126 1 "Not handling restraint 126, item 1, resonance(s) ' .10.HD3' (nmrStar names) not linked" c19759_2mk7 1 105 4 126 1 "Not handling restraint 126, item 1, resonance(s) ' .10.HD3' (nmrStar names) not linked" c19759_2mk7 1 106 4 127 1 "Not handling restraint 127, item 1, resonance(s) ' .1.HA#' (nmrStar names) not linked" c19759_2mk7 1 107 4 127 1 "Not handling restraint 127, item 1, resonance(s) ' .1.HA#' (nmrStar names) not linked" c19759_2mk7 1 108 4 128 1 "Not handling restraint 128, item 1, resonance(s) ' .3.HB3' (nmrStar names) not linked" c19759_2mk7 1 109 4 129 1 "Not handling restraint 129, item 1, resonance(s) ' .14.H1' (nmrStar names) not linked" c19759_2mk7 1 110 4 130 1 "Not handling restraint 130, item 1, resonance(s) ' .12.H1' (nmrStar names) not linked" c19759_2mk7 1 111 4 131 1 "Not handling restraint 131, item 1, resonance(s) ' .15.HN2' (nmrStar names),' .15.H2' (nmrStar names) not linked" c19759_2mk7 1 112 4 132 1 "Not handling restraint 132, item 1, resonance(s) ' .14.HN2' (nmrStar names),' .14.H2' (nmrStar names) not linked" c19759_2mk7 1 113 4 133 1 "Not handling restraint 133, item 1, resonance(s) ' .12.HN2' (nmrStar names),' .12.H2' (nmrStar names) not linked" c19759_2mk7 1 114 4 134 1 "Not handling restraint 134, item 1, resonance(s) ' .13.HN2' (nmrStar names),' .13.H2' (nmrStar names) not linked" c19759_2mk7 1 115 4 135 1 "Not handling restraint 135, item 1, resonance(s) ' .12.HN2' (nmrStar names),' .12.H3' (nmrStar names) not linked" c19759_2mk7 1 116 4 136 1 "Not handling restraint 136, item 1, resonance(s) ' .13.HN2' (nmrStar names),' .13.H3' (nmrStar names) not linked" c19759_2mk7 1 117 4 137 1 "Not handling restraint 137, item 1, resonance(s) ' .15.HN2' (nmrStar names),' .15.H3' (nmrStar names) not linked" c19759_2mk7 1 118 4 138 1 "Not handling restraint 138, item 1, resonance(s) ' .14.HN2' (nmrStar names),' .14.H3' (nmrStar names) not linked" c19759_2mk7 1 119 4 139 1 "Not handling restraint 139, item 1, resonance(s) ' .6.H' (nmrStar names),' .14.HN2' (nmrStar names) not linked" c19759_2mk7 1 120 4 140 1 "Not handling restraint 140, item 1, resonance(s) ' .5.H' (nmrStar names),' .13.HN2' (nmrStar names) not linked" c19759_2mk7 1 121 4 141 1 "Not handling restraint 141, item 1, resonance(s) ' .7.H' (nmrStar names),' .15.HN2' (nmrStar names) not linked" c19759_2mk7 1 122 4 142 1 "Not handling restraint 142, item 1, resonance(s) ' .12.HN2' (nmrStar names),' .4.H' (nmrStar names) not linked" c19759_2mk7 1 123 4 143 1 "Not handling restraint 143, item 1, resonance(s) ' .7.H' (nmrStar names),' .13.H8#' (nmrStar names) not linked" c19759_2mk7 1 124 4 144 1 "Not handling restraint 144, item 1, resonance(s) ' .9.H' (nmrStar names),' .15.H8#' (nmrStar names) not linked" c19759_2mk7 1 125 4 145 1 "Not handling restraint 145, item 1, resonance(s) ' .15.HN2' (nmrStar names),' .15.H8#' (nmrStar names) not linked" c19759_2mk7 1 126 4 146 1 "Not handling restraint 146, item 1, resonance(s) ' .6.H' (nmrStar names),' .12.H8#' (nmrStar