data_c30057_5j6t ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID c30057_5j6t _Entry.Title ; NMR structures of hylin-a1 analogs: Hylin-Ac ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2016-04-05 _Entry.Accession_date 2016-04-05 _Entry.Last_release_date 2016-04-19 _Entry.Original_release_date 2016-04-19 _Entry.Origination author _Entry.NMR_STAR_version 3.1.2.6 _Entry.Original_NMR_STAR_version 3.1.2.6 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype SOLUTION _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.ORCID _Entry_author.Entry_ID 1 Edson 'Crusca Jr.' . . . . c30057_5j6t 2 Carolina Matos C. O. . . c30057_5j6t 3 Luciano Liao L. M. . . c30057_5j6t 4 Aline Oliveira A. L. . . c30057_5j6t stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID DPC . c30057_5j6t 'Hylin-a1 analogues' . c30057_5j6t 'antimicrobial peptides' . c30057_5j6t stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 c30057_5j6t stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '1H chemical shifts' 129 c30057_5j6t 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 . . 2017-04-06 . original BMRB . c30057_5j6t stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID BMRB 30059 'hylin-a1 analogs: Hylin-D' c30057_5j6t BMRB 30060 'hylin-a1 analogs: Hylin-K' c30057_5j6t PDB 5J6T 'BMRB Entry Tracking System' c30057_5j6t stop_ save_ ############### # Citations # ############### save_citation_1 _Citation.Sf_category citations _Citation.Sf_framecode citation_1 _Citation.Entry_ID c30057_5j6t _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 ; NMR structures and molecular dynamics simulation of hylin-a1 analogs bound to dodecylphosphocholine micelles. ; _Citation.Status 'in preparation' _Citation.Type journal _Citation.Journal_abbrev . _Citation.Journal_name_full . _Citation.Journal_volume . _Citation.Journal_issue . _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD 0353 _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first . _Citation.Page_last . _Citation.Year . _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.ORCID _Citation_author.Entry_ID _Citation_author.Citation_ID 1 E. 'Crusca Jr.' . . . . c30057_5j6t 1 2 A. Camara A. . . . c30057_5j6t 1 3 C. Matos C. O. . . c30057_5j6t 1 4 R. Marchetto R. . . . c30057_5j6t 1 5 E. Cilli E. M. . . c30057_5j6t 1 6 L. Liao L. M. . . c30057_5j6t 1 7 A.L. 'de Oliveira' . . . . c30057_5j6t 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID c30057_5j6t _Assembly.ID 1 _Assembly.Name Hylin-Ac _Assembly.BMRB_code . _Assembly.Number_of_components . _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 entity_1 1 $entity_1 A A yes . . . . . . c30057_5j6t 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID c30057_5j6t _Entity.ID 1 _Entity.BMRB_code . _Entity.Name Hylin-Ac _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 ; XIFGAIWPLALGALKNLIKX ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states . _Entity.Ambiguous_chem_comp_sites . _Entity.Nstd_monomer yes _Entity.Nstd_chirality . _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 20 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method syn _Entity.Parent_entity_ID 1 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 1964.463 _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 1 ACE . c30057_5j6t 1 2 2 ILE . c30057_5j6t 1 3 3 PHE . c30057_5j6t 1 4 4 GLY . c30057_5j6t 1 5 5 ALA . c30057_5j6t 1 6 6 ILE . c30057_5j6t 1 7 7 TRP . c30057_5j6t 1 8 8 PRO . c30057_5j6t 1 9 9 LEU . c30057_5j6t 1 10 10 ALA . c30057_5j6t 1 11 11 LEU . c30057_5j6t 1 12 12 GLY . c30057_5j6t 1 13 13 ALA . c30057_5j6t 1 14 14 LEU . c30057_5j6t 1 15 15 LYS . c30057_5j6t 1 16 16 ASN . c30057_5j6t 1 17 17 LEU . c30057_5j6t 1 18 18 ILE . c30057_5j6t 1 19 19 LYS . c30057_5j6t 1 20 20 NH2 . c30057_5j6t 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 c30057_5j6t 1 . ILE 2 2 c30057_5j6t 1 . PHE 3 3 c30057_5j6t 1 . GLY 4 4 c30057_5j6t 1 . ALA 5 5 c30057_5j6t 1 . ILE 6 6 c30057_5j6t 1 . TRP 7 7 c30057_5j6t 1 . PRO 8 8 c30057_5j6t 1 . LEU 9 9 c30057_5j6t 1 . ALA 10 10 c30057_5j6t 1 . LEU 11 11 c30057_5j6t 1 . GLY 12 12 c30057_5j6t 1 . ALA 13 13 c30057_5j6t 1 . LEU 14 14 c30057_5j6t 1 . LYS 15 15 c30057_5j6t 1 . ASN 16 16 c30057_5j6t 1 . LEU 17 17 c30057_5j6t 1 . ILE 18 18 c30057_5j6t 1 . LYS 19 19 c30057_5j6t 1 . NH2 20 20 c30057_5j6t 1 stop_ save_ #################### # Natural source # #################### save_natural_source _Entity_natural_src_list.Sf_category natural_source _Entity_natural_src_list.Sf_framecode natural_source _Entity_natural_src_list.Entry_ID c30057_5j6t _Entity_natural_src_list.ID 1 loop_ _Entity_natural_src.ID _Entity_natural_src.Entity_ID _Entity_natural_src.Entity_label _Entity_natural_src.Entity_chimera_segment_ID _Entity_natural_src.NCBI_taxonomy_ID _Entity_natural_src.Type _Entity_natural_src.Common _Entity_natural_src.Organism_name_scientific _Entity_natural_src.Organism_name_common _Entity_natural_src.Organism_acronym _Entity_natural_src.ICTVdb_decimal_code _Entity_natural_src.Superkingdom _Entity_natural_src.Kingdom _Entity_natural_src.Genus _Entity_natural_src.Species _Entity_natural_src.Strain _Entity_natural_src.Variant _Entity_natural_src.Organ _Entity_natural_src.Tissue _Entity_natural_src.Tissue_fraction _Entity_natural_src.Cell_line _Entity_natural_src.Cell_type _Entity_natural_src.ATCC_number _Entity_natural_src.Organelle _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Details _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $entity_1 . 279985 organism . 'Hypsiboas albopunctatus' 'Spotted tree frog' . . Eukaryota Metazoa Hypsiboas albopunctatus . . . . . . . . . . . . . c30057_5j6t 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 c30057_5j6t _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Details _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $entity_1 . 'chemical synthesis' . . . . . . . . . . . . . . . . c30057_5j6t 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 c30057_5j6t _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 c30057_5j6t ACE CC=O SMILES 'OpenEye OEToolkits' 1.5.0 c30057_5j6t ACE CC=O SMILES_CANONICAL CACTVS 3.341 c30057_5j6t ACE CC=O SMILES_CANONICAL 'OpenEye OEToolkits' 1.5.0 c30057_5j6t ACE IKHGUXGNUITLKF-UHFFFAOYSA-N InChIKey InChI 1.03 c30057_5j6t ACE InChI=1S/C2H4O/c1-2-3/h2H,1H3 InChI InChI 1.03 c30057_5j6t ACE O=CC SMILES ACDLabs 10.04 c30057_5j6t 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 c30057_5j6t ACE ethanal 'SYSTEMATIC NAME' 'OpenEye OEToolkits' 1.5.0 c30057_5j6t 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 . c30057_5j6t ACE O O O O . O . . N 0 . . . 1 no no . . . . 1.973 . -10.223 . 6.862 . -1.113 -0.252 0.000 2 . c30057_5j6t ACE CH3 CH3 CH3 CH3 . C . . N 0 . . . 1 no no . . . . -0.322 . -10.677 . 7.405 . 1.241 -0.167 0.000 3 . c30057_5j6t ACE H H H H . H . . N 0 . . . 1 no no . . . . 0.685 . -9.453 . 5.669 . -0.240 1.528 0.000 4 . c30057_5j6t ACE H1 H1 H1 1H . H . . N 0 . . . 1 no no . . . . -1.191 . -10.444 . 7.018 . 1.360 -0.785 0.890 5 . c30057_5j6t ACE H2 H2 H2 2H . H . . N 0 . . . 1 no no . . . . -0.269 . -10.331 . 8.320 . 1.360 -0.785 -0.890 6 . c30057_5j6t ACE H3 H3 H3 3H . H . . N 0 . . . 1 no no . . . . -0.221 . -11.652 . 7.418 . 1.995 0.620 0.000 7 . c30057_5j6t 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 . c30057_5j6t ACE 2 . SING C CH3 no N 2 . c30057_5j6t ACE 3 . SING C H no N 3 . c30057_5j6t ACE 4 . SING CH3 H1 no N 4 . c30057_5j6t ACE 5 . SING CH3 H2 no N 5 . c30057_5j6t ACE 6 . SING CH3 H3 no N 6 . c30057_5j6t ACE stop_ save_ save_chem_comp_NH2 _Chem_comp.Sf_category chem_comp _Chem_comp.Sf_framecode chem_comp_NH2 _Chem_comp.Entry_ID c30057_5j6t _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 c30057_5j6t NH2 N SMILES ACDLabs 10.04 c30057_5j6t NH2 QGZKDVFQNNGYKY-UHFFFAOYAF InChIKey InChI 1.02b c30057_5j6t NH2 [NH2] SMILES CACTVS 3.341 c30057_5j6t NH2 [NH2] SMILES 'OpenEye OEToolkits' 1.5.0 c30057_5j6t NH2 [NH2] SMILES_CANONICAL CACTVS 3.341 c30057_5j6t NH2 [NH2] SMILES_CANONICAL 'OpenEye OEToolkits' 1.5.0 c30057_5j6t 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 c30057_5j6t NH2 l^{2}-azane 'SYSTEMATIC NAME' 'OpenEye OEToolkits' 1.5.0 c30057_5j6t 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 . c30057_5j6t NH2 HN1 HN1 HN1 1HN . H . . N 0 . . . 1 no no . . . . 9.517 . 8.769 . -7.044 . -0.385 -0.545 -0.771 2 . c30057_5j6t NH2 HN2 HN2 HN2 2HN . H . . N 0 . . . 1 no no . . . . 10.323 . 9.890 . -8.082 . 1.020 0.000 0.000 3 . c30057_5j6t 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 . c30057_5j6t NH2 2 . SING N HN2 no N 2 . c30057_5j6t NH2 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID c30057_5j6t _Sample.ID 1 _Sample.Type micelle _Sample.Sub_type . _Sample.Details '100 mM [U-100% 2H] DPC-d38, 90% H2O/10% D2O' _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 DPC-d38 '[U-100% 2H]' . . 1 $entity_1 . . 100 . . mM . . . . c30057_5j6t 1 2 H2O 'natural abundance' . . . . . . 90 . . % . . . . c30057_5j6t 1 3 D2O 'natural abundance' . . . . . . 10 . . % . . . . c30057_5j6t 1 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_1 _Sample_condition_list.Entry_ID c30057_5j6t _Sample_condition_list.ID 1 _Sample_condition_list.Details 'PBS buffer' loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID pH 7.0 . pH c30057_5j6t 1 pressure 1 . atm c30057_5j6t 1 temperature 298 . K c30057_5j6t 1 stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Software.Sf_category software _Software.Sf_framecode software_1 _Software.Entry_ID c30057_5j6t _Software.ID 1 _Software.Name CNS _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'SCHWIETERS, KUSZEWSKI, TJANDRA AND CLORE' . . c30057_5j6t 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID refinement c30057_5j6t 1 stop_ save_ save_software_2 _Software.Sf_category software _Software.Sf_framecode software_2 _Software.Entry_ID c30057_5j6t _Software.ID 2 _Software.Name NMRVIEW _Software.Version . _Software.Details . loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'structure solution' c30057_5j6t 2 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_NMR_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_1 _NMR_spectrometer.Entry_ID c30057_5j6t _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model AvanceIII _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 500 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 c30057_5j6t _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 NMR_spectrometer_1 Bruker AvanceIII . 500 . . . c30057_5j6t 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 c30057_5j6t _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-1H TOCSY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . c30057_5j6t 1 2 '2D 1H-1H NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . c30057_5j6t 1 3 '2D 1H-1H COSY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . c30057_5j6t 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chem_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chem_shift_reference_1 _Chem_shift_reference.Entry_ID c30057_5j6t _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID H 1 TMS 'methyl protons' . . . . ppm 0.000 internal direct 1.0 . . . . . c30057_5j6t 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chemical_shifts_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_1 _Assigned_chem_shift_list.Entry_ID c30057_5j6t _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chem_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-1H TOCSY' . . . c30057_5j6t 1 2 '2D 1H-1H NOESY' . . . c30057_5j6t 1 3 '2D 1H-1H COSY' . . . c30057_5j6t 1 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 1 $software_1 . . c30057_5j6t 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 ILE H H 1 8.8000 . . 1 . . . A 2 ILE H . c30057_5j6t 1 2 . 1 1 2 2 ILE HA H 1 3.9100 . . 1 . . . A 2 ILE HA . c30057_5j6t 1 3 . 1 1 2 2 ILE HB H 1 1.8300 . . 1 . . . A 2 ILE HB . c30057_5j6t 1 4 . 1 1 2 2 ILE HG12 H 1 1.5400 . . 1 . . . A 2 ILE HG12 . c30057_5j6t 1 5 . 1 1 2 2 ILE HG13 H 1 1.1800 . . 1 . . . A 2 ILE HG13 . c30057_5j6t 1 6 . 1 1 2 2 ILE HG21 H 1 0.7900 . . 1 . . . A 2 ILE HG21 . c30057_5j6t 1 7 . 1 1 2 2 ILE HG22 H 1 0.7900 . . 1 . . . A 2 ILE HG22 . c30057_5j6t 1 8 . 1 1 2 2 ILE HG23 H 1 0.7900 . . 1 . . . A 2 ILE HG23 . c30057_5j6t 1 9 . 1 1 2 2 ILE HD11 H 1 0.8800 . . 1 . . . A 2 ILE HD11 . c30057_5j6t 1 10 . 1 1 2 2 ILE HD12 H 1 0.8800 . . 1 . . . A 2 ILE HD12 . c30057_5j6t 1 11 . 1 1 2 2 ILE HD13 H 1 0.8800 . . 1 . . . A 2 ILE HD13 . c30057_5j6t 1 12 . 1 1 3 3 PHE H H 1 8.9000 . . 1 . . . A 3 PHE H . c30057_5j6t 1 13 . 1 1 3 3 PHE HA H 1 4.3500 . . 1 . . . A 3 PHE HA . c30057_5j6t 1 14 . 1 1 3 3 PHE HB2 H 1 3.2100 . . 2 . . . A 3 PHE HB2 . c30057_5j6t 1 15 . 1 1 3 3 PHE HD1 H 1 7.2300 . . 3 . . . A 3 PHE HD1 . c30057_5j6t 1 16 . 1 1 3 3 PHE HD2 H 1 7.2300 . . 3 . . . A 3 PHE HD2 . c30057_5j6t 1 17 . 1 1 3 3 PHE HE1 H 1 7.2500 . . 3 . . . A 3 PHE HE1 . c30057_5j6t 1 18 . 1 1 3 3 PHE HE2 H 1 7.2500 . . 3 . . . A 3 PHE HE2 . c30057_5j6t 1 19 . 1 1 3 3 PHE HZ H 1 7.0900 . . 1 . . . A 3 PHE HZ . c30057_5j6t 1 20 . 1 1 4 4 GLY H H 1 8.5100 . . 1 . . . A 4 GLY H . c30057_5j6t 1 21 . 1 1 4 4 GLY HA2 H 1 3.9300 . . 1 . . . A 4 GLY HA2 . c30057_5j6t 1 22 . 1 1 5 5 ALA H H 1 7.9100 . . 1 . . . A 5 ALA H . c30057_5j6t 1 23 . 1 1 5 5 ALA HA H 1 4.4000 . . 1 . . . A 5 ALA HA . c30057_5j6t 1 24 . 1 1 5 5 ALA HB1 H 1 1.5200 . . 1 . . . A 5 ALA HB1 . c30057_5j6t 1 25 . 1 1 5 5 ALA HB2 H 1 1.5200 . . 1 . . . A 5 ALA HB2 . c30057_5j6t 1 26 . 1 1 5 5 ALA HB3 H 1 1.5200 . . 1 . . . A 5 ALA HB3 . c30057_5j6t 1 27 . 1 1 6 6 ILE H H 1 7.9200 . . 1 . . . A 6 ILE H . c30057_5j6t 1 28 . 1 1 6 6 ILE HA H 1 4.1300 . . 1 . . . A 6 ILE HA . c30057_5j6t 1 29 . 1 1 6 6 ILE HB H 1 1.9700 . . 1 . . . A 6 ILE HB . c30057_5j6t 1 30 . 1 1 6 6 ILE HG12 H 1 1.5200 . . 1 . . . A 6 ILE HG12 . c30057_5j6t 1 31 . 1 1 6 6 ILE HG13 H 1 0.9300 . . 1 . . . A 6 ILE HG13 . c30057_5j6t 1 32 . 1 1 7 7 TRP H H 1 8.3800 . . 1 . . . A 7 TRP H . c30057_5j6t 1 33 . 1 1 7 7 TRP HA H 1 4.6100 . . 1 . . . A 7 TRP HA . c30057_5j6t 1 34 . 1 1 7 7 TRP HB2 H 1 3.5300 . . 2 . . . A 7 TRP HB2 . c30057_5j6t 1 35 . 1 1 7 7 TRP HB3 H 1 3.2100 . . 2 . . . A 7 TRP HB3 . c30057_5j6t 1 36 . 1 1 7 7 TRP HD1 H 1 7.1700 . . 1 . . . A 7 TRP HD1 . c30057_5j6t 1 37 . 1 1 7 7 TRP HE1 H 1 10.6200 . . 1 . . . A 7 TRP HE1 . c30057_5j6t 1 38 . 1 1 7 7 TRP HE3 H 1 7.8300 . . 1 . . . A 7 TRP HE3 . c30057_5j6t 1 39 . 1 1 7 7 TRP HZ2 H 1 7.1700 . . 1 . . . A 7 TRP HZ2 . c30057_5j6t 1 40 . 1 1 7 7 TRP HZ3 H 1 6.9300 . . 1 . . . A 7 TRP HZ3 . c30057_5j6t 1 41 . 1 1 7 7 TRP HH2 H 1 7.2800 . . 1 . . . A 7 TRP HH2 . c30057_5j6t 1 42 . 1 1 8 8 PRO HA H 1 4.0800 . . 1 . . . A 8 PRO HA . c30057_5j6t 1 43 . 1 1 8 8 PRO HB2 H 1 2.2400 . . 2 . . . A 8 PRO HB2 . c30057_5j6t 1 44 . 1 1 8 8 PRO HB3 H 1 2.2400 . . 2 . . . A 8 PRO HB3 . c30057_5j6t 1 45 . 1 1 8 8 PRO HG2 H 1 2.2400 . . 2 . . . A 8 PRO HG2 . c30057_5j6t 1 46 . 1 1 8 8 PRO HD2 H 1 3.6200 . . 2 . . . A 8 PRO HD2 . c30057_5j6t 1 47 . 1 1 8 8 PRO HD3 H 1 3.5600 . . 2 . . . A 8 PRO HD3 . c30057_5j6t 1 48 . 1 1 9 9 LEU H H 1 7.0100 . . 1 . . . A 9 LEU H . c30057_5j6t 1 49 . 1 1 9 9 LEU HA H 1 4.1800 . . 1 . . . A 9 LEU HA . c30057_5j6t 1 50 . 1 1 9 9 LEU HB2 H 1 1.9900 . . 2 . . . A 9 LEU HB2 . c30057_5j6t 1 51 . 1 1 9 9 LEU HB3 H 1 1.9900 . . 2 . . . A 9 LEU HB3 . c30057_5j6t 1 52 . 1 1 9 9 LEU HG H 1 1.5700 . . 1 . . . A 9 LEU HG . c30057_5j6t 1 53 . 1 1 9 9 LEU HD11 H 1 0.9100 . . 2 . . . A 9 LEU HD11 . c30057_5j6t 1 54 . 1 1 9 9 LEU HD12 H 1 0.9100 . . 2 . . . A 9 LEU HD12 . c30057_5j6t 1 55 . 1 1 9 9 LEU HD13 H 1 0.9100 . . 2 . . . A 9 LEU HD13 . c30057_5j6t 1 56 . 1 1 9 9 LEU HD21 H 1 0.9800 . . 2 . . . A 9 LEU HD21 . c30057_5j6t 1 57 . 1 1 9 9 LEU HD22 H 1 0.9800 . . 2 . . . A 9 LEU HD22 . c30057_5j6t 1 58 . 1 1 9 9 LEU HD23 H 1 0.9800 . . 2 . . . A 9 LEU HD23 . c30057_5j6t 1 59 . 1 1 10 10 ALA H H 1 8.3200 . . 1 . . . A 10 ALA H . c30057_5j6t 1 60 . 1 1 10 10 ALA HA H 1 3.9600 . . 1 . . . A 10 ALA HA . c30057_5j6t 1 61 . 1 1 10 10 ALA HB1 H 1 1.4000 . . 1 . . . A 10 ALA HB1 . c30057_5j6t 1 62 . 1 1 10 10 ALA HB2 H 1 1.4000 . . 1 . . . A 10 ALA HB2 . c30057_5j6t 1 63 . 1 1 10 10 ALA HB3 H 1 1.4000 . . 1 . . . A 10 ALA HB3 . c30057_5j6t 1 64 . 1 1 11 11 LEU H H 1 8.4400 . . 1 . . . A 11 LEU H . c30057_5j6t 1 65 . 1 1 11 11 LEU HA H 1 3.8300 . . 1 . . . A 11 LEU HA . c30057_5j6t 1 66 . 1 1 11 11 LEU HB2 H 1 1.4600 . . 2 . . . A 11 LEU HB2 . c30057_5j6t 1 67 . 1 1 11 11 LEU HB3 H 1 1.1600 . . 2 . . . A 11 LEU HB3 . c30057_5j6t 1 68 . 1 1 11 11 LEU HG H 1 1.3800 . . 1 . . . A 11 LEU HG . c30057_5j6t 1 69 . 1 1 11 11 LEU HD11 H 1 0.8000 . . 2 . . . A 11 LEU HD11 . c30057_5j6t 1 70 . 1 1 11 11 LEU HD12 H 1 0.8000 . . 2 . . . A 11 LEU HD12 . c30057_5j6t 1 71 . 1 1 11 11 LEU HD13 H 1 0.8000 . . 2 . . . A 11 LEU HD13 . c30057_5j6t 1 72 . 1 1 12 12 GLY H H 1 7.8600 . . 1 . . . A 12 GLY H . c30057_5j6t 1 73 . 1 1 12 12 GLY HA2 H 1 3.8900 . . 2 . . . A 12 GLY HA2 . c30057_5j6t 1 74 . 1 1 12 12 GLY HA3 H 1 3.7100 . . 2 . . . A 12 GLY HA3 . c30057_5j6t 1 75 . 1 1 13 13 ALA H H 1 7.8700 . . 1 . . . A 13 ALA H . c30057_5j6t 1 76 . 1 1 13 13 ALA HA H 1 4.2800 . . 1 . . . A 13 ALA HA . c30057_5j6t 1 77 . 1 1 13 13 ALA HB1 H 1 1.5100 . . 1 . . . A 13 ALA HB1 . c30057_5j6t 1 78 . 1 1 13 13 ALA HB2 H 1 1.5100 . . 1 . . . A 13 ALA HB2 . c30057_5j6t 1 79 . 1 1 13 13 ALA HB3 H 1 1.5100 . . 1 . . . A 13 ALA HB3 . c30057_5j6t 1 80 . 1 1 14 14 LEU H H 1 8.3000 . . 1 . . . A 14 LEU H . c30057_5j6t 1 81 . 1 1 14 14 LEU HA H 1 4.0600 . . 1 . . . A 14 LEU HA . c30057_5j6t 1 82 . 1 1 14 14 LEU HB2 H 1 1.8700 . . 2 . . . A 14 LEU HB2 . c30057_5j6t 1 83 . 1 1 14 14 LEU HB3 H 1 1.6700 . . 2 . . . A 14 LEU HB3 . c30057_5j6t 1 84 . 1 1 14 14 LEU HG H 1 0.9000 . . 1 . . . A 14 LEU HG . c30057_5j6t 1 85 . 1 1 15 15 LYS H H 1 8.4100 . . 1 . . . A 15 LYS H . c30057_5j6t 1 86 . 1 1 15 15 LYS HA H 1 3.8400 . . 1 . . . A 15 LYS HA . c30057_5j6t 1 87 . 1 1 15 15 LYS HB2 H 1 1.9300 . . 2 . . . A 15 LYS HB2 . c30057_5j6t 1 88 . 1 1 15 15 LYS HG2 H 1 1.6400 . . 2 . . . A 15 LYS HG2 . c30057_5j6t 1 89 . 1 1 15 15 LYS HD2 H 1 1.7200 . . 2 . . . A 15 LYS HD2 . c30057_5j6t 1 90 . 1 1 15 15 LYS HE2 H 1 2.9100 . . 2 . . . A 15 LYS HE2 . c30057_5j6t 1 91 . 1 1 16 16 ASN H H 1 7.7700 . . 1 . . . A 16 ASN H . c30057_5j6t 1 92 . 1 1 16 16 ASN HA H 1 4.5000 . . 1 . . . A 16 ASN HA . c30057_5j6t 1 93 . 1 1 16 16 ASN HB2 H 1 2.9400 . . 2 . . . A 16 ASN HB2 . c30057_5j6t 1 94 . 1 1 16 16 ASN HB3 H 1 2.8600 . . 2 . . . A 16 ASN HB3 . c30057_5j6t 1 95 . 1 1 16 16 ASN HD21 H 1 7.8400 . . 2 . . . A 16 ASN HD21 . c30057_5j6t 1 96 . 1 1 16 16 ASN HD22 H 1 6.9400 . . 2 . . . A 16 ASN HD22 . c30057_5j6t 1 97 . 1 1 17 17 LEU H H 1 8.0000 . . 1 . . . A 17 LEU H . c30057_5j6t 1 98 . 1 1 17 17 LEU HA H 1 4.1800 . . 1 . . . A 17 LEU HA . c30057_5j6t 1 99 . 1 1 17 17 LEU HB2 H 1 1.9800 . . 2 . . . A 17 LEU HB2 . c30057_5j6t 1 100 . 1 1 17 17 LEU HB3 H 1 1.9200 . . 2 . . . A 17 LEU HB3 . c30057_5j6t 1 101 . 1 1 17 17 LEU HG H 1 1.5100 . . 1 . . . A 17 LEU HG . c30057_5j6t 1 102 . 1 1 17 17 LEU HD11 H 1 0.9900 . . 2 . . . A 17 LEU HD11 . c30057_5j6t 1 103 . 1 1 17 17 LEU HD12 H 1 0.9900 . . 2 . . . A 17 LEU HD12 . c30057_5j6t 1 104 . 1 1 17 17 LEU HD13 H 1 0.9900 . . 2 . . . A 17 LEU HD13 . c30057_5j6t 1 105 . 1 1 17 17 LEU HD21 H 1 0.9300 . . 2 . . . A 17 LEU HD21 . c30057_5j6t 1 106 . 1 1 17 17 LEU HD22 H 1 0.9300 . . 2 . . . A 17 LEU HD22 . c30057_5j6t 1 107 . 1 1 17 17 LEU HD23 H 1 0.9300 . . 2 . . . A 17 LEU HD23 . c30057_5j6t 1 108 . 1 1 18 18 ILE H H 1 7.8100 . . 1 . . . A 18 ILE H . c30057_5j6t 1 109 . 1 1 18 18 ILE HA H 1 3.9000 . . 1 . . . A 18 ILE HA . c30057_5j6t 1 110 . 1 1 18 18 ILE HB H 1 1.9500 . . 1 . . . A 18 ILE HB . c30057_5j6t 1 111 . 1 1 18 18 ILE HG12 H 1 1.5100 . . 1 . . . A 18 ILE HG12 . c30057_5j6t 1 112 . 1 1 18 18 ILE HG13 H 1 0.9300 . . 1 . . . A 18 ILE HG13 . c30057_5j6t 1 113 . 1 1 18 18 ILE HG21 H 1 0.9600 . . 1 . . . A 18 ILE HG21 . c30057_5j6t 1 114 . 1 1 18 18 ILE HG22 H 1 0.9600 . . 1 . . . A 18 ILE HG22 . c30057_5j6t 1 115 . 1 1 18 18 ILE HG23 H 1 0.9600 . . 1 . . . A 18 ILE HG23 . c30057_5j6t 1 116 . 1 1 18 18 ILE HD11 H 1 1.3100 . . 1 . . . A 18 ILE HD11 . c30057_5j6t 1 117 . 1 1 18 18 ILE HD12 H 1 1.3100 . . 1 . . . A 18 ILE HD12 . c30057_5j6t 1 118 . 1 1 18 18 ILE HD13 H 1 1.3100 . . 1 . . . A 18 ILE HD13 . c30057_5j6t 1 119 . 1 1 19 19 LYS H H 1 7.7800 . . 1 . . . A 19 LYS H . c30057_5j6t 1 120 . 1 1 19 19 LYS HA H 1 4.1400 . . 1 . . . A 19 LYS HA . c30057_5j6t 1 121 . 1 1 19 19 LYS HB2 H 1 1.9300 . . 2 . . . A 19 LYS HB2 . c30057_5j6t 1 122 . 1 1 19 19 LYS HG2 H 1 1.6000 . . 2 . . . A 19 LYS HG2 . c30057_5j6t 1 123 . 1 1 19 19 LYS HG3 H 1 1.6000 . . 2 . . . A 19 LYS HG3 . c30057_5j6t 1 124 . 1 1 19 19 LYS HD2 H 1 1.7200 . . 2 . . . A 19 LYS HD2 . c30057_5j6t 1 125 . 1 1 19 19 LYS HD3 H 1 1.7200 . . 2 . . . A 19 LYS HD3 . c30057_5j6t 1 126 . 1 1 19 19 LYS HE2 H 1 3.0100 . . 2 . . . A 19 LYS HE2 . c30057_5j6t 1 127 . 1 1 19 19 LYS HZ1 H 1 7.2000 . . 1 . . . A 19 LYS HZ1 . c30057_5j6t 1 128 . 1 1 19 19 LYS HZ2 H 1 7.2000 . . 1 . . . A 19 LYS HZ2 . c30057_5j6t 1 129 . 1 1 19 19 LYS HZ3 H 1 7.2000 . . 1 . . . A 19 LYS HZ3 . c30057_5j6t 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 c30057_5j6t _Conformer_stat_list.ID 1 _Conformer_stat_list.Conf_family_coord_set_ID 1 _Conformer_stat_list.Conf_family_coord_set_label $Original_constraints_and_structures _Conformer_stat_list.Conformer_submitted_total_num 10 save_ ##################################### # Conformer family coordinate set # ##################################### save_ensemble_of_conformers _Conformer_family_coord_set.Sf_category conformer_family_coord_set _Conformer_family_coord_set.Sf_framecode ensemble_of_conformers _Conformer_family_coord_set.Entry_ID c30057_5j6t _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 . . . c30057_5j6t 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 . . . . c30057_5j6t 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 0.237 -2.294 2.348 . . . 1.0 . . . . . . . . . . . . A . 1 ACE C . . . . . . . . . c30057_5j6t 1 . 1 . 2 . 1 1 1 ACE CH3 C -1.145 -1.932 1.802 . . . 1.0 . . . . . . . . . . . . A . 1 ACE CH3 . . . . . . . . . c30057_5j6t 1 . 1 . 3 . 1 1 1 ACE H1 H -1.876 -1.967 2.609 . . . 1.0 . . . . . . . . . . . . A . 1 ACE H1 . . . . . . . . . c30057_5j6t 1 . 1 . 4 . 1 1 1 ACE H2 H -1.427 -2.643 1.026 . . . 1.0 . . . . . . . . . . . . A . 1 ACE H2 . . . . . . . . . c30057_5j6t 1 . 1 . 5 . 1 1 1 ACE H3 H -1.117 -0.927 1.380 . . . 1.0 . . . . . . . . . . . . A . 1 ACE H3 . . . . . . . . . c30057_5j6t 1 . 1 . 6 . 1 1 1 ACE O O 0.399 -2.562 3.524 . . . 1.0 . . . . . . . . . . . . A . 1 ACE O . . . . . . . . . c30057_5j6t 1 . 1 . 7 . 1 1 2 ILE C C 3.547 -1.446 1.794 . . . 1.0 . . . . . . . . . . . . A . 2 ILE C . . . . . . . . . c30057_5j6t 1 . 1 . 8 . 1 1 2 ILE CA C 2.610 -2.644 1.974 . . . 1.0 . . . . . . . . . . . . A . 2 ILE CA . . . . . . . . . c30057_5j6t 1 . 1 . 9 . 1 1 2 ILE CB C 3.054 -3.813 1.090 . . . 1.0 . . . . . . . . . . . . A . 2 ILE CB . . . . . . . . . c30057_5j6t 1 . 1 . 10 . 1 1 2 ILE CD1 C 4.157 -4.048 -1.141 . . . 1.0 . . . . . . . . . . . . A . 2 ILE CD1 . . . . . . . . . c30057_5j6t 1 . 1 . 11 . 1 1 2 ILE CG1 C 2.996 -3.400 -0.384 . . . 1.0 . . . . . . . . . . . . A . 2 ILE CG1 . . . . . . . . . c30057_5j6t 1 . 1 . 12 . 1 1 2 ILE CG2 C 2.124 -5.006 1.318 . . . 1.0 . . . . . . . . . . . . A . 2 ILE CG2 . . . . . . . . . c30057_5j6t 1 . 1 . 13 . 1 1 2 ILE H H 1.076 -2.071 0.534 . . . 1.0 . . . . . . . . . . . . A . 2 ILE H . . . . . . . . . c30057_5j6t 1 . 1 . 14 . 1 1 2 ILE HA H 2.585 -2.950 3.020 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HA . . . . . . . . . c30057_5j6t 1 . 1 . 15 . 1 1 2 ILE HB H 4.075 -4.095 1.348 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HB . . . . . . . . . c30057_5j6t 1 . 1 . 16 . 1 1 2 ILE HD11 H 4.116 -3.755 -2.190 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HD11 . . . . . . . . . c30057_5j6t 1 . 1 . 17 . 1 1 2 ILE HD12 H 4.080 -5.133 -1.064 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HD12 . . . . . . . . . c30057_5j6t 1 . 1 . 18 . 1 1 2 ILE HD13 H 5.102 -3.719 -0.708 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HD13 . . . . . . . . . c30057_5j6t 1 . 1 . 19 . 1 1 2 ILE HG12 H 2.051 -3.730 -0.817 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HG12 . . . . . . . . . c30057_5j6t 1 . 1 . 20 . 1 1 2 ILE HG13 H 3.072 -2.316 -0.461 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HG13 . . . . . . . . . c30057_5j6t 1 . 1 . 21 . 1 1 2 ILE HG21 H 2.163 -5.303 2.367 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HG21 . . . . . . . . . c30057_5j6t 1 . 1 . 22 . 1 1 2 ILE HG22 H 1.104 -4.726 1.058 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HG22 . . . . . . . . . c30057_5j6t 1 . 1 . 23 . 1 1 2 ILE HG23 H 2.443 -5.840 0.693 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HG23 . . . . . . . . . c30057_5j6t 1 . 1 . 24 . 1 1 2 ILE N N 1.235 -2.300 1.505 . . . 1.0 . . . . . . . . . . . . A . 2 ILE N . . . . . . . . . c30057_5j6t 1 . 1 . 25 . 1 1 2 ILE O O 4.741 -1.601 1.630 . . . 1.0 . . . . . . . . . . . . A . 2 ILE O . . . . . . . . . c30057_5j6t 1 . 1 . 26 . 1 1 3 PHE C C 4.999 0.966 2.696 . . . 1.0 . . . . . . . . . . . . A . 3 PHE C . . . . . . . . . c30057_5j6t 1 . 1 . 27 . 1 1 3 PHE CA C 3.874 0.960 1.655 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CA . . . . . . . . . c30057_5j6t 1 . 1 . 28 . 1 1 3 PHE CB C 2.936 2.148 1.872 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CB . . . . . . . . . c30057_5j6t 1 . 1 . 29 . 1 1 3 PHE CD1 C 4.401 3.670 0.496 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CD1 . . . . . . . . . c30057_5j6t 1 . 1 . 30 . 1 1 3 PHE CD2 C 3.710 4.399 2.704 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CD2 . . . . . . . . . c30057_5j6t 1 . 1 . 31 . 1 1 3 PHE CE1 C 5.110 4.866 0.324 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CE1 . . . . . . . . . c30057_5j6t 1 . 1 . 32 . 1 1 3 PHE CE2 C 4.419 5.594 2.531 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CE2 . . . . . . . . . c30057_5j6t 1 . 1 . 33 . 1 1 3 PHE CG C 3.701 3.437 1.686 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CG . . . . . . . . . c30057_5j6t 1 . 1 . 34 . 1 1 3 PHE CZ C 5.119 5.828 1.342 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CZ . . . . . . . . . c30057_5j6t 1 . 1 . 35 . 1 1 3 PHE H H 2.020 -0.147 1.964 . . . 1.0 . . . . . . . . . . . . A . 3 PHE H . . . . . . . . . c30057_5j6t 1 . 1 . 36 . 1 1 3 PHE HA H 4.292 0.988 0.649 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HA . . . . . . . . . c30057_5j6t 1 . 1 . 37 . 1 1 3 PHE HB2 H 2.120 2.103 1.151 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HB2 . . . . . . . . . c30057_5j6t 1 . 1 . 38 . 1 1 3 PHE HB3 H 2.530 2.110 2.883 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HB3 . . . . . . . . . c30057_5j6t 1 . 1 . 39 . 1 1 3 PHE HD1 H 4.394 2.928 -0.289 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HD1 . . . . . . . . . c30057_5j6t 1 . 1 . 40 . 1 1 3 PHE HD2 H 3.171 4.219 3.622 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HD2 . . . . . . . . . c30057_5j6t 1 . 1 . 41 . 1 1 3 PHE HE1 H 5.649 5.046 -0.594 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HE1 . . . . . . . . . c30057_5j6t 1 . 1 . 42 . 1 1 3 PHE HE2 H 4.426 6.335 3.316 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HE2 . . . . . . . . . c30057_5j6t 1 . 1 . 43 . 1 1 3 PHE HZ H 5.666 6.749 1.209 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HZ . . . . . . . . . c30057_5j6t 1 . 1 . 44 . 1 1 3 PHE N N 3.015 -0.251 1.825 . . . 1.0 . . . . . . . . . . . . A . 3 PHE N . . . . . . . . . c30057_5j6t 1 . 1 . 45 . 1 1 3 PHE O O 6.135 1.272 2.392 . . . 1.0 . . . . . . . . . . . . A . 3 PHE O . . . . . . . . . c30057_5j6t 1 . 1 . 46 . 1 1 4 GLY C C 6.825 -0.405 4.617 . . . 1.0 . . . . . . . . . . . . A . 4 GLY C . . . . . . . . . c30057_5j6t 1 . 1 . 47 . 1 1 4 GLY CA C 5.739 0.614 4.979 . . . 1.0 . . . . . . . . . . . . A . 4 GLY CA . . . . . . . . . c30057_5j6t 1 . 1 . 48 . 1 1 4 GLY H H 3.739 0.381 4.147 . . . 1.0 . . . . . . . . . . . . A . 4 GLY H . . . . . . . . . c30057_5j6t 1 . 1 . 49 . 1 1 4 GLY HA2 H 6.185 1.605 5.063 . . . 1.0 . . . . . . . . . . . . A . 4 GLY HA2 . . . . . . . . . c30057_5j6t 1 . 1 . 50 . 1 1 4 GLY HA3 H 5.287 0.338 5.931 . . . 1.0 . . . . . . . . . . . . A . 4 GLY HA3 . . . . . . . . . c30057_5j6t 1 . 1 . 51 . 1 1 4 GLY N N 4.690 0.630 3.918 . . . 1.0 . . . . . . . . . . . . A . 4 GLY N . . . . . . . . . c30057_5j6t 1 . 1 . 52 . 1 1 4 GLY O O 7.924 -0.360 5.134 . . . 1.0 . . . . . . . . . . . . A . 4 GLY O . . . . . . . . . c30057_5j6t 1 . 1 . 53 . 1 1 5 ALA C C 8.334 -1.872 2.118 . . . 1.0 . . . . . . . . . . . . A . 5 ALA C . . . . . . . . . c30057_5j6t 1 . 1 . 54 . 1 1 5 ALA CA C 7.541 -2.344 3.343 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CA . . . . . . . . . c30057_5j6t 1 . 1 . 55 . 1 1 5 ALA CB C 6.732 -3.597 3.004 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CB . . . . . . . . . c30057_5j6t 1 . 1 . 56 . 1 1 5 ALA H H 5.607 -1.342 3.316 . . . 1.0 . . . . . . . . . . . . A . 5 ALA H . . . . . . . . . c30057_5j6t 1 . 1 . 57 . 1 1 5 ALA HA H 8.216 -2.544 4.176 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HA . . . . . . . . . c30057_5j6t 1 . 1 . 58 . 1 1 5 ALA HB1 H 7.409 -4.398 2.706 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB1 . . . . . . . . . c30057_5j6t 1 . 1 . 59 . 1 1 5 ALA HB2 H 6.047 -3.376 2.185 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB2 . . . . . . . . . c30057_5j6t 1 . 1 . 60 . 1 1 5 ALA HB3 H 6.163 -3.910 3.880 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB3 . . . . . . . . . c30057_5j6t 1 . 1 . 61 . 1 1 5 ALA N N 6.526 -1.324 3.734 . . . 1.0 . . . . . . . . . . . . A . 5 ALA N . . . . . . . . . c30057_5j6t 1 . 1 . 62 . 1 1 5 ALA O O 9.384 -2.402 1.809 . . . 1.0 . . . . . . . . . . . . A . 5 ALA O . . . . . . . . . c30057_5j6t 1 . 1 . 63 . 1 1 6 ILE C C 9.637 0.640 0.630 . . . 1.0 . . . . . . . . . . . . A . 6 ILE C . . . . . . . . . c30057_5j6t 1 . 1 . 64 . 1 1 6 ILE CA C 8.575 -0.381 0.219 . . . 1.0 . . . . . . . . . . . . A . 6 ILE CA . . . . . . . . . c30057_5j6t 1 . 1 . 65 . 1 1 6 ILE CB C 7.504 0.277 -0.655 . . . 1.0 . . . . . . . . . . . . A . 6 ILE CB . . . . . . . . . c30057_5j6t 1 . 1 . 66 . 1 1 6 ILE CD1 C 7.100 -1.908 -1.826 . . . 1.0 . . . . . . . . . . . . A . 6 ILE CD1 . . . . . . . . . c30057_5j6t 1 . 1 . 67 . 1 1 6 ILE CG1 C 6.446 -0.765 -1.042 . . . 1.0 . . . . . . . . . . . . A . 6 ILE CG1 . . . . . . . . . c30057_5j6t 1 . 1 . 68 . 1 1 6 ILE CG2 C 8.150 0.845 -1.922 . . . 1.0 . . . . . . . . . . . . A . 6 ILE CG2 . . . . . . . . . c30057_5j6t 1 . 1 . 69 . 1 1 6 ILE H H 6.972 -0.453 1.696 . . . 1.0 . . . . . . . . . . . . A . 6 ILE H . . . . . . . . . c30057_5j6t 1 . 1 . 70 . 1 1 6 ILE HA H 9.037 -1.212 -0.314 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HA . . . . . . . . . c30057_5j6t 1 . 1 . 71 . 1 1 6 ILE HB H 7.030 1.085 -0.098 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HB . . . . . . . . . c30057_5j6t 1 . 1 . 72 . 1 1 6 ILE HD11 H 6.378 -2.330 -2.524 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HD11 . . . . . . . . . c30057_5j6t 1 . 1 . 73 . 1 1 6 ILE HD12 H 7.429 -2.682 -1.132 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HD12 . . . . . . . . . c30057_5j6t 1 . 1 . 74 . 1 1 6 ILE HD13 H 7.959 -1.525 -2.377 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HD13 . . . . . . . . . c30057_5j6t 1 . 1 . 75 . 1 1 6 ILE HG12 H 5.985 -1.164 -0.139 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HG12 . . . . . . . . . c30057_5j6t 1 . 1 . 76 . 1 1 6 ILE HG13 H 5.682 -0.292 -1.660 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HG13 . . . . . . . . . c30057_5j6t 1 . 1 . 77 . 1 1 6 ILE HG21 H 8.467 1.872 -1.739 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HG21 . . . . . . . . . c30057_5j6t 1 . 