names) not linked" c19759_2mk7 1 127 4 147 1 "Not handling restraint 147, item 1, resonance(s) ' .12.HN2' (nmrStar names),' .12.H8#' (nmrStar names) not linked" c19759_2mk7 1 128 4 148 1 "Not handling restraint 148, item 1, resonance(s) ' .13.HN2' (nmrStar names),' .13.H8#' (nmrStar names) not linked" c19759_2mk7 1 129 4 149 1 "Not handling restraint 149, item 1, resonance(s) ' .8.H' (nmrStar names),' .14.H8#' (nmrStar names) not linked" c19759_2mk7 1 130 4 150 1 "Not handling restraint 150, item 1, resonance(s) ' .14.HN2' (nmrStar names),' .14.H8#' (nmrStar names) not linked" c19759_2mk7 1 131 4 151 1 "Not handling restraint 151, item 1, resonance(s) ' .11.HN#' (nmrStar names),' .10.HB3' (nmrStar names) not linked" c19759_2mk7 1 132 4 152 1 "Not handling restraint 152, item 1, resonance(s) ' .9.H' (nmrStar names) not linked" c19759_2mk7 1 133 4 152 1 "Not handling restraint 152, item 1, resonance(s) ' .9.H' (nmrStar names) not linked" c19759_2mk7 1 134 4 153 1 "Not handling restraint 153, item 1, resonance(s) ' .8.H' (nmrStar names) not linked" c19759_2mk7 1 135 4 153 1 "Not handling restraint 153, item 1, resonance(s) ' .8.H' (nmrStar names) not linked" c19759_2mk7 1 136 4 154 1 "Not handling restraint 154, item 1, resonance(s) ' .9.H' (nmrStar names) not linked" c19759_2mk7 1 137 4 154 1 "Not handling restraint 154, item 1, resonance(s) ' .9.H' (nmrStar names) not linked" c19759_2mk7 1 138 4 155 1 "Not handling restraint 155, item 1, resonance(s) ' .9.H' (nmrStar names) not linked" c19759_2mk7 1 139 4 155 1 "Not handling restraint 155, item 1, resonance(s) ' .9.H' (nmrStar names) not linked" c19759_2mk7 1 140 4 156 1 "Not handling restraint 156, item 1, resonance(s) ' .8.H' (nmrStar names) not linked" c19759_2mk7 1 141 4 156 1 "Not handling restraint 156, item 1, resonance(s) ' .8.H' (nmrStar names) not linked" c19759_2mk7 1 142 4 157 1 "Not handling restraint 157, item 1, resonance(s) ' .5.H' (nmrStar names) not linked" c19759_2mk7 1 143 4 158 1 "Not handling restraint 158, item 1, resonance(s) ' .4.H' (nmrStar names) not linked" c19759_2mk7 1 144 4 159 1 "Not handling restraint 159, item 1, resonance(s) ' .6.H' (nmrStar names) not linked" c19759_2mk7 1 145 4 160 1 "Not handling restraint 160, item 1, resonance(s) ' .5.H' (nmrStar names) not linked" c19759_2mk7 1 146 4 161 1 "Not handling restraint 161, item 1, resonance(s) ' .6.H' (nmrStar names) not linked" c19759_2mk7 1 147 4 162 1 "Not handling restraint 162, item 1, resonance(s) ' .7.H' (nmrStar names) not linked" c19759_2mk7 1 148 4 163 1 "Not handling restraint 163, item 1, resonance(s) ' .8.H' (nmrStar names) not linked" c19759_2mk7 1 149 4 164 1 "Not handling restraint 164, item 1, resonance(s) ' .11.HN#' (nmrStar names) not linked" c19759_2mk7 1 150 4 166 1 "Not handling restraint 166, item 1, resonance(s) ' .3.HB3' (nmrStar names) not linked" c19759_2mk7 1 151 4 167 1 "Not handling restraint 167, item 1, resonance(s) ' .10.HB3' (nmrStar names) not linked" c19759_2mk7 