1 . 78 . 1 1 6 ILE HG22 H 9.016 0.240 -2.190 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HG22 . . . . . . . . . c30057_5j6t 1 . 1 . 79 . 1 1 6 ILE HG23 H 7.427 0.827 -2.737 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HG23 . . . . . . . . . c30057_5j6t 1 . 1 . 80 . 1 1 6 ILE N N 7.844 -0.881 1.421 . . . 1.0 . . . . . . . . . . . . A . 6 ILE N . . . . . . . . . c30057_5j6t 1 . 1 . 81 . 1 1 6 ILE O O 10.681 0.743 0.018 . . . 1.0 . . . . . . . . . . . . A . 6 ILE O . . . . . . . . . c30057_5j6t 1 . 1 . 82 . 1 1 7 TRP C C 11.650 1.718 2.608 . . . 1.0 . . . . . . . . . . . . A . 7 TRP C . . . . . . . . . c30057_5j6t 1 . 1 . 83 . 1 1 7 TRP CA C 10.376 2.412 2.107 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CA . . . . . . . . . c30057_5j6t 1 . 1 . 84 . 1 1 7 TRP CB C 9.694 3.189 3.237 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CB . . . . . . . . . c30057_5j6t 1 . 1 . 85 . 1 1 7 TRP CD1 C 8.595 5.416 2.765 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CD1 . . . . . . . . . c30057_5j6t 1 . 1 . 86 . 1 1 7 TRP CD2 C 10.840 5.521 2.672 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CD2 . . . . . . . . . c30057_5j6t 1 . 1 . 87 . 1 1 7 TRP CE2 C 10.361 6.822 2.390 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CE2 . . . . . . . . . c30057_5j6t 1 . 1 . 88 . 1 1 7 TRP CE3 C 12.231 5.313 2.679 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CE3 . . . . . . . . . c30057_5j6t 1 . 1 . 89 . 1 1 7 TRP CG C 9.699 4.648 2.908 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CG . . . . . . . . . c30057_5j6t 1 . 1 . 90 . 1 1 7 TRP CH2 C 12.611 7.654 2.132 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CH2 . . . . . . . . . c30057_5j6t 1 . 1 . 91 . 1 1 7 TRP CZ2 C 11.232 7.879 2.122 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CZ2 . . . . . . . . . c30057_5j6t 1 . 1 . 92 . 1 1 7 TRP CZ3 C 13.110 6.373 2.409 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CZ3 . . . . . . . . . c30057_5j6t 1 . 1 . 93 . 1 1 7 TRP H H 8.502 1.295 2.156 . . . 1.0 . . . . . . . . . . . . A . 7 TRP H . . . . . . . . . c30057_5j6t 1 . 1 . 94 . 1 1 7 TRP HA H 10.617 3.085 1.284 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HA . . . . . . . . . c30057_5j6t 1 . 1 . 95 . 1 1 7 TRP HB2 H 8.665 2.844 3.347 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HB2 . . . . . . . . . c30057_5j6t 1 . 1 . 96 . 1 1 7 TRP HB3 H 10.234 3.024 4.170 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HB3 . . . . . . . . . c30057_5j6t 1 . 1 . 97 . 1 1 7 TRP HD1 H 7.575 5.077 2.872 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HD1 . . . . . . . . . c30057_5j6t 1 . 1 . 98 . 1 1 7 TRP HE1 H 8.345 7.471 2.303 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HE1 . . . . . . . . . c30057_5j6t 1 . 1 . 99 . 1 1 7 TRP HE3 H 12.625 4.330 2.892 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HE3 . . . . . . . . . c30057_5j6t 1 . 1 . 100 . 1 1 7 TRP HH2 H 13.292 8.466 1.925 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HH2 . . . . . . . . . c30057_5j6t 1 . 1 . 101 . 1 1 7 TRP HZ2 H 10.843 8.864 1.909 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HZ2 . . . . . . . . . c30057_5j6t 1 . 1 . 102 . 1 1 7 TRP HZ3 H 14.177 6.202 2.415 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HZ3 . . . . . . . . . c30057_5j6t 1 . 1 . 103 . 1 1 7 TRP N N 9.377 1.396 1.661 . . . 1.0 . . . . . . . . . . . . A . 7 TRP N . . . . . . . . . c30057_5j6t 1 . 1 . 104 . 1 1 7 TRP NE1 N 8.986 6.707 2.458 . . . 1.0 . . . . . . . . . . . . A . 7 TRP NE1 . . . . . . . . . c30057_5j6t 1 . 1 . 105 . 1 1 7 TRP O O 12.736 2.043 2.171 . . . 1.0 . . . . . . . . . . . . A . 7 TRP O . . . . . . . . . c30057_5j6t 1 . 1 . 106 . 1 1 8 PRO C C 13.469 -0.567 2.894 . . . 1.0 . . . . . . . . . . . . A . 8 PRO C . . . . . . . . . c30057_5j6t 1 . 1 . 107 . 1 1 8 PRO CA C 12.654 0.036 4.042 . . . 1.0 . . . . . . . . . . . . A . 8 PRO CA . . . . . . . . . c30057_5j6t 1 . 1 . 108 . 1 1 8 PRO CB C 12.041 -1.067 4.903 . . . 1.0 . . . . . . . . . . . . A . 8 PRO CB . . . . . . . . . c30057_5j6t 1 . 1 . 109 . 1 1 8 PRO CD C 10.223 0.313 4.092 . . . 1.0 . . . . . . . . . . . . A . 8 PRO CD . . . . . . . . . c30057_5j6t 1 . 1 . 110 . 1 1 8 PRO CG C 10.644 -0.621 5.196 . . . 1.0 . . . . . . . . . . . . A . 8 PRO CG . . . . . . . . . c30057_5j6t 1 . 1 . 111 . 1 1 8 PRO HA H 13.276 0.694 4.648 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HA . . . . . . . . . c30057_5j6t 1 . 1 . 112 . 1 1 8 PRO HB2 H 12.033 -2.012 4.361 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HB2 . . . . . . . . . c30057_5j6t 1 . 1 . 113 . 1 1 8 PRO HB3 H 12.603 -1.172 5.831 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HB3 . . . . . . . . . c30057_5j6t 1 . 1 . 114 . 1 1 8 PRO HD2 H 9.632 -0.222 3.349 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HD2 . . . . . . . . . c30057_5j6t 1 . 1 . 115 . 1 1 8 PRO HD3 H 9.655 1.153 4.493 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HD3 . . . . . . . . . c30057_5j6t 1 . 1 . 116 . 1 1 8 PRO HG2 H 9.978 -1.484 5.227 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HG2 . . . . . . . . . c30057_5j6t 1 . 1 . 117 . 1 1 8 PRO HG3 H 10.616 -0.099 6.152 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HG3 . . . . . . . . . c30057_5j6t 1 . 1 . 118 . 1 1 8 PRO N N 11.483 0.773 3.505 . . . 1.0 . . . . . . . . . . . . A . 8 PRO N . . . . . . . . . c30057_5j6t 1 . 1 . 119 . 1 1 8 PRO O O 14.667 -0.751 3.000 . . . 1.0 . . . . . . . . . . . . A . 8 PRO O . . . . . . . . . c30057_5j6t 1 . 1 . 120 . 1 1 9 LEU C C 14.228 -0.341 -0.180 . . . 1.0 . . . . . . . . . . . . A . 9 LEU C . . . . . . . . . c30057_5j6t 1 . 1 . 121 . 1 1 9 LEU CA C 13.565 -1.453 0.637 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CA . . . . . . . . . c30057_5j6t 1 . 1 . 122 . 1 1 9 LEU CB C 12.499 -2.166 -0.194 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CB . . . . . . . . . c30057_5j6t 1 . 1 . 123 . 1 1 9 LEU CD1 C 13.671 -4.287 -0.799 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CD1 . . . . . . . . . c30057_5j6t 1 . 1 . 124 . 1 1 9 LEU CD2 C 12.161 -3.181 -2.452 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CD2 . . . . . . . . . c30057_5j6t 1 . 1 . 125 . 1 1 9 LEU CG C 13.171 -2.942 -1.327 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CG . . . . . . . . . c30057_5j6t 1 . 1 . 126 . 1 1 9 LEU H H 11.834 -0.705 1.731 . . . 1.0 . . . . . . . . . . . . A . 9 LEU H . . . . . . . . . c30057_5j6t 1 . 1 . 127 . 1 1 9 LEU HA H 14.313 -2.166 0.984 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HA . . . . . . . . . c30057_5j6t 1 . 1 . 128 . 1 1 9 LEU HB2 H 11.945 -2.857 0.441 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HB2 . . . . . . . . . c30057_5j6t 1 . 1 . 129 . 1 1 9 LEU HB3 H 11.813 -1.429 -0.615 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HB3 . . . . . . . . . c30057_5j6t 1 . 1 . 130 . 1 1 9 LEU HD11 H 14.391 -4.118 0.002 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD11 . . . . . . . . . c30057_5j6t 1 . 1 . 131 . 1 1 9 LEU HD12 H 14.151 -4.839 -1.607 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD12 . . . . . . . . . c30057_5j6t 1 . 1 . 132 . 1 1 9 LEU HD13 H 12.829 -4.862 -0.415 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD13 . . . . . . . . . c30057_5j6t 1 . 1 . 133 . 1 1 9 LEU HD21 H 11.804 -2.223 -2.829 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD21 . . . . . . . . . c30057_5j6t 1 . 1 . 134 . 1 1 9 LEU HD22 H 11.319 -3.757 -2.067 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD22 . . . . . . . . . c30057_5j6t 1 . 1 . 135 . 1 1 9 LEU HD23 H 12.641 -3.734 -3.259 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD23 . . . . . . . . . c30057_5j6t 1 . 1 . 136 . 1 1 9 LEU HG H 14.013 -2.367 -1.712 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HG . . . . . . . . . c30057_5j6t 1 . 1 . 137 . 1 1 9 LEU N N 12.829 -0.868 1.796 . . . 1.0 . . . . . . . . . . . . A . 9 LEU N . . . . . . . . . c30057_5j6t 1 . 1 . 138 . 1 1 9 LEU O O 15.236 -0.550 -0.825 . . . 1.0 . . . . . . . . . . . . A . 9 LEU O . . . . . . . . . c30057_5j6t 1 . 1 . 139 . 1 1 10 ALA C C 15.664 2.284 -0.396 . . . 1.0 . . . . . . . . . . . . A . 10 ALA C . . . . . . . . . c30057_5j6t 1 . 1 . 140 . 1 1 10 ALA CA C 14.266 1.965 -0.931 . . . 1.0 . . . . . . . . . . . . A . 10 ALA CA . . . . . . . . . c30057_5j6t 1 . 1 . 141 . 1 1 10 ALA CB C 13.323 3.151 -0.711 . . . 1.0 . . . . . . . . . . . . A . 10 ALA CB . . . . . . . . . c30057_5j6t 1 . 1 . 142 . 1 1 10 ALA H H 12.829 0.989 0.386 . . . 1.0 . . . . . . . . . . . . A . 10 ALA H . . . . . . . . . c30057_5j6t 1 . 1 . 143 . 1 1 10 ALA HA H 14.315 1.712 -1.990 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HA . . . . . . . . . c30057_5j6t 1 . 1 . 144 . 1 1 10 ALA HB1 H 13.698 4.020 -1.252 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HB1 . . . . . . . . . c30057_5j6t 1 . 1 . 145 . 1 1 10 ALA HB2 H 12.328 2.896 -1.079 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HB2 . . . . . . . . . c30057_5j6t 1 . 1 . 146 . 1 1 10 ALA HB3 H 13.269 3.380 0.353 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HB3 . . . . . . . . . c30057_5j6t 1 . 1 . 147 . 1 1 10 ALA N N 13.667 0.839 -0.156 . . . 1.0 . . . . . . . . . . . . A . 10 ALA N . . . . . . . . . c30057_5j6t 1 . 1 . 148 . 1 1 10 ALA O O 16.550 2.672 -1.134 . . . 1.0 . . . . . . . . . . . . A . 10 ALA O . . . . . . . . . c30057_5j6t 1 . 1 . 149 . 1 1 11 LEU C C 18.195 1.304 1.103 . . . 1.0 . . . . . . . . . . . . A . 11 LEU C . . . . . . . . . c30057_5j6t 1 . 1 . 150 . 1 1 11 LEU CA C 17.204 2.411 1.475 . . . 1.0 . . . . . . . . . . . . A . 11 LEU CA . . . . . . . . . c30057_5j6t 1 . 1 . 151 . 1 1 11 LEU CB C 16.974 2.442 2.985 . . . 1.0 . . . . . . . . . . . . A . 11 LEU CB . . . . . . . . . c30057_5j6t 1 . 1 . 152 . 1 1 11 LEU CD1 C 16.181 3.862 4.884 . . . 1.0 . . . . . . . . . . . . A . 11 LEU CD1 . . . . . . . . . c30057_5j6t 1 . 1 . 153 . 1 1 11 LEU CD2 C 17.832 4.773 3.245 . . . 1.0 . . . . . . . . . . . . A . 11 LEU CD2 . . . . . . . . . c30057_5j6t 1 . 1 . 154 . 1 1 11 LEU CG C 16.612 3.864 3.416 . . . 1.0 . . . . . . . . . . . . A . 11 LEU CG . . . . . . . . . c30057_5j6t 1 . 1 . 155 . 1 1 11 LEU H H 15.112 1.797 1.474 . . . 1.0 . . . . . . . . . . . . A . 11 LEU H . . . . . . . . . c30057_5j6t 1 . 1 . 156 . 1 1 11 LEU HA H 17.570 3.377 1.127 . . . 1.0 . . . . . . . . . . . . A . 11 LEU HA . . . . . . . . . c30057_5j6t 1 . 1 . 157 . 1 1 11 LEU HB2 H 16.158 1.766 3.242 . . . 1.0 . . . . . . . . . . . . A . 11 LEU HB2 . . . . . . . . . c30057_5j6t 1 . 1 . 158 . 1 1 11 LEU HB3 H 17.882 2.127 3.498 . . . 1.0 . . . . . . . . . . . . A . 11 LEU HB3 . . . . . . . . . c30057_5j6t 1 . 1 . 159 . 1 1 11 LEU HD11 H 15.313 3.215 5.008 . . . 1.0 . . . . . . . . . . . . A . 11 LEU HD11 . . . . . . . . . c30057_5j6t 1 . 1 . 160 . 1 1 11 LEU HD12 H 15.925 4.876 5.189 . . . 1.0 . . . . . . . . . . . . A . 11 LEU HD12 . . . . . . . . . c30057_5j6t 1 . 1 . 161 . 1 1 11 LEU HD13 H 17.000 3.492 5.503 . . . 1.0 . . . . . . . . . . . . A . 11 LEU HD13 . . . . . . . . . c30057_5j6t 1 . 1 . 162 . 1 1 11 LEU HD21 H 17.576 5.787 3.552 . . . 1.0 . . . . . . . . . . . . A . 11 LEU HD21 . . . . . . . . . c30057_5j6t 1 . 1 . 163 . 1 1 11 LEU HD22 H 18.138 4.776 2.199 . . . 1.0 . . . . . . . . . . . . A . 11 LEU HD22 . . . . . . . . . c30057_5j6t 1 . 1 . 164 . 1 1 11 LEU HD23 H 18.650 4.402 3.863 . . . 1.0 . . . . . . . . . . . . A . 11 LEU HD23 . . . . . . . . . c30057_5j6t 1 . 1 . 165 . 1 1 11 LEU HG H 15.794 4.234 2.798 . . . 1.0 . . . . . . . . . . . . A . 11 LEU HG . . . . . . . . . c30057_5j6t 1 . 1 . 166 . 1 1 11 LEU N N 15.864 2.121 0.883 . . . 1.0 . . . . . . . . . . . . A . 11 LEU N . . . . . . . . . c30057_5j6t 1 . 1 . 167 . 1 1 11 LEU O O 19.386 1.531 1.004 . . . 1.0 . . . . . . . . . . . . A . 11 LEU O . . . . . . . . . c30057_5j6t 1 . 1 . 168 . 1 1 12 GLY C C 19.025 -0.874 -0.942 . . . 1.0 . . . . . . . . . . . . A . 12 GLY C . . . . . . . . . c30057_5j6t 1 . 1 . 169 . 1 1 12 GLY CA C 18.619 -1.012 0.525 . . . 1.0 . . . . . . . . . . . . A . 12 GLY CA . . . . . . . . . c30057_5j6t 1 . 1 . 170 . 1 1 12 GLY H H 16.717 -0.054 0.984 . . . 1.0 . . . . . . . . . . . . A . 12 GLY H . . . . . . . . . c30057_5j6t 1 . 1 . 171 . 1 1 12 GLY HA2 H 19.509 -0.981 1.154 . . . 1.0 . . . . . . . . . . . . A . 12 GLY HA2 . . . . . . . . . c30057_5j6t 1 . 1 . 172 . 1 1 12 GLY HA3 H 18.103 -1.961 0.672 . . . 1.0 . . . . . . . . . . . . A . 12 GLY HA3 . . . . . . . . . c30057_5j6t 1 . 1 . 173 . 1 1 12 GLY N N 17.710 0.110 0.894 . . . 1.0 . . . . . . . . . . . . A . 12 GLY N . . . . . . . . . c30057_5j6t 1 . 1 . 174 . 1 1 12 GLY O O 20.115 -1.247 -1.331 . . . 1.0 . . . . . . . . . . . . A . 12 GLY O . . . . . . . . . c30057_5j6t 1 . 1 . 175 . 1 1 13 ALA C C 19.741 0.704 -3.353 . . . 1.0 . . . . . . . . . . . . A . 13 ALA C . . . . . . . . . c30057_5j6t 1 . 1 . 176 . 1 1 13 ALA CA C 18.494 -0.170 -3.204 . . . 1.0 . . . . . . . . . . . . A . 13 ALA CA . . . . . . . . . c30057_5j6t 1 . 1 . 177 . 1 1 13 ALA CB C 17.276 0.518 -3.822 . . . 1.0 . . . . . . . . . . . . A . 13 ALA CB . . . . . . . . . c30057_5j6t 1 . 1 . 178 . 1 1 13 ALA H H 17.259 -0.035 -1.412 . . . 1.0 . . . . . . . . . . . . A . 13 ALA H . . . . . . . . . c30057_5j6t 1 . 1 . 179 . 1 1 13 ALA HA H 18.656 -1.143 -3.670 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HA . . . . . . . . . c30057_5j6t 1 . 1 . 180 . 1 1 13 ALA HB1 H 17.448 0.675 -4.887 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HB1 . . . . . . . . . c30057_5j6t 1 . 1 . 181 . 1 1 13 ALA HB2 H 16.396 -0.111 -3.685 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HB2 . . . . . . . . . c30057_5j6t 1 . 1 . 182 . 1 1 13 ALA HB3 H 17.115 1.479 -3.334 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HB3 . . . . . . . . . c30057_5j6t 1 . 1 . 183 . 1 1 13 ALA N N 18.158 -0.337 -1.758 . . . 1.0 . . . . . . . . . . . . A . 13 ALA N . . . . . . . . . c30057_5j6t 1 . 1 . 184 . 1 1 13 ALA O O 20.495 0.572 -4.299 . . . 1.0 . . . . . . . . . . . . A . 13 ALA O . . . . . . . . . c30057_5j6t 1 . 1 . 185 . 1 1 14 LEU C C 22.406 1.714 -2.042 . . . 1.0 . . . . . . . . . . . . A . 14 LEU C . . . . . . . . . c30057_5j6t 1 . 1 . 186 . 1 1 14 LEU CA C 21.161 2.478 -2.503 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CA . . . . . . . . . c30057_5j6t 1 . 1 . 187 . 1 1 14 LEU CB C 20.860 3.642 -1.556 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CB . . . . . . . . . c30057_5j6t 1 . 1 . 188 . 1 1 14 LEU CD1 C 22.143 5.373 -2.822 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CD1 . . . . . . . . . c30057_5j6t 1 . 1 . 189 . 1 1 14 LEU CD2 C 21.883 5.575 -0.347 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CD2 . . . . . . . . . c30057_5j6t 1 . 1 . 190 . 1 1 14 LEU CG C 22.056 4.595 -1.510 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CG . . . . . . . . . c30057_5j6t 1 . 1 . 191 . 1 1 14 LEU H H 19.319 1.685 -1.650 . . . 1.0 . . . . . . . . . . . . A . 14 LEU H . . . . . . . . . c30057_5j6t 1 . 1 . 192 . 1 1 14 LEU HA H 21.296 2.844 -3.521 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HA . . . . . . . . . c30057_5j6t 1 . 1 . 193 . 1 1 14 LEU HB2 H 19.981 4.180 -1.910 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HB2 . . . . . . . . . c30057_5j6t 1 . 1 . 194 . 1 1 14 LEU HB3 H 20.668 3.254 -0.556 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HB3 . . . . . . . . . c30057_5j6t 1 . 1 . 195 . 1 1 14 LEU HD11 H 22.267 4.676 -3.651 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD11 . . . . . . . . . c30057_5j6t 1 . 1 . 196 . 1 1 14 LEU HD12 H 21.228 5.948 -2.964 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD12 . . . . . . . . . c30057_5j6t 1 . 1 . 197 . 1 1 14 LEU HD13 H 22.996 6.051 -2.787 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD13 . . . . . . . . . c30057_5j6t 1 . 1 . 198 . 1 1 14 LEU HD21 H 21.821 5.021 0.590 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD21 . . . . . . . . . c30057_5j6t 1 . 1 . 199 . 1 1 14 LEU HD22 H 22.737 6.252 -0.312 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD22 . . . . . . . . . c30057_5j6t 1 . 1 . 200 . 1 1 14 LEU HD23 H 20.969 6.150 -0.490 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD23 . . . . . . . . . c30057_5j6t 1 . 1 . 201 . 1 1 14 LEU HG H 22.972 4.021 -1.367 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HG . . . . . . . . . c30057_5j6t 1 . 1 . 202 . 1 1 14 LEU N N 19.962 1.595 -2.424 . . . 1.0 . . . . . . . . . . . . A . 14 LEU N . . . . . . . . . c30057_5j6t 1 . 1 . 203 . 1 1 14 LEU O O 23.420 1.698 -2.712 . . . 1.0 . . . . . . . . . . . . A . 14 LEU O . . . . . . . . . c30057_5j6t 1 . 1 . 204 . 1 1 15 LYS C C 23.931 -0.751 -1.411 . . . 1.0 . . . . . . . . . . . . A . 15 LYS C . . . . . . . . . c30057_5j6t 1 . 1 . 205 . 1 1 15 LYS CA C 23.513 0.316 -0.393 . . . 1.0 . . . . . . . . . . . . A . 15 LYS CA . . . . . . . . . c30057_5j6t 1 . 1 . 206 . 1 1 15 LYS CB C 23.036 -0.341 0.908 . . . 1.0 . . . . . . . . . . . . A . 15 LYS CB . . . . . . . . . c30057_5j6t 1 . 1 . 207 . 1 1 15 LYS CD C 23.361 0.411 3.272 . . . 1.0 . . . . . . . . . . . . A . 15 LYS CD . . . . . . . . . c30057_5j6t 1 . 1 . 208 . 1 1 15 LYS CE C 22.758 1.789 2.990 . . . 1.0 . . . . . . . . . . . . A . 15 LYS CE . . . . . . . . . c30057_5j6t 1 . 1 . 209 . 1 1 15 LYS CG C 24.069 -0.102 2.016 . . . 1.0 . . . . . . . . . . . . A . 15 LYS CG . . . . . . . . . c30057_5j6t 1 . 1 . 210 . 1 1 15 LYS H H 21.480 1.106 -0.364 . . . 1.0 . . . . . . . . . . . . A . 15 LYS H . . . . . . . . . c30057_5j6t 1 . 1 . 211 . 1 1 15 LYS HA H 24.343 0.992 -0.192 . . . 1.0 . . . . . . . . . . . . A . 15 LYS HA . . . . . . . . . c30057_5j6t 1 . 1 . 212 . 1 1 15 LYS HB2 H 22.080 0.092 1.204 . . . 1.0 . . . . . . . . . . . . A . 15 LYS HB2 . . . . . . . . . c30057_5j6t 1 . 1 . 213 . 1 1 15 LYS HB3 H 22.915 -1.412 0.750 . . . 1.0 . . . . . . . . . . . . A . 15 LYS HB3 . . . . . . . . . c30057_5j6t 1 . 1 . 214 . 1 1 15 LYS HD2 H 22.569 -0.282 3.552 . . . 1.0 . . . . . . . . . . . . A . 15 LYS HD2 . . . . . . . . . c30057_5j6t 1 . 1 . 215 . 1 1 15 LYS HD3 H 24.080 0.490 4.088 . . . 1.0 . . . . . . . . . . . . A . 15 LYS HD3 . . . . . . . . . c30057_5j6t 1 . 1 . 216 . 1 1 15 LYS HE2 H 22.652 1.941 1.916 . . . 1.0 . . . . . . . . . . . . A . 15 LYS HE2 . . . . . . . . . c30057_5j6t 1 . 1 . 217 . 1 1 15 LYS HE3 H 21.790 1.891 3.481 . . . 1.0 . . . . . . . . . . . . A . 15 LYS HE3 . . . . . . . . . c30057_5j6t 1 . 1 . 218 . 1 1 15 LYS HG2 H 24.580 -1.037 2.243 . . . 1.0 . . . . . . . . . . . . A . 15 LYS HG2 . . . . . . . . . c30057_5j6t 1 . 1 . 219 . 1 1 15 LYS HG3 H 24.796 0.638 1.681 . . . 1.0 . . . . . . . . . . . . A . 15 LYS HG3 . . . . . . . . . c30057_5j6t 1 . 1 . 220 . 1 1 15 LYS HZ1 H 23.400 3.703 3.402 . . . 1.0 . . . . . . . . . . . . A . 15 LYS HZ1 . . . . . . . . . c30057_5j6t 1 . 1 . 221 . 1 1 15 LYS HZ2 H 23.841 2.597 4.544 . . . 1.0 . . . . . . . . . . . . A . 15 LYS HZ2 . . . . . . . . . c30057_5j6t 1 . 1 . 222 . 1 1 15 LYS HZ3 H 24.628 2.645 3.095 . . . 1.0 . . . . . . . . . . . . A . 15 LYS HZ3 . . . . . . . . . c30057_5j6t 1 . 1 . 223 . 1 1 15 LYS N N 22.335 1.080 -0.902 . . . 1.0 . . . . . . . . . . . . A . 15 LYS N . . . . . . . . . c30057_5j6t 1 . 1 . 224 . 1 1 15 LYS NZ N 23.735 2.762 3.553 . . . 1.0 . . . . . . . . . . . . A . 15 LYS NZ . . . . . . . . . c30057_5j6t 1 . 1 . 225 . 1 1 15 LYS O O 25.080 -1.141 -1.479 . . . 1.0 . . . . . . . . . . . . A . 15 LYS O . . . . . . . . . c30057_5j6t 1 . 1 . 226 . 1 1 16 ASN C C 24.144 -1.628 -4.365 . . . 1.0 . . . . . . . . . . . . A . 16 ASN C . . . . . . . . . c30057_5j6t 1 . 1 . 227 . 1 1 16 ASN CA C 23.346 -2.258 -3.222 . . . 1.0 . . . . . . . . . . . . A . 16 ASN CA . . . . . . . . . c30057_5j6t 1 . 1 . 228 . 1 1 16 ASN CB C 22.000 -2.772 -3.729 . . . 1.0 . . . . . . . . . . . . A . 16 ASN CB . . . . . . . . . c30057_5j6t 1 . 1 . 229 . 1 1 16 ASN CG C 21.395 -3.730 -2.699 . . . 1.0 . . . . . . . . . . . . A . 16 ASN CG . . . . . . . . . c30057_5j6t 1 . 1 . 230 . 1 1 16 ASN H H 22.056 -0.882 -2.128 . . . 1.0 . . . . . . . . . . . . A . 16 ASN H . . . . . . . . . c30057_5j6t 1 . 1 . 231 . 1 1 16 ASN HA H 23.914 -3.068 -2.763 . . . 1.0 . . . . . . . . . . . . A . 16 ASN HA . . . . . . . . . c30057_5j6t 1 . 1 . 232 . 1 1 16 ASN HB2 H 21.324 -1.931 -3.883 . . . 1.0 . . . . . . . . . . . . A . 16 ASN HB2 . . . . . . . . . c30057_5j6t 1 . 1 . 233 . 1 1 16 ASN HB3 H 22.145 -3.299 -4.672 . . . 1.0 . . . . . . . . . . . . A . 16 ASN HB3 . . . . . . . . . c30057_5j6t 1 . 1 . 234 . 1 1 16 ASN HD21 H 23.033 -4.892 -2.632 . . . 1.0 . . . . . . . . . . . . A . 16 ASN HD21 . . . . . . . . . c30057_5j6t 1 . 1 . 235 . 1 1 16 ASN HD22 H 21.709 -5.381 -1.599 . . . 1.0 . . . . . . . . . . . . A . 16 ASN HD22 . . . . . . . . . c30057_5j6t 1 . 1 . 236 . 1 1 16 ASN N N 23.005 -1.221 -2.204 . . . 1.0 . . . . . . . . . . . . A . 16 ASN N . . . . . . . . . c30057_5j6t 1 . 1 . 237 . 1 1 16 ASN ND2 N 22.098 -4.744 -2.278 . . . 1.0 . . . . . . . . . . . . A . 16 ASN ND2 . . . . . . . . . c30057_5j6t 1 . 1 . 238 . 1 1 16 ASN O O 25.045 -2.233 -4.913 . . . 1.0 . . . . . . . . . . . . A . 16 ASN O . . . . . . . . . c30057_5j6t 1 . 1 . 239 . 1 1 16 ASN OD1 O 20.271 -3.551 -2.274 . . . 1.0 . . . . . . . . . . . . A . 16 ASN OD1 . . . . . . . . . c30057_5j6t 1 . 1 . 240 . 1 1 17 LEU C C 25.959 0.651 -5.369 . . . 1.0 . . . . . . . . . . . . A . 17 LEU C . . . . . . . . . c30057_5j6t 1 . 1 . 241 . 1 1 17 LEU CA C 24.555 0.261 -5.835 . . . 1.0 . . . . . . . . . . . . A . 17 LEU CA . . . . . . . . . c30057_5j6t 1 . 1 . 242 . 1 1 17 LEU CB C 23.730 1.507 -6.160 . . . 1.0 . . . . . . . . . . . . A . 17 LEU CB . . . . . . . . . c30057_5j6t 1 . 1 . 243 . 1 1 17 LEU CD1 C 23.974 1.596 -8.646 . . . 1.0 . . . . . . . . . . . . A . 17 LEU CD1 . . . . . . . . . c30057_5j6t 1 . 1 . 244 . 1 1 17 LEU CD2 C 23.893 3.712 -7.322 . . . 1.0 . . . . . . . . . . . . A . 17 LEU CD2 . . . . . . . . . c30057_5j6t 1 . 1 . 245 . 1 1 17 LEU CG C 24.374 2.259 -7.327 . . . 1.0 . . . . . . . . . . . . A . 17 LEU CG . . . . . . . . . c30057_5j6t 1 . 1 . 246 . 1 1 17 LEU H H 23.067 0.067 -4.256 . . . 1.0 . . . . . . . . . . . . A . 17 LEU H . . . . . . . . . c30057_5j6t 1 . 1 . 247 . 1 1 17 LEU HA H 24.613 -0.393 -6.705 . . . 1.0 . . . . . . . . . . . . A . 17 LEU HA . . . . . . . . . c30057_5j6t 1 . 1 . 248 . 1 1 17 LEU HB2 H 22.718 1.211 -6.434 . . . 1.0 . . . . . . . . . . . . A . 17 LEU HB2 . . . . . . . . . c30057_5j6t 1 . 1 . 249 . 1 1 17 LEU HB3 H 23.694 2.157 -5.286 . . . 1.0 . . . . . . . . . . . . A . 17 LEU HB3 . . . . . . . . . c30057_5j6t 1 . 1 . 250 . 1 1 17 LEU HD11 H 24.316 0.561 -8.652 . . . 1.0 . . . . . . . . . . . . A . 17 LEU HD11 . . . . . . . . . c30057_5j6t 1 . 1 . 251 . 1 1 17 LEU HD12 H 24.432 2.134 -9.476 . . . 1.0 . . . . . . . . . . . . A . 17 LEU HD12 . . . . . . . . . c30057_5j6t 1 . 1 . 252 . 1 1 17 LEU HD13 H 22.890 1.621 -8.751 . . . 1.0 . . . . . . . . . . . . A . 17 LEU HD13 . . . . . . . . . c30057_5j6t 1 . 1 . 253 . 1 1 17 LEU HD21 H 24.351 4.249 -8.153 . . . 1.0 . . . . . . . . . . . . A . 17 LEU HD21 . . . . . . . . . c30057_5j6t 1 . 1 . 254 . 1 1 17 LEU HD22 H 24.178 4.185 -6.382 . . . 1.0 . . . . . . . . . . . . A . 17 LEU HD22 . . . . . . . . . c30057_5j6t 1 . 1 . 255 . 1 1 17 LEU HD23 H 22.808 3.736 -7.427 . . . 1.0 . . . . . . . . . . . . A . 17 LEU HD23 . . . . . . . . . c30057_5j6t 1 . 1 . 256 . 1 1 17 LEU HG H 25.459 2.234 -7.221 . . . 1.0 . . . . . . . . . . . . A . 17 LEU HG . . . . . . . . . c30057_5j6t 1 . 1 . 257 . 1 1 17 LEU N N 23.819 -0.415 -4.728 . . . 1.0 . . . . . . . . . . . . A . 17 LEU N . . . . . . . . . c30057_5j6t 1 . 1 . 258 . 1 1 17 LEU O O 26.917 0.570 -6.115 . . . 1.0 . . . . . . . . . . . . A . 17 LEU O . . . . . . . . . c30057_5j6t 1 . 1 . 259 . 1 1 18 ILE C C 28.145 0.256 -3.024 . . . 1.0 . . . . . . . . . . . . A . 18 ILE C . . . . . . . . . c30057_5j6t 1 . 1 . 260 . 1 1 18 ILE CA C 27.423 1.470 -3.620 . . . 1.0 . . . . . . . . . . . . A . 18 ILE CA . . . . . . . . . c30057_5j6t 1 . 1 . 261 . 1 1 18 ILE CB C 27.135 2.515 -2.540 . . . 1.0 . . . . . . . . . . . . A . 18 ILE CB . . . . . . . . . c30057_5j6t 1 . 1 . 262 . 1 1 18 ILE CD1 C 27.057 1.842 -0.128 . . . 1.0 . . . . . . . . . . . . A . 18 ILE CD1 . . . . . . . . . c30057_5j6t 1 . 1 . 263 . 1 1 18 ILE CG1 C 26.264 1.899 -1.436 . . . 1.0 . . . . . . . . . . . . A . 18 ILE CG1 . . . . . . . . . c30057_5j6t 1 . 1 . 264 . 1 1 18 ILE CG2 C 26.401 3.704 -3.164 . . . 1.0 . . . . . . . . . . . . A . 18 ILE CG2 . . . . . . . . . c30057_5j6t 1 . 1 . 265 . 1 1 18 ILE H H 25.273 1.130 -3.544 . . . 1.0 . . . . . . . . . . . . A . 18 ILE H . . . . . . . . . c30057_5j6t 1 . 1 . 266 . 1 1 18 ILE HA H 28.022 1.909 -4.418 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HA . . . . . . . . . c30057_5j6t 1 . 1 . 267 . 1 1 18 ILE HB H 28.076 2.858 -2.109 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HB . . . . . . . . . c30057_5j6t 1 . 1 . 268 . 1 1 18 ILE HD11 H 26.437 1.404 0.654 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HD11 . . . . . . . . . c30057_5j6t 1 . 1 . 269 . 1 1 18 ILE HD12 H 27.349 2.851 0.163 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HD12 . . . . . . . . . c30057_5j6t 1 . 1 . 270 . 1 1 18 ILE HD13 H 27.948 1.232 -0.270 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HD13 . . . . . . . . . c30057_5j6t 1 . 1 . 271 . 1 1 18 ILE HG12 H 25.372 2.509 -1.294 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HG12 . . . . . . . . . c30057_5j6t 1 . 1 . 272 . 1 1 18 ILE HG13 H 25.971 0.890 -1.727 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HG13 . . . . . . . . . c30057_5j6t 1 . 1 . 273 . 1 1 18 ILE HG21 H 26.196 4.449 -2.396 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HG21 . . . . . . . . . c30057_5j6t 1 . 1 . 274 . 1 1 18 ILE HG22 H 25.462 3.363 -3.600 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HG22 . . . . . . . . . c30057_5j6t 1 . 1 . 275 . 1 1 18 ILE HG23 H 27.023 4.147 -3.942 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HG23 . . . . . . . . . c30057_5j6t 1 . 1 . 276 . 1 1 18 ILE N N 26.085 1.073 -4.143 . . . 1.0 . . . . . . . . . . . . A . 18 ILE N . . . . . . . . . c30057_5j6t 1 . 1 . 277 . 1 1 18 ILE O O 29.354 0.238 -2.907 . . . 1.0 . . . . . . . . . . . . A . 18 ILE O . . . . . . . . . c30057_5j6t 1 . 1 . 278 . 1 1 19 LYS C C 27.052 -3.125 -1.992 . . . 1.0 . . . . . . . . . . . . A . 19 LYS C . . . . . . . . . c30057_5j6t 1 . 1 . 279 . 1 1 19 LYS CA C 28.056 -1.970 -2.061 . . . 1.0 . . . . . . . . . . . . A . 19 LYS CA . . . . . . . . . c30057_5j6t 1 . 1 . 280 . 1 1 19 LYS CB C 28.487 -1.551 -0.656 . . . 1.0 . . . . . . . . . . . . A . 19 LYS CB . . . . . . . . . c30057_5j6t 1 . 1 . 281 . 1 1 19 LYS CD C 28.979 -3.635 0.631 . . . 1.0 . . . . . . . . . . . . A . 19 LYS CD . . . . . . . . . c30057_5j6t 1 . 1 . 282 . 1 1 19 LYS CE C 30.057 -4.289 1.501 . . . 1.0 . . . . . . . . . . . . A . 19 LYS CE . . . . . . . . . c30057_5j6t 1 . 1 . 283 . 1 1 19 LYS CG C 29.597 -2.481 -0.162 . . . 1.0 . . . . . . . . . . . . A . 19 LYS CG . . . . . . . . . c30057_5j6t 1 . 1 . 284 . 1 1 19 LYS H H 26.407 -0.725 -2.755 . . . 1.0 . . . . . . . . . . . . A . 19 LYS H . . . . . . . . . c30057_5j6t 1 . 1 . 285 . 1 1 19 LYS HA H 28.925 -2.260 -2.653 . . . 1.0 . . . . . . . . . . . . A . 19 LYS HA . . . . . . . . . c30057_5j6t 1 . 1 . 286 . 1 1 19 LYS HB2 H 28.857 -0.526 -0.681 . . . 1.0 . . . . . . . . . . . . A . 19 LYS HB2 . . . . . . . . . c30057_5j6t 1 . 1 . 287 . 1 1 19 LYS HB3 H 27.634 -1.613 0.019 . . . 1.0 . . . . . . . . . . . . A . 19 LYS HB3 . . . . . . . . . c30057_5j6t 1 . 1 . 288 . 1 1 19 LYS HD2 H 28.182 -3.252 1.267 . . . 1.0 . . . . . . . . . . . . A . 19 LYS HD2 . . . . . . . . . c30057_5j6t 1 . 1 . 289 . 1 1 19 LYS HD3 H 28.571 -4.373 -0.060 . . . 1.0 . . . . . . . . . . . . A . 19 LYS HD3 . . . . . . . . . c30057_5j6t 1 . 1 . 290 . 1 1 19 LYS HE2 H 30.381 -5.229 1.054 . . . 1.0 . . . . . . . . . . . . A . 19 LYS HE2 . . . . . . . . . c30057_5j6t 1 . 1 . 291 . 1 1 19 LYS HE3 H 30.907 -3.619 1.627 . . . 1.0 . . . . . . . . . . . . A . 19 LYS HE3 . . . . . . . . . c30057_5j6t 1 . 1 . 292 . 1 1 19 LYS HG2 H 30.144 -2.879 -1.017 . . . 1.0 . . . . . . . . . . . . A . 19 LYS HG2 . . . . . . . . . c30057_5j6t 1 . 1 . 293 . 1 1 19 LYS HG3 H 30.280 -1.923 0.479 . . . 1.0 . . . . . . . . . . . . A . 19 LYS HG3 . . . . . . . . . c30057_5j6t 1 . 1 . 294 . 1 1 19 LYS HZ1 H 30.047 -4.979 3.442 . . . 1.0 . . . . . . . . . . . . A . 19 LYS HZ1 . . . . . . . . . c30057_5j6t 1 . 1 . 295 . 1 1 19 LYS HZ2 H 28.600 -5.156 2.671 . . . 1.0 . . . . . . . . . . . . A . 19 LYS HZ2 . . . . . . . . . c30057_5j6t 1 . 1 . 296 . 1 1 19 LYS HZ3 H 29.075 -3.668 3.202 . . . 1.0 . . . . . . . . . . . . A . 19 LYS HZ3 . . . . . . . . . c30057_5j6t 1 . 1 . 297 . 1 1 19 LYS N N 27.411 -0.760 -2.648 . . . 1.0 . . . . . . . . . . . . A . 19 LYS N . . . . . . . . . c30057_5j6t 1 . 1 . 298 . 1 1 19 LYS NZ N 29.392 -4.543 2.809 . . . 1.0 . . . . . . . . . . . . A . 19 LYS NZ . . . . . . . . . c30057_5j6t 1 . 1 . 299 . 1 1 19 LYS O O 26.445 -3.362 -0.967 . . . 1.0 . . . . . . . . . . . . A . 19 LYS O . . . . . . . . . c30057_5j6t 1 . 1 . 300 . 1 1 20 NH2 HN1 H 27.351 -3.661 -3.906 . . . 1.0 . . . . . . . . . . . . A . 20 NH2 HN1 . . . . . . . . . c30057_5j6t 1 . 1 . 301 . 1 1 20 NH2 HN2 H 26.188 -4.620 -3.020 . . . 1.0 . . . . . . . . . . . . A . 20 NH2 HN2 . . . . . . . . . c30057_5j6t 1 . 1 . 302 . 1 1 20 NH2 N N 26.848 -3.857 -3.053 . . . 1.0 . . . . . . . . . . . . A . 20 NH2 N . . . . . . . . . c30057_5j6t 1 . 2 . 303 . 1 1 1 ACE C C -0.167 -1.951 3.182 . . . 1.0 . . . . . . . . . . . . A . 1 ACE C . . . . . . . . . c30057_5j6t 1 . 2 . 304 . 1 1 1 ACE CH3 C -1.551 -1.398 2.840 . . . 1.0 . . . . . . . . . . . . A . 1 ACE CH3 . . . . . . . . . c30057_5j6t 1 . 2 . 305 . 1 1 1 ACE H1 H -2.245 -1.629 3.648 . . . 1.0 . . . . . . . . . . . . A . 1 ACE H1 . . . . . . . . . c30057_5j6t 1 . 2 . 306 . 1 1 1 ACE H2 H -1.906 -1.855 1.916 . . . 1.0 . . . . . . . . . . . . A . 1 ACE H2 . . . . . . . . . c30057_5j6t 1 . 2 . 307 . 1 1 1 ACE H3 H -1.490 -0.318 2.711 . . . 1.0 . . . . . . . . . . . . A . 1 ACE H3 . . . . . . . . . c30057_5j6t 1 . 2 . 308 . 1 1 1 ACE O O 0.034 -2.546 4.223 . . . 1.0 . . . . . . . . . . . . A . 1 ACE O . . . . . . . . . c30057_5j6t 1 . 2 . 309 . 1 1 2 ILE C C 3.214 -1.225 2.205 . . . 1.0 . . . . . . . . . . . . A . 2 ILE C . . . . . . . . . c30057_5j6t 1 . 2 . 310 . 1 1 2 ILE CA C 2.164 -2.275 2.586 . . . 1.0 . . . . . . . . . . . . A . 2 ILE CA . . . . . . . . . c30057_5j6t 1 . 2 . 311 . 1 1 2 ILE CB C 2.306 -3.523 1.711 . . . 1.0 . . . . . . . . . . . . A . 2 ILE CB . . . . . . . . . c30057_5j6t 1 . 2 . 312 . 1 1 2 ILE CD1 C 2.898 -4.063 -0.659 . . . 1.0 . . . . . . . . . . . . A . 2 ILE CD1 . . . . . . . . . c30057_5j6t 1 . 2 . 313 . 1 1 2 ILE CG1 C 2.058 -3.156 0.243 . . . 1.0 . . . . . . . . . . . . A . 2 ILE CG1 . . . . . . . . . c30057_5j6t 1 . 2 . 314 . 1 1 2 ILE CG2 C 1.285 -4.573 2.150 . . . 1.0 . . . . . . . . . . . . A . 2 ILE CG2 . . . . . . . . . c30057_5j6t 1 . 2 . 315 . 1 1 2 ILE H H 0.599 -1.263 1.455 . . . 1.0 . . . . . . . . . . . . A . 2 ILE H . . . . . . . . . c30057_5j6t 1 . 2 . 316 . 1 1 2 ILE HA H 2.264 -2.541 3.639 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HA . . . . . . . . . c30057_5j6t 1 . 2 . 317 . 1 1 2 ILE HB H 3.312 -3.929 1.818 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HB . . . . . . . . . c30057_5j6t 1 . 2 . 318 . 1 1 2 ILE HD11 H 2.722 -3.801 -1.703 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HD11 . . . . . . . . . c30057_5j6t 1 . 2 . 319 . 1 1 2 ILE HD12 H 3.954 -3.930 -0.425 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HD12 . . . . . . . . . c30057_5j6t 1 . 2 . 320 . 1 1 2 ILE HD13 H 2.617 -5.102 -0.493 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HD13 . . . . . . . . . c30057_5j6t 1 . 2 . 321 . 1 1 2 ILE HG12 H 1.002 -3.288 0.008 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HG12 . . . . . . . . . c30057_5j6t 1 . 2 . 322 . 1 1 2 ILE HG13 H 2.340 -2.116 0.076 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HG13 . . . . . . . . . c30057_5j6t 1 . 2 . 323 . 1 1 2 ILE HG21 H 1.459 -4.835 3.193 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HG21 . . . . . . . . . c30057_5j6t 1 . 2 . 324 . 1 1 2 ILE HG22 H 1.389 -5.463 1.529 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HG22 . . . . . . . . . c30057_5j6t 1 . 2 . 325 . 1 1 2 ILE HG23 H 0.278 -4.169 2.040 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HG23 . . . . . . . . . c30057_5j6t 1 . 2 . 326 . 1 1 2 ILE N N 0.790 -1.760 2.314 . . . 1.0 . . . . . . . . . . . . A . 2 ILE N . . . . . . . . . c30057_5j6t 1 . 2 . 327 . 1 1 2 ILE O O 4.341 -1.551 1.889 . . . 1.0 . . . . . . . . . . . . A . 2 ILE O . . . . . . . . . c30057_5j6t 1 . 2 . 328 . 1 1 3 PHE C C 5.000 1.090 2.863 . . . 1.0 . . . . . . . . . . . . A . 3 PHE C . . . . . . . . . c30057_5j6t 1 . 2 . 329 . 1 1 3 PHE CA C 3.830 1.099 1.878 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CA . . . . . . . . . c30057_5j6t 1 . 2 . 330 . 1 1 3 PHE CB C 3.050 2.409 1.985 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CB . . . . . . . . . c30057_5j6t 1 . 2 . 331 . 1 1 3 PHE CD1 C 4.396 3.601 0.220 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CD1 . . . . . . . . . c30057_5j6t 1 . 2 . 332 . 1 1 3 PHE CD2 C 4.277 4.562 2.442 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CD2 . . . . . . . . . c30057_5j6t 1 . 2 . 333 . 1 1 3 PHE CE1 C 5.210 4.659 -0.196 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CE1 . . . . . . . . . c30057_5j6t 1 . 2 . 334 . 1 1 3 PHE CE2 C 5.092 5.623 2.026 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CE2 . . . . . . . . . c30057_5j6t 1 . 2 . 335 . 1 1 3 PHE CG C 3.929 3.551 1.539 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CG . . . . . . . . . c30057_5j6t 1 . 2 . 336 . 1 1 3 PHE CZ C 5.558 5.672 0.707 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CZ . . . . . . . . . c30057_5j6t 1 . 2 . 337 . 1 1 3 PHE H H 1.908 0.277 2.500 . . . 1.0 . . . . . . . . . . . . A . 3 PHE H . . . . . . . . . c30057_5j6t 1 . 2 . 338 . 1 1 3 PHE HA H 4.192 0.956 0.860 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HA . . . . . . . . . c30057_5j6t 1 . 2 . 339 . 1 1 3 PHE HB2 H 2.167 2.359 1.348 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HB2 . . . . . . . . . c30057_5j6t 1 . 2 . 340 . 1 1 3 PHE HB3 H 2.745 2.567 3.019 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HB3 . . . . . . . . . c30057_5j6t 1 . 2 . 341 . 1 1 3 PHE HD1 H 4.127 2.821 -0.477 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HD1 . . . . . . . . . c30057_5j6t 1 . 2 . 342 . 1 1 3 PHE HD2 H 3.916 4.525 3.460 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HD2 . . . . . . . . . c30057_5j6t 1 . 2 . 343 . 1 1 3 PHE HE1 H 5.571 4.696 -1.214 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HE1 . . . . . . . . . c30057_5j6t 1 . 2 . 344 . 1 1 3 PHE HE2 H 5.361 6.402 2.723 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HE2 . . . . . . . . . c30057_5j6t 1 . 2 . 345 . 1 1 3 PHE HZ H 6.185 6.491 0.386 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HZ . . . . . . . . . c30057_5j6t 1 . 2 . 346 . 1 1 3 PHE N N 2.851 0.030 2.235 . . . 1.0 . . . . . . . . . . . . A . 3 PHE N . . . . . . . . . c30057_5j6t 1 . 2 . 347 . 1 1 3 PHE O O 6.138 1.299 2.491 . . . 1.0 . . . . . . . . . . . . A . 3 PHE O . . . . . . . . . c30057_5j6t 1 . 2 . 348 . 1 1 4 GLY C C 6.829 -0.280 4.768 . . . 1.0 . . . . . . . . . . . . A . 4 GLY C . . . . . . . . . c30057_5j6t 1 . 2 . 349 . 1 1 4 GLY CA C 5.823 0.816 5.130 . . . 1.0 . . . . . . . . . . . . A . 4 GLY CA . . . . . . . . . c30057_5j6t 1 . 2 . 350 . 1 1 4 GLY H H 3.775 0.673 4.402 . . . 1.0 . . . . . . . . . . . . A . 4 GLY H . . . . . . . . . c30057_5j6t 1 . 2 . 351 . 1 1 4 GLY HA2 H 6.329 1.782 5.145 . . . 1.0 . . . . . . . . . . . . A . 4 GLY HA2 . . . . . . . . . c30057_5j6t 1 . 2 . 352 . 1 1 4 GLY HA3 H 5.402 0.612 6.114 . . . 1.0 . . . . . . . . . . . . A . 4 GLY HA3 . . . . . . . . . c30057_5j6t 1 . 2 . 353 . 1 1 4 GLY N N 4.729 0.845 4.117 . . . 1.0 . . . . . . . . . . . . A . 4 GLY N . . . . . . . . . c30057_5j6t 1 . 2 . 354 . 1 1 4 GLY O O 7.959 -0.268 5.215 . . . 1.0 . . . . . . . . . . . . A . 4 GLY O . . . . . . . . . c30057_5j6t 1 . 2 . 355 . 1 1 5 ALA C C 8.147 -1.927 2.309 . . . 1.0 . . . . . . . . . . . . A . 5 ALA C . . . . . . . . . c30057_5j6t 1 . 2 . 356 . 1 1 5 ALA CA C 7.365 -2.321 3.567 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CA . . . . . . . . . c30057_5j6t 1 . 2 . 357 . 1 1 5 ALA CB C 6.467 -3.527 3.285 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CB . . . . . . . . . c30057_5j6t 1 . 2 . 358 . 1 1 5 ALA H H 5.486 -1.216 3.599 . . . 1.0 . . . . . . . . . . . . A . 5 ALA H . . . . . . . . . c30057_5j6t 1 . 2 . 359 . 1 1 5 ALA HA H 8.051 -2.544 4.384 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HA . . . . . . . . . c30057_5j6t 1 . 2 . 360 . 1 1 5 ALA HB1 H 7.081 -4.378 2.989 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB1 . . . . . . . . . c30057_5j6t 1 . 2 . 361 . 1 1 5 ALA HB2 H 5.906 -3.780 4.184 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB2 . . . . . . . . . c30057_5j6t 1 . 2 . 362 . 1 1 5 ALA HB3 H 5.773 -3.283 2.480 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB3 . . . . . . . . . c30057_5j6t 1 . 2 . 363 . 1 1 5 ALA N N 6.429 -1.226 3.959 . . . 1.0 . . . . . . . . . . . . A . 5 ALA N . . . . . . . . . c30057_5j6t 1 . 2 . 364 . 1 1 5 ALA O O 9.176 -2.500 2.003 . . . 1.0 . . . . . . . . . . . . A . 5 ALA O . . . . . . . . . c30057_5j6t 1 . 2 . 365 . 1 1 6 ILE C C 9.515 0.449 0.690 . . . 1.0 . . . . . . . . . . . . A . 6 ILE C . . . . . . . . . c30057_5j6t 1 . 2 . 366 . 1 1 6 ILE CA C 8.387 -0.526 0.342 . . . 1.0 . . . . . . . . . . . . A . 6 ILE CA . . . . . . . . . c30057_5j6t 1 . 2 . 367 . 1 1 6 ILE CB C 7.323 0.165 -0.516 . . . 1.0 . . . . . . . . . . . . A . 6 ILE CB . . . . . . . . . c30057_5j6t 1 . 2 . 368 . 1 1 6 ILE CD1 C 6.730 -2.037 -1.569 . . . 1.0 . . . . . . . . . . . . A . 6 ILE CD1 . . . . . . . . . c30057_5j6t 1 . 2 . 369 . 1 1 6 ILE CG1 C 6.185 -0.819 -0.818 . . . 1.0 . . . . . . . . . . . . A . 6 ILE CG1 . . . . . . . . . c30057_5j6t 1 . 2 . 370 . 1 1 6 ILE CG2 C 7.949 0.639 -1.829 . . . 1.0 . . . . . . . . . . . . A . 6 ILE CG2 . . . . . . . . . c30057_5j6t 1 . 2 . 371 . 1 1 6 ILE H H 6.814 -0.491 1.850 . . . 1.0 . . . . . . . . . . . . A . 6 ILE H . . . . . . . . . c30057_5j6t 1 . 2 . 372 . 1 1 6 ILE HA H 8.788 -1.394 -0.181 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HA . . . . . . . . . c30057_5j6t 1 . 2 . 373 . 1 1 6 ILE HB H 6.925 1.023 0.025 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HB . . . . . . . . . c30057_5j6t 1 . 2 . 374 . 1 1 6 ILE HD11 H 5.954 -2.441 -2.219 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HD11 . . . . . . . . . c30057_5j6t 1 . 2 . 375 . 1 1 6 ILE HD12 H 7.588 -1.739 -2.170 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HD12 . . . . . . . . . c30057_5j6t 1 . 2 . 376 . 1 1 6 ILE HD13 H 7.035 -2.799 -0.851 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HD13 . . . . . . . . . c30057_5j6t 1 . 2 . 377 . 1 1 6 ILE HG12 H 5.730 -1.144 0.118 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HG12 . . . . . . . . . c30057_5j6t 1 . 2 . 378 . 1 1 6 ILE HG13 H 5.433 -0.323 -1.432 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HG13 . . . . . . . . . c30057_5j6t 1 . 2 . 379 . 1 1 6 ILE HG21 H 8.337 1.650 -1.703 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HG21 . . . . . . . . . c30057_5j6t 1 . 2 . 380 . 1 1 6 ILE HG22 H 8.764 -0.031 -2.106 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HG22 . . . . . . . . . c30057_5j6t 1 . 2 . 381 . 1 1 6 ILE HG23 H 7.194 0.635 -2.615 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HG23 . . . . . . . . . c30057_5j6t 1 . 2 . 382 . 1 1 6 ILE N N 7.670 -0.954 1.578 . . . 1.0 . . . . . . . . . . . . A . 6 ILE N . . . . . . . . . c30057_5j6t 1 . 2 . 383 . 1 1 6 ILE O O 10.549 0.467 0.050 . . . 1.0 . . . . . . . . . . . . A . 6 ILE O . . . . . . . . . c30057_5j6t 1 . 2 . 384 . 1 1 7 TRP C C 11.662 1.488 2.507 . . . 1.0 . . . . . . . . . . . . A . 7 TRP C . . . . . . . . . c30057_5j6t 1 . 2 . 385 . 1 1 7 TRP CA C 10.389 2.232 2.079 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CA . . . . . . . . . c30057_5j6t 1 . 2 . 386 . 1 1 7 TRP CB C 9.808 3.038 3.245 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CB . . . . . . . . . c30057_5j6t 1 . 2 . 387 . 1 1 7 TRP CD1 C 8.861 5.333 2.776 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CD1 . . . . . . . . . c30057_5j6t 1 . 2 . 388 . 1 1 7 TRP CD2 C 11.110 5.303 2.747 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CD2 . . . . . . . . . c30057_5j6t 1 . 2 . 389 . 1 1 7 TRP CE2 C 10.721 6.634 2.473 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CE2 . . . . . . . . . c30057_5j6t 1 . 2 . 390 . 1 1 7 TRP CE3 C 12.486 5.009 2.787 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CE3 . . . . . . . . . c30057_5j6t 1 . 2 . 391 . 1 1 7 TRP CG C 9.912 4.497 2.937 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CG . . . . . . . . . c30057_5j6t 1 . 2 . 392 . 1 1 7 TRP CH2 C 13.023 7.331 2.287 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CH2 . . . . . . . . . c30057_5j6t 1 . 2 . 393 . 1 1 7 TRP CZ2 C 11.661 7.639 2.243 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CZ2 . . . . . . . . . c30057_5j6t 1 . 2 . 394 . 1 1 7 TRP CZ3 C 13.435 6.018 2.557 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CZ3 . . . . . . . . . c30057_5j6t 1 . 2 . 395 . 1 1 7 TRP H H 8.459 1.223 2.215 . . . 1.0 . . . . . . . . . . . . A . 7 TRP H . . . . . . . . . c30057_5j6t 1 . 2 . 396 . 1 1 7 TRP HA H 10.608 2.894 1.241 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HA . . . . . . . . . c30057_5j6t 1 . 2 . 397 . 1 1 7 TRP HB2 H 8.762 2.769 3.387 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HB2 . . . . . . . . . c30057_5j6t 1 . 2 . 398 . 1 1 7 TRP HB3 H 10.367 2.817 4.154 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HB3 . . . . . . . . . c30057_5j6t 1 . 2 . 399 . 1 1 7 TRP HD1 H 7.819 5.057 2.850 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HD1 . . . . . . . . . c30057_5j6t 1 . 2 . 400 . 1 1 7 TRP HE1 H 8.752 7.408 2.341 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HE1 . . . . . . . . . c30057_5j6t 1 . 2 . 401 . 1 1 7 TRP HE3 H 12.813 4.001 2.995 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HE3 . . . . . . . . . c30057_5j6t 1 . 2 . 402 . 1 1 7 TRP HH2 H 13.758 8.102 2.112 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HH2 . . . . . . . . . c30057_5j6t 1 . 2 . 403 . 1 1 7 TRP HZ2 H 11.338 8.649 2.034 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HZ2 . . . . . . . . . c30057_5j6t 1 . 2 . 404 . 1 1 7 TRP HZ3 H 14.489 5.782 2.589 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HZ3 . . . . . . . . . c30057_5j6t 1 . 2 . 405 . 1 1 7 TRP N N 9.325 1.257 1.696 . . . 1.0 . . . . . . . . . . . . A . 7 TRP N . . . . . . . . . c30057_5j6t 1 . 2 . 406 . 1 1 7 TRP NE1 N 9.340 6.603 2.501 . . . 1.0 . . . . . . . . . . . . A . 7 TRP NE1 . . . . . . . . . c30057_5j6t 1 . 2 . 407 . 1 1 7 TRP O O 12.731 1.765 2.002 . . . 1.0 . . . . . . . . . . . . A . 7 TRP O . . . . . . . . . c30057_5j6t 1 . 2 . 408 . 1 1 8 PRO C C 13.438 -0.822 2.700 . . . 1.0 . . . . . . . . . . . . A . 8 PRO C . . . . . . . . . c30057_5j6t 1 . 2 . 409 . 1 1 8 PRO CA C 12.684 -0.228 3.893 . . . 1.0 . . . . . . . . . . . . A . 8 PRO CA . . . . . . . . . c30057_5j6t 1 . 2 . 410 . 1 1 8 PRO CB C 12.073 -1.332 4.751 . . . 1.0 . . . . . . . . . . . . A . 8 PRO CB . . . . . . . . . c30057_5j6t 1 . 2 . 411 . 1 1 8 PRO CD C 10.273 0.149 4.090 . . . 1.0 . . . . . . . . . . . . A . 8 PRO CD . . . . . . . . . c30057_5j6t 1 . 2 . 412 . 1 1 8 PRO CG C 10.718 -0.833 5.142 . . . 1.0 . . . . . . . . . . . . A . 8 PRO CG . . . . . . . . . c30057_5j6t 1 . 2 . 413 . 1 1 8 PRO HA H 13.347 0.398 4.490 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HA . . . . . . . . . c30057_5j6t 1 . 2 . 414 . 1 1 8 PRO HB2 H 11.988 -2.256 4.178 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HB2 . . . . . . . . . c30057_5j6t 1 . 2 . 415 . 1 1 8 PRO HB3 H 12.683 -1.497 5.639 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HB3 . . . . . . . . . c30057_5j6t 1 . 2 . 416 . 1 1 8 PRO HD2 H 9.592 -0.325 3.383 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HD2 . . . . . . . . . c30057_5j6t 1 . 2 . 417 . 1 1 8 PRO HD3 H 9.795 1.011 4.555 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HD3 . . . . . . . . . c30057_5j6t 1 . 2 . 418 . 1 1 8 PRO HG2 H 10.016 -1.665 5.194 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HG2 . . . . . . . . . c30057_5j6t 1 . 2 . 419 . 1 1 8 PRO HG3 H 10.773 -0.336 6.111 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HG3 . . . . . . . . . c30057_5j6t 1 . 2 . 420 . 1 1 8 PRO N N 11.513 0.555 3.422 . . . 1.0 . . . . . . . . . . . . A . 8 PRO N . . . . . . . . . c30057_5j6t 1 . 2 . 421 . 1 1 8 PRO O O 14.641 -0.985 2.732 . . . 1.0 . . . . . . . . . . . . A . 8 PRO O . . . . . . . . . c30057_5j6t 1 . 2 . 422 . 1 1 9 LEU C C 14.103 -0.601 -0.350 . . . 1.0 . . . . . . . . . . . . A . 9 LEU C . . . . . . . . . c30057_5j6t 1 . 2 . 423 . 1 1 9 LEU CA C 13.406 -1.711 0.444 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CA . . . . . . . . . c30057_5j6t 1 . 2 . 424 . 1 1 9 LEU CB C 12.280 -2.337 -0.381 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CB . . . . . . . . . c30057_5j6t 1 . 2 . 425 . 1 1 9 LEU CD1 C 10.423 -3.994 -0.164 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CD1 . . . . . . . . . c30057_5j6t 1 . 2 . 426 . 1 1 9 LEU CD2 C 12.796 -4.772 -0.209 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CD2 . . . . . . . . . c30057_5j6t 1 . 2 . 427 . 1 1 9 LEU CG C 11.855 -3.659 0.256 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CG . . . . . . . . . c30057_5j6t 1 . 2 . 428 . 1 1 9 LEU H H 11.736 -0.990 1.642 . . . 1.0 . . . . . . . . . . . . A . 9 LEU H . . . . . . . . . c30057_5j6t 1 . 2 . 429 . 1 1 9 LEU HA H 14.126 -2.474 0.741 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HA . . . . . . . . . c30057_5j6t 1 . 2 . 430 . 1 1 9 LEU HB2 H 11.428 -1.657 -0.408 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HB2 . . . . . . . . . c30057_5j6t 1 . 2 . 431 . 1 1 9 LEU HB3 H 12.631 -2.519 -1.397 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HB3 . . . . . . . . . c30057_5j6t 1 . 2 . 432 . 1 1 9 LEU HD11 H 10.442 -4.622 -1.055 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD11 . . . . . . . . . c30057_5j6t 1 . 2 . 433 . 1 1 9 LEU HD12 H 9.883 -3.073 -0.381 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD12 . . . . . . . . . c30057_5j6t 1 . 2 . 434 . 1 1 9 LEU HD13 H 9.922 -4.527 0.645 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD13 . . . . . . . . . c30057_5j6t 1 . 2 . 435 . 1 1 9 LEU HD21 H 12.495 -5.717 0.244 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD21 . . . . . . . . . c30057_5j6t 1 . 2 . 436 . 1 1 9 LEU HD22 H 13.816 -4.534 0.091 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD22 . . . . . . . . . c30057_5j6t 1 . 2 . 437 . 1 1 9 LEU HD23 H 12.748 -4.859 -1.295 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD23 . . . . . . . . . c30057_5j6t 1 . 2 . 438 . 1 1 9 LEU HG H 11.904 -3.572 1.342 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HG . . . . . . . . . c30057_5j6t 1 . 2 . 439 . 1 1 9 LEU N N 12.736 -1.136 1.645 . . . 1.0 . . . . . . . . . . . . A . 9 LEU N . . . . . . . . . c30057_5j6t 1 . 2 . 440 . 1 1 9 LEU O O 15.062 -0.838 -1.058 . . . 1.0 . . . . . . . . . . . . A . 9 LEU O . . . . . . . . . c30057_5j6t 1 . 2 . 441 . 1 1 10 ALA C C 15.648 2.038 -0.407 . . . 1.0 . . . . . . . . . . . . A . 10 ALA C . . . . . . . . . c30057_5j6t 1 . 2 . 442 . 1 1 10 ALA CA C 14.258 1.741 -0.976 . . . 1.0 . . . . . . . . . . . . A . 10 ALA CA . . . . . . . . . c30057_5j6t 1 . 2 . 443 . 1 1 10 ALA CB C 13.326 2.932 -0.754 . . . 1.0 . . . . . . . . . . . . A . 10 ALA CB . . . . . . . . . c30057_5j6t 1 . 2 . 444 . 1 1 10 ALA H H 12.829 0.783 0.362 . . . 1.0 . . . . . . . . . . . . A . 10 ALA H . . . . . . . . . c30057_5j6t 1 . 2 . 445 . 1 1 10 ALA HA H 14.326 1.505 -2.038 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HA . . . . . . . . . c30057_5j6t 1 . 2 . 446 . 1 1 10 ALA HB1 H 13.335 3.570 -1.638 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HB1 . . . . . . . . . c30057_5j6t 1 . 2 . 447 . 1 1 10 ALA HB2 H 13.666 3.503 0.110 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HB2 . . . . . . . . . c30057_5j6t 1 . 2 . 448 . 1 1 10 ALA HB3 H 12.313 2.572 -0.576 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HB3 . . . . . . . . . c30057_5j6t 1 . 2 . 449 . 1 1 10 ALA N N 13.627 0.611 -0.233 . . . 1.0 . . . . . . . . . . . . A . 10 ALA N . . . . . . . . . c30057_5j6t 1 . 2 . 450 . 1 1 10 ALA O O 16.530 2.498 -1.107 . . . 1.0 . . . . . . . . . . . . A . 10 ALA O . . . . . . . . . c30057_5j6t 1 . 2 . 451 . 1 1 11 LEU C C 18.177 0.948 1.084 . . . 1.0 . . . . . . . . . . . . A . 11 LEU C . . . . . . . . . c30057_5j6t 1 . 2 . 452 . 1 1 11 LEU CA C 17.181 2.045 1.474 . . . 1.0 . . . . . . . . . . . . A . 11 LEU CA . . . . . . . . . c30057_5j6t 1 . 2 . 453 . 1 1 11 LEU CB C 16.929 2.031 2.983 . . . 1.0 . . . . . . . . . . . . A . 11 LEU CB . . . . . . . . . c30057_5j6t 1 . 2 . 454 . 1 1 11 LEU CD1 C 16.148 3.436 4.897 . . . 1.0 . . . . . . . . . . . . A . 11 LEU CD1 . . . . . . . . . c30057_5j6t 1 . 2 . 455 . 1 1 11 LEU CD2 C 18.062 4.200 3.484 . . . 1.0 . . . . . . . . . . . . A . 11 LEU CD2 . . . . . . . . . c30057_5j6t 1 . 2 . 456 . 1 1 11 LEU CG C 16.720 3.464 3.477 . . . 1.0 . . . . . . . . . . . . A . 11 LEU CG . . . . . . . . . c30057_5j6t 1 . 2 . 457 . 1 1 11 LEU H H 15.101 1.394 1.416 . . . 1.0 . . . . . . . . . . . . A . 11 LEU H . . . . . . . . . c30057_5j6t 1 . 2 . 458 . 1 1 11 LEU HA H 17.553 3.021 1.162 . . . 1.0 . . . . . . . . . . . . A . 11 LEU HA . . . . . . . . . c30057_5j6t 1 . 2 . 459 . 1 1 11 LEU HB2 H 16.039 1.439 3.197 . . . 1.0 . . . . . . . . . . . . A . 11 LEU HB2 . . . . . . . . . c30057_5j6t 1 . 2 . 460 . 1 1 11 LEU HB3 H 17.788 1.593 3.491 . . . 1.0 . . . . . . . . . . . . A . 11 LEU HB3 . . . . . . . . . c30057_5j6t 1 . 2 . 461 . 1 1 11 LEU HD11 H 15.192 2.912 4.894 . . . 1.0 . . . . . . . . . . . . A . 11 LEU HD11 . . . . . . . . . c30057_5j6t 1 . 2 . 462 . 1 1 11 LEU HD12 H 16.001 4.457 5.249 . . . 1.0 . . . . . . . . . . . . A . 11 LEU HD12 . . . . . . . . . c30057_5j6t 1 . 2 . 463 . 1 1 11 LEU HD13 H 16.843 2.920 5.559 . . . 1.0 . . . . . . . . . . . . A . 11 LEU HD13 . . . . . . . . . c30057_5j6t 1 . 2 . 464 . 1 1 11 LEU HD21 H 17.914 5.221 3.836 . . . 1.0 . . . . . . . . . . . . A . 11 LEU HD21 . . . . . . . . . c30057_5j6t 1 . 2 . 465 . 1 1 11 LEU HD22 H 18.756 3.684 4.147 . . . 1.0 . . . . . . . . . . . . A . 11 LEU HD22 . . . . . . . . . c30057_5j6t 1 . 2 . 466 . 1 1 11 LEU HD23 H 18.471 4.219 2.474 . . . 1.0 . . . . . . . . . . . . A . 11 LEU HD23 . . . . . . . . . c30057_5j6t 1 . 2 . 467 . 1 1 11 LEU HG H 16.025 3.980 2.815 . . . 1.0 . . . . . . . . . . . . A . 11 LEU HG . . . . . . . . . c30057_5j6t 1 . 2 . 468 . 1 1 11 LEU N N 15.848 1.777 0.856 . . . 1.0 . . . . . . . . . . . . A . 11 LEU N . . . . . . . . . c30057_5j6t 1 . 2 . 469 . 1 1 11 LEU O O 19.375 1.158 1.084 . . . 1.0 . . . . . . . . . . . . A . 11 LEU O . . . . . . . . . c30057_5j6t 1 . 2 . 470 . 1 1 12 GLY C C 19.055 -1.139 -1.089 . . . 1.0 . . . . . . . . . . . . A . 12 GLY C . . . . . . . . . c30057_5j6t 1 . 2 . 471 . 1 1 12 GLY CA C 18.608 -1.326 0.362 . . . 1.0 . . . . . . . . . . . . A . 12 GLY CA . . . . . . . . . c30057_5j6t 1 . 2 . 472 . 1 1 12 GLY H H 16.692 -0.369 0.756 . . . 1.0 . . . . . . . . . . . . A . 12 GLY H . . . . . . . . . c30057_5j6t 1 . 2 . 473 . 1 1 12 GLY HA2 H 19.482 -1.319 1.014 . . . 1.0 . . . . . . . . . . . . A . 12 GLY HA2 . . . . . . . . . c30057_5j6t 1 . 2 . 474 . 1 1 12 GLY HA3 H 18.089 -2.279 0.462 . . . 1.0 . . . . . . . . . . . . A . 12 GLY HA3 . . . . . . . . . c30057_5j6t 1 . 2 . 475 . 1 1 12 GLY N N 17.691 -0.219 0.750 . . . 1.0 . . . . . . . . . . . . A . 12 GLY N . . . . . . . . . c30057_5j6t 1 . 2 . 476 . 1 1 12 GLY O O 20.166 -1.469 -1.452 . . . 1.0 . . . . . . . . . . . . A . 12 GLY O . . . . . . . . . c30057_5j6t 1 . 2 . 477 . 1 1 13 ALA C C 19.769 0.552 -3.441 . . . 1.0 . . . . . . . . . . . . A . 13 ALA C . . . . . . . . . c30057_5j6t 1 . 2 . 478 . 1 1 13 ALA CA C 18.577 -0.402 -3.351 . . . 1.0 . . . . . . . . . . . . A . 13 ALA CA . . . . . . . . . c30057_5j6t 1 . 2 . 479 . 1 1 13 ALA CB C 17.342 0.216 -4.007 . . . 1.0 . . . . . . . . . . . . A . 13 ALA CB . . . . . . . . . c30057_5j6t 1 . 2 . 480 . 1 1 13 ALA H H 17.278 -0.343 -1.599 . . . 1.0 . . . . . . . . . . . . A . 13 ALA H . . . . . . . . . c30057_5j6t 1 . 2 . 481 . 1 1 13 ALA HA H 18.818 -1.355 -3.821 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HA . . . . . . . . . c30057_5j6t 1 . 2 . 482 . 1 1 13 ALA HB1 H 17.545 0.400 -5.062 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HB1 . . . . . . . . . c30057_5j6t 1 . 2 . 483 . 1 1 13 ALA HB2 H 17.103 1.159 -3.514 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HB2 . . . . . . . . . c30057_5j6t 1 . 2 . 484 . 1 1 13 ALA HB3 H 16.499 -0.468 -3.912 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HB3 . . . . . . . . . c30057_5j6t 1 . 2 . 485 . 1 1 13 ALA N N 18.197 -0.610 -1.922 . . . 1.0 . . . . . . . . . . . . A . 13 ALA N . . . . . . . . . c30057_5j6t 1 . 2 . 486 . 1 1 13 ALA O O 20.599 0.443 -4.321 . . . 1.0 . . . . . . . . . . . . A . 13 ALA O . . . . . . . . . c30057_5j6t 1 . 2 . 487 . 1 1 14 LEU C C 22.254 1.774 -1.978 . . . 1.0 . . . . . . . . . . . . A . 14 LEU C . . . . . . . . . c30057_5j6t 1 . 2 . 488 . 1 1 14 LEU CA C 21.000 2.442 -2.550 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CA . . . . . . . . . c30057_5j6t 1 . 2 . 489 . 1 1 14 LEU CB C 20.553 3.605 -1.662 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CB . . . . . . . . . c30057_5j6t 1 . 2 . 490 . 1 1 14 LEU CD1 C 21.766 5.406 -2.898 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CD1 . . . . . . . . . c30057_5j6t 1 . 2 . 491 . 1 1 14 LEU CD2 C 21.361 5.630 -0.444 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CD2 . . . . . . . . . c30057_5j6t 1 . 2 . 492 . 1 1 14 LEU CG C 21.670 4.647 -1.574 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CG . . . . . . . . . c30057_5j6t 1 . 2 . 493 . 1 1 14 LEU H H 19.157 1.550 -1.808 . . . 1.0 . . . . . . . . . . . . A . 14 LEU H . . . . . . . . . c30057_5j6t 1 . 2 . 494 . 1 1 14 LEU HA H 21.185 2.789 -3.567 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HA . . . . . . . . . c30057_5j6t 1 . 2 . 495 . 1 1 14 LEU HB2 H 19.661 4.064 -2.088 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HB2 . . . . . . . . . c30057_5j6t 1 . 2 . 496 . 1 1 14 LEU HB3 H 20.326 3.231 -0.663 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HB3 . . . . . . . . . c30057_5j6t 1 . 2 . 497 . 1 1 14 LEU HD11 H 21.986 4.705 -3.704 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD11 . . . . . . . . . c30057_5j6t 1 . 2 . 498 . 1 1 14 LEU HD12 H 22.563 6.147 -2.834 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD12 . . . . . . . . . c30057_5j6t 1 . 2 . 499 . 1 1 14 LEU HD13 H 20.819 5.906 -3.100 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD13 . . . . . . . . . c30057_5j6t 1 . 2 . 500 . 1 1 14 LEU HD21 H 21.292 5.090 0.500 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD21 . . . . . . . . . c30057_5j6t 1 . 2 . 501 . 1 1 14 LEU HD22 H 20.414 6.130 -0.647 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD22 . . . . . . . . . c30057_5j6t 1 . 2 . 502 . 1 1 14 LEU HD23 H 22.157 6.372 -0.381 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD23 . . . . . . . . . c30057_5j6t 1 . 2 . 503 . 1 1 14 LEU HG H 22.617 4.147 -1.372 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HG . . . . . . . . . c30057_5j6t 1 . 2 . 504 . 1 1 14 LEU N N 19.860 1.481 -2.530 . . . 1.0 . . . . . . . . . . . . A . 14 LEU N . . . . . . . . . c30057_5j6t 1 . 2 . 505 . 1 1 14 LEU O O 23.312 1.804 -2.574 . . . 1.0 . . . . . . . . . . . . A . 14 LEU O . . . . . . . . . c30057_5j6t 1 . 2 . 506 . 1 1 15 LYS C C 23.901 -0.545 -1.165 . . . 1.0 . . . . . . . . . . . . A . 15 LYS C . . . . . . . . . c30057_5j6t 1 . 2 . 507 . 1 1 15 LYS CA C 23.318 0.497 -0.205 . . . 1.0 . . . . . . . . . . . . A . 15 LYS CA . . . . . . . . . c30057_5j6t 1 . 2 . 508 . 1 1 15 LYS CB C 22.774 -0.179 1.057 . . . 1.0 . . . . . . . . . . . . A . 15 LYS CB . . . . . . . . . c30057_5j6t 1 . 2 . 509 . 1 1 15 LYS CD C 23.044 1.112 3.184 . . . 1.0 . . . . . . . . . . . . A . 15 LYS CD . . . . . . . . . c30057_5j6t 1 . 2 . 510 . 1 1 15 LYS CE C 23.049 2.499 2.538 . . . 1.0 . . . . . . . . . . . . A . 15 LYS CE . . . . . . . . . c30057_5j6t 1 . 2 . 511 . 1 1 15 LYS CG C 23.705 0.106 2.238 . . . 1.0 . . . . . . . . . . . . A . 15 LYS CG . . . . . . . . . c30057_5j6t 1 . 2 . 512 . 1 1 15 LYS H H 21.244 1.161 -0.350 . . . 1.0 . . . . . . . . . . . . A . 15 LYS H . . . . . . . . . c30057_5j6t 1 . 2 . 513 . 1 1 15 LYS HA H 24.077 1.234 0.059 . . . 1.0 . . . . . . . . . . . . A . 15 LYS HA . . . . . . . . . c30057_5j6t 1 . 2 . 514 . 1 1 15 LYS HB2 H 21.780 0.212 1.278 . . . 1.0 . . . . . . . . . . . . A . 15 LYS HB2 . . . . . . . . . c30057_5j6t 1 . 2 . 515 . 1 1 15 LYS HB3 H 22.712 -1.255 0.895 . . . 1.0 . . . . . . . . . . . . A . 15 LYS HB3 . . . . . . . . . c30057_5j6t 1 . 2 . 516 . 1 1 15 LYS HD2 H 22.016 0.806 3.379 . . . 1.0 . . . . . . . . . . . . A . 15 LYS HD2 . . . . . . . . . c30057_5j6t 1 . 2 . 517 . 1 1 15 LYS HD3 H 23.597 1.146 4.122 . . . 1.0 . . . . . . . . . . . . A . 15 LYS HD3 . . . . . . . . . c30057_5j6t 1 . 2 . 518 . 1 1 15 LYS HE2 H 24.031 2.726 2.125 . . . 1.0 . . . . . . . . . . . . A . 15 LYS HE2 . . . . . . . . . c30057_5j6t 1 . 2 . 519 . 1 1 15 LYS HE3 H 22.290 2.554 1.758 . . . 1.0 . . . . . . . . . . . . A . 15 LYS HE3 . . . . . . . . . c30057_5j6t 1 . 2 . 520 . 1 1 15 LYS HG2 H 23.902 -0.822 2.776 . . . 1.0 . . . . . . . . . . . . A . 15 LYS HG2 . . . . . . . . . c30057_5j6t 1 . 2 . 521 . 1 1 15 LYS HG3 H 24.644 0.518 1.869 . . . 1.0 . . . . . . . . . . . . A . 15 LYS HG3 . . . . . . . . . c30057_5j6t 1 . 2 . 522 . 1 1 15 LYS HZ1 H 22.702 4.385 3.292 . . . 1.0 . . . . . . . . . . . . A . 15 LYS HZ1 . . . . . . . . . c30057_5j6t 1 . 2 . 523 . 1 1 15 LYS HZ2 H 21.810 3.206 4.024 . . . 1.0 . . . . . . . . . . . . A . 15 LYS HZ2 . . . . . . . . . c30057_5j6t 1 . 2 . 524 . 1 1 15 LYS HZ3 H 23.415 3.362 4.372 . . . 1.0 . . . . . . . . . . . . A . 15 LYS HZ3 . . . . . . . . . c30057_5j6t 1 . 2 . 525 . 1 1 15 LYS N N 22.136 1.172 -0.824 . . . 1.0 . . . . . . . . . . . . A . 15 LYS N . . . . . . . . . c30057_5j6t 1 . 2 . 526 . 1 1 15 LYS NZ N 22.717 3.439 3.646 . . . 1.0 . . . . . . . . . . . . A . 15 LYS NZ . . . . . . . . . c30057_5j6t 1 . 2 . 527 . 1 1 15 LYS O O 25.079 -0.841 -1.133 . . . 1.0 . . . . . . . . . . . . A . 15 LYS O . . . . . . . . . c30057_5j6t 1 . 2 . 528 . 1 1 16 ASN C C 24.321 -1.430 -4.138 . . . 1.0 . . . . . . . . . . . . A . 16 ASN C . . . . . . . . . c30057_5j6t 1 . 2 . 529 . 1 1 16 ASN CA C 23.587 -2.118 -2.986 . . . 1.0 . . . . . . . . . . . . A . 16 ASN CA . . . . . . . . . c30057_5j6t 1 . 2 . 530 . 1 1 16 ASN CB C 22.336 -2.830 -3.497 . . . 1.0 . . . . . . . . . . . . A . 16 ASN CB . . . . . . . . . c30057_5j6t 1 . 2 . 531 . 1 1 16 ASN CG C 21.809 -3.779 -2.418 . . . 1.0 . . . . . . . . . . . . A . 16 ASN CG . . . . . . . . . c30057_5j6t 1 . 2 . 532 . 1 1 16 ASN H H 22.108 -0.835 -2.028 . . . 1.0 . . . . . . . . . . . . A . 16 ASN H . . . . . . . . . c30057_5j6t 1 . 2 . 533 . 1 1 16 ASN HA H 24.247 -2.824 -2.482 . . . 1.0 . . . . . . . . . . . . A . 16 ASN HA . . . . . . . . . c30057_5j6t 1 . 2 . 534 . 1 1 16 ASN HB2 H 21.570 -2.092 -3.736 . . . 1.0 . . . . . . . . . . . . A . 16 ASN HB2 . . . . . . . . . c30057_5j6t 1 . 2 . 535 . 1 1 16 ASN HB3 H 22.583 -3.400 -4.393 . . . 1.0 . . . . . . . . . . . . A . 16 ASN HB3 . . . . . . . . . c30057_5j6t 1 . 2 . 536 . 1 1 16 ASN HD21 H 19.922 -3.724 -3.111 . . . 1.0 . . . . . . . . . . . . A . 16 ASN HD21 . . . . . . . . . c30057_5j6t 1 . 2 . 537 . 1 1 16 ASN HD22 H 20.187 -4.727 -1.702 . . . 1.0 . . . . . . . . . . . . A . 16 ASN HD22 . . . . . . . . . c30057_5j6t 1 . 2 . 538 . 1 1 16 ASN N N 23.083 -1.098 -2.020 . . . 1.0 . . . . . . . . . . . . A . 16 ASN N . . . . . . . . . c30057_5j6t 1 . 2 . 539 . 1 1 16 ASN ND2 N 20.544 -4.101 -2.410 . . . 1.0 . . . . . . . . . . . . A . 16 ASN ND2 . . . . . . . . . c30057_5j6t 1 . 2 . 540 . 1 1 16 ASN O O 25.225 -1.984 -4.732 . . . 1.0 . . . . . . . . . . . . A . 16 ASN O . . . . . . . . . c30057_5j6t 1 . 2 . 541 . 1 1 16 ASN OD1 O 22.556 -4.233 -1.575 . . . 1.0 . . . . . . . . . . . . A . 16 ASN OD1 . . . . . . . . . c30057_5j6t 1 . 2 . 542 . 1 1 17 LEU C C 25.962 1.046 -5.109 . . . 1.0 . . . . . . . . . . . . A . 17 LEU C . . . . . . . . . c30057_5j6t 1 . 2 . 543 . 1 1 17 LEU CA C 24.607 0.508 -5.571 . . . 1.0 . . . . . . . . . . . . A . 17 LEU CA . . . . . . . . . c30057_5j6t 1 . 2 . 544 . 1 1 17 LEU CB C 23.660 1.659 -5.915 . . . 1.0 . . . . . . . . . . . . A . 17 LEU CB . . . . . . . . . c30057_5j6t 1 . 2 . 545 . 1 1 17 LEU CD1 C 23.050 2.727 -8.092 . . . 1.0 . . . . . . . . . . . . A . 17 LEU CD1 . . . . . . . . . c30057_5j6t 1 . 2 . 546 . 1 1 17 LEU CD2 C 24.827 3.739 -6.659 . . . 1.0 . . . . . . . . . . . . A . 17 LEU CD2 . . . . . . . . . c30057_5j6t 1 . 2 . 547 . 1 1 17 LEU CG C 24.197 2.425 -7.126 . . . 1.0 . . . . . . . . . . . . A . 17 LEU CG . . . . . . . . . c30057_5j6t 1 . 2 . 548 . 1 1 17 LEU H H 23.179 0.215 -3.952 . . . 1.0 . . . . . . . . . . . . A . 17 LEU H . . . . . . . . . c30057_5j6t 1 . 2 . 549 . 1 1 17 LEU HA H 24.733 -0.148 -6.433 . . . 1.0 . . . . . . . . . . . . A . 17 LEU HA . . . . . . . . . c30057_5j6t 1 . 2 . 550 . 1 1 17 LEU HB2 H 22.673 1.259 -6.148 . . . 1.0 . . . . . . . . . . . . A . 17 LEU HB2 . . . . . . . . . c30057_5j6t 1 . 2 . 551 . 1 1 17 LEU HB3 H 23.586 2.334 -5.062 . . . 1.0 . . . . . . . . . . . . A . 17 LEU HB3 . . . . . . . . . c30057_5j6t 1 . 2 . 552 . 1 1 17 LEU HD11 H 22.599 1.792 -8.426 . . . 1.0 . . . . . . . . . . . . A . 17 LEU HD11 . . . . . . . . . c30057_5j6t 1 . 2 . 553 . 1 1 17 LEU HD12 H 22.298 3.331 -7.584 . . . 1.0 . . . . . . . . . . . . A . 17 LEU HD12 . . . . . . . . . c30057_5j6t 1 . 2 . 554 . 1 1 17 LEU HD13 H 23.434 3.273 -8.953 . . . 1.0 . . . . . . . . . . . . A . 17 LEU HD13 . . . . . . . . . c30057_5j6t 1 . 2 . 555 . 1 1 17 LEU HD21 H 25.645 3.527 -5.971 . . . 1.0 . . . . . . . . . . . . A . 17 LEU HD21 . . . . . . . . . c30057_5j6t 1 . 2 . 556 . 1 1 17 LEU HD22 H 25.211 4.284 -7.522 . . . 1.0 . . . . . . . . . . . . A . 17 LEU HD22 . . . . . . . . . c30057_5j6t 1 . 2 . 557 . 1 1 17 LEU HD23 H 24.074 4.343 -6.153 . . . 1.0 . . . . . . . . . . . . A . 17 LEU HD23 . . . . . . . . . c30057_5j6t 1 . 2 . 558 . 1 1 17 LEU HG H 24.950 1.821 -7.633 . . . 1.0 . . . . . . . . . . . . A . 17 LEU HG . . . . . . . . . c30057_5j6t 1 . 2 . 559 . 1 1 17 LEU N N 23.935 -0.223 -4.459 . . . 1.0 . . . . . . . . . . . . A . 17 LEU N . . . . . . . . . c30057_5j6t 1 . 2 . 560 . 1 1 17 LEU O O 26.874 1.220 -5.895 . . . 1.0 . . . . . . . . . . . . A . 17 LEU O . . . . . . . . . c30057_5j6t 1 . 2 . 561 . 1 1 18 ILE C C 28.305 0.678 -2.876 . . . 1.0 . . . . . . . . . . . . A . 18 ILE C . . . . . . . . . c30057_5j6t 1 . 2 . 562 . 1 1 18 ILE CA C 27.400 1.833 -3.321 . . . 1.0 . . . . . . . . . . . . A . 18 ILE CA . . . . . . . . . c30057_5j6t 1 . 2 . 563 . 1 1 18 ILE CB C 27.028 2.718 -2.128 . . . 1.0 . . . . . . . . . . . . A . 18 ILE CB . . . . . . . . . c30057_5j6t 1 . 2 . 564 . 1 1 18 ILE CD1 C 26.371 2.558 0.280 . . . 