1 152 4 170 1 "Not handling restraint 170, item 1, resonance(s) ' .12.H8#' (nmrStar names) not linked" c19759_2mk7 1 153 4 171 1 "Not handling restraint 171, item 1, resonance(s) ' .13.H8#' (nmrStar names) not linked" c19759_2mk7 1 154 4 174 1 "Not handling restraint 174, item 1, resonance(s) ' .10.HB3' (nmrStar names),' .10.HG3' (nmrStar names) not linked" c19759_2mk7 1 155 4 175 1 "Not handling restraint 175, item 1, resonance(s) ' .3.HB3' (nmrStar names) not linked" c19759_2mk7 1 156 4 175 1 "Not handling restraint 175, item 1, resonance(s) ' .3.HB3' (nmrStar names) not linked" c19759_2mk7 1 stop_ save_ save_CNS/XPLOR_dihedral_2 _Torsion_angle_constraint_list.Sf_category torsion_angle_constraints _Torsion_angle_constraint_list.Sf_framecode CNS/XPLOR_dihedral_2 _Torsion_angle_constraint_list.Entry_ID c19759_2mk7 _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 2 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 . . . . c19759_2mk7 1 stop_ loop_ _TA_constraint_parse_err.ID _TA_constraint_parse_err.Content _TA_constraint_parse_err.Begin_line _TA_constraint_parse_err.Begin_column _TA_constraint_parse_err.End_line _TA_constraint_parse_err.End_column _TA_constraint_parse_err.Entry_ID _TA_constraint_parse_err.Torsion_angle_constraint_list_ID 1 'nres=100 class phi potential harmonic degeneracy 1 coeff 6.98 -1.38 1.72 -60 force 5' 14 3 19 9 c19759_2mk7 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 2 1 1 "Not handling restraint 1, resonance(s) ' .12.H2' (nmrStar names),' .12.C2' (nmrStar names),' .12.NA' (nmrStar names),' .12.HNA' (nmrStar names) not linked" c19759_2mk7 1 2 2 2 1 "Not handling restraint 2, resonance(s) ' .13.H2' (nmrStar names),' .13.C2' (nmrStar names),' .13.NA' (nmrStar names),' .13.HNA' (nmrStar names) not linked" c19759_2mk7 1 3 2 3 1 "Not handling restraint 3, resonance(s) ' .14.H2' (nmrStar names),' .14.C2' (nmrStar names),' .14.NA' (nmrStar names),' .14.HNA' (nmrStar names) not linked" c19759_2mk7 1 4 2 4 1 "Not handling restraint 4, resonance(s) ' .15.H2' (nmrStar names),' .15.C2' (nmrStar names),' .15.NA' (nmrStar names),' .15.HNA' (nmrStar names) not linked" c19759_2mk7 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 c19759_2mk7 _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 STRUCTURAL PROTEIN 02-FEB-14 2MK7 *TITLE TETRA-O-GALNAC GLYCOSYLATED MUCIN SEQUENCE FROM ALPHA DYSTROGLYCAN *TITLE 2 MUCIN DOMAIN *COMPND MOL_ID: 1; *COMPND 2 MOLECULE: ALPHA-DYSTROGLYCAN; *COMPND 3 CHAIN: A; *COMPND 4 FRAGMENT: MUCIN DOMAIN PEPTIDE (UNP RESIDUES 419-427); *COMPND 5 SYNONYM: ALPHA-DG, ADG; *COMPND 6 ENGINEERED: YES *SOURCE MOL_ID: 1; *SOURCE 2 SYNTHETIC: YES; *SOURCE 3 ORGANISM_SCIENTIFIC: HOMO SAPIENS; *SOURCE 4 ORGANISM_COMMON: HUMAN; *SOURCE 5 ORGANISM_TAXID: 9606 *KEYWDS MUCIN DOMAIN, GLYCOPROTEIN, GLYCOSYLATION, ALPHA-DYSTROGLYCAN, TN *KEYWDS 2 ANTIGEN, N-ACETYL-GALACTOSAMINE, STRUCTURAL PROTEIN *EXPDTA SOLUTION NMR *NUMMDL 16 *AUTHOR D.LIVE, A.BORGERT *REVDAT 1 04-FEB-15 2MK7 0' save_