1.0 . . . . . . . . . . . . A . 18 ILE CD1 . . . . . . . . . c30057_5j6t 1 . 2 . 565 . 1 1 18 ILE CG1 C 26.244 1.900 -1.095 . . . 1.0 . . . . . . . . . . . . A . 18 ILE CG1 . . . . . . . . . c30057_5j6t 1 . 2 . 566 . 1 1 18 ILE CG2 C 26.167 3.887 -2.608 . . . 1.0 . . . . . . . . . . . . A . 18 ILE CG2 . . . . . . . . . c30057_5j6t 1 . 2 . 567 . 1 1 18 ILE H H 25.333 1.157 -3.203 . . . 1.0 . . . . . . . . . . . . A . 18 ILE H . . . . . . . . . c30057_5j6t 1 . 2 . 568 . 1 1 18 ILE HA H 27.898 2.426 -4.088 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HA . . . . . . . . . c30057_5j6t 1 . 2 . 569 . 1 1 18 ILE HB H 27.938 3.104 -1.668 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HB . . . . . . . . . c30057_5j6t 1 . 2 . 570 . 1 1 18 ILE HD11 H 25.814 1.977 1.014 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HD11 . . . . . . . . . c30057_5j6t 1 . 2 . 571 . 1 1 18 ILE HD12 H 25.969 3.570 0.236 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HD12 . . . . . . . . . c30057_5j6t 1 . 2 . 572 . 1 1 18 ILE HD13 H 27.422 2.597 0.568 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HD13 . . . . . . . . . c30057_5j6t 1 . 2 . 573 . 1 1 18 ILE HG12 H 25.194 1.862 -1.384 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HG12 . . . . . . . . . c30057_5j6t 1 . 2 . 574 . 1 1 18 ILE HG13 H 26.646 0.888 -1.052 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HG13 . . . . . . . . . c30057_5j6t 1 . 2 . 575 . 1 1 18 ILE HG21 H 26.722 4.471 -3.343 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HG21 . . . . . . . . . c30057_5j6t 1 . 2 . 576 . 1 1 18 ILE HG22 H 25.911 4.522 -1.760 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HG22 . . . . . . . . . c30057_5j6t 1 . 2 . 577 . 1 1 18 ILE HG23 H 25.254 3.503 -3.064 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HG23 . . . . . . . . . c30057_5j6t 1 . 2 . 578 . 1 1 18 ILE N N 26.104 1.309 -3.838 . . . 1.0 . . . . . . . . . . . . A . 18 ILE N . . . . . . . . . c30057_5j6t 1 . 2 . 579 . 1 1 18 ILE O O 29.509 0.818 -2.797 . . . 1.0 . . . . . . . . . . . . A . 18 ILE O . . . . . . . . . c30057_5j6t 1 . 2 . 580 . 1 1 19 LYS C C 28.568 -2.706 -3.224 . . . 1.0 . . . . . . . . . . . . A . 19 LYS C . . . . . . . . . c30057_5j6t 1 . 2 . 581 . 1 1 19 LYS CA C 28.560 -1.621 -2.144 . . . 1.0 . . . . . . . . . . . . A . 19 LYS CA . . . . . . . . . c30057_5j6t 1 . 2 . 582 . 1 1 19 LYS CB C 27.878 -2.133 -0.874 . . . 1.0 . . . . . . . . . . . . A . 19 LYS CB . . . . . . . . . c30057_5j6t 1 . 2 . 583 . 1 1 19 LYS CD C 29.523 -3.896 -0.217 . . . 1.0 . . . . . . . . . . . . A . 19 LYS CD . . . . . . . . . c30057_5j6t 1 . 2 . 584 . 1 1 19 LYS CE C 30.951 -4.006 0.322 . . . 1.0 . . . . . . . . . . . . A . 19 LYS CE . . . . . . . . . c30057_5j6t 1 . 2 . 585 . 1 1 19 LYS CG C 28.940 -2.530 0.153 . . . 1.0 . . . . . . . . . . . . A . 19 LYS CG . . . . . . . . . c30057_5j6t 1 . 2 . 586 . 1 1 19 LYS H H 26.729 -0.554 -2.656 . . . 1.0 . . . . . . . . . . . . A . 19 LYS H . . . . . . . . . c30057_5j6t 1 . 2 . 587 . 1 1 19 LYS HA H 29.578 -1.299 -1.924 . . . 1.0 . . . . . . . . . . . . A . 19 LYS HA . . . . . . . . . c30057_5j6t 1 . 2 . 588 . 1 1 19 LYS HB2 H 27.247 -1.347 -0.459 . . . 1.0 . . . . . . . . . . . . A . 19 LYS HB2 . . . . . . . . . c30057_5j6t 1 . 2 . 589 . 1 1 19 LYS HB3 H 27.265 -3.001 -1.116 . . . 1.0 . . . . . . . . . . . . A . 19 LYS HB3 . . . . . . . . . c30057_5j6t 1 . 2 . 590 . 1 1 19 LYS HD2 H 28.909 -4.683 0.220 . . . 1.0 . . . . . . . . . . . . A . 19 LYS HD2 . . . . . . . . . c30057_5j6t 1 . 2 . 591 . 1 1 19 LYS HD3 H 29.535 -4.004 -1.302 . . . 1.0 . . . . . . . . . . . . A . 19 LYS HD3 . . . . . . . . . c30057_5j6t 1 . 2 . 592 . 1 1 19 LYS HE2 H 31.098 -3.323 1.159 . . . 1.0 . . . . . . . . . . . . A . 19 LYS HE2 . . . . . . . . . c30057_5j6t 1 . 2 . 593 . 1 1 19 LYS HE3 H 31.158 -5.030 0.632 . . . 1.0 . . . . . . . . . . . . A . 19 LYS HE3 . . . . . . . . . c30057_5j6t 1 . 2 . 594 . 1 1 19 LYS HG2 H 29.736 -1.785 0.160 . . . 1.0 . . . . . . . . . . . . A . 19 LYS HG2 . . . . . . . . . c30057_5j6t 1 . 2 . 595 . 1 1 19 LYS HG3 H 28.486 -2.585 1.143 . . . 1.0 . . . . . . . . . . . . A . 19 LYS HG3 . . . . . . . . . c30057_5j6t 1 . 2 . 596 . 1 1 19 LYS HZ1 H 32.792 -3.678 -0.539 . . . 1.0 . . . . . . . . . . . . A . 19 LYS HZ1 . . . . . . . . . c30057_5j6t 1 . 2 . 597 . 1 1 19 LYS HZ2 H 31.606 -2.686 -1.114 . . . 1.0 . . . . . . . . . . . . A . 19 LYS HZ2 . . . . . . . . . c30057_5j6t 1 . 2 . 598 . 1 1 19 LYS HZ3 H 31.665 -4.264 -1.591 . . . 1.0 . . . . . . . . . . . . A . 19 LYS HZ3 . . . . . . . . . c30057_5j6t 1 . 2 . 599 . 1 1 19 LYS N N 27.732 -0.460 -2.584 . . . 1.0 . . . . . . . . . . . . A . 19 LYS N . . . . . . . . . c30057_5j6t 1 . 2 . 600 . 1 1 19 LYS NZ N 31.824 -3.628 -0.822 . . . 1.0 . . . . . . . . . . . . A . 19 LYS NZ . . . . . . . . . c30057_5j6t 1 . 2 . 601 . 1 1 19 LYS O O 27.659 -3.507 -3.309 . . . 1.0 . . . . . . . . . . . . A . 19 LYS O . . . . . . . . . c30057_5j6t 1 . 2 . 602 . 1 1 20 NH2 HN1 H 30.324 -2.101 -3.992 . . . 1.0 . . . . . . . . . . . . A . 20 NH2 HN1 . . . . . . . . . c30057_5j6t 1 . 2 . 603 . 1 1 20 NH2 HN2 H 29.584 -3.477 -4.778 . . . 1.0 . . . . . . . . . . . . A . 20 NH2 HN2 . . . . . . . . . c30057_5j6t 1 . 2 . 604 . 1 1 20 NH2 N N 29.567 -2.766 -4.061 . . . 1.0 . . . . . . . . . . . . A . 20 NH2 N . . . . . . . . . c30057_5j6t 1 . 3 . 605 . 1 1 1 ACE C C 0.450 -1.950 3.937 . . . 1.0 . . . . . . . . . . . . A . 1 ACE C . . . . . . . . . c30057_5j6t 1 . 3 . 606 . 1 1 1 ACE CH3 C -0.982 -1.415 3.937 . . . 1.0 . . . . . . . . . . . . A . 1 ACE CH3 . . . . . . . . . c30057_5j6t 1 . 3 . 607 . 1 1 1 ACE H1 H -1.349 -1.358 4.962 . . . 1.0 . . . . . . . . . . . . A . 1 ACE H1 . . . . . . . . . c30057_5j6t 1 . 3 . 608 . 1 1 1 ACE H2 H -0.999 -0.422 3.490 . . . 1.0 . . . . . . . . . . . . A . 1 ACE H2 . . . . . . . . . c30057_5j6t 1 . 3 . 609 . 1 1 1 ACE H3 H -1.620 -2.085 3.360 . . . 1.0 . . . . . . . . . . . . A . 1 ACE H3 . . . . . . . . . c30057_5j6t 1 . 3 . 610 . 1 1 1 ACE O O 1.013 -2.242 4.974 . . . 1.0 . . . . . . . . . . . . A . 1 ACE O . . . . . . . . . c30057_5j6t 1 . 3 . 611 . 1 1 2 ILE C C 3.411 -1.457 2.383 . . . 1.0 . . . . . . . . . . . . A . 2 ILE C . . . . . . . . . c30057_5j6t 1 . 3 . 612 . 1 1 2 ILE CA C 2.442 -2.598 2.710 . . . 1.0 . . . . . . . . . . . . A . 2 ILE CA . . . . . . . . . c30057_5j6t 1 . 3 . 613 . 1 1 2 ILE CB C 2.428 -3.632 1.582 . . . 1.0 . . . . . . . . . . . . A . 2 ILE CB . . . . . . . . . c30057_5j6t 1 . 3 . 614 . 1 1 2 ILE CD1 C 1.242 -5.642 0.685 . . . 1.0 . . . . . . . . . . . . A . 2 ILE CD1 . . . . . . . . . c30057_5j6t 1 . 3 . 615 . 1 1 2 ILE CG1 C 1.385 -4.709 1.890 . . . 1.0 . . . . . . . . . . . . A . 2 ILE CG1 . . . . . . . . . c30057_5j6t 1 . 3 . 616 . 1 1 2 ILE CG2 C 3.809 -4.283 1.467 . . . 1.0 . . . . . . . . . . . . A . 2 ILE CG2 . . . . . . . . . c30057_5j6t 1 . 3 . 617 . 1 1 2 ILE H H 0.554 -1.833 1.933 . . . 1.0 . . . . . . . . . . . . A . 2 ILE H . . . . . . . . . c30057_5j6t 1 . 3 . 618 . 1 1 2 ILE HA H 2.719 -3.070 3.653 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HA . . . . . . . . . c30057_5j6t 1 . 3 . 619 . 1 1 2 ILE HB H 2.178 -3.142 0.642 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HB . . . . . . . . . c30057_5j6t 1 . 3 . 620 . 1 1 2 ILE HD11 H 0.499 -6.408 0.905 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HD11 . . . . . . . . . c30057_5j6t 1 . 3 . 621 . 1 1 2 ILE HD12 H 2.201 -6.115 0.476 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HD12 . . . . . . . . . c30057_5j6t 1 . 3 . 622 . 1 1 2 ILE HD13 H 0.924 -5.066 -0.184 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HD13 . . . . . . . . . c30057_5j6t 1 . 3 . 623 . 1 1 2 ILE HG12 H 1.704 -5.285 2.759 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HG12 . . . . . . . . . c30057_5j6t 1 . 3 . 624 . 1 1 2 ILE HG13 H 0.426 -4.237 2.100 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HG13 . . . . . . . . . c30057_5j6t 1 . 3 . 625 . 1 1 2 ILE HG21 H 3.693 -5.356 1.310 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HG21 . . . . . . . . . c30057_5j6t 1 . 3 . 626 . 1 1 2 ILE HG22 H 4.346 -3.849 0.623 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HG22 . . . . . . . . . c30057_5j6t 1 . 3 . 627 . 1 1 2 ILE HG23 H 4.371 -4.108 2.384 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HG23 . . . . . . . . . c30057_5j6t 1 . 3 . 628 . 1 1 2 ILE N N 1.043 -2.082 2.781 . . . 1.0 . . . . . . . . . . . . A . 2 ILE N . . . . . . . . . c30057_5j6t 1 . 3 . 629 . 1 1 2 ILE O O 4.478 -1.671 1.842 . . . 1.0 . . . . . . . . . . . . A . 2 ILE O . . . . . . . . . c30057_5j6t 1 . 3 . 630 . 1 1 3 PHE C C 5.210 0.820 3.278 . . . 1.0 . . . . . . . . . . . . A . 3 PHE C . . . . . . . . . c30057_5j6t 1 . 3 . 631 . 1 1 3 PHE CA C 3.947 0.908 2.419 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CA . . . . . . . . . c30057_5j6t 1 . 3 . 632 . 1 1 3 PHE CB C 3.137 2.151 2.787 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CB . . . . . . . . . c30057_5j6t 1 . 3 . 633 . 1 1 3 PHE CD1 C 4.292 4.298 3.427 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CD1 . . . . . . . . . c30057_5j6t 1 . 3 . 634 . 1 1 3 PHE CD2 C 4.292 3.622 1.098 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CD2 . . . . . . . . . c30057_5j6t 1 . 3 . 635 . 1 1 3 PHE CE1 C 5.025 5.444 3.094 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CE1 . . . . . . . . . c30057_5j6t 1 . 3 . 636 . 1 1 3 PHE CE2 C 5.024 4.767 0.765 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CE2 . . . . . . . . . c30057_5j6t 1 . 3 . 637 . 1 1 3 PHE CG C 3.926 3.387 2.428 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CG . . . . . . . . . c30057_5j6t 1 . 3 . 638 . 1 1 3 PHE CZ C 5.391 5.678 1.763 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CZ . . . . . . . . . c30057_5j6t 1 . 3 . 639 . 1 1 3 PHE H H 2.155 -0.089 3.158 . . . 1.0 . . . . . . . . . . . . A . 3 PHE H . . . . . . . . . c30057_5j6t 1 . 3 . 640 . 1 1 3 PHE HA H 4.209 0.927 1.361 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HA . . . . . . . . . c30057_5j6t 1 . 3 . 641 . 1 1 3 PHE HB2 H 2.196 2.148 2.236 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HB2 . . . . . . . . . c30057_5j6t 1 . 3 . 642 . 1 1 3 PHE HB3 H 2.932 2.148 3.858 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HB3 . . . . . . . . . c30057_5j6t 1 . 3 . 643 . 1 1 3 PHE HD1 H 4.010 4.116 4.453 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HD1 . . . . . . . . . c30057_5j6t 1 . 3 . 644 . 1 1 3 PHE HD2 H 4.008 2.920 0.329 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HD2 . . . . . . . . . c30057_5j6t 1 . 3 . 645 . 1 1 3 PHE HE1 H 5.307 6.146 3.864 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HE1 . . . . . . . . . c30057_5j6t 1 . 3 . 646 . 1 1 3 PHE HE2 H 5.306 4.948 -0.262 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HE2 . . . . . . . . . c30057_5j6t 1 . 3 . 647 . 1 1 3 PHE HZ H 5.957 6.561 1.506 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HZ . . . . . . . . . c30057_5j6t 1 . 3 . 648 . 1 1 3 PHE N N 3.047 -0.245 2.709 . . . 1.0 . . . . . . . . . . . . A . 3 PHE N . . . . . . . . . c30057_5j6t 1 . 3 . 649 . 1 1 3 PHE O O 6.296 1.140 2.835 . . . 1.0 . . . . . . . . . . . . A . 3 PHE O . . . . . . . . . c30057_5j6t 1 . 3 . 650 . 1 1 4 GLY C C 7.261 -0.731 4.800 . . . 1.0 . . . . . . . . . . . . A . 4 GLY C . . . . . . . . . c30057_5j6t 1 . 3 . 651 . 1 1 4 GLY CA C 6.265 0.271 5.392 . . . 1.0 . . . . . . . . . . . . A . 4 GLY CA . . . . . . . . . c30057_5j6t 1 . 3 . 652 . 1 1 4 GLY H H 4.161 0.127 4.846 . . . 1.0 . . . . . . . . . . . . A . 4 GLY H . . . . . . . . . c30057_5j6t 1 . 3 . 653 . 1 1 4 GLY HA2 H 6.744 1.246 5.484 . . . 1.0 . . . . . . . . . . . . A . 4 GLY HA2 . . . . . . . . . c30057_5j6t 1 . 3 . 654 . 1 1 4 GLY HA3 H 5.949 -0.071 6.378 . . . 1.0 . . . . . . . . . . . . A . 4 GLY HA3 . . . . . . . . . c30057_5j6t 1 . 3 . 655 . 1 1 4 GLY N N 5.075 0.386 4.501 . . . 1.0 . . . . . . . . . . . . A . 4 GLY N . . . . . . . . . c30057_5j6t 1 . 3 . 656 . 1 1 4 GLY O O 8.421 -0.750 5.160 . . . 1.0 . . . . . . . . . . . . A . 4 GLY O . . . . . . . . . c30057_5j6t 1 . 3 . 657 . 1 1 5 ALA C C 8.375 -1.997 2.006 . . . 1.0 . . . . . . . . . . . . A . 5 ALA C . . . . . . . . . c30057_5j6t 1 . 3 . 658 . 1 1 5 ALA CA C 7.741 -2.565 3.281 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CA . . . . . . . . . c30057_5j6t 1 . 3 . 659 . 1 1 5 ALA CB C 6.857 -3.767 2.951 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CB . . . . . . . . . c30057_5j6t 1 . 3 . 660 . 1 1 5 ALA H H 5.849 -1.531 3.609 . . . 1.0 . . . . . . . . . . . . A . 5 ALA H . . . . . . . . . c30057_5j6t 1 . 3 . 661 . 1 1 5 ALA HA H 8.516 -2.850 3.993 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HA . . . . . . . . . c30057_5j6t 1 . 3 . 662 . 1 1 5 ALA HB1 H 7.347 -4.682 3.285 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB1 . . . . . . . . . c30057_5j6t 1 . 3 . 663 . 1 1 5 ALA HB2 H 6.695 -3.814 1.874 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB2 . . . . . . . . . c30057_5j6t 1 . 3 . 664 . 1 1 5 ALA HB3 H 5.898 -3.663 3.458 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB3 . . . . . . . . . c30057_5j6t 1 . 3 . 665 . 1 1 5 ALA N N 6.817 -1.565 3.894 . . . 1.0 . . . . . . . . . . . . A . 5 ALA N . . . . . . . . . c30057_5j6t 1 . 3 . 666 . 1 1 5 ALA O O 9.400 -2.465 1.551 . . . 1.0 . . . . . . . . . . . . A . 5 ALA O . . . . . . . . . c30057_5j6t 1 . 3 . 667 . 1 1 6 ILE C C 9.422 0.627 0.521 . . . 1.0 . . . . . . . . . . . . A . 6 ILE C . . . . . . . . . c30057_5j6t 1 . 3 . 668 . 1 1 6 ILE CA C 8.340 -0.399 0.179 . . . 1.0 . . . . . . . . . . . . A . 6 ILE CA . . . . . . . . . c30057_5j6t 1 . 3 . 669 . 1 1 6 ILE CB C 7.156 0.278 -0.515 . . . 1.0 . . . . . . . . . . . . A . 6 ILE CB . . . . . . . . . c30057_5j6t 1 . 3 . 670 . 1 1 6 ILE CD1 C 4.784 -0.043 -1.245 . . . 1.0 . . . . . . . . . . . . A . 6 ILE CD1 . . . . . . . . . c30057_5j6t 1 . 3 . 671 . 1 1 6 ILE CG1 C 6.058 -0.755 -0.782 . . . 1.0 . . . . . . . . . . . . A . 6 ILE CG1 . . . . . . . . . c30057_5j6t 1 . 3 . 672 . 1 1 6 ILE CG2 C 7.618 0.879 -1.845 . . . 1.0 . . . . . . . . . . . . A . 6 ILE CG2 . . . . . . . . . c30057_5j6t 1 . 3 . 673 . 1 1 6 ILE H H 6.920 -0.619 1.819 . . . 1.0 . . . . . . . . . . . . A . 6 ILE H . . . . . . . . . c30057_5j6t 1 . 3 . 674 . 1 1 6 ILE HA H 8.752 -1.182 -0.457 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HA . . . . . . . . . c30057_5j6t 1 . 3 . 675 . 1 1 6 ILE HB H 6.764 1.069 0.124 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HB . . . . . . . . . c30057_5j6t 1 . 3 . 676 . 1 1 6 ILE HD11 H 4.003 -0.780 -1.434 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HD11 . . . . . . . . . c30057_5j6t 1 . 3 . 677 . 1 1 6 ILE HD12 H 4.451 0.647 -0.470 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HD12 . . . . . . . . . c30057_5j6t 1 . 3 . 678 . 1 1 6 ILE HD13 H 4.990 0.511 -2.161 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HD13 . . . . . . . . . c30057_5j6t 1 . 3 . 679 . 1 1 6 ILE HG12 H 6.390 -1.445 -1.557 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HG12 . . . . . . . . . c30057_5j6t 1 . 3 . 680 . 1 1 6 ILE HG13 H 5.851 -1.310 0.134 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HG13 . . . . . . . . . c30057_5j6t 1 . 3 . 681 . 1 1 6 ILE HG21 H 8.400 1.615 -1.660 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HG21 . . . . . . . . . c30057_5j6t 1 . 3 . 682 . 1 1 6 ILE HG22 H 6.774 1.362 -2.338 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HG22 . . . . . . . . . c30057_5j6t 1 . 3 . 683 . 1 1 6 ILE HG23 H 8.008 0.087 -2.486 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HG23 . . . . . . . . . c30057_5j6t 1 . 3 . 684 . 1 1 6 ILE N N 7.772 -0.993 1.425 . . . 1.0 . . . . . . . . . . . . A . 6 ILE N . . . . . . . . . c30057_5j6t 1 . 3 . 685 . 1 1 6 ILE O O 10.338 0.854 -0.245 . . . 1.0 . . . . . . . . . . . . A . 6 ILE O . . . . . . . . . c30057_5j6t 1 . 3 . 686 . 1 1 7 TRP C C 11.706 1.571 2.296 . . . 1.0 . . . . . . . . . . . . A . 7 TRP C . . . . . . . . . c30057_5j6t 1 . 3 . 687 . 1 1 7 TRP CA C 10.356 2.259 2.051 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CA . . . . . . . . . c30057_5j6t 1 . 3 . 688 . 1 1 7 TRP CB C 9.830 2.912 3.333 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CB . . . . . . . . . c30057_5j6t 1 . 3 . 689 . 1 1 7 TRP CD1 C 8.577 5.106 3.223 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CD1 . . . . . . . . . c30057_5j6t 1 . 3 . 690 . 1 1 7 TRP CD2 C 10.773 5.339 2.792 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CD2 . . . . . . . . . c30057_5j6t 1 . 3 . 691 . 1 1 7 TRP CE2 C 10.202 6.629 2.698 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CE2 . . . . . . . . . c30057_5j6t 1 . 3 . 692 . 1 1 7 TRP CE3 C 12.154 5.206 2.562 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CE3 . . . . . . . . . c30057_5j6t 1 . 3 . 693 . 1 1 7 TRP CG C 9.721 4.389 3.128 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CG . . . . . . . . . c30057_5j6t 1 . 3 . 694 . 1 1 7 TRP CH2 C 12.345 7.600 2.163 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CH2 . . . . . . . . . c30057_5j6t 1 . 3 . 695 . 1 1 7 TRP CZ2 C 10.974 7.750 2.387 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CZ2 . . . . . . . . . c30057_5j6t 1 . 3 . 696 . 1 1 7 TRP CZ3 C 12.934 6.331 2.249 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CZ3 . . . . . . . . . c30057_5j6t 1 . 3 . 697 . 1 1 7 TRP H H 8.558 1.046 2.290 . . . 1.0 . . . . . . . . . . . . A . 7 TRP H . . . . . . . . . c30057_5j6t 1 . 3 . 698 . 1 1 7 TRP HA H 10.456 3.008 1.265 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HA . . . . . . . . . c30057_5j6t 1 . 3 . 699 . 1 1 7 TRP HB2 H 8.847 2.504 3.572 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HB2 . . . . . . . . . c30057_5j6t 1 . 3 . 700 . 1 1 7 TRP HB3 H 10.518 2.708 4.153 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HB3 . . . . . . . . . c30057_5j6t 1 . 3 . 701 . 1 1 7 TRP HD1 H 7.602 4.706 3.459 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HD1 . . . . . . . . . c30057_5j6t 1 . 3 . 702 . 1 1 7 TRP HE1 H 8.173 7.175 2.982 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HE1 . . . . . . . . . c30057_5j6t 1 . 3 . 703 . 1 1 7 TRP HE3 H 12.618 4.233 2.628 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HE3 . . . . . . . . . c30057_5j6t 1 . 3 . 704 . 1 1 7 TRP HH2 H 12.950 8.462 1.923 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HH2 . . . . . . . . . c30057_5j6t 1 . 3 . 705 . 1 1 7 TRP HZ2 H 10.515 8.725 2.320 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HZ2 . . . . . . . . . c30057_5j6t 1 . 3 . 706 . 1 1 7 TRP HZ3 H 13.994 6.218 2.072 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HZ3 . . . . . . . . . c30057_5j6t 1 . 3 . 707 . 1 1 7 TRP N N 9.327 1.249 1.667 . . . 1.0 . . . . . . . . . . . . A . 7 TRP N . . . . . . . . . c30057_5j6t 1 . 3 . 708 . 1 1 7 TRP NE1 N 8.862 6.436 2.970 . . . 1.0 . . . . . . . . . . . . A . 7 TRP NE1 . . . . . . . . . c30057_5j6t 1 . 3 . 709 . 1 1 7 TRP O O 12.705 1.966 1.731 . . . 1.0 . . . . . . . . . . . . A . 7 TRP O . . . . . . . . . c30057_5j6t 1 . 3 . 710 . 1 1 8 PRO C C 13.595 -0.671 2.116 . . . 1.0 . . . . . . . . . . . . A . 8 PRO C . . . . . . . . . c30057_5j6t 1 . 3 . 711 . 1 1 8 PRO CA C 12.952 -0.184 3.419 . . . 1.0 . . . . . . . . . . . . A . 8 PRO CA . . . . . . . . . c30057_5j6t 1 . 3 . 712 . 1 1 8 PRO CB C 12.500 -1.367 4.273 . . . 1.0 . . . . . . . . . . . . A . 8 PRO CB . . . . . . . . . c30057_5j6t 1 . 3 . 713 . 1 1 8 PRO CD C 10.552 0.007 3.856 . . . 1.0 . . . . . . . . . . . . A . 8 PRO CD . . . . . . . . . c30057_5j6t 1 . 3 . 714 . 1 1 8 PRO CG C 11.157 -0.989 4.810 . . . 1.0 . . . . . . . . . . . . A . 8 PRO CG . . . . . . . . . c30057_5j6t 1 . 3 . 715 . 1 1 8 PRO HA H 13.645 0.447 3.975 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HA . . . . . . . . . c30057_5j6t 1 . 3 . 716 . 1 1 8 PRO HB2 H 12.426 -2.269 3.665 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HB2 . . . . . . . . . c30057_5j6t 1 . 3 . 717 . 1 1 8 PRO HB3 H 13.200 -1.526 5.093 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HB3 . . . . . . . . . c30057_5j6t 1 . 3 . 718 . 1 1 8 PRO HD2 H 9.859 -0.484 3.174 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HD2 . . . . . . . . . c30057_5j6t 1 . 3 . 719 . 1 1 8 PRO HD3 H 10.042 0.797 4.408 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HD3 . . . . . . . . . c30057_5j6t 1 . 3 . 720 . 1 1 8 PRO HG2 H 10.522 -1.872 4.878 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HG2 . . . . . . . . . c30057_5j6t 1 . 3 . 721 . 1 1 8 PRO HG3 H 11.268 -0.537 5.795 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HG3 . . . . . . . . . c30057_5j6t 1 . 3 . 722 . 1 1 8 PRO N N 11.697 0.555 3.126 . . . 1.0 . . . . . . . . . . . . A . 8 PRO N . . . . . . . . . c30057_5j6t 1 . 3 . 723 . 1 1 8 PRO O O 14.794 -0.851 2.035 . . . 1.0 . . . . . . . . . . . . A . 8 PRO O . . . . . . . . . c30057_5j6t 1 . 3 . 724 . 1 1 9 LEU C C 14.022 -0.185 -0.946 . . . 1.0 . . . . . . . . . . . . A . 9 LEU C . . . . . . . . . c30057_5j6t 1 . 3 . 725 . 1 1 9 LEU CA C 13.369 -1.353 -0.203 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CA . . . . . . . . . c30057_5j6t 1 . 3 . 726 . 1 1 9 LEU CB C 12.168 -1.884 -0.987 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CB . . . . . . . . . c30057_5j6t 1 . 3 . 727 . 1 1 9 LEU CD1 C 11.415 -3.702 -2.527 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CD1 . . . . . . . . . c30057_5j6t 1 . 3 . 728 . 1 1 9 LEU CD2 C 13.405 -2.313 -3.113 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CD2 . . . . . . . . . c30057_5j6t 1 . 3 . 729 . 1 1 9 LEU CG C 12.632 -2.964 -1.965 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CG . . . . . . . . . c30057_5j6t 1 . 3 . 730 . 1 1 9 LEU H H 11.810 -0.723 1.188 . . . 1.0 . . . . . . . . . . . . A . 9 LEU H . . . . . . . . . c30057_5j6t 1 . 3 . 731 . 1 1 9 LEU HA H 14.094 -2.148 -0.034 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HA . . . . . . . . . c30057_5j6t 1 . 3 . 732 . 1 1 9 LEU HB2 H 11.441 -2.310 -0.294 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HB2 . . . . . . . . . c30057_5j6t 1 . 3 . 733 . 1 1 9 LEU HB3 H 11.705 -1.067 -1.541 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HB3 . . . . . . . . . c30057_5j6t 1 . 3 . 734 . 1 1 9 LEU HD11 H 10.862 -4.167 -1.710 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD11 . . . . . . . . . c30057_5j6t 1 . 3 . 735 . 1 1 9 LEU HD12 H 11.747 -4.471 -3.224 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD12 . . . . . . . . . c30057_5j6t 1 . 3 . 736 . 1 1 9 LEU HD13 H 10.769 -2.994 -3.046 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD13 . . . . . . . . . c30057_5j6t 1 . 3 . 737 . 1 1 9 LEU HD21 H 13.126 -2.787 -4.054 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD21 . . . . . . . . . c30057_5j6t 1 . 3 . 738 . 1 1 9 LEU HD22 H 13.165 -1.251 -3.157 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD22 . . . . . . . . . c30057_5j6t 1 . 3 . 739 . 1 1 9 LEU HD23 H 14.475 -2.437 -2.947 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD23 . . . . . . . . . c30057_5j6t 1 . 3 . 740 . 1 1 9 LEU HG H 13.279 -3.671 -1.446 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HG . . . . . . . . . c30057_5j6t 1 . 3 . 741 . 1 1 9 LEU N N 12.804 -0.880 1.097 . . . 1.0 . . . . . . . . . . . . A . 9 LEU N . . . . . . . . . c30057_5j6t 1 . 3 . 742 . 1 1 9 LEU O O 14.943 -0.368 -1.718 . . . 1.0 . . . . . . . . . . . . A . 9 LEU O . . . . . . . . . c30057_5j6t 1 . 3 . 743 . 1 1 10 ALA C C 15.572 2.437 -0.919 . . . 1.0 . . . . . . . . . . . . A . 10 ALA C . . . . . . . . . c30057_5j6t 1 . 3 . 744 . 1 1 10 ALA CA C 14.144 2.195 -1.414 . . . 1.0 . . . . . . . . . . . . A . 10 ALA CA . . . . . . . . . c30057_5j6t 1 . 3 . 745 . 1 1 10 ALA CB C 13.239 3.372 -1.041 . . . 1.0 . . . . . . . . . . . . A . 10 ALA CB . . . . . . . . . c30057_5j6t 1 . 3 . 746 . 1 1 10 ALA H H 12.785 1.138 -0.074 . . . 1.0 . . . . . . . . . . . . A . 10 ALA H . . . . . . . . . c30057_5j6t 1 . 3 . 747 . 1 1 10 ALA HA H 14.138 2.041 -2.493 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HA . . . . . . . . . c30057_5j6t 1 . 3 . 748 . 1 1 10 ALA HB1 H 13.611 4.280 -1.515 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HB1 . . . . . . . . . c30057_5j6t 1 . 3 . 749 . 1 1 10 ALA HB2 H 12.224 3.172 -1.384 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HB2 . . . . . . . . . c30057_5j6t 1 . 3 . 750 . 1 1 10 ALA HB3 H 13.238 3.501 0.041 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HB3 . . . . . . . . . c30057_5j6t 1 . 3 . 751 . 1 1 10 ALA N N 13.551 1.012 -0.719 . . . 1.0 . . . . . . . . . . . . A . 10 ALA N . . . . . . . . . c30057_5j6t 1 . 3 . 752 . 1 1 10 ALA O O 16.471 2.700 -1.695 . . . 1.0 . . . . . . . . . . . . A . 10 ALA O . . . . . . . . . c30057_5j6t 1 . 3 . 753 . 1 1 11 LEU C C 18.058 1.393 0.579 . . . 1.0 . . . . . . . . . . . . A . 11 LEU C . . . . . . . . . c30057_5j6t 1 . 3 . 754 . 1 1 11 LEU CA C 17.149 2.577 0.917 . . . 1.0 . . . . . . . . . . . . A . 11 LEU CA . . . . . . . . . c30057_5j6t 1 . 3 . 755 . 1 1 11 LEU CB C 16.954 2.690 2.430 . . . 1.0 . . . . . . . . . . . . A . 11 LEU CB . . . . . . . . . c30057_5j6t 1 . 3 . 756 . 1 1 11 LEU CD1 C 15.990 4.239 4.136 . . . 1.0 . . . . . . . . . . . . A . 11 LEU CD1 . . . . . . . . . c30057_5j6t 1 . 3 . 757 . 1 1 11 LEU CD2 C 18.110 4.839 2.960 . . . 1.0 . . . . . . . . . . . . A . 11 LEU CD2 . . . . . . . . . c30057_5j6t 1 . 3 . 758 . 1 1 11 LEU CG C 16.749 4.158 2.811 . . . 1.0 . . . . . . . . . . . . A . 11 LEU CG . . . . . . . . . c30057_5j6t 1 . 3 . 759 . 1 1 11 LEU H H 15.016 2.132 0.986 . . . 1.0 . . . . . . . . . . . . A . 11 LEU H . . . . . . . . . c30057_5j6t 1 . 3 . 760 . 1 1 11 LEU HA H 17.570 3.502 0.520 . . . 1.0 . . . . . . . . . . . . A . 11 LEU HA . . . . . . . . . c30057_5j6t 1 . 3 . 761 . 1 1 11 LEU HB2 H 16.080 2.112 2.727 . . . 1.0 . . . . . . . . . . . . A . 11 LEU HB2 . . . . . . . . . c30057_5j6t 1 . 3 . 762 . 1 1 11 LEU HB3 H 17.836 2.303 2.940 . . . 1.0 . . . . . . . . . . . . A . 11 LEU HB3 . . . . . . . . . c30057_5j6t 1 . 3 . 763 . 1 1 11 LEU HD11 H 15.020 3.754 4.031 . . . 1.0 . . . . . . . . . . . . A . 11 LEU HD11 . . . . . . . . . c30057_5j6t 1 . 3 . 764 . 1 1 11 LEU HD12 H 15.846 5.285 4.408 . . . 1.0 . . . . . . . . . . . . A . 11 LEU HD12 . . . . . . . . . c30057_5j6t 1 . 3 . 765 . 1 1 11 LEU HD13 H 16.565 3.737 4.915 . . . 1.0 . . . . . . . . . . . . A . 11 LEU HD13 . . . . . . . . . c30057_5j6t 1 . 3 . 766 . 1 1 11 LEU HD21 H 17.966 5.885 3.232 . . . 1.0 . . . . . . . . . . . . A . 11 LEU HD21 . . . . . . . . . c30057_5j6t 1 . 3 . 767 . 1 1 11 LEU HD22 H 18.684 4.337 3.739 . . . 1.0 . . . . . . . . . . . . A . 11 LEU HD22 . . . . . . . . . c30057_5j6t 1 . 3 . 768 . 1 1 11 LEU HD23 H 18.651 4.780 2.015 . . . 1.0 . . . . . . . . . . . . A . 11 LEU HD23 . . . . . . . . . c30057_5j6t 1 . 3 . 769 . 1 1 11 LEU HG H 16.174 4.659 2.032 . . . 1.0 . . . . . . . . . . . . A . 11 LEU HG . . . . . . . . . c30057_5j6t 1 . 3 . 770 . 1 1 11 LEU N N 15.781 2.352 0.364 . . . 1.0 . . . . . . . . . . . . A . 11 LEU N . . . . . . . . . c30057_5j6t 1 . 3 . 771 . 1 1 11 LEU O O 19.257 1.538 0.442 . . . 1.0 . . . . . . . . . . . . A . 11 LEU O . . . . . . . . . c30057_5j6t 1 . 3 . 772 . 1 1 12 GLY C C 18.859 -0.844 -1.312 . . . 1.0 . . . . . . . . . . . . A . 12 GLY C . . . . . . . . . c30057_5j6t 1 . 3 . 773 . 1 1 12 GLY CA C 18.324 -0.973 0.114 . . . 1.0 . . . . . . . . . . . . A . 12 GLY CA . . . . . . . . . c30057_5j6t 1 . 3 . 774 . 1 1 12 GLY H H 16.497 0.127 0.562 . . . 1.0 . . . . . . . . . . . . A . 12 GLY H . . . . . . . . . c30057_5j6t 1 . 3 . 775 . 1 1 12 GLY HA2 H 19.159 -1.039 0.811 . . . 1.0 . . . . . . . . . . . . A . 12 GLY HA2 . . . . . . . . . c30057_5j6t 1 . 3 . 776 . 1 1 12 GLY HA3 H 17.712 -1.871 0.192 . . . 1.0 . . . . . . . . . . . . A . 12 GLY HA3 . . . . . . . . . c30057_5j6t 1 . 3 . 777 . 1 1 12 GLY N N 17.495 0.223 0.443 . . . 1.0 . . . . . . . . . . . . A . 12 GLY N . . . . . . . . . c30057_5j6t 1 . 3 . 778 . 1 1 12 GLY O O 19.952 -1.280 -1.616 . . . 1.0 . . . . . . . . . . . . A . 12 GLY O . . . . . . . . . c30057_5j6t 1 . 3 . 779 . 1 1 13 ALA C C 19.836 0.760 -3.642 . . . 1.0 . . . . . . . . . . . . A . 13 ALA C . . . . . . . . . c30057_5j6t 1 . 3 . 780 . 1 1 13 ALA CA C 18.564 -0.089 -3.600 . . . 1.0 . . . . . . . . . . . . A . 13 ALA CA . . . . . . . . . c30057_5j6t 1 . 3 . 781 . 1 1 13 ALA CB C 17.420 0.622 -4.323 . . . 1.0 . . . . . . . . . . . . A . 13 ALA CB . . . . . . . . . c30057_5j6t 1 . 3 . 782 . 1 1 13 ALA H H 17.194 0.108 -1.915 . . . 1.0 . . . . . . . . . . . . A . 13 ALA H . . . . . . . . . c30057_5j6t 1 . 3 . 783 . 1 1 13 ALA HA H 18.747 -1.065 -4.049 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HA . . . . . . . . . c30057_5j6t 1 . 3 . 784 . 1 1 13 ALA HB1 H 17.688 0.774 -5.368 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HB1 . . . . . . . . . c30057_5j6t 1 . 3 . 785 . 1 1 13 ALA HB2 H 17.236 1.587 -3.851 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HB2 . . . . . . . . . c30057_5j6t 1 . 3 . 786 . 1 1 13 ALA HB3 H 16.518 0.011 -4.265 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HB3 . . . . . . . . . c30057_5j6t 1 . 3 . 787 . 1 1 13 ALA N N 18.098 -0.247 -2.190 . . . 1.0 . . . . . . . . . . . . A . 13 ALA N . . . . . . . . . c30057_5j6t 1 . 3 . 788 . 1 1 13 ALA O O 20.669 0.604 -4.514 . . . 1.0 . . . . . . . . . . . . A . 13 ALA O . . . . . . . . . c30057_5j6t 1 . 3 . 789 . 1 1 14 LEU C C 22.378 1.753 -2.044 . . . 1.0 . . . . . . . . . . . . A . 14 LEU C . . . . . . . . . c30057_5j6t 1 . 3 . 790 . 1 1 14 LEU CA C 21.212 2.512 -2.684 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CA . . . . . . . . . c30057_5j6t 1 . 3 . 791 . 1 1 14 LEU CB C 20.826 3.727 -1.837 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CB . . . . . . . . . c30057_5j6t 1 . 3 . 792 . 1 1 14 LEU CD1 C 22.355 5.303 -3.038 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CD1 . . . . . . . . . c30057_5j6t 1 . 3 . 793 . 1 1 14 LEU CD2 C 21.706 5.750 -0.663 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CD2 . . . . . . . . . c30057_5j6t 1 . 3 . 794 . 1 1 14 LEU CG C 22.031 4.657 -1.686 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CG . . . . . . . . . c30057_5j6t 1 . 3 . 795 . 1 1 14 LEU H H 19.287 1.765 -1.991 . . . 1.0 . . . . . . . . . . . . A . 14 LEU H . . . . . . . . . c30057_5j6t 1 . 3 . 796 . 1 1 14 LEU HA H 21.473 2.824 -3.695 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HA . . . . . . . . . c30057_5j6t 1 . 3 . 797 . 1 1 14 LEU HB2 H 20.012 4.264 -2.323 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HB2 . . . . . . . . . c30057_5j6t 1 . 3 . 798 . 1 1 14 LEU HB3 H 20.502 3.392 -0.851 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HB3 . . . . . . . . . c30057_5j6t 1 . 3 . 799 . 1 1 14 LEU HD11 H 22.586 4.526 -3.766 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD11 . . . . . . . . . c30057_5j6t 1 . 3 . 800 . 1 1 14 LEU HD12 H 21.496 5.878 -3.381 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD12 . . . . . . . . . c30057_5j6t 1 . 3 . 801 . 1 1 14 LEU HD13 H 23.215 5.964 -2.928 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD13 . . . . . . . . . c30057_5j6t 1 . 3 . 802 . 1 1 14 LEU HD21 H 22.564 6.413 -0.555 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD21 . . . . . . . . . c30057_5j6t 1 . 3 . 803 . 1 1 14 LEU HD22 H 20.845 6.323 -1.005 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD22 . . . . . . . . . c30057_5j6t 1 . 3 . 804 . 1 1 14 LEU HD23 H 21.479 5.291 0.299 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD23 . . . . . . . . . c30057_5j6t 1 . 3 . 805 . 1 1 14 LEU HG H 22.891 4.083 -1.342 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HG . . . . . . . . . c30057_5j6t 1 . 3 . 806 . 1 1 14 LEU N N 19.993 1.654 -2.705 . . . 1.0 . . . . . . . . . . . . A . 14 LEU N . . . . . . . . . c30057_5j6t 1 . 3 . 807 . 1 1 14 LEU O O 23.470 1.711 -2.575 . . . 1.0 . . . . . . . . . . . . A . 14 LEU O . . . . . . . . . c30057_5j6t 1 . 3 . 808 . 1 1 15 LYS C C 23.737 -0.747 -1.122 . . . 1.0 . . . . . . . . . . . . A . 15 LYS C . . . . . . . . . c30057_5j6t 1 . 3 . 809 . 1 1 15 LYS CA C 23.243 0.395 -0.228 . . . 1.0 . . . . . . . . . . . . A . 15 LYS CA . . . . . . . . . c30057_5j6t 1 . 3 . 810 . 1 1 15 LYS CB C 22.610 -0.158 1.050 . . . 1.0 . . . . . . . . . . . . A . 15 LYS CB . . . . . . . . . c30057_5j6t 1 . 3 . 811 . 1 1 15 LYS CD C 22.435 2.079 2.152 . . . 1.0 . . . . . . . . . . . . A . 15 LYS CD . . . . . . . . . c30057_5j6t 1 . 3 . 812 . 1 1 15 LYS CE C 21.089 2.098 2.885 . . . 1.0 . . . . . . . . . . . . A . 15 LYS CE . . . . . . . . . c30057_5j6t 1 . 3 . 813 . 1 1 15 LYS CG C 23.052 0.683 2.251 . . . 1.0 . . . . . . . . . . . . A . 15 LYS CG . . . . . . . . . c30057_5j6t 1 . 3 . 814 . 1 1 15 LYS H H 21.235 1.203 -0.484 . . . 1.0 . . . . . . . . . . . . A . 15 LYS H . . . . . . . . . c30057_5j6t 1 . 3 . 815 . 1 1 15 LYS HA H 24.068 1.063 0.020 . . . 1.0 . . . . . . . . . . . . A . 15 LYS HA . . . . . . . . . c30057_5j6t 1 . 3 . 816 . 1 1 15 LYS HB2 H 21.524 -0.122 0.962 . . . 1.0 . . . . . . . . . . . . A . 15 LYS HB2 . . . . . . . . . c30057_5j6t 1 . 3 . 817 . 1 1 15 LYS HB3 H 22.928 -1.191 1.194 . . . 1.0 . . . . . . . . . . . . A . 15 LYS HB3 . . . . . . . . . c30057_5j6t 1 . 3 . 818 . 1 1 15 LYS HD2 H 23.107 2.806 2.608 . . . 1.0 . . . . . . . . . . . . A . 15 LYS HD2 . . . . . . . . . c30057_5j6t 1 . 3 . 819 . 1 1 15 LYS HD3 H 22.281 2.334 1.104 . . . 1.0 . . . . . . . . . . . . A . 15 LYS HD3 . . . . . . . . . c30057_5j6t 1 . 3 . 820 . 1 1 15 LYS HE2 H 20.290 2.402 2.209 . . . 1.0 . . . . . . . . . . . . A . 15 LYS HE2 . . . . . . . . . c30057_5j6t 1 . 3 . 821 . 1 1 15 LYS HE3 H 20.874 1.115 3.303 . . . 1.0 . . . . . . . . . . . . A . 15 LYS HE3 . . . . . . . . . c30057_5j6t 1 . 3 . 822 . 1 1 15 LYS HG2 H 22.721 0.203 3.172 . . . 1.0 . . . . . . . . . . . . A . 15 LYS HG2 . . . . . . . . . c30057_5j6t 1 . 3 . 823 . 1 1 15 LYS HG3 H 24.139 0.766 2.255 . . . 1.0 . . . . . . . . . . . . A . 15 LYS HG3 . . . . . . . . . c30057_5j6t 1 . 3 . 824 . 1 1 15 LYS HZ1 H 20.400 3.162 4.508 . . . 1.0 . . . . . . . . . . . . A . 15 LYS HZ1 . . . . . . . . . c30057_5j6t 1 . 3 . 825 . 1 1 15 LYS HZ2 H 22.008 2.804 4.586 . . . 1.0 . . . . . . . . . . . . A . 15 LYS HZ2 . . . . . . . . . c30057_5j6t 1 . 3 . 826 . 1 1 15 LYS HZ3 H 21.477 3.997 3.579 . . . 1.0 . . . . . . . . . . . . A . 15 LYS HZ3 . . . . . . . . . c30057_5j6t 1 . 3 . 827 . 1 1 15 LYS N N 22.151 1.153 -0.906 . . . 1.0 . . . . . . . . . . . . A . 15 LYS N . . . . . . . . . c30057_5j6t 1 . 3 . 828 . 1 1 15 LYS NZ N 21.257 3.095 3.977 . . . 1.0 . . . . . . . . . . . . A . 15 LYS NZ . . . . . . . . . c30057_5j6t 1 . 3 . 829 . 1 1 15 LYS O O 24.844 -1.227 -0.974 . . . 1.0 . . . . . . . . . . . . A . 15 LYS O . . . . . . . . . c30057_5j6t 1 . 3 . 830 . 1 1 16 ASN C C 24.338 -1.796 -3.995 . . . 1.0 . . . . . . . . . . . . A . 16 ASN C . . . . . . . . . c30057_5j6t 1 . 3 . 831 . 1 1 16 ASN CA C 23.345 -2.303 -2.943 . . . 1.0 . . . . . . . . . . . . A . 16 ASN CA . . . . . . . . . c30057_5j6t 1 . 3 . 832 . 1 1 16 ASN CB C 22.057 -2.779 -3.615 . . . 1.0 . . . . . . . . . . . . A . 16 ASN CB . . . . . . . . . c30057_5j6t 1 . 3 . 833 . 1 1 16 ASN CG C 21.411 -3.870 -2.760 . . . 1.0 . . . . . . . . . . . . A . 16 ASN CG . . . . . . . . . c30057_5j6t 1 . 3 . 834 . 1 1 16 ASN H H 22.008 -0.775 -2.149 . . . 1.0 . . . . . . . . . . . . A . 16 ASN H . . . . . . . . . c30057_5j6t 1 . 3 . 835 . 1 1 16 ASN HA H 23.790 -3.111 -2.362 . . . 1.0 . . . . . . . . . . . . A . 16 ASN HA . . . . . . . . . c30057_5j6t 1 . 3 . 836 . 1 1 16 ASN HB2 H 21.368 -1.940 -3.715 . . . 1.0 . . . . . . . . . . . . A . 16 ASN HB2 . . . . . . . . . c30057_5j6t 1 . 3 . 837 . 1 1 16 ASN HB3 H 22.288 -3.180 -4.602 . . . 1.0 . . . . . . . . . . . . A . 16 ASN HB3 . . . . . . . . . c30057_5j6t 1 . 3 . 838 . 1 1 16 ASN HD21 H 22.872 -5.201 -3.127 . . . 1.0 . . . . . . . . . . . . A . 16 ASN HD21 . . . . . . . . . c30057_5j6t 1 . 3 . 839 . 1 1 16 ASN HD22 H 21.578 -5.757 -2.088 . . . 1.0 . . . . . . . . . . . . A . 16 ASN HD22 . . . . . . . . . c30057_5j6t 1 . 3 . 840 . 1 1 16 ASN N N 22.924 -1.188 -2.044 . . . 1.0 . . . . . . . . . . . . A . 16 ASN N . . . . . . . . . c30057_5j6t 1 . 3 . 841 . 1 1 16 ASN ND2 N 21.998 -5.030 -2.650 . . . 1.0 . . . . . . . . . . . . A . 16 ASN ND2 . . . . . . . . . c30057_5j6t 1 . 3 . 842 . 1 1 16 ASN O O 25.270 -2.484 -4.362 . . . 1.0 . . . . . . . . . . . . A . 16 ASN O . . . . . . . . . c30057_5j6t 1 . 3 . 843 . 1 1 16 ASN OD1 O 20.359 -3.666 -2.186 . . . 1.0 . . . . . . . . . . . . A . 16 ASN OD1 . . . . . . . . . c30057_5j6t 1 . 3 . 844 . 1 1 17 LEU C C 26.397 0.356 -4.873 . . . 1.0 . . . . . . . . . . . . A . 17 LEU C . . . . . . . . . c30057_5j6t 1 . 3 . 845 . 1 1 17 LEU CA C 25.072 -0.054 -5.516 . . . 1.0 . . . . . . . . . . . . A . 17 LEU CA . . . . . . . . . c30057_5j6t 1 . 3 . 846 . 1 1 17 LEU CB C 24.355 1.172 -6.090 . . . 1.0 . . . . . . . . . . . . A . 17 LEU CB . . . . . . . . . c30057_5j6t 1 . 3 . 847 . 1 1 17 LEU CD1 C 24.394 0.211 -8.402 . . . 1.0 . . . . . . . . . . . . A . 17 LEU CD1 . . . . . . . . . c30057_5j6t 1 . 3 . 848 . 1 1 17 LEU CD2 C 22.500 -0.320 -6.862 . . . 1.0 . . . . . . . . . . . . A . 17 LEU CD2 . . . . . . . . . c30057_5j6t 1 . 3 . 849 . 1 1 17 LEU CG C 23.497 0.759 -7.291 . . . 1.0 . . . . . . . . . . . . A . 17 LEU CG . . . . . . . . . c30057_5j6t 1 . 3 . 850 . 1 1 17 LEU H H 23.361 -0.046 -4.164 . . . 1.0 . . . . . . . . . . . . A . 17 LEU H . . . . . . . . . c30057_5j6t 1 . 3 . 851 . 1 1 17 LEU HA H 25.245 -0.792 -6.299 . . . 1.0 . . . . . . . . . . . . A . 17 LEU HA . . . . . . . . . c30057_5j6t 1 . 3 . 852 . 1 1 17 LEU HB2 H 23.717 1.611 -5.323 . . . 1.0 . . . . . . . . . . . . A . 17 LEU HB2 . . . . . . . . . c30057_5j6t 1 . 3 . 853 . 1 1 17 LEU HB3 H 25.094 1.906 -6.410 . . . 1.0 . . . . . . . . . . . . A . 17 LEU HB3 . . . . . . . . . c30057_5j6t 1 . 3 . 854 . 1 1 17 LEU HD11 H 25.105 0.979 -8.707 . . . 1.0 . . . . . . . . . . . . A . 17 LEU HD11 . . . . . . . . . c30057_5j6t 1 . 3 . 855 . 1 1 17 LEU HD12 H 24.937 -0.660 -8.034 . . . 1.0 . . . . . . . . . . . . A . 17 LEU HD12 . . . . . . . . . c30057_5j6t 1 . 3 . 856 . 1 1 17 LEU HD13 H 23.781 -0.077 -9.255 . . . 1.0 . . . . . . . . . . . . A . 17 LEU HD13 . . . . . . . . . c30057_5j6t 1 . 3 . 857 . 1 1 17 LEU HD21 H 21.728 -0.425 -7.625 . . . 1.0 . . . . . . . . . . . . A . 17 LEU HD21 . . . . . . . . . c30057_5j6t 1 . 3 . 858 . 1 1 17 LEU HD22 H 22.040 -0.034 -5.917 . . . 1.0 . . . . . . . . . . . . A . 17 LEU HD22 . . . . . . . . . c30057_5j6t 1 . 3 . 859 . 1 1 17 LEU HD23 H 23.022 -1.269 -6.740 . . . 1.0 . . . . . . . . . . . . A . 17 LEU HD23 . . . . . . . . . c30057_5j6t 1 . 3 . 860 . 1 1 17 LEU HG H 22.952 1.627 -7.661 . . . 1.0 . . . . . . . . . . . . A . 17 LEU HG . . . . . . . . . c30057_5j6t 1 . 3 . 861 . 1 1 17 LEU N N 24.143 -0.600 -4.484 . . . 1.0 . . . . . . . . . . . . A . 17 LEU N . . . . . . . . . c30057_5j6t 1 . 3 . 862 . 1 1 17 LEU O O 27.447 0.267 -5.481 . . . 1.0 . . . . . . . . . . . . A . 17 LEU O . . . . . . . . . c30057_5j6t 1 . 3 . 863 . 1 1 18 ILE C C 28.252 0.037 -2.242 . . . 1.0 . . . . . . . . . . . . A . 18 ILE C . . . . . . . . . c30057_5j6t 1 . 3 . 864 . 1 1 18 ILE CA C 27.612 1.228 -2.967 . . . 1.0 . . . . . . . . . . . . A . 18 ILE CA . . . . . . . . . c30057_5j6t 1 . 3 . 865 . 1 1 18 ILE CB C 27.180 2.303 -1.966 . . . 1.0 . . . . . . . . . . . . A . 18 ILE CB . . . . . . . . . c30057_5j6t 1 . 3 . 866 . 1 1 18 ILE CD1 C 26.838 1.665 0.431 . . . 1.0 . . . . . . . . . . . . A . 18 ILE CD1 . . . . . . . . . c30057_5j6t 1 . 3 . 867 . 1 1 18 ILE CG1 C 26.191 1.707 -0.956 . . . 1.0 . . . . . . . . . . . . A . 18 ILE CG1 . . . . . . . . . c30057_5j6t 1 . 3 . 868 . 1 1 18 ILE CG2 C 26.510 3.458 -2.715 . . . 1.0 . . . . . . . . . . . . A . 18 ILE CG2 . . . . . . . . . c30057_5j6t 1 . 3 . 869 . 1 1 18 ILE H H 25.472 0.872 -3.166 . . . 1.0 . . . . . . . . . . . . A . 18 ILE H . . . . . . . . . c30057_5j6t 1 . 3 . 870 . 1 1 18 ILE HA H 28.311 1.647 -3.690 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HA . . . . . . . . . c30057_5j6t 1 . 3 . 871 . 1 1 18 ILE HB H 28.056 2.676 -1.436 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HB . . . . . . . . . c30057_5j6t 1 . 3 . 872 . 1 1 18 ILE HD11 H 26.135 1.241 1.148 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HD11 . . . . . . . . . c30057_5j6t 1 . 3 . 873 . 1 1 18 ILE HD12 H 27.105 2.676 0.738 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HD12 . . . . . . . . . c30057_5j6t 1 . 3 . 874 . 1 1 18 ILE HD13 H 27.736 1.048 0.394 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HD13 . . . . . . . . . c30057_5j6t 1 . 3 . 875 . 1 1 18 ILE HG12 H 25.293 2.324 -0.919 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HG12 . . . . . . . . . c30057_5j6t 1 . 3 . 876 . 1 1 18 ILE HG13 H 25.924 0.695 -1.263 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HG13 . . . . . . . . . c30057_5j6t 1 . 3 . 877 . 1 1 18 ILE HG21 H 26.203 4.224 -2.003 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HG21 . . . . . . . . . c30057_5j6t 1 . 3 . 878 . 1 1 18 ILE HG22 H 25.636 3.087 -3.249 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HG22 . . . . . . . . . c30057_5j6t 1 . 3 . 879 . 1 1 18 ILE HG23 H 27.216 3.887 -3.427 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HG23 . . . . . . . . . c30057_5j6t 1 . 3 . 880 . 1 1 18 ILE N N 26.356 0.807 -3.650 . . . 1.0 . . . . . . . . . . . . A . 18 ILE N . . . . . . . . . c30057_5j6t 1 . 3 . 881 . 1 1 18 ILE O O 29.435 0.035 -1.963 . . . 1.0 . . . . . . . . . . . . A . 18 ILE O . . . . . . . . . c30057_5j6t 1 . 3 . 882 . 1 1 19 LYS C C 27.823 -3.425 -2.071 . . . 1.0 . . . . . . . . . . . . A . 19 LYS C . . . . . . . . . c30057_5j6t 1 . 3 . 883 . 1 1 19 LYS CA C 28.045 -2.161 -1.235 . . . 1.0 . . . . . . . . . . . . A . 19 LYS CA . . . . . . . . . c30057_5j6t 1 . 3 . 884 . 1 1 19 LYS CB C 27.274 -2.247 0.083 . . . 1.0 . . . . . . . . . . . . A . 19 LYS CB . . . . . . . . . c30057_5j6t 1 . 3 . 885 . 1 1 19 LYS CD C 27.597 -2.271 2.561 . . . 1.0 . . . . . . . . . . . . A . 19 LYS CD . . . . . . . . . c30057_5j6t 1 . 3 . 886 . 1 1 19 LYS CE C 28.063 -3.270 3.623 . . . 1.0 . . . . . . . . . . . . A . 19 LYS CE . . . . . . . . . c30057_5j6t 1 . 3 . 887 . 1 1 19 LYS CG C 28.233 -2.624 1.215 . . . 1.0 . . . . . . . . . . . . A . 19 LYS CG . . . . . . . . . c30057_5j6t 1 . 3 . 888 . 1 1 19 LYS H H 26.501 -0.951 -2.183 . . . 1.0 . . . . . . . . . . . . A . 19 LYS H . . . . . . . . . c30057_5j6t 1 . 3 . 889 . 1 1 19 LYS HA H 29.108 -2.017 -1.043 . . . 1.0 . . . . . . . . . . . . A . 19 LYS HA . . . . . . . . . c30057_5j6t 1 . 3 . 890 . 1 1 19 LYS HB2 H 26.819 -1.281 0.300 . . . 1.0 . . . . . . . . . . . . A . 19 LYS HB2 . . . . . . . . . c30057_5j6t 1 . 3 . 891 . 1 1 19 LYS HB3 H 26.495 -3.005 -0.001 . . . 1.0 . . . . . . . . . . . . A . 19 LYS HB3 . . . . . . . . . c30057_5j6t 1 . 3 . 892 . 1 1 19 LYS HD2 H 27.897 -1.265 2.852 . . . 1.0 . . . . . . . . . . . . A . 19 LYS HD2 . . . . . . . . . c30057_5j6t 1 . 3 . 893 . 1 1 19 LYS HD3 H 26.512 -2.316 2.472 . . . 1.0 . . . . . . . . . . . . A . 19 LYS HD3 . . . . . . . . . c30057_5j6t 1 . 3 . 894 . 1 1 19 LYS HE2 H 27.635 -4.255 3.437 . . . 1.0 . . . . . . . . . . . . A . 19 LYS HE2 . . . . . . . . . c30057_5j6t 1 . 3 . 895 . 1 1 19 LYS HE3 H 29.152 -3.329 3.633 . . . 1.0 . . . . . . . . . . . . A . 19 LYS HE3 . . . . . . . . . c30057_5j6t 1 . 3 . 896 . 1 1 19 LYS HG2 H 28.436 -3.694 1.179 . . . 1.0 . . . . . . . . . . . . A . 19 LYS HG2 . . . . . . . . . c30057_5j6t 1 . 3 . 897 . 1 1 19 LYS HG3 H 29.167 -2.073 1.099 . . . 1.0 . . . . . . . . . . . . A . 19 LYS HG3 . . . . . . . . . c30057_5j6t 1 . 3 . 898 . 1 1 19 LYS HZ1 H 27.837 -3.328 5.670 . . . 1.0 . . . . . . . . . . . . A . 19 LYS HZ1 . . . . . . . . . c30057_5j6t 1 . 3 . 899 . 1 1 19 LYS HZ2 H 27.963 -1.800 5.062 . . . 1.0 . . . . . . . . . . . . A . 19 LYS HZ2 . . . . . . . . . c30057_5j6t 1 . 3 . 900 . 1 1 19 LYS HZ3 H 26.558 -2.645 4.883 . . . 1.0 . . . . . . . . . . . . A . 19 LYS HZ3 . . . . . . . . . c30057_5j6t 1 . 3 . 901 . 1 1 19 LYS N N 27.481 -0.974 -1.939 . . . 1.0 . . . . . . . . . . . . A . 19 LYS N . . . . . . . . . c30057_5j6t 1 . 3 . 902 . 1 1 19 LYS NZ N 27.566 -2.716 4.913 . . . 1.0 . . . . . . . . . . . . A . 19 LYS NZ . . . . . . . . . c30057_5j6t 1 . 3 . 903 . 1 1 19 LYS O O 27.584 -3.353 -3.260 . . . 1.0 . . . . . . . . . . . . A . 19 LYS O . . . . . . . . . c30057_5j6t 1 . 3 . 904 . 1 1 20 NH2 HN1 H 27.746 -5.434 -2.034 . . . 1.0 . . . . . . . . . . . . A . 20 NH2 HN1 . . . . . . . . . c30057_5j6t 1 . 3 . 905 . 1 1 20 NH2 HN2 H 28.089 -4.657 -0.504 . . . 1.0 . . . . . . . . . . . . A . 20 NH2 HN2 . . . . . . . . . c30057_5j6t 1 . 3 . 906 . 1 1 20 NH2 N N 27.891 -4.594 -1.493 . . . 1.0 . . . . . . . . . . . . A . 20 NH2 N . . . . . . . . . c30057_5j6t 1 . 4 . 907 . 1 1 1 ACE C C 0.442 -1.642 3.972 . . . 1.0 . . . . . . . . . . . . A . 1 ACE C . . . . . . . . . c30057_5j6t 1 . 4 . 908 . 1 1 1 ACE CH3 C -0.978 -1.079 4.046 . . . 1.0 . . . . . . . . . . . . A . 1 ACE CH3 . . . . . . . . . c30057_5j6t 1 . 4 . 909 . 1 1 1 ACE H1 H -1.282 -0.994 5.090 . . . 1.0 . . . . . . . . . . . . A . 1 ACE H1 . . . . . . . . . c30057_5j6t 1 . 4 . 910 . 1 1 1 ACE H2 H -1.003 -0.094 3.580 . . . 1.0 . . . . . . . . . . . . A . 1 ACE H2 . . . . . . . . . c30057_5j6t 1 . 4 . 911 . 1 1 1 ACE H3 H -1.661 -1.746 3.522 . . . 1.0 . . . . . . . . . . . . A . 1 ACE H3 . . . . . . . . . c30057_5j6t 1 . 4 . 912 . 1 1 1 ACE O O 1.061 -1.925 4.980 . . . 1.0 . . . . . . . . . . . . A . 1 ACE O . . . . . . . . . c30057_5j6t 1 . 4 . 913 . 1 1 2 ILE C C 3.321 -1.232 2.274 . . . 1.0 . . . . . . . . . . . . A . 2 ILE C . . . . . . . . . c30057_5j6t 1 . 4 . 914 . 1 1 2 ILE CA C 2.345 -2.352 2.644 . . . 1.0 . . . . . . . . . . . . A . 2 ILE CA . . . . . . . . . c30057_5j6t 1 . 4 . 915 . 1 1 2 ILE CB C 2.257 -3.387 1.518 . . . 1.0 . . . . . . . . . . . . A . 2 ILE CB . . . . . . . . . c30057_5j6t 1 . 4 . 916 . 1 1 2 ILE CD1 C 2.452 -3.330 -0.976 . . . 1.0 . . . . . . . . . . . . A . 2 ILE CD1 . . . . . . . . . c30057_5j6t 1 . 4 . 917 . 1 1 2 ILE CG1 C 1.744 -2.720 0.237 . . . 1.0 . . . . . . . . . . . . A . 2 ILE CG1 . . . . . . . . . c30057_5j6t 1 . 4 . 918 . 1 1 2 ILE CG2 C 1.295 -4.504 1.927 . . . 1.0 . . . . . . . . . . . . A . 2 ILE CG2 . . . . . . . . . c30057_5j6t 1 . 4 . 919 . 1 1 2 ILE H H 0.429 -1.567 1.962 . . . 1.0 . . . . . . . . . . . . A . 2 ILE H . . . . . . . . . c30057_5j6t 1 . 4 . 920 . 1 1 2 ILE HA H 2.657 -2.831 3.572 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HA . . . . . . . . . c30057_5j6t 1 . 4 . 921 . 1 1 2 ILE HB H 3.245 -3.809 1.336 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HB . . . . . . . . . c30057_5j6t 1 . 4 . 922 . 1 1 2 ILE HD11 H 2.087 -2.855 -1.887 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HD11 . . . . . . . . . c30057_5j6t 1 . 4 . 923 . 1 1 2 ILE HD12 H 3.526 -3.169 -0.888 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HD12 . . . . . . . . . c30057_5j6t 1 . 4 . 924 . 1 1 2 ILE HD13 H 2.246 -4.399 -1.017 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HD13 . . . . . . . . . c30057_5j6t 1 . 4 . 925 . 1 1 2 ILE HG12 H 0.669 -2.880 0.149 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HG12 . . . . . . . . . c30057_5j6t 1 . 4 . 926 . 1 1 2 ILE HG13 H 1.949 -1.650 0.277 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HG13 . . . . . . . . . c30057_5j6t 1 . 4 . 927 . 1 1 2 ILE HG21 H 1.657 -4.981 2.838 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HG21 . . . . . . . . . c30057_5j6t 1 . 4 . 928 . 1 1 2 ILE HG22 H 0.305 -4.084 2.106 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HG22 . . . . . . . . . c30057_5j6t 1 . 4 . 929 . 1 1 2 ILE HG23 H 1.236 -5.244 1.129 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HG23 . . . . . . . . . c30057_5j6t 1 . 4 . 930 . 1 1 2 ILE N N 0.963 -1.807 2.785 . . . 1.0 . . . . . . . . . . . . A . 2 ILE N . . . . . . . . . c30057_5j6t 1 . 4 . 931 . 1 1 2 ILE O O 4.313 -1.456 1.610 . . . 1.0 . . . . . . . . . . . . A . 2 ILE O . . . . . . . . . c30057_5j6t 1 . 4 . 932 . 1 1 3 PHE C C 5.222 1.028 3.232 . . . 1.0 . . . . . . . . . . . . A . 3 PHE C . . . . . . . . . c30057_5j6t 1 . 4 . 933 . 1 1 3 PHE CA C 3.956 1.107 2.377 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CA . . . . . . . . . c30057_5j6t 1 . 4 . 934 . 1 1 3 PHE CB C 3.160 2.368 2.715 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CB . . . . . . . . . c30057_5j6t 1 . 4 . 935 . 1 1 3 PHE CD1 C 4.309 4.536 3.284 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CD1 . . . . . . . . . c30057_5j6t 1 . 4 . 936 . 1 1 3 PHE CD2 C 4.343 3.765 0.985 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CD2 . . . . . . . . . c30057_5j6t 1 . 4 . 937 . 1 1 3 PHE CE1 C 5.049 5.666 2.915 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CE1 . . . . . . . . . c30057_5j6t 1 . 4 . 938 . 1 1 3 PHE CE2 C 5.082 4.895 0.616 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CE2 . . . . . . . . . c30057_5j6t 1 . 4 . 939 . 1 1 3 PHE CG C 3.958 3.586 2.318 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CG . . . . . . . . . c30057_5j6t 1 . 4 . 940 . 1 1 3 PHE CZ C 5.435 5.846 1.581 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CZ . . . . . . . . . c30057_5j6t 1 . 4 . 941 . 1 1 3 PHE H H 2.213 0.133 3.251 . . . 1.0 . . . . . . . . . . . . A . 3 PHE H . . . . . . . . . c30057_5j6t 1 . 4 . 942 . 1 1 3 PHE HA H 4.213 1.096 1.317 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HA . . . . . . . . . c30057_5j6t 1 . 4 . 943 . 1 1 3 PHE HB2 H 2.215 2.359 2.172 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HB2 . . . . . . . . . c30057_5j6t 1 . 4 . 944 . 1 1 3 PHE HB3 H 2.964 2.397 3.787 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HB3 . . . . . . . . . c30057_5j6t 1 . 4 . 945 . 1 1 3 PHE HD1 H 4.010 4.398 4.312 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HD1 . . . . . . . . . c30057_5j6t 1 . 4 . 946 . 1 1 3 PHE HD2 H 4.069 3.032 0.240 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HD2 . . . . . . . . . c30057_5j6t 1 . 4 . 947 . 1 1 3 PHE HE1 H 5.322 6.400 3.659 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HE1 . . . . . . . . . c30057_5j6t 1 . 4 . 948 . 1 1 3 PHE HE2 H 5.381 5.033 -0.413 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HE2 . . . . . . . . . c30057_5j6t 1 . 4 . 949 . 1 1 3 PHE HZ H 6.005 6.718 1.296 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HZ . . . . . . . . . c30057_5j6t 1 . 4 . 950 . 1 1 3 PHE N N 3.044 -0.029 2.701 . . . 1.0 . . . . . . . . . . . . A . 3 PHE N . . . . . . . . . c30057_5j6t 1 . 4 . 951 . 1 1 3 PHE O O 6.309 1.331 2.780 . . . 1.0 . . . . . . . . . . . . A . 3 PHE O . . . . . . . . . c30057_5j6t 1 . 4 . 952 . 1 1 4 GLY C C 7.234 -0.556 4.818 . . . 1.0 . . . . . . . . . . . . A . 4 GLY C . . . . . . . . . c30057_5j6t 1 . 4 . 953 . 1 1 4 GLY CA C 6.280 0.516 5.353 . . . 1.0 . . . . . . . . . . . . A . 4 GLY CA . . . . . . . . . c30057_5j6t 1 . 4 . 954 . 1 1 4 GLY H H 4.174 0.373 4.818 . . . 1.0 . . . . . . . . . . . . A . 4 GLY H . . . . . . . . . c30057_5j6t 1 . 4 . 955 . 1 1 4 GLY HA2 H 6.794 1.477 5.383 . . . 1.0 . . . . . . . . . . . . A . 4 GLY HA2 . . . . . . . . . c30057_5j6t 1 . 4 . 956 . 1 1 4 GLY HA3 H 5.960 0.246 6.359 . . . 1.0 . . . . . . . . . . . . A . 4 GLY HA3 . . . . . . . . . c30057_5j6t 1 . 4 . 957 . 1 1 4 GLY N N 5.087 0.619 4.465 . . . 1.0 . . . . . . . . . . . . A . 4 GLY N . . . . . . . . . c30057_5j6t 1 . 4 . 958 . 1 1 4 GLY O O 8.383 -0.621 5.203 . . . 1.0 . . . . . . . . . . . . A . 4 GLY O . . . . . . . . . c30057_5j6t 1 . 4 . 959 . 1 1 5 ALA C C 8.333 -1.983 2.097 . . . 1.0 . . . . . . . . . . . . A . 5 ALA C . . . . . . . . . c30057_5j6t 1 . 4 . 960 . 1 1 5 ALA CA C 7.648 -2.470 3.379 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CA . . . . . . . . . c30057_5j6t 1 . 4 . 961 . 1 1 5 ALA CB C 6.711 -3.639 3.077 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CB . . . . . . . . . c30057_5j6t 1 . 4 . 962 . 1 1 5 ALA H H 5.806 -1.330 3.629 . . . 1.0 . . . . . . . . . . . . A . 5 ALA H . . . . . . . . . c30057_5j6t 1 . 4 . 963 . 1 1 5 ALA HA H 8.395 -2.764 4.117 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HA . . . . . . . . . c30057_5j6t 1 . 4 . 964 . 1 1 5 ALA HB1 H 7.286 -4.468 2.664 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB1 . . . . . . . . . c30057_5j6t 1 . 4 . 965 . 1 1 5 ALA HB2 H 5.958 -3.324 2.355 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB2 . . . . . . . . . c30057_5j6t 1 . 4 . 966 . 1 1 5 ALA HB3 H 6.222 -3.959 3.997 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB3 . . . . . . . . . c30057_5j6t 1 . 4 . 967 . 1 1 5 ALA N N 6.765 -1.401 3.935 . . . 1.0 . . . . . . . . . . . . A . 5 ALA N . . . . . . . . . c30057_5j6t 1 . 4 . 968 . 1 1 5 ALA O O 9.357 -2.504 1.695 . . . 1.0 . . . . . . . . . . . . A . 5 ALA O . . . . . . . . . c30057_5j6t 1 . 4 . 969 . 1 1 6 ILE C C 9.517 0.516 0.520 . . . 1.0 . . . . . . . . . . . . A . 6 ILE C . . . . . . . . . c30057_5j6t 1 . 4 . 970 . 1 1 6 ILE CA C 8.398 -0.477 0.196 . . . 1.0 . . . . . . . . . . . . A . 6 ILE CA . . . . . . . . . c30057_5j6t 1 . 4 . 971 . 1 1 6 ILE CB C 7.259 0.218 -0.552 . . . 1.0 . . . . . . . . . . . . A . 6 ILE CB . . . . . . . . . c30057_5j6t 1 . 4 . 972 . 1 1 6 ILE CD1 C 4.931 -0.075 -1.417 . . . 1.0 . . . . . . . . . . . . A . 6 ILE CD1 . . . . . . . . . c30057_5j6t 1 . 4 . 973 . 1 1 6 ILE CG1 C 6.159 -0.800 -0.863 . . . 1.0 . . . . . . . . . . . . A . 6 ILE CG1 . . . . . . . . . c30057_5j6t 1 . 4 . 974 . 1 1 6 ILE CG2 C 7.787 0.810 -1.861 . . . 1.0 . . . . . . . . . . . . A . 6 ILE CG2 . . . . . . . . . c30057_5j6t 1 . 4 . 975 . 1 1 6 ILE H H 6.928 -0.574 1.802 . . . 1.0 . . . . . . . . . . . . A . 6 ILE H . . . . . . . . . c30057_5j6t 1 . 4 . 976 . 1 1 6 ILE HA H 8.789 -1.303 -0.397 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HA . . . . . . . . . c30057_5j6t 1 . 4 . 977 . 1 1 6 ILE HB H 6.850 1.016 0.069 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HB . . . . . . . . . c30057_5j6t 1 . 4 . 978 . 1 1 6 ILE HD11 H 4.149 -0.801 -1.638 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HD11 . . . . . . . . . c30057_5j6t 1 . 4 . 979 . 1 1 6 ILE HD12 H 4.567 0.638 -0.677 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HD12 . . . . . . . . . c30057_5j6t 1 . 4 . 980 . 1 1 6 ILE HD13 H 5.204 0.455 -2.329 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HD13 . . . . . . . . . c30057_5j6t 1 . 4 . 981 . 1 1 6 ILE HG12 H 6.523 -1.514 -1.602 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HG12 . . . . . . . . . c30057_5j6t 1 . 4 . 982 . 1 1 6 ILE HG13 H 5.886 -1.330 0.050 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HG13 . . . . . . . . . c30057_5j6t 1 . 4 . 983 . 1 1 6 ILE HG21 H 8.571 1.535 -1.643 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HG21 . . . . . . . . . c30057_5j6t 1 . 4 . 984 . 1 1 6 ILE HG22 H 8.195 0.012 -2.482 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HG22 . . . . . . . . . c30057_5j6t 1 . 4 . 985 . 1 1 6 ILE HG23 H 6.973 1.303 -2.392 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HG23 . . . . . . . . . c30057_5j6t 1 . 4 . 986 . 1 1 6 ILE N N 7.778 -0.992 1.451 . . . 1.0 . . . . . . . . . . . . A . 6 ILE N . . . . . . . . . c30057_5j6t 1 . 4 . 987 . 1 1 6 ILE O O 10.475 0.644 -0.215 . . . 1.0 . . . . . . . . . . . . A . 6 ILE O . . . . . . . . . c30057_5j6t 1 . 4 . 988 . 1 1 7 TRP C C 11.782 1.467 2.277 . . . 1.0 . . . . . . . . . . . . A . 7 TRP C . . . . . . . . . c30057_5j6t 1 . 4 . 989 . 1 1 7 TRP CA C 10.467 2.199 1.981 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CA . . . . . . . . . c30057_5j6t 1 . 4 . 990 . 1 1 7 TRP CB C 9.945 2.918 3.229 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CB . . . . . . . . . c30057_5j6t 1 . 4 . 991 . 1 1 7 TRP CD1 C 8.701 5.110 3.035 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CD1 . . . . . . . . . c30057_5j6t 1 . 4 . 992 . 1 1 7 TRP CD2 C 10.885 5.307 2.536 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CD2 . . . . . . . . . c30057_5j6t 1 . 4 . 993 . 1 1 7 TRP CE2 C 10.317 6.595 2.388 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CE2 . . . . . . . . . c30057_5j6t 1 . 4 . 994 . 1 1 7 TRP CE3 C 12.259 5.154 2.281 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CE3 . . . . . . . . . c30057_5j6t 1 . 4 . 995 . 1 1 7 TRP CG C 9.838 4.384 2.949 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CG . . . . . . . . . c30057_5j6t 1 . 4 . 996 . 1 1 7 TRP CH2 C 12.451 7.523 1.748 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CH2 . . . . . . . . . c30057_5j6t 1 . 4 . 997 . 1 1 7 TRP CZ2 C 11.086 7.692 1.998 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CZ2 . . . . . . . . . c30057_5j6t 1 . 4 . 998 . 1 1 7 TRP CZ3 C 13.037 6.257 1.887 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CZ3 . . . . . . . . . c30057_5j6t 1 . 4 . 999 . 1 1 7 TRP H H 8.598 1.095 2.213 . . . 1.0 . . . . . . . . . . . . A . 7 TRP H . . . . . . . . . c30057_5j6t 1 . 4 . 1000 . 1 1 7 TRP HA H 10.611 2.913 1.170 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HA . . . . . . . . . c30057_5j6t 1 . 4 . 1001 . 1 1 7 TRP HB2 H 8.963 2.525 3.492 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HB2 . . . . . . . . . c30057_5j6t 1 . 4 . 1002 . 1 1 7 TRP HB3 H 10.635 2.756 4.057 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HB3 . . . . . . . . . c30057_5j6t 1 . 4 . 1003 . 1 1 7 TRP HD1 H 7.731 4.728 3.317 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HD1 . . . . . . . . . c30057_5j6t 1 . 4 . 1004 . 1 1 7 TRP HE1 H 8.298 7.165 2.692 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HE1 . . . . . . . . . c30057_5j6t 1 . 4 . 1005 . 1 1 7 TRP HE3 H 12.720 4.184 2.389 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HE3 . . . . . . . . . c30057_5j6t 1 . 4 . 1006 . 1 1 7 TRP HH2 H 13.054 8.367 1.447 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HH2 . . . . . . . . . c30057_5j6t 1 . 4 . 1007 . 1 1 7 TRP HZ2 H 10.630 8.665 1.891 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HZ2 . . . . . . . . . c30057_5j6t 1 . 4 . 1008 . 1 1 7 TRP HZ3 H 14.091 6.128 1.691 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HZ3 . . . . . . . . . c30057_5j6t 1 . 4 . 1009 . 1 1 7 TRP N N 9.403 1.216 1.615 . . . 1.0 . . . . . . . . . . . . A . 7 TRP N . . . . . . . . . c30057_5j6t 1 . 4 . 1010 . 1 1 7 TRP NE1 N 8.983 6.423 2.703 . . . 1.0 . . . . . . . . . . . . A . 7 TRP NE1 . . . . . . . . . c30057_5j6t 1 . 4 . 1011 . 1 1 7 TRP O O 12.804 1.790 1.705 . . . 1.0 . . . . . . . . . . . . A . 7 TRP O . . . . . . . . . c30057_5j6t 1 . 4 . 1012 . 1 1 8 PRO C C 13.607 -0.814 2.232 . . . 1.0 . . . . . . . . . . . . A . 8 PRO C . . . . . . . . . c30057_5j6t 1 . 4 . 1013 . 1 1 8 PRO CA C 12.936 -0.284 3.503 . . . 1.0 . . . . . . . . . . . . A . 8 PRO CA . . . . . . . . . c30057_5j6t 1 . 4 . 1014 . 1 1 8 PRO CB C 12.413 -1.435 4.358 . . . 1.0 . . . . . . . . . . . . A . 8 PRO CB . . . . . . . . . c30057_5j6t 1 . 4 . 1015 . 1 1 8 PRO CD C 10.542 0.033 3.896 . . . 1.0 . . . . . . . . . . . . A . 8 PRO CD . . . . . . . . . c30057_5j6t 1 . 4 . 1016 . 1 1 8 PRO CG C 11.080 -0.988 4.865 . . . 1.0 . . . . . . . . . . . . A . 8 PRO CG . . . . . . . . . c30057_5j6t 1 . 4 . 1017 . 1 1 8 PRO HA H 13.632 0.331 4.075 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HA . . . . . . . . . c30057_5j6t 1 . 4 . 1018 . 1 1 8 PRO HB2 H 12.301 -2.333 3.750 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HB2 . . . . . . . . . c30057_5j6t 1 . 4 . 1019 . 1 1 8 PRO HB3 H 13.090 -1.629 5.190 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HB3 . . . . . . . . . c30057_5j6t 1 . 4 . 1020 . 1 1 8 PRO HD2 H 9.816 -0.420 3.221 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HD2 . . . . . . . . . c30057_5j6t 1 . 4 . 1021 . 1 1 8 PRO HD3 H 10.087 0.864 4.437 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HD3 . . . . . . . . . c30057_5j6t 1 . 4 . 1022 . 1 1 8 PRO HG2 H 10.401 -1.839 4.923 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HG2 . . . . . . . . . c30057_5j6t 1 . 4 . 1023 . 1 1 8 PRO HG3 H 11.192 -0.538 5.851 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HG3 . . . . . . . . . c30057_5j6t 1 . 4 . 1024 . 1 1 8 PRO N N 11.721 0.493 3.157 . . . 1.0 . . . . . . . . . . . . A . 8 PRO N . . . . . . . . . c30057_5j6t 1 . 4 . 1025 . 1 1 8 PRO O O 14.809 -0.997 2.183 . . . 1.0 . . . . . . . . . . . . A . 8 PRO O . . . . . . . . . c30057_5j6t 1 . 4 . 1026 . 1 1 9 LEU C C 14.105 -0.424 -0.827 . . . 1.0 . . . . . . . . . . . . A . 9 LEU C . . . . . . . . . c30057_5j6t 1 . 4 . 1027 . 1 1 9 LEU CA C 13.430 -1.566 -0.067 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CA . . . . . . . . . c30057_5j6t 1 . 4 . 1028 . 1 1 9 LEU CB C 12.247 -2.118 -0.863 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CB . . . . . . . . . c30057_5j6t 1 . 4 . 1029 . 1 1 9 LEU CD1 C 13.197 -4.425 -1.009 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CD1 . . . . . . . . . c30057_5j6t 1 . 4 . 1030 . 1 1 9 LEU CD2 C 11.596 -3.619 -2.749 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CD2 . . . . . . . . . c30057_5j6t 1 . 4 . 1031 . 1 1 9 LEU CG C 12.736 -3.210 -1.816 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CG . . . . . . . . . c30057_5j6t 1 . 4 . 1032 . 1 1 9 LEU H H 11.844 -0.895 1.269 . . . 1.0 . . . . . . . . . . . . A . 9 LEU H . . . . . . . . . c30057_5j6t 1 . 4 . 1033 . 1 1 9 LEU HA H 14.148 -2.359 0.142 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HA . . . . . . . . . c30057_5j6t 1 . 4 . 1034 . 1 1 9 LEU HB2 H 11.512 -2.538 -0.177 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HB2 . . . . . . . . . c30057_5j6t 1 . 4 . 1035 . 1 1 9 LEU HB3 H 11.789 -1.313 -1.438 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HB3 . . . . . . . . . c30057_5j6t 1 . 4 . 1036 . 1 1 9 LEU HD11 H 14.010 -4.133 -0.344 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD11 . . . . . . . . . c30057_5j6t 1 . 4 . 1037 . 1 1 9 LEU HD12 H 13.545 -5.202 -1.689 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD12 . . . . . . . . . c30057_5j6t 1 . 4 . 1038 . 1 1 9 LEU HD13 H 12.363 -4.806 -0.419 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD13 . . . . . . . . . c30057_5j6t 1 . 4 . 1039 . 1 1 9 LEU HD21 H 11.943 -4.397 -3.429 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD21 . . . . . . . . . c30057_5j6t 1 . 4 . 1040 . 1 1 9 LEU HD22 H 10.762 -3.999 -2.158 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD22 . . . . . . . . . c30057_5j6t 1 . 4 . 1041 . 1 1 9 LEU HD23 H 11.269 -2.753 -3.325 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD23 . . . . . . . . . c30057_5j6t 1 . 4 . 1042 . 1 1 9 LEU HG H 13.570 -2.829 -2.407 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HG . . . . . . . . . c30057_5j6t 1 . 4 . 1043 . 1 1 9 LEU N N 12.839 -1.055 1.204 . . . 1.0 . . . . . . . . . . . . A . 9 LEU N . . . . . . . . . c30057_5j6t 1 . 4 . 1044 . 1 1 9 LEU O O 15.038 -0.629 -1.577 . . . 1.0 . . . . . . . . . . . . A . 9 LEU O . . . . . . . . . c30057_5j6t 1 . 4 . 1045 . 1 1 10 ALA C C 15.608 2.282 -0.713 . . . 1.0 . . . . . . . . . . . . A . 10 ALA C . . . . . . . . . c30057_5j6t 1 . 4 . 1046 . 1 1 10 ALA CA C 14.254 1.944 -1.341 . . . 1.0 . . . . . . . . . . . . A . 10 ALA CA . . . . . . . . . c30057_5j6t 1 . 4 . 1047 . 1 1 10 ALA CB C 13.267 3.095 -1.145 . . . 1.0 . . . . . . . . . . . . A . 10 ALA CB . . . . . . . . . c30057_5j6t 1 . 4 . 1048 . 1 1 10 ALA H H 12.862 0.928 -0.007 . . . 1.0 . . . . . . . . . . . . A . 10 ALA H . . . . . . . . . c30057_5j6t 1 . 4 . 1049 . 1 1 10 ALA HA H 14.373 1.723 -2.402 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HA . . . . . . . . . c30057_5j6t 1 . 4 . 1050 . 1 1 10 ALA HB1 H 13.649 3.990 -1.637 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HB1 . . . . . . . . . c30057_5j6t 1 . 4 . 1051 . 1 1 10 ALA HB2 H 13.146 3.292 -0.079 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HB2 . . . . . . . . . c30057_5j6t 1 . 4 . 1052 . 1 1 10 ALA HB3 H 12.304 2.826 -1.577 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HB3 . . . . . . . . . c30057_5j6t 1 . 4 . 1053 . 1 1 10 ALA N N 13.640 0.782 -0.635 . . . 1.0 . . . . . . . . . . . . A . 10 ALA N . . . . . . . . . c30057_5j6t 1 . 4 . 1054 . 1 1 10 ALA O O 16.520 2.728 -1.382 . . . 1.0 . . . . . . . . . . . . A . 10 ALA O . . . . . . . . . c30057_5j6t 1 . 4 . 1055 . 1 1 11 LEU C C 18.047 1.256 0.976 . . . 1.0 . . . . . . . . . . . . A . 11 LEU C . . . . . . . . . c30057_5j6t 1 . 4 . 1056 . 1 1 11 LEU CA C 17.035 2.373 1.246 . . . 1.0 . . . . . . . . . . . . A . 11 LEU CA . . . . . . . . . c30057_5j6t 1 . 4 . 1057 . 1 1 11 LEU CB C 16.696 2.441 2.736 . . . 1.0 . . . . . . . . . . . . A . 11 LEU CB . . . . . . . . . c30057_5j6t 1 . 4 . 1058 . 1 1 11 LEU CD1 C 15.387 3.925 4.260 . . . 1.0 . . . . . . . . . . . . A . 11 LEU CD1 . . . . . . . . . c30057_5j6t 1 . 4 . 1059 . 1 1 11 LEU CD2 C 17.721 4.542 3.616 . . . 1.0 . . . . . . . . . . . . A . 11 LEU CD2 . . . . . . . . . c30057_5j6t 1 . 4 . 1060 . 1 1 11 LEU CG C 16.422 3.892 3.134 . . . 1.0 . . . . . . . . . . . . A . 11 LEU CG . . . . . . . . . c30057_5j6t 1 . 4 . 1061 . 1 1 11 LEU H H 14.968 1.700 1.100 . . . 1.0 . . . . . . . . . . . . A . 11 LEU H . . . . . . . . . c30057_5j6t 1 . 4 . 1062 . 1 1 11 LEU HA H 17.427 3.331 0.904 . . . 1.0 . . . . . . . . . . . . A . 11 LEU HA . . . . . . . . . c30057_5j6t 1 . 4 . 1063 . 1 1 11 LEU HB2 H 15.811 1.837 2.935 . . . 1.0 . . . . . . . . . . . . A . 11 LEU HB2 . . . . . . . . . c30057_5j6t 1 . 4 . 1064 . 1 1 11 LEU HB3 H 17.535 2.058 3.318 . . . 1.0 . . . . . . . . . . . . A . 11 LEU HB3 . . . . . . . . . c30057_5j6t 1 . 4 . 1065 . 1 1 11 LEU HD11 H 15.191 4.959 4.544 . . . 1.0 . . . . . . . . . . . . A . 11 LEU HD11 . . . . . . . . . c30057_5j6t 1 . 4 . 1066 . 1 1 11 LEU HD12 H 15.770 3.379 5.122 . . . 1.0 . . . . . . . . . . . . A . 11 LEU HD12 . . . . . . . . . c30057_5j6t 1 . 4 . 1067 . 1 1 11 LEU HD13 H 14.462 3.461 3.918 . . . 1.0 . . . . . . . . . . . . A . 11 LEU HD13 . . . . . . . . . c30057_5j6t 1 . 4 . 1068 . 1 1 11 LEU HD21 H 17.527 5.577 3.899 . . . 1.0 . . . . . . . . . . . . A . 11 LEU HD21 . . . . . . . . . c30057_5j6t 1 . 4 . 1069 . 1 1 11 LEU HD22 H 18.102 3.995 4.478 . . . 1.0 . . . . . . . . . . . . A . 11 LEU HD22 . . . . . . . . . c30057_5j6t 1 . 4 . 1070 . 1 1 11 LEU HD23 H 18.459 4.517 2.814 . . . 1.0 . . . . . . . . . . . . A . 11 LEU HD23 . . . . . . . . . c30057_5j6t 1 . 4 . 1071 . 1 1 11 LEU HG H 16.039 4.439 2.272 . . . 1.0 . . . . . . . . . . . . A . 11 LEU HG . . . . . . . . . c30057_5j6t 1 . 4 . 1072 . 1 1 11 LEU N N 15.742 2.070 0.567 . . . 1.0 . . . . . . . . . . . . A . 11 LEU N . . . . . . . . . c30057_5j6t 1 . 4 . 1073 . 1 1 11 LEU O O 19.242 1.476 0.973 . . . 1.0 . . . . . . . . . . . . A . 11 LEU O . . . . . . . . . c30057_5j6t 1 . 4 . 1074 . 1 1 12 GLY C C 19.002 -0.988 -0.969 . . . 1.0 . . . . . . . . . . . . A . 12 GLY C . . . . . . . . . c30057_5j6t 1 . 4 . 1075 . 1 1 12 GLY CA C 18.505 -1.073 0.475 . . . 1.0 . . . . . . . . . . . . A . 12 GLY CA . . . . . . . . . c30057_5j6t 1 . 4 . 1076 . 1 1 12 GLY H H 16.576 -0.096 0.753 . . . 1.0 . . . . . . . . . . . . A . 12 GLY H . . . . . . . . . c30057_5j6t 1 . 4 . 1077 . 1 1 12 GLY HA2 H 19.354 -1.017 1.156 . . . 1.0 . . . . . . . . . . . . A . 12 GLY HA2 . . . . . . . . . c30057_5j6t 1 . 4 . 1078 . 1 1 12 GLY HA3 H 17.981 -2.017 0.625 . . . 1.0 . . . . . . . . . . . . A . 12 GLY HA3 . . . . . . . . . c30057_5j6t 1 . 4 . 1079 . 1 1 12 GLY N N 17.574 0.061 0.746 . . . 1.0 . . . . . . . . . . . . A . 12 GLY N . . . . . . . . . c30057_5j6t 1 . 4 . 1080 . 1 1 12 GLY O O 20.122 -1.352 -1.271 . . . 1.0 . . . . . . . . . . . . A . 12 GLY O . . . . . . . . . c30057_5j6t 1 . 4 . 1081 . 1 1 13 ALA C C 19.815 0.538 -3.402 . . . 1.0 . . . . . . . . . . . . A . 13 ALA C . . . . . . . . . c30057_5j6t 1 . 4 . 1082 . 1 1 13 ALA CA C 18.608 -0.394 -3.288 . . . 1.0 . . . . . . . . . . . . A . 13 ALA CA . . . . . . . . . c30057_5j6t 1 . 4 . 1083 . 1 1 13 ALA CB C 17.402 0.196 -4.021 . . . 1.0 . . . . . . . . . . . . A . 13 ALA CB . . . . . . . . . c30057_5j6t 1 . 4 . 1084 . 1 1 13 ALA H H 17.254 -0.210 -1.588 . . . 1.0 . . . . . . . . . . . . A . 13 ALA H . . . . . . . . . c30057_5j6t 1 . 4 . 1085 . 1 1 13 ALA HA H 18.851 -1.378 -3.689 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HA . . . . . . . . . c30057_5j6t 1 . 4 . 1086 . 1 1 13 ALA HB1 H 17.639 0.309 -5.079 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HB1 . . . . . . . . . c30057_5j6t 1 . 4 . 1087 . 1 1 13 ALA HB2 H 16.547 -0.472 -3.910 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HB2 . . . . . . . . . c30057_5j6t 1 . 4 . 1088 . 1 1 13 ALA HB3 H 17.159 1.170 -3.597 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HB3 . . . . . . . . . c30057_5j6t 1 . 4 . 1089 . 1 1 13 ALA N N 18.180 -0.507 -1.862 . . . 1.0 . . . . . . . . . . . . A . 13 ALA N . . . . . . . . . c30057_5j6t 1 . 4 . 1090 . 1 1 13 ALA O O 20.634 0.404 -4.291 . . . 1.0 . . . . . . . . . . . . A . 13 ALA O . . . . . . . . . c30057_5j6t 1 . 4 . 1091 . 1 1 14 LEU C C 22.337 1.750 -1.981 . . . 1.0 . . . . . . . . . . . . A . 14 LEU C . . . . . . . . . c30057_5j6t 1 . 4 . 1092 . 1 1 14 LEU CA C 21.086 2.422 -2.551 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CA . . . . . . . . . c30057_5j6t 1 . 4 . 1093 . 1 1 14 LEU CB C 20.664 3.607 -1.679 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CB . . . . . . . . . c30057_5j6t 1 . 4 . 1094 . 1 1 14 LEU CD1 C 21.957 5.276 -3.014 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CD1 . . . . . . . . . c30057_5j6t 1 . 4 . 1095 . 1 1 14 LEU CD2 C 21.445 5.725 -0.612 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CD2 . . . . . . . . . c30057_5j6t 1 . 4 . 1096 . 1 1 14 LEU CG C 21.791 4.639 -1.634 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CG . . . . . . . . . c30057_5j6t 1 . 4 . 1097 . 1 1 14 LEU H H 19.238 1.567 -1.776 . . . 1.0 . . . . . . . . . . . . A . 14 LEU H . . . . . . . . . c30057_5j6t 1 . 4 . 1098 . 1 1 14 LEU HA H 21.266 2.750 -3.575 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HA . . . . . . . . . c30057_5j6t 1 . 4 . 1099 . 1 1 14 LEU HB2 H 19.769 4.065 -2.099 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HB2 . . . . . . . . . c30057_5j6t 1 . 4 . 1100 . 1 1 14 LEU HB3 H 20.452 3.257 -0.669 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HB3 . . . . . . . . . c30057_5j6t 1 . 4 . 1101 . 1 1 14 LEU HD11 H 22.203 4.504 -3.743 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD11 . . . . . . . . . c30057_5j6t 1 . 4 . 1102 . 1 1 14 LEU HD12 H 21.026 5.764 -3.303 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD12 . . . . . . . . . c30057_5j6t 1 . 4 . 1103 . 1 1 14 LEU HD13 H 22.759 6.013 -2.980 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD13 . . . . . . . . . c30057_5j6t 1 . 4 . 1104 . 1 1 14 LEU HD21 H 22.247 6.462 -0.578 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD21 . . . . . . . . . c30057_5j6t 1 . 4 . 1105 . 1 1 14 LEU HD22 H 21.327 5.272 0.372 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD22 . . . . . . . . . c30057_5j6t 1 . 4 . 1106 . 1 1 14 LEU HD23 H 20.515 6.213 -0.902 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD23 . . . . . . . . . c30057_5j6t 1 . 4 . 1107 . 1 1 14 LEU HG H 22.722 4.150 -1.345 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HG . . . . . . . . . c30057_5j6t 1 . 4 . 1108 . 1 1 14 LEU N N 19.932 1.478 -2.505 . . . 1.0 . . . . . . . . . . . . A . 14 LEU N . . . . . . . . . c30057_5j6t 1 . 4 . 1109 . 1 1 14 LEU O O 23.387 1.753 -2.592 . . . 1.0 . . . . . . . . . . . . A . 14 LEU O . . . . . . . . . c30057_5j6t 1 . 4 . 1110 . 1 1 15 LYS C C 23.958 -0.580 -1.147 . . . 1.0 . . . . . . . . . . . . A . 15 LYS C . . . . . . . . . c30057_5j6t 1 . 4 . 1111 . 1 1 15 LYS CA C 23.416 0.497 -0.202 . . . 1.0 . . . . . . . . . . . . A . 15 LYS CA . . . . . . . . . c30057_5j6t 1 . 4 . 1112 . 1 1 15 LYS CB C 22.896 -0.137 1.093 . . . 1.0 . . . . . . . . . . . . A . 15 LYS CB . . . . . . . . . c30057_5j6t 1 . 4 . 1113 . 1 1 15 LYS CD C 23.268 1.930 2.448 . . . 1.0 . . . . . . . . . . . . A . 15 LYS CD . . . . . . . . . c30057_5j6t 1 . 4 . 1114 . 1 1 15 LYS CE C 21.820 2.041 2.930 . . . 1.0 . . . . . . . . . . . . A . 15 LYS CE . . . . . . . . . c30057_5j6t 1 . 4 . 1115 . 1 1 15 LYS CG C 23.643 0.456 2.291 . . . 1.0 . . . . . . . . . . . . A . 15 LYS CG . . . . . . . . . c30057_5j6t 1 . 4 . 1116 . 1 1 15 LYS H H 21.349 1.181 -0.324 . . . 1.0 . . . . . . . . . . . . A . 15 LYS H . . . . . . . . . c30057_5j6t 1 . 4 . 1117 . 1 1 15 LYS HA H 24.193 1.228 0.022 . . . 1.0 . . . . . . . . . . . . A . 15 LYS HA . . . . . . . . . c30057_5j6t 1 . 4 . 1118 . 1 1 15 LYS HB2 H 21.830 0.065 1.193 . . . 1.0 . . . . . . . . . . . . A . 15 LYS HB2 . . . . . . . . . c30057_5j6t 1 . 4 . 1119 . 1 1 15 LYS HB3 H 23.060 -1.214 1.060 . . . 1.0 . . . . . . . . . . . . A . 15 LYS HB3 . . . . . . . . . c30057_5j6t 1 . 4 . 1120 . 1 1 15 LYS HD2 H 23.930 2.397 3.177 . . . 1.0 . . . . . . . . . . . . A . 15 LYS HD2 . . . . . . . . . c30057_5j6t 1 . 4 . 1121 . 1 1 15 LYS HD3 H 23.370 2.435 1.488 . . . 1.0 . . . . . . . . . . . . A . 15 LYS HD3 . . . . . . . . . c30057_5j6t 1 . 4 . 1122 . 1 1 15 LYS HE2 H 21.152 2.247 2.094 . . . 1.0 . . . . . . . . . . . . A . 15 LYS HE2 . . . . . . . . . c30057_5j6t 1 . 4 . 1123 . 1 1 15 LYS HE3 H 21.520 1.122 3.434 . . . 1.0 . . . . . . . . . . . . A . 15 LYS HE3 . . . . . . . . . c30057_5j6t 1 . 4 . 1124 . 1 1 15 LYS HG2 H 23.367 -0.087 3.195 . . . 1.0 . . . . . . . . . . . . A . 15 LYS HG2 . . . . . . . . . c30057_5j6t 1 . 4 . 1125 . 1 1 15 LYS HG3 H 24.717 0.370 2.129 . . . 1.0 . . . . . . . . . . . . A . 15 LYS HG3 . . . . . . . . . c30057_5j6t 1 . 4 . 1126 . 1 1 15 LYS HZ1 H 20.888 3.312 4.256 . . . 1.0 . . . . . . . . . . . . A . 15 LYS HZ1 . . . . . . . . . c30057_5j6t 1 . 4 . 1127 . 1 1 15 LYS HZ2 H 22.452 2.974 4.653 . . . 1.0 . . . . . . . . . . . . A . 15 LYS HZ2 . . . . . . . . . c30057_5j6t 1 . 4 . 1128 . 1 1 15 LYS HZ3 H 22.122 4.018 3.419 . . . 1.0 . . . . . . . . . . . . A . 15 LYS HZ3 . . . . . . . . . c30057_5j6t 1 . 4 . 1129 . 1 1 15 LYS N N 22.232 1.171 -0.814 . . . 1.0 . . . . . . . . . . . . A . 15 LYS N . . . . . . . . . c30057_5j6t 1 . 4 . 1130 . 1 1 15 LYS NZ N 21.820 3.177 3.892 . . . 1.0 . . . . . . . . . . . . A . 15 LYS NZ . . . . . . . . . c30057_5j6t 1 . 4 . 1131 . 1 1 15 LYS O O 25.146 -0.828 -1.203 . . . 1.0 . . . . . . . . . . . . A . 15 LYS O . . . . . . . . . c30057_5j6t 1 . 4 . 1132 . 1 1 16 ASN C C 24.356 -1.651 -3.977 . . . 1.0 . . . . . . . . . . . . A . 16 ASN C . . . . . . . . . c30057_5j6t 1 . 4 . 1133 . 1 1 16 ASN CA C 23.555 -2.276 -2.834 . . . 1.0 . . . . . . . . . . . . A . 16 ASN CA . . . . . . . . . c30057_5j6t 1 . 4 . 1134 . 1 1 16 ASN CB C 22.274 -2.917 -3.368 . . . 1.0 . . . . . . . . . . . . A . 16 ASN CB . . . . . . . . . c30057_5j6t 1 . 4 . 1135 . 1 1 16 ASN CG C 21.768 -3.959 -2.368 . . . 1.0 . . . . . . . . . . . . A . 16 ASN CG . . . . . . . . . c30057_5j6t 1 . 4 . 1136 . 1 1 16 ASN H H 22.112 -0.990 -1.826 . . . 1.0 . . . . . . . . . . . . A . 16 ASN H . . . . . . . . . c30057_5j6t 1 . 4 . 1137 . 1 1 16 ASN HA H 24.159 -3.016 -2.308 . . . 1.0 . . . . . . . . . . . . A . 16 ASN HA . . . . . . . . . c30057_5j6t 1 . 4 . 1138 . 1 1 16 ASN HB2 H 21.514 -2.148 -3.506 . . . 1.0 . . . . . . . . . . . . A . 16 ASN HB2 . . . . . . . . . c30057_5j6t 1 . 4 . 1139 . 1 1 16 ASN HB3 H 22.480 -3.400 -4.323 . . . 1.0 . . . . . . . . . . . . A . 16 ASN HB3 . . . . . . . . . c30057_5j6t 1 . 4 . 1140 . 1 1 16 ASN HD21 H 21.508 -2.611 -0.900 . . . 1.0 . . . . . . . . . . . . A . 16 ASN HD21 . . . . . . . . . c30057_5j6t 1 . 4 . 1141 . 1 1 16 ASN HD22 H 21.097 -4.263 -0.497 . . . 1.0 . . . . . . . . . . . . A . 16 ASN HD22 . . . . . . . . . c30057_5j6t 1 . 4 . 1142 . 1 1 16 ASN N N 23.094 -1.216 -1.890 . . . 1.0 . . . . . . . . . . . . A . 16 ASN N . . . . . . . . . c30057_5j6t 1 . 4 . 1143 . 1 1 16 ASN ND2 N 21.432 -3.582 -1.164 . . . 1.0 . . . . . . . . . . . . A . 16 ASN ND2 . . . . . . . . . c30057_5j6t 1 . 4 . 1144 . 1 1 16 ASN O O 25.329 -2.210 -4.445 . . . 1.0 . . . . . . . . . . . . A . 16 ASN O . . . . . . . . . c30057_5j6t 1 . 4 . 1145 . 1 1 16 ASN OD1 O 21.677 -5.128 -2.687 . . . 1.0 . . . . . . . . . . . . A . 16 ASN OD1 . . . . . . . . . c30057_5j6t 1 . 4 . 1146 . 1 1 17 LEU C C 26.081 0.608 -5.074 . . . 1.0 . . . . . . . . . . . . A . 17 LEU C . . . . . . . . . c30057_5j6t 1 . 4 . 1147 . 1 1 17 LEU CA C 24.691 0.172 -5.545 . . . 1.0 . . . . . . . . . . . . A . 17 LEU CA . . . . . . . . . c30057_5j6t 1 . 4 . 1148 . 1 1 17 LEU CB C 23.843 1.390 -5.913 . . . 1.0 . . . . . . . . . . . . A . 17 LEU CB . . . . . . . . . c30057_5j6t 1 . 4 . 1149 . 1 1 17 LEU CD1 C 23.504 1.487 -8.387 . . . 1.0 . . . . . . . . . . . . A . 17 LEU CD1 . . . . . . . . . c30057_5j6t 1 . 4 . 1150 . 1 1 17 LEU CD2 C 24.262 3.519 -7.152 . . . 1.0 . . . . . . . . . . . . A . 17 LEU CD2 . . . . . . . . . c30057_5j6t 1 . 4 . 1151 . 1 1 17 LEU CG C 24.356 1.994 -7.223 . . . 1.0 . . . . . . . . . . . . A . 17 LEU CG . . . . . . . . . c30057_5j6t 1 . 4 . 1152 . 1 1 17 LEU H H 23.143 -0.048 -4.026 . . . 1.0 . . . . . . . . . . . . A . 17 LEU H . . . . . . . . . c30057_5j6t 1 . 4 . 1153 . 1 1 17 LEU HA H 24.775 -0.502 -6.398 . . . 1.0 . . . . . . . . . . . . A . 17 LEU HA . . . . . . . . . c30057_5j6t 1 . 4 . 1154 . 1 1 17 LEU HB2 H 22.804 1.085 -6.037 . . . 1.0 . . . . . . . . . . . . A . 17 LEU HB2 . . . . . . . . . c30057_5j6t 1 . 4 . 1155 . 1 1 17 LEU HB3 H 23.911 2.134 -5.119 . . . 1.0 . . . . . . . . . . . . A . 17 LEU HB3 . . . . . . . . . c30057_5j6t 1 . 4 . 1156 . 1 1 17 LEU HD11 H 23.570 0.400 -8.440 . . . 1.0 . . . . . . . . . . . . A . 17 LEU HD11 . . . . . . . . . c30057_5j6t 1 . 4 . 1157 . 1 1 17 LEU HD12 H 22.466 1.780 -8.233 . . . 1.0 . . . . . . . . . . . . A . 17 LEU HD12 . . . . . . . . . c30057_5j6t 1 . 4 . 1158 . 1 1 17 LEU HD13 H 23.869 1.918 -9.319 . . . 1.0 . . . . . . . . . . . . A . 17 LEU HD13 . . . . . . . . . c30057_5j6t 1 . 4 . 1159 . 1 1 17 LEU HD21 H 24.868 3.883 -6.322 . . . 1.0 . . . . . . . . . . . . A . 17 LEU HD21 . . . . . . . . . c30057_5j6t 1 . 4 . 1160 . 1 1 17 LEU HD22 H 24.627 3.949 -8.084 . . . 1.0 . . . . . . . . . . . . A . 17 LEU HD22 . . . . . . . . . c30057_5j6t 1 . 4 . 1161 . 1 1 17 LEU HD23 H 23.223 3.812 -6.999 . . . 1.0 . . . . . . . . . . . . A . 17 LEU HD23 . . . . . . . . . c30057_5j6t 1 . 4 . 1162 . 1 1 17 LEU HG H 25.394 1.701 -7.376 . . . 1.0 . . . . . . . . . . . . A . 17 LEU HG . . . . . . . . . c30057_5j6t 1 . 4 . 1163 . 1 1 17 LEU N N 23.955 -0.493 -4.431 . . . 1.0 . . . . . . . . . . . . A . 17 LEU N . . . . . . . . . c30057_5j6t 1 . 4 . 1164 . 1 1 17 LEU O O 27.035 0.592 -5.828 . . . 1.0 . . . . . . . . . . . . A . 17 LEU O . . . . . . . . . c30057_5j6t 1 . 4 . 1165 . 1 1 18 ILE C C 28.280 0.255 -2.700 . . . 1.0 . . . . . . . . . . . . A . 18 ILE C . . . . . . . . . c30057_5j6t 1 . 4 . 1166 . 1 1 18 ILE CA C 27.524 1.438 -3.312 . . . 1.0 . . . . . . . . . . . . A . 18 ILE CA . . . . . . . . . c30057_5j6t 1 . 4 . 1167 . 1 1 18 ILE CB C 27.203 2.488 -2.245 . . . 1.0 . . . . . . . . . . . . A . 18 ILE CB . . . . . . . . . c30057_5j6t 1 . 4 . 1168 . 1 1 18 ILE CD1 C 26.410 2.736 0.117 . . . 1.0 . . . . . . . . . . . . A . 18 ILE CD1 . . . . . . . . . c30057_5j6t 1 . 4 . 1169 . 1 1 18 ILE CG1 C 26.333 1.871 -1.144 . . . 1.0 . . . . . . . . . . . . A . 18 ILE CG1 . . . . . . . . . c30057_5j6t 1 . 4 . 1170 . 1 1 18 ILE CG2 C 26.454 3.657 -2.887 . . . 1.0 . . . . . . . . . . . . A . 18 ILE CG2 . . . . . . . . . c30057_5j6t 1 . 4 . 1171 . 1 1 18 ILE H H 25.391 1.003 -3.229 . . . 1.0 . . . . . . . . . . . . A . 18 ILE H . . . . . . . . . c30057_5j6t 1 . 4 . 1172 . 1 1 18 ILE HA H 28.113 1.885 -4.113 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HA . . . . . . . . . c30057_5j6t 1 . 4 . 1173 . 1 1 18 ILE HB H 28.133 2.853 -1.808 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HB . . . . . . . . . c30057_5j6t 1 . 4 . 1174 . 1 1 18 ILE HD11 H 25.791 2.296 0.898 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HD11 . . . . . . . . . c30057_5j6t 1 . 4 . 1175 . 1 1 18 ILE HD12 H 26.051 3.740 -0.109 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HD12 . . . . . . . . . c30057_5j6t 1 . 4 . 1176 . 1 1 18 ILE HD13 H 27.444 2.788 0.458 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HD13 . . . . . . . . . c30057_5j6t 1 . 4 . 1177 . 1 1 18 ILE HG12 H 25.299 1.819 -1.486 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HG12 . . . . . . . . . c30057_5j6t 1 . 4 . 1178 . 1 1 18 ILE HG13 H 26.692 0.867 -0.918 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HG13 . . . . . . . . . c30057_5j6t 1 . 4 . 1179 . 1 1 18 ILE HG21 H 27.070 4.099 -3.670 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HG21 . . . . . . . . . c30057_5j6t 1 . 4 . 1180 . 1 1 18 ILE HG22 H 26.237 4.409 -2.128 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HG22 . . . . . . . . . c30057_5j6t 1 . 4 . 1181 . 1 1 18 ILE HG23 H 25.520 3.297 -3.319 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HG23 . . . . . . . . . c30057_5j6t 1 . 4 . 1182 . 1 1 18 ILE N N 26.199 0.998 -3.835 . . . 1.0 . . . . . . . . . . . . A . 18 ILE N . . . . . . . . . c30057_5j6t 1 . 4 . 1183 . 1 1 18 ILE O O 29.492 0.268 -2.600 . . . 1.0 . . . . . . . . . . . . A . 18 ILE O . . . . . . . . . c30057_5j6t 1 . 4 . 1184 . 1 1 19 LYS C C 28.126 -3.166 -2.605 . . . 1.0 . . . . . . . . . . . . A . 19 LYS C . . . . . . . . . c30057_5j6t 1 . 4 . 1185 . 1 1 19 LYS CA C 28.260 -1.949 -1.685 . . . 1.0 . . . . . . . . . . . . A . 19 LYS CA . . . . . . . . . c30057_5j6t 1 . 4 . 1186 . 1 1 19 LYS CB C 27.531 -2.194 -0.361 . . . 1.0 . . . . . . . . . . . . A . 19 LYS CB . . . . . . . . . c30057_5j6t 1 . 4 . 1187 . 1 1 19 LYS CD C 28.915 -1.299 1.520 . . . 1.0 . . . . . . . . . . . . A . 19 LYS CD . . . . . . . . . c30057_5j6t 1 . 4 . 1188 . 1 1 19 LYS CE C 29.035 -1.647 3.004 . . . 1.0 . . . . . . . . . . . . A . 19 LYS CE . . . . . . . . . c30057_5j6t 1 . 4 . 1189 . 1 1 19 LYS CG C 28.546 -2.554 0.726 . . . 1.0 . . . . . . . . . . . . A . 19 LYS CG . . . . . . . . . c30057_5j6t 1 . 4 . 1190 . 1 1 19 LYS H H 26.571 -0.759 -2.381 . . . 1.0 . . . . . . . . . . . . A . 19 LYS H . . . . . . . . . c30057_5j6t 1 . 4 . 1191 . 1 1 19 LYS HA H 29.311 -1.727 -1.503 . . . 1.0 . . . . . . . . . . . . A . 19 LYS HA . . . . . . . . . c30057_5j6t 1 . 4 . 1192 . 1 1 19 LYS HB2 H 26.994 -1.290 -0.071 . . . 1.0 . . . . . . . . . . . . A . 19 LYS HB2 . . . . . . . . . c30057_5j6t 1 . 4 . 1193 . 1 1 19 LYS HB3 H 26.823 -3.013 -0.482 . . . 1.0 . . . . . . . . . . . . A . 19 LYS HB3 . . . . . . . . . c30057_5j6t 1 . 4 . 1194 . 1 1 19 LYS HD2 H 29.867 -0.908 1.160 . . . 1.0 . . . . . . . . . . . . A . 19 LYS HD2 . . . . . . . . . c30057_5j6t 1 . 4 . 1195 . 1 1 19 LYS HD3 H 28.139 -0.545 1.386 . . . 1.0 . . . . . . . . . . . . A . 19 LYS HD3 . . . . . . . . . c30057_5j6t 1 . 4 . 1196 . 1 1 19 LYS HE2 H 28.875 -0.762 3.619 . . . 1.0 . . . . . . . . . . . . A . 19 LYS HE2 . . . . . . . . . c30057_5j6t 1 . 4 . 1197 . 1 1 19 LYS HE3 H 28.318 -2.424 3.267 . . . 1.0 . . . . . . . . . . . . A . 19 LYS HE3 . . . . . . . . . c30057_5j6t 1 . 4 . 1198 . 1 1 19 LYS HG2 H 28.111 -3.293 1.398 . . . 1.0 . . . . . . . . . . . . A . 19 LYS HG2 . . . . . . . . . c30057_5j6t 1 . 4 . 1199 . 1 1 19 LYS HG3 H 29.443 -2.967 0.263 . . . 1.0 . . . . . . . . . . . . A . 19 LYS HG3 . . . . . . . . . c30057_5j6t 1 . 4 . 1200 . 1 1 19 LYS HZ1 H 30.580 -2.406 4.134 . . . 1.0 . . . . . . . . . . . . A . 19 LYS HZ1 . . . . . . . . . c30057_5j6t 1 . 4 . 1201 . 1 1 19 LYS HZ2 H 30.559 -2.966 2.582 . . . 1.0 . . . . . . . . . . . . A . 19 LYS HZ2 . . . . . . . . . c30057_5j6t 1 . 4 . 1202 . 1 1 19 LYS HZ3 H 31.080 -1.433 2.899 . . . 1.0 . . . . . . . . . . . . A . 19 LYS HZ3 . . . . . . . . . c30057_5j6t 1 . 4 . 1203 . 1 1 19 LYS N N 27.577 -0.768 -2.289 . . . 1.0 . . . . . . . . . . . . A . 19 LYS N . . . . . . . . . c30057_5j6t 1 . 4 . 1204 . 1 1 19 LYS NZ N 30.425 -2.154 3.168 . . . 1.0 . . . . . . . . . . . . A . 19 LYS NZ . . . . . . . . . c30057_5j6t 1 . 4 . 1205 . 1 1 19 LYS O O 29.108 -3.710 -3.065 . . . 1.0 . . . . . . . . . . . . A . 19 LYS O . . . . . . . . . c30057_5j6t 1 . 4 . 1206 . 1 1 20 NH2 HN1 H 26.117 -3.167 -2.514 . . . 1.0 . . . . . . . . . . . . A . 20 NH2 HN1 . . . . . . . . . c30057_5j6t 1 . 4 . 1207 . 1 1 20 NH2 HN2 H 26.836 -4.420 -3.501 . . . 1.0 . . . . . . . . . . . . A . 20 NH2 HN2 . . . . . . . . . c30057_5j6t 1 . 4 . 1208 . 1 1 20 NH2 N N 26.937 -3.618 -2.895 . . . 1.0 . . . . . . . . . . . . A . 20 NH2 N . . . . . . . . . c30057_5j6t 1 . 5 . 1209 . 1 1 1 ACE C C 0.431 -2.193 2.838 . . . 1.0 . . . . . . . . . . . . A . 1 ACE C . . . . . . . . . c30057_5j6t 1 . 5 . 1210 . 1 1 1 ACE CH3 C -1.029 -1.782 2.645 . . . 1.0 . . . . . . . . . . . . A . 1 ACE CH3 . . . . . . . . . c30057_5j6t 1 . 5 . 1211 . 1 1 1 ACE H1 H -1.478 -1.568 3.615 . . . 1.0 . . . . . . . . . . . . A . 1 ACE H1 . . . . . . . . . c30057_5j6t 1 . 5 . 1212 . 1 1 1 ACE H2 H -1.075 -0.891 2.018 . . . 1.0 . . . . . . . . . . . . A . 1 ACE H2 . . . . . . . . . c30057_5j6t 1 . 5 . 1213 . 1 1 1 ACE H3 H -1.574 -2.594 2.164 . . . 1.0 . . . . . . . . . . . . A . 1 ACE H3 . . . . . . . . . c30057_5j6t 1 . 5 . 1214 . 1 1 1 ACE O O 0.930 -2.245 3.946 . . . 1.0 . . . . . . . . . . . . A . 1 ACE O . . . . . . . . . c30057_5j6t 1 . 5 . 1215 . 1 1 2 ILE C C 3.472 -1.694 1.644 . . . 1.0 . . . . . . . . . . . . A . 2 ILE C . . . . . . . . . c30057_5j6t 1 . 5 . 1216 . 1 1 2 ILE CA C 2.551 -2.896 1.887 . . . 1.0 . . . . . . . . . . . . A . 2 ILE CA . . . . . . . . . c30057_5j6t 1 . 5 . 1217 . 1 1 2 ILE CB C 2.752 -3.955 0.799 . . . 1.0 . . . . . . . . . . . . A . 2 ILE CB . . . . . . . . . c30057_5j6t 1 . 5 . 1218 . 1 1 2 ILE CD1 C 1.778 -6.036 -0.189 . . . 1.0 . . . . . . . . . . . . A . 2 ILE CD1 . . . . . . . . . c30057_5j6t 1 . 5 . 1219 . 1 1 2 ILE CG1 C 1.787 -5.120 1.038 . . . 1.0 . . . . . . . . . . . . A . 2 ILE CG1 . . . . . . . . . c30057_5j6t 1 . 5 . 1220 . 1 1 2 ILE CG2 C 4.191 -4.474 0.844 . . . 1.0 . . . . . . . . . . . . A . 2 ILE CG2 . . . . . . . . . c30057_5j6t 1 . 5 . 1221 . 1 1 2 ILE H H 0.686 -2.437 0.858 . . . 1.0 . . . . . . . . . . . . A . 2 ILE H . . . . . . . . . c30057_5j6t 1 . 5 . 1222 . 1 1 2 ILE HA H 2.741 -3.324 2.871 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HA . . . . . . . . . c30057_5j6t 1 . 5 . 1223 . 1 1 2 ILE HB H 2.555 -3.515 -0.179 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HB . . . . . . . . . c30057_5j6t 1 . 5 . 1224 . 1 1 2 ILE HD11 H 1.092 -6.865 -0.019 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HD11 . . . . . . . . . c30057_5j6t 1 . 5 . 1225 . 1 1 2 ILE HD12 H 2.782 -6.425 -0.359 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HD12 . . . . . . . . . c30057_5j6t 1 . 5 . 1226 . 1 1 2 ILE HD13 H 1.455 -5.470 -1.062 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HD13 . . . . . . . . . c30057_5j6t 1 . 5 . 1227 . 1 1 2 ILE HG12 H 2.111 -5.687 1.912 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HG12 . . . . . . . . . c30057_5j6t 1 . 5 . 1228 . 1 1 2 ILE HG13 H 0.783 -4.732 1.209 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HG13 . . . . . . . . . c30057_5j6t 1 . 5 . 1229 . 1 1 2 ILE HG21 H 4.199 -5.545 0.640 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HG21 . . . . . . . . . c30057_5j6t 1 . 5 . 1230 . 1 1 2 ILE HG22 H 4.788 -3.957 0.093 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HG22 . . . . . . . . . c30057_5j6t 1 . 5 . 1231 . 1 1 2 ILE HG23 H 4.612 -4.290 1.833 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HG23 . . . . . . . . . c30057_5j6t 1 . 5 . 1232 . 1 1 2 ILE N N 1.121 -2.487 1.768 . . . 1.0 . . . . . . . . . . . . A . 2 ILE N . . . . . . . . . c30057_5j6t 1 . 5 . 1233 . 1 1 2 ILE O O 4.651 -1.846 1.395 . . . 1.0 . . . . . . . . . . . . A . 2 ILE O . . . . . . . . . c30057_5j6t 1 . 5 . 1234 . 1 1 3 PHE C C 4.899 0.776 2.547 . . . 1.0 . . . . . . . . . . . . A . 3 PHE C . . . . . . . . . c30057_5j6t 1 . 5 . 1235 . 1 1 3 PHE CA C 3.793 0.709 1.494 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CA . . . . . . . . . c30057_5j6t 1 . 5 . 1236 . 1 1 3 PHE CB C 2.844 1.899 1.638 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CB . . . . . . . . . c30057_5j6t 1 . 5 . 1237 . 1 1 3 PHE CD1 C 3.827 4.119 2.314 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CD1 . . . . . . . . . c30057_5j6t 1 . 5 . 1238 . 1 1 3 PHE CD2 C 4.026 3.407 0.003 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CD2 . . . . . . . . . c30057_5j6t 1 . 5 . 1239 . 1 1 3 PHE CE1 C 4.513 5.301 2.009 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CE1 . . . . . . . . . c30057_5j6t 1 . 5 . 1240 . 1 1 3 PHE CE2 C 4.712 4.589 -0.301 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CE2 . . . . . . . . . c30057_5j6t 1 . 5 . 1241 . 1 1 3 PHE CG C 3.583 3.172 1.310 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CG . . . . . . . . . c30057_5j6t 1 . 5 . 1242 . 1 1 3 PHE CZ C 4.954 5.536 0.701 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CZ . . . . . . . . . c30057_5j6t 1 . 5 . 1243 . 1 1 3 PHE H H 1.961 -0.394 1.927 . . . 1.0 . . . . . . . . . . . . A . 3 PHE H . . . . . . . . . c30057_5j6t 1 . 5 . 1244 . 1 1 3 PHE HA H 4.225 0.688 0.493 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HA . . . . . . . . . c30057_5j6t 1 . 5 . 1245 . 1 1 3 PHE HB2 H 2.004 1.779 0.954 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HB2 . . . . . . . . . c30057_5j6t 1 . 5 . 1246 . 1 1 3 PHE HB3 H 2.474 1.947 2.663 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HB3 . . . . . . . . . c30057_5j6t 1 . 5 . 1247 . 1 1 3 PHE HD1 H 3.486 3.936 3.322 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HD1 . . . . . . . . . c30057_5j6t 1 . 5 . 1248 . 1 1 3 PHE HD2 H 3.838 2.677 -0.770 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HD2 . . . . . . . . . c30057_5j6t 1 . 5 . 1249 . 1 1 3 PHE HE1 H 4.701 6.032 2.782 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HE1 . . . . . . . . . c30057_5j6t 1 . 5 . 1250 . 1 1 3 PHE HE2 H 5.054 4.771 -1.309 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HE2 . . . . . . . . . c30057_5j6t 1 . 5 . 1251 . 1 1 3 PHE HZ H 5.482 6.448 0.466 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HZ . . . . . . . . . c30057_5j6t 1 . 5 . 1252 . 1 1 3 PHE N N 2.943 -0.499 1.718 . . . 1.0 . . . . . . . . . . . . A . 3 PHE N . . . . . . . . . c30057_5j6t 1 . 5 . 1253 . 1 1 3 PHE O O 6.026 1.130 2.255 . . . 1.0 . . . . . . . . . . . . A . 3 PHE O . . . . . . . . . c30057_5j6t 1 . 5 . 1254 . 1 1 4 GLY C C 6.770 -0.477 4.488 . . . 1.0 . . . . . . . . . . . . A . 4 GLY C . . . . . . . . . c30057_5j6t 1 . 5 . 1255 . 1 1 4 GLY CA C 5.624 0.475 4.844 . . . 1.0 . . . . . . . . . . . . A . 4 GLY CA . . . . . . . . . c30057_5j6t 1 . 5 . 1256 . 1 1 4 GLY H H 3.647 0.147 3.988 . . . 1.0 . . . . . . . . . . . . A . 4 GLY H . . . . . . . . . c30057_5j6t 1 . 5 . 1257 . 1 1 4 GLY HA2 H 6.011 1.490 4.939 . . . 1.0 . . . . . . . . . . . . A . 4 GLY HA2 . . . . . . . . . c30057_5j6t 1 . 5 . 1258 . 1 1 4 GLY HA3 H 5.177 0.167 5.789 . . . 1.0 . . . . . . . . . . . . A . 4 GLY HA3 . . . . . . . . . c30057_5j6t 1 . 5 . 1259 . 1 1 4 GLY N N 4.589 0.437 3.770 . . . 1.0 . . . . . . . . . . . . A . 4 GLY N . . . . . . . . . c30057_5j6t 1 . 5 . 1260 . 1 1 4 GLY O O 7.862 -0.364 5.008 . . . 1.0 . . . . . . . . . . . . A . 4 GLY O . . . . . . . . . c30057_5j6t 1 . 5 . 1261 . 1 1 5 ALA C C 8.386 -1.834 2.008 . . . 1.0 . . . . . . . . . . . . A . 5 ALA C . . . . . . . . . c30057_5j6t 1 . 5 . 1262 . 1 1 5 ALA CA C 7.606 -2.368 3.215 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CA . . . . . . . . . c30057_5j6t 1 . 5 . 1263 . 1 1 5 ALA CB C 6.873 -3.659 2.849 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CB . . . . . . . . . c30057_5j6t 1 . 5 . 1264 . 1 1 5 ALA H H 5.613 -1.487 3.188 . . . 1.0 . . . . . . . . . . . . A . 5 ALA H . . . . . . . . . c30057_5j6t 1 . 5 . 1265 . 1 1 5 ALA HA H 8.280 -2.541 4.054 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HA . . . . . . . . . c30057_5j6t 1 . 5 . 1266 . 1 1 5 ALA HB1 H 7.339 -4.500 3.362 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB1 . . . . . . . . . c30057_5j6t 1 . 5 . 1267 . 1 1 5 ALA HB2 H 5.829 -3.583 3.151 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB2 . . . . . . . . . c30057_5j6t 1 . 5 . 1268 . 1 1 5 ALA HB3 H 6.930 -3.816 1.771 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB3 . . . . . . . . . c30057_5j6t 1 . 5 . 1269 . 1 1 5 ALA N N 6.529 -1.412 3.606 . . . 1.0 . . . . . . . . . . . . A . 5 ALA N . . . . . . . . . c30057_5j6t 1 . 5 . 1270 . 1 1 5 ALA O O 9.449 -2.325 1.681 . . . 1.0 . . . . . . . . . . . . A . 5 ALA O . . . . . . . . . c30057_5j6t 1 . 5 . 1271 . 1 1 6 ILE C C 9.619 0.762 0.608 . . . 1.0 . . . . . . . . . . . . A . 6 ILE C . . . . . . . . . c30057_5j6t 1 . 5 . 1272 . 1 1 6 ILE CA C 8.584 -0.272 0.161 . . . 1.0 . . . . . . . . . . . . A . 6 ILE CA . . . . . . . . . c30057_5j6t 1 . 5 . 1273 . 1 1 6 ILE CB C 7.493 0.393 -0.683 . . . 1.0 . . . . . . . . . . . . A . 6 ILE CB . . . . . . . . . c30057_5j6t 1 . 5 . 1274 . 1 1 6 ILE CD1 C 7.109 -1.776 -1.890 . . . 1.0 . . . . . . . . . . . . A . 6 ILE CD1 . . . . . . . . . c30057_5j6t 1 . 5 . 1275 . 1 1 6 ILE CG1 C 6.444 -0.652 -1.088 . . . 1.0 . . . . . . . . . . . . A . 6 ILE CG1 . . . . . . . . . c30057_5j6t 1 . 5 . 1276 . 1 1 6 ILE CG2 C 8.115 1.006 -1.940 . . . 1.0 . . . . . . . . . . . . A . 6 ILE CG2 . . . . . . . . . c30057_5j6t 1 . 5 . 1277 . 1 1 6 ILE H H 6.986 -0.438 1.637 . . . 1.0 . . . . . . . . . . . . A . 6 ILE H . . . . . . . . . c30057_5j6t 1 . 5 . 1278 . 1 1 6 ILE HA H 9.066 -1.070 -0.403 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HA . . . . . . . . . c30057_5j6t 1 . 5 . 1279 . 1 1 6 ILE HB H 7.012 1.178 -0.099 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HB . . . . . . . . . c30057_5j6t 1 . 5 . 1280 . 1 1 6 ILE HD11 H 6.389 -2.197 -2.591 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HD11 . . . . . . . . . c30057_5j6t 1 . 5 . 1281 . 1 1 6 ILE HD12 H 7.450 -2.555 -1.208 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HD12 . . . . . . . . . c30057_5j6t 1 . 5 . 1282 . 1 1 6 ILE HD13 H 7.960 -1.376 -2.440 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HD13 . . . . . . . . . c30057_5j6t 1 . 5 . 1283 . 1 1 6 ILE HG12 H 5.986 -1.070 -0.192 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HG12 . . . . . . . . . c30057_5j6t 1 . 5 . 1284 . 1 1 6 ILE HG13 H 5.677 -0.176 -1.699 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HG13 . . . . . . . . . c30057_5j6t 1 . 5 . 1285 . 1 1 6 ILE HG21 H 8.415 2.033 -1.733 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HG21 . . . . . . . . . c30057_5j6t 1 . 5 . 1286 . 1 1 6 ILE HG22 H 7.385 0.996 -2.749 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HG22 . . . . . . . . . c30057_5j6t 1 . 5 . 1287 . 1 1 6 ILE HG23 H 8.990 0.424 -2.233 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HG23 . . . . . . . . . c30057_5j6t 1 . 5 . 1288 . 1 1 6 ILE N N 7.869 -0.833 1.346 . . . 1.0 . . . . . . . . . . . . A . 6 ILE N . . . . . . . . . c30057_5j6t 1 . 5 . 1289 . 1 1 6 ILE O O 10.703 0.843 0.065 . . . 1.0 . . . . . . . . . . . . A . 6 ILE O . . . . . . . . . c30057_5j6t 1 . 5 . 1290 . 1 1 7 TRP C C 11.541 1.929 2.579 . . . 1.0 . . . . . . . . . . . . A . 7 TRP C . . . . . . . . . c30057_5j6t 1 . 5 . 1291 . 1 1 7 TRP CA C 10.255 2.590 2.067 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CA . . . . . . . . . c30057_5j6t 1 . 5 . 1292 . 1 1 7 TRP CB C 9.534 3.332 3.195 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CB . . . . . . . . . c30057_5j6t 1 . 5 . 1293 . 1 1 7 TRP CD1 C 8.553 5.613 2.727 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CD1 . . . . . . . . . c30057_5j6t 1 . 5 . 1294 . 1 1 7 TRP CD2 C 10.797 5.650 2.887 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CD2 . . . . . . . . . c30057_5j6t 1 . 5 . 1295 . 1 1 7 TRP CE2 C 10.387 6.979 2.625 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CE2 . . . . . . . . . c30057_5j6t 1 . 5 . 1296 . 1 1 7 TRP CE3 C 12.172 5.395 3.033 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CE3 . . . . . . . . . c30057_5j6t 1 . 5 . 1297 . 1 1 7 TRP CG C 9.614 4.804 2.948 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CG . . . . . . . . . c30057_5j6t 1 . 5 . 1298 . 1 1 7 TRP CH2 C 12.674 7.748 2.659 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CH2 . . . . . . . . . c30057_5j6t 1 . 5 . 1299 . 1 1 7 TRP CZ2 C 11.311 8.018 2.512 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CZ2 . . . . . . . . . c30057_5j6t 1 . 5 . 1300 . 1 1 7 TRP CZ3 C 13.104 6.440 2.920 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CZ3 . . . . . . . . . c30057_5j6t 1 . 5 . 1301 . 1 1 7 TRP H H 8.382 1.471 2.023 . . . 1.0 . . . . . . . . . . . . A . 7 TRP H . . . . . . . . . c30057_5j6t 1 . 5 . 1302 . 1 1 7 TRP HA H 10.489 3.282 1.258 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HA . . . . . . . . . c30057_5j6t 1 . 5 . 1303 . 1 1 7 TRP HB2 H 8.488 3.024 3.224 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HB2 . . . . . . . . . c30057_5j6t 1 . 5 . 1304 . 1 1 7 TRP HB3 H 10.009 3.096 4.148 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HB3 . . . . . . . . . c30057_5j6t 1 . 5 . 1305 . 1 1 7 TRP HD1 H 7.519 5.302 2.705 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HD1 . . . . . . . . . c30057_5j6t 1 . 5 . 1306 . 1 1 7 TRP HE1 H 8.411 7.698 2.352 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HE1 . . . . . . . . . c30057_5j6t 1 . 5 . 1307 . 1 1 7 TRP HE3 H 12.513 4.391 3.234 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HE3 . . . . . . . . . c30057_5j6t 1 . 5 . 1308 . 1 1 7 TRP HH2 H 13.395 8.547 2.572 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HH2 . . . . . . . . . c30057_5j6t 1 . 5 . 1309 . 1 1 7 TRP HZ2 H 10.975 9.025 2.312 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HZ2 . . . . . . . . . c30057_5j6t 1 . 5 . 1310 . 1 1 7 TRP HZ3 H 14.158 6.234 3.034 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HZ3 . . . . . . . . . c30057_5j6t 1 . 5 . 1311 . 1 1 7 TRP N N 9.290 1.556 1.588 . . . 1.0 . . . . . . . . . . . . A . 7 TRP N . . . . . . . . . c30057_5j6t 1 . 5 . 1312 . 1 1 7 TRP NE1 N 9.010 6.906 2.535 . . . 1.0 . . . . . . . . . . . . A . 7 TRP NE1 . . . . . . . . . c30057_5j6t 1 . 5 . 1313 . 1 1 7 TRP O O 12.623 2.303 2.174 . . . 1.0 . . . . . . . . . . . . A . 7 TRP O . . . . . . . . . c30057_5j6t 1 . 5 . 1314 . 1 1 8 PRO C C 13.433 -0.311 2.857 . . . 1.0 . . . . . . . . . . . . A . 8 PRO C . . . . . . . . . c30057_5j6t 1 . 5 . 1315 . 1 1 8 PRO CA C 12.580 0.254 3.997 . . . 1.0 . . . . . . . . . . . . A . 8 PRO CA . . . . . . . . . c30057_5j6t 1 . 5 . 1316 . 1 1 8 PRO CB C 11.993 -0.876 4.841 . . . 1.0 . . . . . . . . . . . . A . 8 PRO CB . . . . . . . . . c30057_5j6t 1 . 5 . 1317 . 1 1 8 PRO CD C 10.140 0.435 4.001 . . . 1.0 . . . . . . . . . . . . A . 8 PRO CD . . . . . . . . . c30057_5j6t 1 . 5 . 1318 . 1 1 8 PRO CG C 10.578 -0.479 5.116 . . . 1.0 . . . . . . . . . . . . A . 8 PRO CG . . . . . . . . . c30057_5j6t 1 . 5 . 1319 . 1 1 8 PRO HA H 13.171 0.927 4.618 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HA . . . . . . . . . c30057_5j6t 1 . 5 . 1320 . 1 1 8 PRO HB2 H 12.024 -1.817 4.292 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HB2 . . . . . . . . . c30057_5j6t 1 . 5 . 1321 . 1 1 8 PRO HB3 H 12.544 -0.970 5.777 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HB3 . . . . . . . . . c30057_5j6t 1 . 5 . 1322 . 1 1 8 PRO HD2 H 9.587 -0.119 3.242 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HD2 . . . . . . . . . c30057_5j6t 1 . 5 . 1323 . 1 1 8 PRO HD3 H 9.530 1.248 4.395 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HD3 . . . . . . . . . c30057_5j6t 1 . 5 . 1324 . 1 1 8 PRO HG2 H 9.943 -1.365 5.138 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HG2 . . . . . . . . . c30057_5j6t 1 . 5 . 1325 . 1 1 8 PRO HG3 H 10.516 0.043 6.071 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HG3 . . . . . . . . . c30057_5j6t 1 . 5 . 1326 . 1 1 8 PRO N N 11.392 0.958 3.452 . . . 1.0 . . . . . . . . . . . . A . 8 PRO N . . . . . . . . . c30057_5j6t 1 . 5 . 1327 . 1 1 8 PRO O O 14.634 -0.451 2.978 . . . 1.0 . . . . . . . . . . . . A . 8 PRO O . . . . . . . . . c30057_5j6t 1 . 5 . 1328 . 1 1 9 LEU C C 14.282 -0.054 -0.167 . . . 1.0 . . . . . . . . . . . . A . 9 LEU C . . . . . . . . . c30057_5j6t 1 . 5 . 1329 . 1 1 9 LEU CA C 13.587 -1.185 0.598 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CA . . . . . . . . . c30057_5j6t 1 . 5 . 1330 . 1 1 9 LEU CB C 12.543 -1.868 -0.287 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CB . . . . . . . . . c30057_5j6t 1 . 5 . 1331 . 1 1 9 LEU CD1 C 12.862 -4.330 -0.002 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CD1 . . . . . . . . . c30057_5j6t 1 . 5 . 1332 . 1 1 9 LEU CD2 C 12.521 -3.369 -2.282 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CD2 . . . . . . . . . c30057_5j6t 1 . 5 . 1333 . 1 1 9 LEU CG C 13.146 -3.130 -0.906 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CG . . . . . . . . . c30057_5j6t 1 . 5 . 1334 . 1 1 9 LEU H H 11.818 -0.506 1.675 . . . 1.0 . . . . . . . . . . . . A . 9 LEU H . . . . . . . . . c30057_5j6t 1 . 5 . 1335 . 1 1 9 LEU HA H 14.321 -1.912 0.947 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HA . . . . . . . . . c30057_5j6t 1 . 5 . 1336 . 1 1 9 LEU HB2 H 11.676 -2.139 0.317 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HB2 . . . . . . . . . c30057_5j6t 1 . 5 . 1337 . 1 1 9 LEU HB3 H 12.236 -1.186 -1.079 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HB3 . . . . . . . . . c30057_5j6t 1 . 5 . 1338 . 1 1 9 LEU HD11 H 13.307 -4.160 0.979 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD11 . . . . . . . . . c30057_5j6t 1 . 5 . 1339 . 1 1 9 LEU HD12 H 11.784 -4.456 0.105 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD12 . . . . . . . . . c30057_5j6t 1 . 5 . 1340 . 1 1 9 LEU HD13 H 13.291 -5.229 -0.445 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD13 . . . . . . . . . c30057_5j6t 1 . 5 . 1341 . 1 1 9 LEU HD21 H 12.950 -4.268 -2.725 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD21 . . . . . . . . . c30057_5j6t 1 . 5 . 1342 . 1 1 9 LEU HD22 H 12.724 -2.514 -2.927 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD22 . . . . . . . . . c30057_5j6t 1 . 5 . 1343 . 1 1 9 LEU HD23 H 11.444 -3.495 -2.175 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD23 . . . . . . . . . c30057_5j6t 1 . 5 . 1344 . 1 1 9 LEU HG H 14.224 -3.003 -1.014 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HG . . . . . . . . . c30057_5j6t 1 . 5 . 1345 . 1 1 9 LEU N N 12.817 -0.632 1.751 . . . 1.0 . . . . . . . . . . . . A . 9 LEU N . . . . . . . . . c30057_5j6t 1 . 5 . 1346 . 1 1 9 LEU O O 15.283 -0.261 -0.823 . . . 1.0 . . . . . . . . . . . . A . 9 LEU O . . . . . . . . . c30057_5j6t 1 . 5 . 1347 . 1 1 10 ALA C C 15.803 2.527 -0.281 . . . 1.0 . . . . . . . . . . . . A . 10 ALA C . . . . . . . . . c30057_5j6t 1 . 5 . 1348 . 1 1 10 ALA CA C 14.389 2.285 -0.811 . . . 1.0 . . . . . . . . . . . . A . 10 ALA CA . . . . . . . . . c30057_5j6t 1 . 5 . 1349 . 1 1 10 ALA CB C 13.492 3.489 -0.517 . . . 1.0 . . . . . . . . . . . . A . 10 ALA CB . . . . . . . . . c30057_5j6t 1 . 5 . 1350 . 1 1 10 ALA H H 12.924 1.290 0.464 . . . 1.0 . . . . . . . . . . . . A . 10 ALA H . . . . . . . . . c30057_5j6t 1 . 5 . 1351 . 1 1 10 ALA HA H 14.416 2.086 -1.882 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HA . . . . . . . . . c30057_5j6t 1 . 5 . 1352 . 1 1 10 ALA HB1 H 13.552 4.197 -1.344 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HB1 . . . . . . . . . c30057_5j6t 1 . 5 . 1353 . 1 1 10 ALA HB2 H 12.462 3.154 -0.400 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HB2 . . . . . . . . . c30057_5j6t 1 . 5 . 1354 . 1 1 10 ALA HB3 H 13.824 3.974 0.401 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HB3 . . . . . . . . . c30057_5j6t 1 . 5 . 1355 . 1 1 10 ALA N N 13.757 1.141 -0.087 . . . 1.0 . . . . . . . . . . . . A . 10 ALA N . . . . . . . . . c30057_5j6t 1 . 5 . 1356 . 1 1 10 ALA O O 16.694 2.916 -1.012 . . . 1.0 . . . . . . . . . . . . A . 10 ALA O . . . . . . . . . c30057_5j6t 1 . 5 . 1357 . 1 1 11 LEU C C 18.308 1.375 1.164 . . . 1.0 . . . . . . . . . . . . A . 11 LEU C . . . . . . . . . c30057_5j6t 1 . 5 . 1358 . 1 1 11 LEU CA C 17.371 2.514 1.571 . . . 1.0 . . . . . . . . . . . . A . 11 LEU CA . . . . . . . . . c30057_5j6t 1 . 5 . 1359 . 1 1 11 LEU CB C 17.153 2.516 3.085 . . . 1.0 . . . . . . . . . . . . A . 11 LEU CB . . . . . . . . . c30057_5j6t 1 . 5 . 1360 . 1 1 11 LEU CD1 C 15.158 3.398 4.313 . . . 1.0 . . . . . . . . . . . . A . 11 LEU CD1 . . . . . . . . . c30057_5j6t 1 . 5 . 1361 . 1 1 11 LEU CD2 C 17.305 4.674 4.345 . . . 1.0 . . . . . . . . . . . . A . 11 LEU CD2 . . . . . . . . . c30057_5j6t 1 . 5 . 1362 . 1 1 11 LEU CG C 16.392 3.783 3.496 . . . 1.0 . . . . . . . . . . . . A . 11 LEU CG . . . . . . . . . c30057_5j6t 1 . 5 . 1363 . 1 1 11 LEU H H 15.258 1.978 1.574 . . . 1.0 . . . . . . . . . . . . A . 11 LEU H . . . . . . . . . c30057_5j6t 1 . 5 . 1364 . 1 1 11 LEU HA H 17.776 3.472 1.245 . . . 1.0 . . . . . . . . . . . . A . 11 LEU HA . . . . . . . . . c30057_5j6t 1 . 5 . 1365 . 1 1 11 LEU HB2 H 16.574 1.638 3.369 . . . 1.0 . . . . . . . . . . . . A . 11 LEU HB2 . . . . . . . . . c30057_5j6t 1 . 5 . 1366 . 1 1 11 LEU HB3 H 18.118 2.493 3.590 . . . 1.0 . . . . . . . . . . . . A . 11 LEU HB3 . . . . . . . . . c30057_5j6t 1 . 5 . 1367 . 1 1 11 LEU HD11 H 14.507 2.764 3.710 . . . 1.0 . . . . . . . . . . . . A . 11 LEU HD11 . . . . . . . . . c30057_5j6t 1 . 5 . 1368 . 1 1 11 LEU HD12 H 15.468 2.856 5.206 . . . 1.0 . . . . . . . . . . . . A . 11 LEU HD12 . . . . . . . . . c30057_5j6t 1 . 5 . 1369 . 1 1 11 LEU HD13 H 14.619 4.300 4.604 . . . 1.0 . . . . . . . . . . . . A . 11 LEU HD13 . . . . . . . . . c30057_5j6t 1 . 5 . 1370 . 1 1 11 LEU HD21 H 18.186 4.949 3.765 . . . 1.0 . . . . . . . . . . . . A . 11 LEU HD21 . . . . . . . . . c30057_5j6t 1 . 5 . 1371 . 1 1 11 LEU HD22 H 16.765 5.575 4.635 . . . 1.0 . . . . . . . . . . . . A . 11 LEU HD22 . . . . . . . . . c30057_5j6t 1 . 5 . 1372 . 1 1 11 LEU HD23 H 17.613 4.131 5.238 . . . 1.0 . . . . . . . . . . . . A . 11 LEU HD23 . . . . . . . . . c30057_5j6t 1 . 5 . 1373 . 1 1 11 LEU HG H 16.082 4.327 2.604 . . . 1.0 . . . . . . . . . . . . A . 11 LEU HG . . . . . . . . . c30057_5j6t 1 . 5 . 1374 . 1 1 11 LEU N N 16.014 2.299 0.987 . . . 1.0 . . . . . . . . . . . . A . 11 LEU N . . . . . . . . . c30057_5j6t 1 . 5 . 1375 . 1 1 11 LEU O O 19.508 1.548 1.080 . . . 1.0 . . . . . . . . . . . . A . 11 LEU O . . . . . . . . . c30057_5j6t 1 . 5 . 1376 . 1 1 12 GLY C C 18.996 -0.804 -0.973 . . . 1.0 . . . . . . . . . . . . A . 12 GLY C . . . . . . . . . c30057_5j6t 1 . 5 . 1377 . 1 1 12 GLY CA C 18.627 -0.938 0.505 . . . 1.0 . . . . . . . . . . . . A . 12 GLY CA . . . . . . . . . c30057_5j6t 1 . 5 . 1378 . 1 1 12 GLY H H 16.769 0.094 0.984 . . . 1.0 . . . . . . . . . . . . A . 12 GLY H . . . . . . . . . c30057_5j6t 1 . 5 . 1379 . 1 1 12 GLY HA2 H 19.535 -0.943 1.107 . . . 1.0 . . . . . . . . . . . . A . 12 GLY HA2 . . . . . . . . . c30057_5j6t 1 . 5 . 1380 . 1 1 12 GLY HA3 H 18.082 -1.869 0.661 . . . 1.0 . . . . . . . . . . . . A . 12 GLY HA3 . . . . . . . . . c30057_5j6t 1 . 5 . 1381 . 1 1 12 GLY N N 17.769 0.213 0.908 . . . 1.0 . . . . . . . . . . . . A . 12 GLY N . . . . . . . . . c30057_5j6t 1 . 5 . 1382 . 1 1 12 GLY O O 20.057 -1.220 -1.397 . . . 1.0 . . . . . . . . . . . . A . 12 GLY O . . . . . . . . . c30057_5j6t 1 . 5 . 1383 . 1 1 13 ALA C C 19.684 0.803 -3.393 . . . 1.0 . . . . . . . . . . . . A . 13 ALA C . . . . . . . . . c30057_5j6t 1 . 5 . 1384 . 1 1 13 ALA CA C 18.432 -0.059 -3.213 . . . 1.0 . . . . . . . . . . . . A . 13 ALA CA . . . . . . . . . c30057_5j6t 1 . 5 . 1385 . 1 1 13 ALA CB C 17.207 0.645 -3.798 . . . 1.0 . . . . . . . . . . . . A . 13 ALA CB . . . . . . . . . c30057_5j6t 1 . 5 . 1386 . 1 1 13 ALA H H 17.256 0.114 -1.384 . . . 1.0 . . . . . . . . . . . . A . 13 ALA H . . . . . . . . . c30057_5j6t 1 . 5 . 1387 . 1 1 13 ALA HA H 18.571 -1.032 -3.684 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HA . . . . . . . . . c30057_5j6t 1 . 5 . 1388 . 1 1 13 ALA HB1 H 17.353 0.802 -4.866 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HB1 . . . . . . . . . c30057_5j6t 1 . 5 . 1389 . 1 1 13 ALA HB2 H 17.071 1.607 -3.305 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HB2 . . . . . . . . . c30057_5j6t 1 . 5 . 1390 . 1 1 13 ALA HB3 H 16.323 0.027 -3.639 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HB3 . . . . . . . . . c30057_5j6t 1 . 5 . 1391 . 1 1 13 ALA N N 18.131 -0.224 -1.759 . . . 1.0 . . . . . . . . . . . . A . 13 ALA N . . . . . . . . . c30057_5j6t 1 . 5 . 1392 . 1 1 13 ALA O O 20.391 0.688 -4.374 . . . 1.0 . . . . . . . . . . . . A . 13 ALA O . . . . . . . . . c30057_5j6t 1 . 5 . 1393 . 1 1 14 LEU C C 22.416 1.754 -2.125 . . . 1.0 . . . . . . . . . . . . A . 14 LEU C . . . . . . . . . c30057_5j6t 1 . 5 . 1394 . 1 1 14 LEU CA C 21.170 2.531 -2.562 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CA . . . . . . . . . c30057_5j6t 1 . 5 . 1395 . 1 1 14 LEU CB C 20.902 3.700 -1.611 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CB . . . . . . . . . c30057_5j6t 1 . 5 . 1396 . 1 1 14 LEU CD1 C 22.138 5.432 -2.924 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CD1 . . . . . . . . . c30057_5j6t 1 . 5 . 1397 . 1 1 14 LEU CD2 C 21.973 5.628 -0.439 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CD2 . . . . . . . . . c30057_5j6t 1 . 5 . 1398 . 1 1 14 LEU CG C 22.101 4.651 -1.609 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CG . . . . . . . . . c30057_5j6t 1 . 5 . 1399 . 1 1 14 LEU H H 19.360 1.741 -1.645 . . . 1.0 . . . . . . . . . . . . A . 14 LEU H . . . . . . . . . c30057_5j6t 1 . 5 . 1400 . 1 1 14 LEU HA H 21.286 2.891 -3.584 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HA . . . . . . . . . c30057_5j6t 1 . 5 . 1401 . 1 1 14 LEU HB2 H 20.014 4.239 -1.942 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HB2 . . . . . . . . . c30057_5j6t 1 . 5 . 1402 . 1 1 14 LEU HB3 H 20.740 3.318 -0.603 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HB3 . . . . . . . . . c30057_5j6t 1 . 5 . 1403 . 1 1 14 LEU HD11 H 22.230 4.736 -3.758 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD11 . . . . . . . . . c30057_5j6t 1 . 5 . 1404 . 1 1 14 LEU HD12 H 21.218 6.007 -3.031 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD12 . . . . . . . . . c30057_5j6t 1 . 5 . 1405 . 1 1 14 LEU HD13 H 22.992 6.109 -2.921 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD13 . . . . . . . . . c30057_5j6t 1 . 5 . 1406 . 1 1 14 LEU HD21 H 22.826 6.306 -0.436 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD21 . . . . . . . . . c30057_5j6t 1 . 5 . 1407 . 1 1 14 LEU HD22 H 21.948 5.072 0.498 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD22 . . . . . . . . . c30057_5j6t 1 . 5 . 1408 . 1 1 14 LEU HD23 H 21.052 6.203 -0.545 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD23 . . . . . . . . . c30057_5j6t 1 . 5 . 1409 . 1 1 14 LEU HG H 23.021 4.076 -1.502 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HG . . . . . . . . . c30057_5j6t 1 . 5 . 1410 . 1 1 14 LEU N N 19.963 1.663 -2.451 . . . 1.0 . . . . . . . . . . . . A . 14 LEU N . . . . . . . . . c30057_5j6t 1 . 5 . 1411 . 1 1 14 LEU O O 23.411 1.715 -2.820 . . . 1.0 . . . . . . . . . . . . A . 14 LEU O . . . . . . . . . c30057_5j6t 1 . 5 . 1412 . 1 1 15 LYS C C 23.920 -0.733 -1.486 . . . 1.0 . . . . . . . . . . . . A . 15 LYS C . . . . . . . . . c30057_5j6t 1 . 5 . 1413 . 1 1 15 LYS CA C 23.540 0.361 -0.482 . . . 1.0 . . . . . . . . . . . . A . 15 LYS CA . . . . . . . . . c30057_5j6t 1 . 5 . 1414 . 1 1 15 LYS CB C 23.077 -0.262 0.838 . . . 1.0 . . . . . . . . . . . . A . 15 LYS CB . . . . . . . . . c30057_5j6t 1 . 5 . 1415 . 1 1 15 LYS CD C 23.864 0.784 2.972 . . . 1.0 . . . . . . . . . . . . A . 15 LYS CD . . . . . . . . . c30057_5j6t 1 . 5 . 1416 . 1 1 15 LYS CE C 23.932 2.210 2.424 . . . 1.0 . . . . . . . . . . . . A . 15 LYS CE . . . . . . . . . c30057_5j6t 1 . 5 . 1417 . 1 1 15 LYS CG C 24.217 -0.209 1.860 . . . 1.0 . . . . . . . . . . . . A . 15 LYS CG . . . . . . . . . c30057_5j6t 1 . 5 . 1418 . 1 1 15 LYS H H 21.522 1.183 -0.418 . . . 1.0 . . . . . . . . . . . . A . 15 LYS H . . . . . . . . . c30057_5j6t 1 . 5 . 1419 . 1 1 15 LYS HA H 24.385 1.026 -0.310 . . . 1.0 . . . . . . . . . . . . A . 15 LYS HA . . . . . . . . . c30057_5j6t 1 . 5 . 1420 . 1 1 15 LYS HB2 H 22.221 0.292 1.220 . . . 1.0 . . . . . . . . . . . . A . 15 LYS HB2 . . . . . . . . . c30057_5j6t 1 . 5 . 1421 . 1 1 15 LYS HB3 H 22.792 -1.300 0.668 . . . 1.0 . . . . . . . . . . . . A . 15 LYS HB3 . . . . . . . . . c30057_5j6t 1 . 5 . 1422 . 1 1 15 LYS HD2 H 22.855 0.581 3.332 . . . 1.0 . . . . . . . . . . . . A . 15 LYS HD2 . . . . . . . . . c30057_5j6t 1 . 5 . 1423 . 1 1 15 LYS HD3 H 24.572 0.676 3.794 . . . 1.0 . . . . . . . . . . . . A . 15 LYS HD3 . . . . . . . . . c30057_5j6t 1 . 5 . 1424 . 1 1 15 LYS HE2 H 23.895 2.198 1.334 . . . 1.0 . . . . . . . . . . . . A . 15 LYS HE2 . . . . . . . . . c30057_5j6t 1 . 5 . 1425 . 1 1 15 LYS HE3 H 23.116 2.813 2.821 . . . 1.0 . . . . . . . . . . . . A . 15 LYS HE3 . . . . . . . . . c30057_5j6t 1 . 5 . 1426 . 1 1 15 LYS HG2 H 24.365 -1.199 2.291 . . . 1.0 . . . . . . . . . . . . A . 15 LYS HG2 . . . . . . . . . c30057_5j6t 1 . 5 . 1427 . 1 1 15 LYS HG3 H 25.134 0.112 1.365 . . . 1.0 . . . . . . . . . . . . A . 15 LYS HG3 . . . . . . . . . c30057_5j6t 1 . 5 . 1428 . 1 1 15 LYS HZ1 H 25.365 3.684 2.562 . . . 1.0 . . . . . . . . . . . . A . 15 LYS HZ1 . . . . . . . . . c30057_5j6t 1 . 5 . 1429 . 1 1 15 LYS HZ2 H 25.989 2.158 2.520 . . . 1.0 . . . . . . . . . . . . A . 15 LYS HZ2 . . . . . . . . . c30057_5j6t 1 . 5 . 1430 . 1 1 15 LYS HZ3 H 25.278 2.721 3.898 . . . 1.0 . . . . . . . . . . . . A . 15 LYS HZ3 . . . . . . . . . c30057_5j6t 1 . 5 . 1431 . 1 1 15 LYS N N 22.362 1.136 -0.976 . . . 1.0 . . . . . . . . . . . . A . 15 LYS N . . . . . . . . . c30057_5j6t 1 . 5 . 1432 . 1 1 15 LYS NZ N 25.247 2.736 2.888 . . . 1.0 . . . . . . . . . . . . A . 15 LYS NZ . . . . . . . . . c30057_5j6t 1 . 5 . 1433 . 1 1 15 LYS O O 25.056 -1.158 -1.552 . . . 1.0 . . . . . . . . . . . . A . 15 LYS O . . . . . . . . . c30057_5j6t 1 . 5 . 1434 . 1 1 16 ASN C C 24.113 -1.696 -4.416 . . . 1.0 . . . . . . . . . . . . A . 16 ASN C . . . . . . . . . c30057_5j6t 1 . 5 . 1435 . 1 1 16 ASN CA C 23.282 -2.262 -3.260 . . . 1.0 . . . . . . . . . . . . A . 16 ASN CA . . . . . . . . . c30057_5j6t 1 . 5 . 1436 . 1 1 16 ASN CB C 21.918 -2.733 -3.766 . . . 1.0 . . . . . . . . . . . . A . 16 ASN CB . . . . . . . . . c30057_5j6t 1 . 5 . 1437 . 1 1 16 ASN CG C 21.247 -3.604 -2.699 . . . 1.0 . . . . . . . . . . . . A . 16 ASN CG . . . . . . . . . c30057_5j6t 1 . 5 . 1438 . 1 1 16 ASN H H 22.038 -0.824 -2.190 . . . 1.0 . . . . . . . . . . . . A . 16 ASN H . . . . . . . . . c30057_5j6t 1 . 5 . 1439 . 1 1 16 ASN HA H 23.812 -3.085 -2.781 . . . 1.0 . . . . . . . . . . . . A . 16 ASN HA . . . . . . . . . c30057_5j6t 1 . 5 . 1440 . 1 1 16 ASN HB2 H 21.290 -1.867 -3.974 . . . 1.0 . . . . . . . . . . . . A . 16 ASN HB2 . . . . . . . . . c30057_5j6t 1 . 5 . 1441 . 1 1 16 ASN HB3 H 22.050 -3.314 -4.678 . . . 1.0 . . . . . . . . . . . . A . 16 ASN HB3 . . . . . . . . . c30057_5j6t 1 . 5 . 1442 . 1 1 16 ASN HD21 H 19.697 -4.082 -3.886 . . . 1.0 . . . . . . . . . . . . A . 16 ASN HD21 . . . . . . . . . c30057_5j6t 1 . 5 . 1443 . 1 1 16 ASN HD22 H 19.667 -4.775 -2.281 . . . 1.0 . . . . . . . . . . . . A . 16 ASN HD22 . . . . . . . . . c30057_5j6t 1 . 5 . 1444 . 1 1 16 ASN N N 22.976 -1.192 -2.263 . . . 1.0 . . . . . . . . . . . . A . 16 ASN N . . . . . . . . . c30057_5j6t 1 . 5 . 1445 . 1 1 16 ASN ND2 N 20.119 -4.198 -2.976 . . . 1.0 . . . . . . . . . . . . A . 16 ASN ND2 . . . . . . . . . c30057_5j6t 1 . 5 . 1446 . 1 1 16 ASN O O 24.987 -2.356 -4.943 . . . 1.0 . . . . . . . . . . . . A . 16 ASN O . . . . . . . . . c30057_5j6t 1 . 5 . 1447 . 1 1 16 ASN OD1 O 21.754 -3.746 -1.603 . . . 1.0 . . . . . . . . . . . . A . 16 ASN OD1 . . . . . . . . . c30057_5j6t 1 . 5 . 1448 . 1 1 17 LEU C C 26.029 0.484 -5.485 . . . 1.0 . . . . . . . . . . . . A . 17 LEU C . . . . . . . . . c30057_5j6t 1 . 5 . 1449 . 1 1 17 LEU CA C 24.616 0.124 -5.941 . . . 1.0 . . . . . . . . . . . . A . 17 LEU CA . . . . . . . . . c30057_5j6t 1 . 5 . 1450 . 1 1 17 LEU CB C 23.839 1.387 -6.322 . . . 1.0 . . . . . . . . . . . . A . 17 LEU CB . . . . . . . . . c30057_5j6t 1 . 5 . 1451 . 1 1 17 LEU CD1 C 23.557 0.616 -8.686 . . . 1.0 . . . . . . . . . . . . A . 17 LEU CD1 . . . . . . . . . c30057_5j6t 1 . 5 . 1452 . 1 1 17 LEU CD2 C 21.899 -0.066 -6.945 . . . 1.0 . . . . . . . . . . . . A . 17 LEU CD2 . . . . . . . . . c30057_5j6t 1 . 5 . 1453 . 1 1 17 LEU CG C 22.822 1.060 -7.420 . . . 1.0 . . . . . . . . . . . . A . 17 LEU CG . . . . . . . . . c30057_5j6t 1 . 5 . 1454 . 1 1 17 LEU H H 23.115 0.048 -4.363 . . . 1.0 . . . . . . . . . . . . A . 17 LEU H . . . . . . . . . c30057_5j6t 1 . 5 . 1455 . 1 1 17 LEU HA H 24.655 -0.564 -6.786 . . . 1.0 . . . . . . . . . . . . A . 17 LEU HA . . . . . . . . . c30057_5j6t 1 . 5 . 1456 . 1 1 17 LEU HB2 H 23.315 1.768 -5.445 . . . 1.0 . . . . . . . . . . . . A . 17 LEU HB2 . . . . . . . . . c30057_5j6t 1 . 5 . 1457 . 1 1 17 LEU HB3 H 24.534 2.143 -6.686 . . . 1.0 . . . . . . . . . . . . A . 17 LEU HB3 . . . . . . . . . c30057_5j6t 1 . 5 . 1458 . 1 1 17 LEU HD11 H 24.214 1.417 -9.025 . . . 1.0 . . . . . . . . . . . . A . 17 LEU HD11 . . . . . . . . . c30057_5j6t 1 . 5 . 1459 . 1 1 17 LEU HD12 H 24.150 -0.273 -8.469 . . . 1.0 . . . . . . . . . . . . A . 17 LEU HD12 . . . . . . . . . c30057_5j6t 1 . 5 . 1460 . 1 1 17 LEU HD13 H 22.831 0.386 -9.466 . . . 1.0 . . . . . . . . . . . . A . 17 LEU HD13 . . . . . . . . . c30057_5j6t 1 . 5 . 1461 . 1 1 17 LEU HD21 H 21.036 -0.133 -7.607 . . . 1.0 . . . . . . . . . . . . A . 17 LEU HD21 . . . . . . . . . c30057_5j6t 1 . 5 . 1462 . 1 1 17 LEU HD22 H 21.563 0.145 -5.930 . . . 1.0 . . . . . . . . . . . . A . 17 LEU HD22 . . . . . . . . . c30057_5j6t 1 . 5 . 1463 . 1 1 17 LEU HD23 H 22.442 -1.011 -6.959 . . . 1.0 . . . . . . . . . . . . A . 17 LEU HD23 . . . . . . . . . c30057_5j6t 1 . 5 . 1464 . 1 1 17 LEU HG H 22.227 1.947 -7.639 . . . 1.0 . . . . . . . . . . . . A . 17 LEU HG . . . . . . . . . c30057_5j6t 1 . 5 . 1465 . 1 1 17 LEU N N 23.845 -0.482 -4.816 . . . 1.0 . . . . . . . . . . . . A . 17 LEU N . . . . . . . . . c30057_5j6t 1 . 5 . 1466 . 1 1 17 LEU O O 26.983 0.361 -6.230 . . . 1.0 . . . . . . . . . . . . A . 17 LEU O . . . . . . . . . c30057_5j6t 1 . 5 . 1467 . 1 1 18 ILE C C 28.251 0.067 -3.212 . . . 1.0 . . . . . . . . . . . . A . 18 ILE C . . . . . . . . . c30057_5j6t 1 . 5 . 1468 . 1 1 18 ILE CA C 27.522 1.301 -3.759 . . . 1.0 . . . . . . . . . . . . A . 18 ILE CA . . . . . . . . . c30057_5j6t 1 . 5 . 1469 . 1 1 18 ILE CB C 27.263 2.318 -2.646 . . . 1.0 . . . . . . . . . . . . A . 18 ILE CB . . . . . . . . . c30057_5j6t 1 . 5 . 1470 . 1 1 18 ILE CD1 C 26.820 2.202 -0.188 . . . 1.0 . . . . . . . . . . . . A . 18 ILE CD1 . . . . . . . . . c30057_5j6t 1 . 5 . 1471 . 1 1 18 ILE CG1 C 26.383 1.691 -1.562 . . . 1.0 . . . . . . . . . . . . A . 18 ILE CG1 . . . . . . . . . c30057_5j6t 1 . 5 . 1472 . 1 1 18 ILE CG2 C 26.557 3.543 -3.229 . . . 1.0 . . . . . . . . . . . . A . 18 ILE CG2 . . . . . . . . . c30057_5j6t 1 . 5 . 1473 . 1 1 18 ILE H H 25.361 1.021 -3.669 . . . 1.0 . . . . . . . . . . . . A . 18 ILE H . . . . . . . . . c30057_5j6t 1 . 5 . 1474 . 1 1 18 ILE HA H 28.108 1.759 -4.555 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HA . . . . . . . . . c30057_5j6t 1 . 5 . 1475 . 1 1 18 ILE HB H 28.214 2.623 -2.208 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HB . . . . . . . . . c30057_5j6t 1 . 5 . 1476 . 1 1 18 ILE HD11 H 26.192 1.755 0.583 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HD11 . . . . . . . . . c30057_5j6t 1 . 5 . 1477 . 1 1 18 ILE HD12 H 26.719 3.286 -0.155 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HD12 . . . . . . . . . c30057_5j6t 1 . 5 . 1478 . 1 1 18 ILE HD13 H 27.860 1.928 -0.013 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HD13 . . . . . . . . . c30057_5j6t 1 . 5 . 1479 . 1 1 18 ILE HG12 H 25.342 1.965 -1.736 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HG12 . . . . . . . . . c30057_5j6t 1 . 5 . 1480 . 1 1 18 ILE HG13 H 26.483 0.606 -1.595 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HG13 . . . . . . . . . c30057_5j6t 1 . 5 . 1481 . 1 1 18 ILE HG21 H 27.182 3.991 -4.001 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HG21 . . . . . . . . . c30057_5j6t 1 . 5 . 1482 . 1 1 18 ILE HG22 H 26.380 4.271 -2.437 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HG22 . . . . . . . . . c30057_5j6t 1 . 5 . 1483 . 1 1 18 ILE HG23 H 25.604 3.240 -3.663 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HG23 . . . . . . . . . c30057_5j6t 1 . 5 . 1484 . 1 1 18 ILE N N 26.169 0.928 -4.268 . . . 1.0 . . . . . . . . . . . . A . 18 ILE N . . . . . . . . . c30057_5j6t 1 . 5 . 1485 . 1 1 18 ILE O O 29.431 0.115 -2.922 . . . 1.0 . . . . . . . . . . . . A . 18 ILE O . . . . . . . . . c30057_5j6t 1 . 5 . 1486 . 1 1 19 LYS C C 29.371 -2.689 -3.461 . . . 1.0 . . . . . . . . . . . . A . 19 LYS C . . . . . . . . . c30057_5j6t 1 . 5 . 1487 . 1 1 19 LYS CA C 28.225 -2.265 -2.538 . . . 1.0 . . . . . . . . . . . . A . 19 LYS CA . . . . . . . . . c30057_5j6t 1 . 5 . 1488 . 1 1 19 LYS CB C 27.130 -3.334 -2.522 . . . 1.0 . . . . . . . . . . . . A . 19 LYS CB . . . . . . . . . c30057_5j6t 1 . 5 . 1489 . 1 1 19 LYS CD C 27.018 -3.370 -0.026 . . . 1.0 . . . . . . . . . . . . A . 19 LYS CD . . . . . . . . . c30057_5j6t 1 . 5 . 1490 . 1 1 19 LYS CE C 26.350 -4.242 1.040 . . . 1.0 . . . . . . . . . . . . A . 19 LYS CE . . . . . . . . . c30057_5j6t 1 . 5 . 1491 . 1 1 19 LYS CG C 27.290 -4.209 -1.276 . . . 1.0 . . . . . . . . . . . . A . 19 LYS CG . . . . . . . . . c30057_5j6t 1 . 5 . 1492 . 1 1 19 LYS H H 26.583 -1.056 -3.314 . . . 1.0 . . . . . . . . . . . . A . 19 LYS H . . . . . . . . . c30057_5j6t 1 . 5 . 1493 . 1 1 19 LYS HA H 28.597 -2.090 -1.529 . . . 1.0 . . . . . . . . . . . . A . 19 LYS HA . . . . . . . . . c30057_5j6t 1 . 5 . 1494 . 1 1 19 LYS HB2 H 26.152 -2.852 -2.505 . . . 1.0 . . . . . . . . . . . . A . 19 LYS HB2 . . . . . . . . . c30057_5j6t 1 . 5 . 1495 . 1 1 19 LYS HB3 H 27.214 -3.954 -3.415 . . . 1.0 . . . . . . . . . . . . A . 19 LYS HB3 . . . . . . . . . c30057_5j6t 1 . 5 . 1496 . 1 1 19 LYS HD2 H 27.959 -2.980 0.362 . . . 1.0 . . . . . . . . . . . . A . 19 LYS HD2 . . . . . . . . . c30057_5j6t 1 . 5 . 1497 . 1 1 19 LYS HD3 H 26.358 -2.540 -0.281 . . . 1.0 . . . . . . . . . . . . A . 19 LYS HD3 . . . . . . . . . c30057_5j6t 1 . 5 . 1498 . 1 1 19 LYS HE2 H 25.291 -4.374 0.819 . . . 1.0 . . . . . . . . . . . . A . 19 LYS HE2 . . . . . . . . . c30057_5j6t 1 . 5 . 1499 . 1 1 19 LYS HE3 H 26.847 -5.210 1.099 . . . 1.0 . . . . . . . . . . . . A . 19 LYS HE3 . . . . . . . . . c30057_5j6t 1 . 5 . 1500 . 1 1 19 LYS HG2 H 26.581 -5.036 -1.320 . . . 1.0 . . . . . . . . . . . . A . 19 LYS HG2 . . . . . . . . . c30057_5j6t 1 . 5 . 1501 . 1 1 19 LYS HG3 H 28.306 -4.602 -1.236 . . . 1.0 . . . . . . . . . . . . A . 19 LYS HG3 . . . . . . . . . c30057_5j6t 1 . 5 . 1502 . 1 1 19 LYS HZ1 H 26.110 -4.013 3.073 . . . 1.0 . . . . . . . . . . . . A . 19 LYS HZ1 . . . . . . . . . c30057_5j6t 1 . 5 . 1503 . 1 1 19 LYS HZ2 H 26.085 -2.589 2.240 . . . 1.0 . . . . . . . . . . . . A . 19 LYS HZ2 . . . . . . . . . c30057_5j6t 1 . 5 . 1504 . 1 1 19 LYS HZ3 H 27.515 -3.369 2.497 . . . 1.0 . . . . . . . . . . . . A . 19 LYS HZ3 . . . . . . . . . c30057_5j6t 1 . 5 . 1505 . 1 1 19 LYS N N 27.562 -1.036 -3.067 . . . 1.0 . . . . . . . . . . . . A . 19 LYS N . . . . . . . . . c30057_5j6t 1 . 5 . 1506 . 1 1 19 LYS NZ N 26.530 -3.493 2.315 . . . 1.0 . . . . . . . . . . . . A . 19 LYS NZ . . . . . . . . . c30057_5j6t 1 . 5 . 1507 . 1 1 19 LYS O O 29.308 -2.501 -4.660 . . . 1.0 . . . . . . . . . . . . A . 19 LYS O . . . . . . . . . c30057_5j6t 1 . 5 . 1508 . 1 1 20 NH2 HN1 H 30.480 -3.414 -1.951 . . . 1.0 . . . . . . . . . . . . A . 20 NH2 HN1 . . . . . . . . . c30057_5j6t 1 . 5 . 1509 . 1 1 20 NH2 HN2 H 31.189 -3.541 -3.545 . . . 1.0 . . . . . . . . . . . . A . 20 NH2 HN2 . . . . . . . . . c30057_5j6t 1 . 5 . 1510 . 1 1 20 NH2 N N 30.426 -3.258 -2.947 . . . 1.0 . . . . . . . . . . . . A . 20 NH2 N . . . . . . . . . c30057_5j6t 1 . 6 . 1511 . 1 1 1 ACE C C 0.114 -1.856 3.086 . . . 1.0 . . . . . . . . . . . . A . 1 ACE C . . . . . . . . . c30057_5j6t 1 . 6 . 1512 . 1 1 1 ACE CH3 C -1.289 -1.347 2.751 . . . 1.0 . . . . . . . . . . . . A . 1 ACE CH3 . . . . . . . . . c30057_5j6t 1 . 6 . 1513 . 1 1 1 ACE H1 H -1.916 -1.395 3.642 . . . 1.0 . . . . . . . . . . . . A . 1 ACE H1 . . . . . . . . . c30057_5j6t 1 . 6 . 1514 . 1 1 1 ACE H2 H -1.227 -0.314 2.407 . . . 1.0 . . . . . . . . . . . . A . 1 ACE H2 . . . . . . . . . c30057_5j6t 1 . 6 . 1515 . 1 1 1 ACE H3 H -1.723 -1.966 1.967 . . . 1.0 . . . . . . . . . . . . A . 1 ACE H3 . . . . . . . . . c30057_5j6t 1 . 6 . 1516 . 1 1 1 ACE O O 0.392 -2.239 4.206 . . . 1.0 . . . . . . . . . . . . A . 1 ACE O . . . . . . . . . c30057_5j6t 1 . 6 . 1517 . 1 1 2 ILE C C 3.397 -1.232 2.129 . . . 1.0 . . . . . . . . . . . . A . 2 ILE C . . . . . . . . . c30057_5j6t 1 . 6 . 1518 . 1 1 2 ILE CA C 2.385 -2.351 2.387 . . . 1.0 . . . . . . . . . . . . A . 2 ILE CA . . . . . . . . . c30057_5j6t 1 . 6 . 1519 . 1 1 2 ILE CB C 2.595 -3.508 1.406 . . . 1.0 . . . . . . . . . . . . A . 2 ILE CB . . . . . . . . . c30057_5j6t 1 . 6 . 1520 . 1 1 2 ILE CD1 C 3.299 -3.760 -0.979 . . . 1.0 . . . . . . . . . . . . A . 2 ILE CD1 . . . . . . . . . c30057_5j6t 1 . 6 . 1521 . 1 1 2 ILE CG1 C 2.359 -3.020 -0.026 . . . 1.0 . . . . . . . . . . . . A . 2 ILE CG1 . . . . . . . . . c30057_5j6t 1 . 6 . 1522 . 1 1 2 ILE CG2 C 1.613 -4.635 1.728 . . . 1.0 . . . . . . . . . . . . A . 2 ILE CG2 . . . . . . . . . c30057_5j6t 1 . 6 . 1523 . 1 1 2 ILE H H 0.742 -1.544 1.203 . . . 1.0 . . . . . . . . . . . . A . 2 ILE H . . . . . . . . . c30057_5j6t 1 . 6 . 1524 . 1 1 2 ILE HA H 2.472 -2.708 3.413 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HA . . . . . . . . . c30057_5j6t 1 . 6 . 1525 . 1 1 2 ILE HB H 3.616 -3.879 1.498 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HB . . . . . . . . . c30057_5j6t 1 . 6 . 1526 . 1 1 2 ILE HD11 H 3.131 -3.413 -1.999 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HD11 . . . . . . . . . c30057_5j6t 1 . 6 . 1527 . 1 1 2 ILE HD12 H 4.333 -3.564 -0.695 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HD12 . . . . . . . . . c30057_5j6t 1 . 6 . 1528 . 1 1 2 ILE HD13 H 3.104 -4.831 -0.923 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HD13 . . . . . . . . . c30057_5j6t 1 . 6 . 1529 . 1 1 2 ILE HG12 H 1.325 -3.216 -0.310 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HG12 . . . . . . . . . c30057_5j6t 1 . 6 . 1530 . 1 1 2 ILE HG13 H 2.554 -1.949 -0.082 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HG13 . . . . . . . . . c30057_5j6t 1 . 6 . 1531 . 1 1 2 ILE HG21 H 1.781 -4.983 2.747 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HG21 . . . . . . . . . c30057_5j6t 1 . 6 . 1532 . 1 1 2 ILE HG22 H 1.767 -5.460 1.032 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HG22 . . . . . . . . . c30057_5j6t 1 . 6 . 1533 . 1 1 2 ILE HG23 H 0.592 -4.265 1.633 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HG23 . . . . . . . . . c30057_5j6t 1 . 6 . 1534 . 1 1 2 ILE N N 0.997 -1.866 2.126 . . . 1.0 . . . . . . . . . . . . A . 2 ILE N . . . . . . . . . c30057_5j6t 1 . 6 . 1535 . 1 1 2 ILE O O 4.527 -1.481 1.754 . . . 1.0 . . . . . . . . . . . . A . 2 ILE O . . . . . . . . . c30057_5j6t 1 . 6 . 1536 . 1 1 3 PHE C C 5.147 1.016 3.031 . . . 1.0 . . . . . . . . . . . . A . 3 PHE C . . . . . . . . . c30057_5j6t 1 . 6 . 1537 . 1 1 3 PHE CA C 3.943 1.131 2.095 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CA . . . . . . . . . c30057_5j6t 1 . 6 . 1538 . 1 1 3 PHE CB C 3.137 2.391 2.411 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CB . . . . . . . . . c30057_5j6t 1 . 6 . 1539 . 1 1 3 PHE CD1 C 4.485 3.769 0.787 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CD1 . . . . . . . . . c30057_5j6t 1 . 6 . 1540 . 1 1 3 PHE CD2 C 4.200 4.585 3.052 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CD2 . . . . . . . . . c30057_5j6t 1 . 6 . 1541 . 1 1 3 PHE CE1 C 5.248 4.900 0.475 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CE1 . . . . . . . . . c30057_5j6t 1 . 6 . 1542 . 1 1 3 PHE CE2 C 4.963 5.717 2.741 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CE2 . . . . . . . . . c30057_5j6t 1 . 6 . 1543 . 1 1 3 PHE CG C 3.961 3.612 2.076 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CG . . . . . . . . . c30057_5j6t 1 . 6 . 1544 . 1 1 3 PHE CZ C 5.486 5.874 1.452 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CZ . . . . . . . . . c30057_5j6t 1 . 6 . 1545 . 1 1 3 PHE H H 2.058 0.179 2.636 . . . 1.0 . . . . . . . . . . . . A . 3 PHE H . . . . . . . . . c30057_5j6t 1 . 6 . 1546 . 1 1 3 PHE HA H 4.272 1.144 1.056 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HA . . . . . . . . . c30057_5j6t 1 . 6 . 1547 . 1 1 3 PHE HB2 H 2.223 2.396 1.818 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HB2 . . . . . . . . . c30057_5j6t 1 . 6 . 1548 . 1 1 3 PHE HB3 H 2.883 2.404 3.471 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HB3 . . . . . . . . . c30057_5j6t 1 . 6 . 1549 . 1 1 3 PHE HD1 H 4.301 3.017 0.034 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HD1 . . . . . . . . . c30057_5j6t 1 . 6 . 1550 . 1 1 3 PHE HD2 H 3.796 4.463 4.046 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HD2 . . . . . . . . . c30057_5j6t 1 . 6 . 1551 . 1 1 3 PHE HE1 H 5.653 5.021 -0.519 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HE1 . . . . . . . . . c30057_5j6t 1 . 6 . 1552 . 1 1 3 PHE HE2 H 5.147 6.468 3.494 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HE2 . . . . . . . . . c30057_5j6t 1 . 6 . 1553 . 1 1 3 PHE HZ H 6.074 6.748 1.211 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HZ . . . . . . . . . c30057_5j6t 1 . 6 . 1554 . 1 1 3 PHE N N 3.001 -0.003 2.326 . . . 1.0 . . . . . . . . . . . . A . 3 PHE N . . . . . . . . . c30057_5j6t 1 . 6 . 1555 . 1 1 3 PHE O O 6.268 1.292 2.653 . . . 1.0 . . . . . . . . . . . . A . 3 PHE O . . . . . . . . . c30057_5j6t 1 . 6 . 1556 . 1 1 4 GLY C C 7.040 -0.581 4.701 . . . 1.0 . . . . . . . . . . . . A . 4 GLY C . . . . . . . . . c30057_5j6t 1 . 6 . 1557 . 1 1 4 GLY CA C 6.051 0.470 5.215 . . . 1.0 . . . . . . . . . . . . A . 4 GLY CA . . . . . . . . . c30057_5j6t 1 . 6 . 1558 . 1 1 4 GLY H H 3.980 0.386 4.542 . . . 1.0 . . . . . . . . . . . . A . 4 GLY H . . . . . . . . . c30057_5j6t 1 . 6 . 1559 . 1 1 4 GLY HA2 H 6.561 1.428 5.316 . . . 1.0 . . . . . . . . . . . . A . 4 GLY HA2 . . . . . . . . . c30057_5j6t 1 . 6 . 1560 . 1 1 4 GLY HA3 H 5.664 0.160 6.186 . . . 1.0 . . . . . . . . . . . . A . 4 GLY HA3 . . . . . . . . . c30057_5j6t 1 . 6 . 1561 . 1 1 4 GLY N N 4.921 0.608 4.251 . . . 1.0 . . . . . . . . . . . . A . 4 GLY N . . . . . . . . . c30057_5j6t 1 . 6 . 1562 . 1 1 4 GLY O O 8.173 -0.640 5.135 . . . 1.0 . . . . . . . . . . . . A . 4 GLY O . . . . . . . . . c30057_5j6t 1 . 6 . 1563 . 1 1 5 ALA C C 8.265 -1.939 1.995 . . . 1.0 . . . . . . . . . . . . A . 5 ALA C . . . . . . . . . c30057_5j6t 1 . 6 . 1564 . 1 1 5 ALA CA C 7.538 -2.456 3.242 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CA . . . . . . . . . c30057_5j6t 1 . 6 . 1565 . 1 1 5 ALA CB C 6.631 -3.633 2.881 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CB . . . . . . . . . c30057_5j6t 1 . 6 . 1566 . 1 1 5 ALA H H 5.673 -1.345 3.436 . . . 1.0 . . . . . . . . . . . . A . 5 ALA H . . . . . . . . . c30057_5j6t 1 . 6 . 1567 . 1 1 5 ALA HA H 8.259 -2.755 4.003 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HA . . . . . . . . . c30057_5j6t 1 . 6 . 1568 . 1 1 5 ALA HB1 H 7.233 -4.446 2.476 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB1 . . . . . . . . . c30057_5j6t 1 . 6 . 1569 . 1 1 5 ALA HB2 H 6.111 -3.977 3.775 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB2 . . . . . . . . . c30057_5j6t 1 . 6 . 1570 . 1 1 5 ALA HB3 H 5.902 -3.314 2.136 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB3 . . . . . . . . . c30057_5j6t 1 . 6 . 1571 . 1 1 5 ALA N N 6.620 -1.411 3.782 . . . 1.0 . . . . . . . . . . . . A . 5 ALA N . . . . . . . . . c30057_5j6t 1 . 6 . 1572 . 1 1 5 ALA O O 9.252 -2.503 1.565 . . . 1.0 . . . . . . . . . . . . A . 5 ALA O . . . . . . . . . c30057_5j6t 1 . 6 . 1573 . 1 1 6 ILE C C 9.595 0.611 0.588 . . . 1.0 . . . . . . . . . . . . A . 6 ILE C . . . . . . . . . c30057_5j6t 1 . 6 . 1574 . 1 1 6 ILE CA C 8.451 -0.322 0.193 . . . 1.0 . . . . . . . . . . . . A . 6 ILE CA . . . . . . . . . c30057_5j6t 1 . 6 . 1575 . 1 1 6 ILE CB C 7.355 0.453 -0.542 . . . 1.0 . . . . . . . . . . . . A . 6 ILE CB . . . . . . . . . c30057_5j6t 1 . 6 . 1576 . 1 1 6 ILE CD1 C 6.730 -1.615 -1.820 . . . 1.0 . . . . . . . . . . . . A . 6 ILE CD1 . . . . . . . . . c30057_5j6t 1 . 6 . 1577 . 1 1 6 ILE CG1 C 6.209 -0.498 -0.909 . . . 1.0 . . . . . . . . . . . . A . 6 ILE CG1 . . . . . . . . . c30057_5j6t 1 . 6 . 1578 . 1 1 6 ILE CG2 C 7.931 1.076 -1.818 . . . 1.0 . . . . . . . . . . . . A . 6 ILE CG2 . . . . . . . . . c30057_5j6t 1 . 6 . 1579 . 1 1 6 ILE H H 6.963 -0.418 1.786 . . . 1.0 . . . . . . . . . . . . A . 6 ILE H . . . . . . . . . c30057_5j6t 1 . 6 . 1580 . 1 1 6 ILE HA H 8.824 -1.134 -0.431 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HA . . . . . . . . . c30057_5j6t 1 . 6 . 1581 . 1 1 6 ILE HB H 6.975 1.243 0.105 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HB . . . . . . . . . c30057_5j6t 1 . 6 . 1582 . 1 1 6 ILE HD11 H 6.144 -2.520 -1.657 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HD11 . . . . . . . . . c30057_5j6t 1 . 6 . 1583 . 1 1 6 ILE HD12 H 6.640 -1.306 -2.861 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HD12 . . . . . . . . . c30057_5j6t 1 . 6 . 1584 . 1 1 6 ILE HD13 H 7.776 -1.814 -1.588 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HD13 . . . . . . . . . c30057_5j6t 1 . 6 . 1585 . 1 1 6 ILE HG12 H 5.796 -0.935 0.000 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HG12 . . . . . . . . . c30057_5j6t 1 . 6 . 1586 . 1 1 6 ILE HG13 H 5.429 0.059 -1.429 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HG13 . . . . . . . . . c30057_5j6t 1 . 6 . 1587 . 1 1 6 ILE HG21 H 8.321 2.068 -1.594 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HG21 . . . . . . . . . c30057_5j6t 1 . 6 . 1588 . 1 1 6 ILE HG22 H 7.145 1.156 -2.569 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HG22 . . . . . . . . . c30057_5j6t 1 . 6 . 1589 . 1 1 6 ILE HG23 H 8.735 0.446 -2.198 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HG23 . . . . . . . . . c30057_5j6t 1 . 6 . 1590 . 1 1 6 ILE N N 7.785 -0.871 1.412 . . . 1.0 . . . . . . . . . . . . A . 6 ILE N . . . . . . . . . c30057_5j6t 1 . 6 . 1591 . 1 1 6 ILE O O 10.603 0.691 -0.087 . . . 1.0 . . . . . . . . . . . . A . 6 ILE O . . . . . . . . . c30057_5j6t 1 . 6 . 1592 . 1 1 7 TRP C C 11.797 1.461 2.463 . . . 1.0 . . . . . . . . . . . . A . 7 TRP C . . . . . . . . . c30057_5j6t 1 . 6 . 1593 . 1 1 7 TRP CA C 10.531 2.250 2.106 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CA . . . . . . . . . c30057_5j6t 1 . 6 . 1594 . 1 1 7 TRP CB C 9.975 2.985 3.329 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CB . . . . . . . . . c30057_5j6t 1 . 6 . 1595 . 1 1 7 TRP CD1 C 8.847 5.238 3.128 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CD1 . . . . . . . . . c30057_5j6t 1 . 6 . 1596 . 1 1 7 TRP CD2 C 11.041 5.320 2.641 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CD2 . . . . . . . . . c30057_5j6t 1 . 6 . 1597 . 1 1 7 TRP CE2 C 10.543 6.635 2.490 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CE2 . . . . . . . . . c30057_5j6t 1 . 6 . 1598 . 1 1 7 TRP CE3 C 12.407 5.095 2.393 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CE3 . . . . . . . . . c30057_5j6t 1 . 6 . 1599 . 1 1 7 TRP CG C 9.945 4.453 3.049 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CG . . . . . . . . . c30057_5j6t 1 . 6 . 1600 . 1 1 7 TRP CH2 C 12.727 7.449 1.859 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CH2 . . . . . . . . . c30057_5j6t 1 . 6 . 1601 . 1 1 7 TRP CZ2 C 11.372 7.691 2.104 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CZ2 . . . . . . . . . c30057_5j6t 1 . 6 . 1602 . 1 1 7 TRP CZ3 C 13.244 6.153 2.004 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CZ3 . . . . . . . . . c30057_5j6t 1 . 6 . 1603 . 1 1 7 TRP H H 8.603 1.238 2.219 . . . 1.0 . . . . . . . . . . . . A . 7 TRP H . . . . . . . . . c30057_5j6t 1 . 6 . 1604 . 1 1 7 TRP HA H 10.748 2.963 1.311 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HA . . . . . . . . . c30057_5j6t 1 . 6 . 1605 . 1 1 7 TRP HB2 H 8.965 2.633 3.538 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HB2 . . . . . . . . . c30057_5j6t 1 . 6 . 1606 . 1 1 7 TRP HB3 H 10.614 2.792 4.191 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HB3 . . . . . . . . . c30057_5j6t 1 . 6 . 1607 . 1 1 7 TRP HD1 H 7.856 4.907 3.403 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HD1 . . . . . . . . . c30057_5j6t 1 . 6 . 1608 . 1 1 7 TRP HE1 H 8.557 7.313 2.782 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HE1 . . . . . . . . . c30057_5j6t 1 . 6 . 1609 . 1 1 7 TRP HE3 H 12.816 4.101 2.502 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HE3 . . . . . . . . . c30057_5j6t 1 . 6 . 1610 . 1 1 7 TRP HH2 H 13.375 8.260 1.560 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HH2 . . . . . . . . . c30057_5j6t 1 . 6 . 1611 . 1 1 7 TRP HZ2 H 10.969 8.687 1.994 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HZ2 . . . . . . . . . c30057_5j6t 1 . 6 . 1612 . 1 1 7 TRP HZ3 H 14.291 5.968 1.815 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HZ3 . . . . . . . . . c30057_5j6t 1 . 6 . 1613 . 1 1 7 TRP N N 9.448 1.319 1.673 . . . 1.0 . . . . . . . . . . . . A . 7 TRP N . . . . . . . . . c30057_5j6t 1 . 6 . 1614 . 1 1 7 TRP NE1 N 9.201 6.535 2.797 . . . 1.0 . . . . . . . . . . . . A . 7 TRP NE1 . . . . . . . . . c30057_5j6t 1 . 6 . 1615 . 1 1 7 TRP O O 12.864 1.758 1.963 . . . 1.0 . . . . . . . . . . . . A . 7 TRP O . . . . . . . . . c30057_5j6t 1 . 6 . 1616 . 1 1 8 PRO C C 13.502 -0.932 2.465 . . . 1.0 . . . . . . . . . . . . A . 8 PRO C . . . . . . . . . c30057_5j6t 1 . 6 . 1617 . 1 1 8 PRO CA C 12.814 -0.358 3.708 . . . 1.0 . . . . . . . . . . . . A . 8 PRO CA . . . . . . . . . c30057_5j6t 1 . 6 . 1618 . 1 1 8 PRO CB C 12.211 -1.476 4.554 . . . 1.0 . . . . . . . . . . . . A . 8 PRO CB . . . . . . . . . c30057_5j6t 1 . 6 . 1619 . 1 1 8 PRO CD C 10.413 0.035 3.970 . . . 1.0 . . . . . . . . . . . . A . 8 PRO CD . . . . . . . . . c30057_5j6t 1 . 6 . 1620 . 1 1 8 PRO CG C 10.872 -0.972 4.991 . . . 1.0 . . . . . . . . . . . . A . 8 PRO CG . . . . . . . . . c30057_5j6t 1 . 6 . 1621 . 1 1 8 PRO HA H 13.518 0.230 4.297 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HA . . . . . . . . . c30057_5j6t 1 . 6 . 1622 . 1 1 8 PRO HB2 H 12.095 -2.379 3.954 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HB2 . . . . . . . . . c30057_5j6t 1 . 6 . 1623 . 1 1 8 PRO HB3 H 12.841 -1.680 5.420 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HB3 . . . . . . . . . c30057_5j6t 1 . 6 . 1624 . 1 1 8 PRO HD2 H 9.744 -0.434 3.249 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HD2 . . . . . . . . . c30057_5j6t 1 . 6 . 1625 . 1 1 8 PRO HD3 H 9.916 0.876 4.454 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HD3 . . . . . . . . . c30057_5j6t 1 . 6 . 1626 . 1 1 8 PRO HG2 H 10.163 -1.799 5.043 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HG2 . . . . . . . . . c30057_5j6t 1 . 6 . 1627 . 1 1 8 PRO HG3 H 10.957 -0.496 5.967 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HG3 . . . . . . . . . c30057_5j6t 1 . 6 . 1628 . 1 1 8 PRO N N 11.648 0.469 3.312 . . . 1.0 . . . . . . . . . . . . A . 8 PRO N . . . . . . . . . c30057_5j6t 1 . 6 . 1629 . 1 1 8 PRO O O 14.691 -1.179 2.459 . . . 1.0 . . . . . . . . . . . . A . 8 PRO O . . . . . . . . . c30057_5j6t 1 . 6 . 1630 . 1 1 9 LEU C C 14.066 -0.571 -0.614 . . . 1.0 . . . . . . . . . . . . A . 9 LEU C . . . . . . . . . c30057_5j6t 1 . 6 . 1631 . 1 1 9 LEU CA C 13.363 -1.687 0.163 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CA . . . . . . . . . c30057_5j6t 1 . 6 . 1632 . 1 1 9 LEU CB C 12.184 -2.242 -0.640 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CB . . . . . . . . . c30057_5j6t 1 . 6 . 1633 . 1 1 9 LEU CD1 C 11.508 -4.441 -1.611 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CD1 . . . . . . . . . c30057_5j6t 1 . 6 . 1634 . 1 1 9 LEU CD2 C 13.063 -2.946 -2.868 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CD2 . . . . . . . . . c30057_5j6t 1 . 6 . 1635 . 1 1 9 LEU CG C 12.650 -3.433 -1.477 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CG . . . . . . . . . c30057_5j6t 1 . 6 . 1636 . 1 1 9 LEU H H 11.771 -0.923 1.440 . . . 1.0 . . . . . . . . . . . . A . 9 LEU H . . . . . . . . . c30057_5j6t 1 . 6 . 1637 . 1 1 9 LEU HA H 14.067 -2.484 0.403 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HA . . . . . . . . . c30057_5j6t 1 . 6 . 1638 . 1 1 9 LEU HB2 H 11.399 -2.564 0.044 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HB2 . . . . . . . . . c30057_5j6t 1 . 6 . 1639 . 1 1 9 LEU HB3 H 11.795 -1.465 -1.298 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HB3 . . . . . . . . . c30057_5j6t 1 . 6 . 1640 . 1 1 9 LEU HD11 H 11.213 -4.789 -0.621 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD11 . . . . . . . . . c30057_5j6t 1 . 6 . 1641 . 1 1 9 LEU HD12 H 11.841 -5.290 -2.209 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD12 . . . . . . . . . c30057_5j6t 1 . 6 . 1642 . 1 1 9 LEU HD13 H 10.657 -3.965 -2.098 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD13 . . . . . . . . . c30057_5j6t 1 . 6 . 1643 . 1 1 9 LEU HD21 H 13.396 -3.794 -3.467 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD21 . . . . . . . . . c30057_5j6t 1 . 6 . 1644 . 1 1 9 LEU HD22 H 12.212 -2.470 -3.354 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD22 . . . . . . . . . c30057_5j6t 1 . 6 . 1645 . 1 1 9 LEU HD23 H 13.877 -2.226 -2.774 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD23 . . . . . . . . . c30057_5j6t 1 . 6 . 1646 . 1 1 9 LEU HG H 13.501 -3.909 -0.991 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HG . . . . . . . . . c30057_5j6t 1 . 6 . 1647 . 1 1 9 LEU N N 12.757 -1.137 1.410 . . . 1.0 . . . . . . . . . . . . A . 9 LEU N . . . . . . . . . c30057_5j6t 1 . 6 . 1648 . 1 1 9 LEU O O 15.006 -0.809 -1.348 . . . 1.0 . . . . . . . . . . . . A . 9 LEU O . . . . . . . . . c30057_5j6t 1 . 6 . 1649 . 1 1 10 ALA C C 15.622 2.098 -0.562 . . . 1.0 . . . . . . . . . . . . A . 10 ALA C . . . . . . . . . c30057_5j6t 1 . 6 . 1650 . 1 1 10 ALA CA C 14.259 1.782 -1.182 . . . 1.0 . . . . . . . . . . . . A . 10 ALA CA . . . . . . . . . c30057_5j6t 1 . 6 . 1651 . 1 1 10 ALA CB C 13.301 2.962 -1.001 . . . 1.0 . . . . . . . . . . . . A . 10 ALA CB . . . . . . . . . c30057_5j6t 1 . 6 . 1652 . 1 1 10 ALA H H 12.835 0.819 0.159 . . . 1.0 . . . . . . . . . . . . A . 10 ALA H . . . . . . . . . c30057_5j6t 1 . 6 . 1653 . 1 1 10 ALA HA H 14.370 1.542 -2.240 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HA . . . . . . . . . c30057_5j6t 1 . 6 . 1654 . 1 1 10 ALA HB1 H 13.704 3.839 -1.508 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HB1 . . . . . . . . . c30057_5j6t 1 . 6 . 1655 . 1 1 10 ALA HB2 H 13.188 3.177 0.061 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HB2 . . . . . . . . . c30057_5j6t 1 . 6 . 1656 . 1 1 10 ALA HB3 H 12.330 2.710 -1.427 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HB3 . . . . . . . . . c30057_5j6t 1 . 6 . 1657 . 1 1 10 ALA N N 13.617 0.646 -0.456 . . . 1.0 . . . . . . . . . . . . A . 10 ALA N . . . . . . . . . c30057_5j6t 1 . 6 . 1658 . 1 1 10 ALA O O 16.519 2.581 -1.226 . . . 1.0 . . . . . . . . . . . . A . 10 ALA O . . . . . . . . . c30057_5j6t 1 . 6 . 1659 . 1 1 11 LEU C C 18.100 1.016 1.038 . . . 1.0 . . . . . . . . . . . . A . 11 LEU C . . . . . . . . . c30057_5j6t 1 . 6 . 1660 . 1 1 11 LEU CA C 17.086 2.113 1.372 . . . 1.0 . . . . . . . . . . . . A . 11 LEU CA . . . . . . . . . c30057_5j6t 1 . 6 . 1661 . 1 1 11 LEU CB C 16.774 2.118 2.869 . . . 1.0 . . . . . . . . . . . . A . 11 LEU CB . . . . . . . . . c30057_5j6t 1 . 6 . 1662 . 1 1 11 LEU CD1 C 15.489 3.387 4.596 . . . 1.0 . . . . . . . . . . . . A . 11 LEU CD1 . . . . . . . . . c30057_5j6t 1 . 6 . 1663 . 1 1 11 LEU CD2 C 17.435 4.455 3.452 . . . 1.0 . . . . . . . . . . . . A . 11 LEU CD2 . . . . . . . . . c30057_5j6t 1 . 6 . 1664 . 1 1 11 LEU CG C 16.255 3.498 3.277 . . . 1.0 . . . . . . . . . . . . A . 11 LEU CG . . . . . . . . . c30057_5j6t 1 . 6 . 1665 . 1 1 11 LEU H H 15.021 1.429 1.235 . . . 1.0 . . . . . . . . . . . . A . 11 LEU H . . . . . . . . . c30057_5j6t 1 . 6 . 1666 . 1 1 11 LEU HA H 17.466 3.086 1.061 . . . 1.0 . . . . . . . . . . . . A . 11 LEU HA . . . . . . . . . c30057_5j6t 1 . 6 . 1667 . 1 1 11 LEU HB2 H 16.015 1.366 3.085 . . . 1.0 . . . . . . . . . . . . A . 11 LEU HB2 . . . . . . . . . c30057_5j6t 1 . 6 . 1668 . 1 1 11 LEU HB3 H 17.681 1.891 3.430 . . . 1.0 . . . . . . . . . . . . A . 11 LEU HB3 . . . . . . . . . c30057_5j6t 1 . 6 . 1669 . 1 1 11 LEU HD11 H 14.647 2.706 4.472 . . . 1.0 . . . . . . . . . . . . A . 11 LEU HD11 . . . . . . . . . c30057_5j6t 1 . 6 . 1670 . 1 1 11 LEU HD12 H 15.119 4.371 4.885 . . . 1.0 . . . . . . . . . . . . A . 11 LEU HD12 . . . . . . . . . c30057_5j6t 1 . 6 . 1671 . 1 1 11 LEU HD13 H 16.154 3.007 5.371 . . . 1.0 . . . . . . . . . . . . A . 11 LEU HD13 . . . . . . . . . c30057_5j6t 1 . 6 . 1672 . 1 1 11 LEU HD21 H 17.066 5.438 3.742 . . . 1.0 . . . . . . . . . . . . A . 11 LEU HD21 . . . . . . . . . c30057_5j6t 1 . 6 . 1673 . 1 1 11 LEU HD22 H 18.100 4.073 4.227 . . . 1.0 . . . . . . . . . . . . A . 11 LEU HD22 . . . . . . . . . c30057_5j6t 1 . 6 . 1674 . 1 1 11 LEU HD23 H 17.980 4.534 2.512 . . . 1.0 . . . . . . . . . . . . A . 11 LEU HD23 . . . . . . . . . c30057_5j6t 1 . 6 . 1675 . 1 1 11 LEU HG H 15.590 3.880 2.502 . . . 1.0 . . . . . . . . . . . . A . 11 LEU HG . . . . . . . . . c30057_5j6t 1 . 6 . 1676 . 1 1 11 LEU N N 15.782 1.830 0.704 . . . 1.0 . . . . . . . . . . . . A . 11 LEU N . . . . . . . . . c30057_5j6t 1 . 6 . 1677 . 1 1 11 LEU O O 19.294 1.243 1.029 . . . 1.0 . . . . . . . . . . . . A . 11 LEU O . . . . . . . . . c30057_5j6t 1 . 6 . 1678 . 1 1 12 GLY C C 19.018 -1.149 -1.030 . . . 1.0 . . . . . . . . . . . . A . 12 GLY C . . . . . . . . . c30057_5j6t 1 . 6 . 1679 . 1 1 12 GLY CA C 18.568 -1.284 0.424 . . . 1.0 . . . . . . . . . . . . A . 12 GLY CA . . . . . . . . . c30057_5j6t 1 . 6 . 1680 . 1 1 12 GLY H H 16.637 -0.338 0.775 . . . 1.0 . . . . . . . . . . . . A . 12 GLY H . . . . . . . . . c30057_5j6t 1 . 6 . 1681 . 1 1 12 GLY HA2 H 19.438 -1.237 1.079 . . . 1.0 . . . . . . . . . . . . A . 12 GLY HA2 . . . . . . . . . c30057_5j6t 1 . 6 . 1682 . 1 1 12 GLY HA3 H 18.061 -2.239 0.561 . . . 1.0 . . . . . . . . . . . . A . 12 GLY HA3 . . . . . . . . . c30057_5j6t 1 . 6 . 1683 . 1 1 12 GLY N N 17.633 -0.172 0.761 . . . 1.0 . . . . . . . . . . . . A . 12 GLY N . . . . . . . . . c30057_5j6t 1 . 6 . 1684 . 1 1 12 GLY O O 20.143 -1.451 -1.372 . . . 1.0 . . . . . . . . . . . . A . 12 GLY O . . . . . . . . . c30057_5j6t 1 . 6 . 1685 . 1 1 13 ALA C C 19.695 0.437 -3.459 . . . 1.0 . . . . . . . . . . . . A . 13 ALA C . . . . . . . . . c30057_5j6t 1 . 6 . 1686 . 1 1 13 ALA CA C 18.521 -0.538 -3.326 . . . 1.0 . . . . . . . . . . . . A . 13 ALA CA . . . . . . . . . c30057_5j6t 1 . 6 . 1687 . 1 1 13 ALA CB C 17.274 0.027 -4.007 . . . 1.0 . . . . . . . . . . . . A . 13 ALA CB . . . . . . . . . c30057_5j6t 1 . 6 . 1688 . 1 1 13 ALA H H 17.215 -0.450 -1.583 . . . 1.0 . . . . . . . . . . . . A . 13 ALA H . . . . . . . . . c30057_5j6t 1 . 6 . 1689 . 1 1 13 ALA HA H 18.782 -1.505 -3.757 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HA . . . . . . . . . c30057_5j6t 1 . 6 . 1690 . 1 1 13 ALA HB1 H 17.473 0.170 -5.069 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HB1 . . . . . . . . . c30057_5j6t 1 . 6 . 1691 . 1 1 13 ALA HB2 H 16.446 -0.671 -3.884 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HB2 . . . . . . . . . c30057_5j6t 1 . 6 . 1692 . 1 1 13 ALA HB3 H 17.014 0.983 -3.554 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HB3 . . . . . . . . . c30057_5j6t 1 . 6 . 1693 . 1 1 13 ALA N N 18.145 -0.695 -1.890 . . . 1.0 . . . . . . . . . . . . A . 13 ALA N . . . . . . . . . c30057_5j6t 1 . 6 . 1694 . 1 1 13 ALA O O 20.475 0.360 -4.389 . . . 1.0 . . . . . . . . . . . . A . 13 ALA O . . . . . . . . . c30057_5j6t 1 . 6 . 1695 . 1 1 14 LEU C C 22.225 1.700 -2.038 . . . 1.0 . . . . . . . . . . . . A . 14 LEU C . . . . . . . . . c30057_5j6t 1 . 6 . 1696 . 1 1 14 LEU CA C 20.948 2.329 -2.604 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CA . . . . . . . . . c30057_5j6t 1 . 6 . 1697 . 1 1 14 LEU CB C 20.497 3.508 -1.737 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CB . . . . . . . . . c30057_5j6t 1 . 6 . 1698 . 1 1 14 LEU CD1 C 21.816 5.174 -3.053 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CD1 . . . . . . . . . c30057_5j6t 1 . 6 . 1699 . 1 1 14 LEU CD2 C 21.215 5.650 -0.676 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CD2 . . . . . . . . . c30057_5j6t 1 . 6 . 1700 . 1 1 14 LEU CG C 21.610 4.555 -1.669 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CG . . . . . . . . . c30057_5j6t 1 . 6 . 1701 . 1 1 14 LEU H H 19.163 1.395 -1.774 . . . 1.0 . . . . . . . . . . . . A . 14 LEU H . . . . . . . . . c30057_5j6t 1 . 6 . 1702 . 1 1 14 LEU HA H 21.108 2.653 -3.632 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HA . . . . . . . . . c30057_5j6t 1 . 6 . 1703 . 1 1 14 LEU HB2 H 19.604 3.957 -2.173 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HB2 . . . . . . . . . c30057_5j6t 1 . 6 . 1704 . 1 1 14 LEU HB3 H 20.271 3.154 -0.732 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HB3 . . . . . . . . . c30057_5j6t 1 . 6 . 1705 . 1 1 14 LEU HD11 H 22.097 4.395 -3.761 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD11 . . . . . . . . . c30057_5j6t 1 . 6 . 1706 . 1 1 14 LEU HD12 H 20.890 5.646 -3.381 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD12 . . . . . . . . . c30057_5j6t 1 . 6 . 1707 . 1 1 14 LEU HD13 H 22.608 5.921 -3.002 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD13 . . . . . . . . . c30057_5j6t 1 . 6 . 1708 . 1 1 14 LEU HD21 H 22.007 6.398 -0.625 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD21 . . . . . . . . . c30057_5j6t 1 . 6 . 1709 . 1 1 14 LEU HD22 H 21.068 5.210 0.311 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD22 . . . . . . . . . c30057_5j6t 1 . 6 . 1710 . 1 1 14 LEU HD23 H 20.290 6.123 -1.004 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD23 . . . . . . . . . c30057_5j6t 1 . 6 . 1711 . 1 1 14 LEU HG H 22.535 4.081 -1.341 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HG . . . . . . . . . c30057_5j6t 1 . 6 . 1712 . 1 1 14 LEU N N 19.825 1.351 -2.536 . . . 1.0 . . . . . . . . . . . . A . 14 LEU N . . . . . . . . . c30057_5j6t 1 . 6 . 1713 . 1 1 14 LEU O O 23.279 1.764 -2.637 . . . 1.0 . . . . . . . . . . . . A . 14 LEU O . . . . . . . . . c30057_5j6t 1 . 6 . 1714 . 1 1 15 LYS C C 23.920 -0.600 -1.223 . . . 1.0 . . . . . . . . . . . . A . 15 LYS C . . . . . . . . . c30057_5j6t 1 . 6 . 1715 . 1 1 15 LYS CA C 23.338 0.453 -0.274 . . . 1.0 . . . . . . . . . . . . A . 15 LYS CA . . . . . . . . . c30057_5j6t 1 . 6 . 1716 . 1 1 15 LYS CB C 22.833 -0.207 1.014 . . . 1.0 . . . . . . . . . . . . A . 15 LYS CB . . . . . . . . . c30057_5j6t 1 . 6 . 1717 . 1 1 15 LYS CD C 22.547 1.087 3.138 . . . 1.0 . . . . . . . . . . . . A . 15 LYS CD . . . . . . . . . c30057_5j6t 1 . 6 . 1718 . 1 1 15 LYS CE C 22.066 2.380 2.477 . . . 1.0 . . . . . . . . . . . . A . 15 LYS CE . . . . . . . . . c30057_5j6t 1 . 6 . 1719 . 1 1 15 LYS CG C 23.559 0.391 2.225 . . . 1.0 . . . . . . . . . . . . A . 15 LYS CG . . . . . . . . . c30057_5j6t 1 . 6 . 1720 . 1 1 15 LYS H H 21.244 1.049 -0.408 . . . 1.0 . . . . . . . . . . . . A . 15 LYS H . . . . . . . . . c30057_5j6t 1 . 6 . 1721 . 1 1 15 LYS HA H 24.088 1.209 -0.042 . . . 1.0 . . . . . . . . . . . . A . 15 LYS HA . . . . . . . . . c30057_5j6t 1 . 6 . 1722 . 1 1 15 LYS HB2 H 21.761 -0.034 1.113 . . . 1.0 . . . . . . . . . . . . A . 15 LYS HB2 . . . . . . . . . c30057_5j6t 1 . 6 . 1723 . 1 1 15 LYS HB3 H 23.023 -1.280 0.970 . . . 1.0 . . . . . . . . . . . . A . 15 LYS HB3 . . . . . . . . . c30057_5j6t 1 . 6 . 1724 . 1 1 15 LYS HD2 H 21.696 0.427 3.306 . . . 1.0 . . . . . . . . . . . . A . 15 LYS HD2 . . . . . . . . . c30057_5j6t 1 . 6 . 1725 . 1 1 15 LYS HD3 H 23.019 1.320 4.093 . . . 1.0 . . . . . . . . . . . . A . 15 LYS HD3 . . . . . . . . . c30057_5j6t 1 . 6 . 1726 . 1 1 15 LYS HE2 H 22.896 3.078 2.368 . . . 1.0 . . . . . . . . . . . . A . 15 LYS HE2 . . . . . . . . . c30057_5j6t 1 . 6 . 1727 . 1 1 15 LYS HE3 H 21.620 2.170 1.505 . . . 1.0 . . . . . . . . . . . . A . 15 LYS HE3 . . . . . . . . . c30057_5j6t 1 . 6 . 1728 . 1 1 15 LYS HG2 H 24.059 -0.405 2.778 . . . 1.0 . . . . . . . . . . . . A . 15 LYS HG2 . . . . . . . . . c30057_5j6t 1 . 6 . 1729 . 1 1 15 LYS HG3 H 24.298 1.116 1.884 . . . 1.0 . . . . . . . . . . . . A . 15 LYS HG3 . . . . . . . . . c30057_5j6t 1 . 6 . 1730 . 1 1 15 LYS HZ1 H 20.682 3.798 3.038 . . . 1.0 . . . . . . . . . . . . A . 15 LYS HZ1 . . . . . . . . . c30057_5j6t 1 . 6 . 1731 . 1 1 15 LYS HZ2 H 21.476 3.111 4.310 . . . 1.0 . . . . . . . . . . . . A . 15 LYS HZ2 . . . . . . . . . c30057_5j6t 1 . 6 . 1732 . 1 1 15 LYS HZ3 H 20.296 2.270 3.523 . . . 1.0 . . . . . . . . . . . . A . 15 LYS HZ3 . . . . . . . . . c30057_5j6t 1 . 6 . 1733 . 1 1 15 LYS N N 22.132 1.090 -0.886 . . . 1.0 . . . . . . . . . . . . A . 15 LYS N . . . . . . . . . c30057_5j6t 1 . 6 . 1734 . 1 1 15 LYS NZ N 21.048 2.934 3.412 . . . 1.0 . . . . . . . . . . . . A . 15 LYS NZ . . . . . . . . . c30057_5j6t 1 . 6 . 1735 . 1 1 15 LYS O O 25.103 -0.879 -1.203 . . . 1.0 . . . . . . . . . . . . A . 15 LYS O . . . . . . . . . c30057_5j6t 1 . 6 . 1736 . 1 1 16 ASN C C 24.472 -1.583 -4.082 . . . 1.0 . . . . . . . . . . . . A . 16 ASN C . . . . . . . . . c30057_5j6t 1 . 6 . 1737 . 1 1 16 ASN CA C 23.601 -2.225 -2.998 . . . 1.0 . . . . . . . . . . . . A . 16 ASN CA . . . . . . . . . c30057_5j6t 1 . 6 . 1738 . 1 1 16 ASN CB C 22.346 -2.842 -3.615 . . . 1.0 . . . . . . . . . . . . A . 16 ASN CB . . . . . . . . . c30057_5j6t 1 . 6 . 1739 . 1 1 16 ASN CG C 21.547 -3.571 -2.533 . . . 1.0 . . . . . . . . . . . . A . 16 ASN CG . . . . . . . . . c30057_5j6t 1 . 6 . 1740 . 1 1 16 ASN H H 22.118 -0.938 -2.050 . . . 1.0 . . . . . . . . . . . . A . 16 ASN H . . . . . . . . . c30057_5j6t 1 . 6 . 1741 . 1 1 16 ASN HA H 24.168 -2.984 -2.459 . . . 1.0 . . . . . . . . . . . . A . 16 ASN HA . . . . . . . . . c30057_5j6t 1 . 6 . 1742 . 1 1 16 ASN HB2 H 21.731 -2.054 -4.051 . . . 1.0 . . . . . . . . . . . . A . 16 ASN HB2 . . . . . . . . . c30057_5j6t 1 . 6 . 1743 . 1 1 16 ASN HB3 H 22.633 -3.549 -4.393 . . . 1.0 . . . . . . . . . . . . A . 16 ASN HB3 . . . . . . . . . c30057_5j6t 1 . 6 . 1744 . 1 1 16 ASN HD21 H 19.802 -3.377 -3.512 . . . 1.0 . . . . . . . . . . . . A . 16 ASN HD21 . . . . . . . . . c30057_5j6t 1 . 6 . 1745 . 1 1 16 ASN HD22 H 19.724 -4.211 -1.976 . . . 1.0 . . . . . . . . . . . . A . 16 ASN HD22 . . . . . . . . . c30057_5j6t 1 . 6 . 1746 . 1 1 16 ASN N N 23.097 -1.187 -2.051 . . . 1.0 . . . . . . . . . . . . A . 16 ASN N . . . . . . . . . c30057_5j6t 1 . 6 . 1747 . 1 1 16 ASN ND2 N 20.261 -3.732 -2.685 . . . 1.0 . . . . . . . . . . . . A . 16 ASN ND2 . . . . . . . . . c30057_5j6t 1 . 6 . 1748 . 1 1 16 ASN O O 25.442 -2.163 -4.533 . . . 1.0 . . . . . . . . . . . . A . 16 ASN O . . . . . . . . . c30057_5j6t 1 . 6 . 1749 . 1 1 16 ASN OD1 O 22.099 -3.997 -1.538 . . . 1.0 . . . . . . . . . . . . A . 16 ASN OD1 . . . . . . . . . c30057_5j6t 1 . 6 . 1750 . 1 1 17 LEU C C 26.258 0.793 -4.979 . . . 1.0 . . . . . . . . . . . . A . 17 LEU C . . . . . . . . . c30057_5j6t 1 . 6 . 1751 . 1 1 17 LEU CA C 24.944 0.278 -5.565 . . . 1.0 . . . . . . . . . . . . A . 17 LEU CA . . . . . . . . . c30057_5j6t 1 . 6 . 1752 . 1 1 17 LEU CB C 24.077 1.446 -6.046 . . . 1.0 . . . . . . . . . . . . A . 17 LEU CB . . . . . . . . . c30057_5j6t 1 . 6 . 1753 . 1 1 17 LEU CD1 C 24.091 0.584 -8.401 . . . 1.0 . . . . . . . . . . . . A . 17 LEU CD1 . . . . . . . . . c30057_5j6t 1 . 6 . 1754 . 1 1 17 LEU CD2 C 22.338 -0.193 -6.790 . . . 1.0 . . . . . . . . . . . . A . 17 LEU CD2 . . . . . . . . . c30057_5j6t 1 . 6 . 1755 . 1 1 17 LEU CG C 23.202 0.996 -7.222 . . . 1.0 . . . . . . . . . . . . A . 17 LEU CG . . . . . . . . . c30057_5j6t 1 . 6 . 1756 . 1 1 17 LEU H H 23.325 0.068 -4.119 . . . 1.0 . . . . . . . . . . . . A . 17 LEU H . . . . . . . . . c30057_5j6t 1 . 6 . 1757 . 1 1 17 LEU HA H 25.141 -0.410 -6.387 . . . 1.0 . . . . . . . . . . . . A . 17 LEU HA . . . . . . . . . c30057_5j6t 1 . 6 . 1758 . 1 1 17 LEU HB2 H 23.440 1.784 -5.229 . . . 1.0 . . . . . . . . . . . . A . 17 LEU HB2 . . . . . . . . . c30057_5j6t 1 . 6 . 1759 . 1 1 17 LEU HB3 H 24.720 2.266 -6.367 . . . 1.0 . . . . . . . . . . . . A . 17 LEU HB3 . . . . . . . . . c30057_5j6t 1 . 6 . 1760 . 1 1 17 LEU HD11 H 24.704 1.431 -8.707 . . . 1.0 . . . . . . . . . . . . A . 17 LEU HD11 . . . . . . . . . c30057_5j6t 1 . 6 . 1761 . 1 1 17 LEU HD12 H 23.464 0.270 -9.236 . . . 1.0 . . . . . . . . . . . . A . 17 LEU HD12 . . . . . . . . . c30057_5j6t 1 . 6 . 1762 . 1 1 17 LEU HD13 H 24.735 -0.242 -8.100 . . . 1.0 . . . . . . . . . . . . A . 17 LEU HD13 . . . . . . . . . c30057_5j6t 1 . 6 . 1763 . 1 1 17 LEU HD21 H 21.540 -0.346 -7.516 . . . 1.0 . . . . . . . . . . . . A . 17 LEU HD21 . . . . . . . . . c30057_5j6t 1 . 6 . 1764 . 1 1 17 LEU HD22 H 22.956 -1.090 -6.735 . . . 1.0 . . . . . . . . . . . . A . 17 LEU HD22 . . . . . . . . . c30057_5j6t 1 . 6 . 1765 . 1 1 17 LEU HD23 H 21.905 0.009 -5.811 . . . 1.0 . . . . . . . . . . . . A . 17 LEU HD23 . . . . . . . . . c30057_5j6t 1 . 6 . 1766 . 1 1 17 LEU HG H 22.556 1.819 -7.527 . . . 1.0 . . . . . . . . . . . . A . 17 LEU HG . . . . . . . . . c30057_5j6t 1 . 6 . 1767 . 1 1 17 LEU N N 24.134 -0.395 -4.507 . . . 1.0 . . . . . . . . . . . . A . 17 LEU N . . . . . . . . . c30057_5j6t 1 . 6 . 1768 . 1 1 17 LEU O O 27.290 0.762 -5.620 . . . 1.0 . . . . . . . . . . . . A . 17 LEU O . . . . . . . . . c30057_5j6t 1 . 6 . 1769 . 1 1 18 ILE C C 28.202 0.670 -2.385 . . . 1.0 . . . . . . . . . . . . A . 18 ILE C . . . . . . . . . c30057_5j6t 1 . 6 . 1770 . 1 1 18 ILE CA C 27.469 1.790 -3.130 . . . 1.0 . . . . . . . . . . . . A . 18 ILE CA . . . . . . . . . c30057_5j6t 1 . 6 . 1771 . 1 1 18 ILE CB C 26.993 2.870 -2.156 . . . 1.0 . . . . . . . . . . . . A . 18 ILE CB . . . . . . . . . c30057_5j6t 1 . 6 . 1772 . 1 1 18 ILE CD1 C 26.317 2.835 0.256 . . . 1.0 . . . . . . . . . . . . A . 18 ILE CD1 . . . . . . . . . c30057_5j6t 1 . 6 . 1773 . 1 1 18 ILE CG1 C 26.023 2.262 -1.133 . . . 1.0 . . . . . . . . . . . . A . 18 ILE CG1 . . . . . . . . . c30057_5j6t 1 . 6 . 1774 . 1 1 18 ILE CG2 C 26.282 3.981 -2.931 . . . 1.0 . . . . . . . . . . . . A . 18 ILE CG2 . . . . . . . . . c30057_5j6t 1 . 6 . 1775 . 1 1 18 ILE H H 25.353 1.283 -3.254 . . . 1.0 . . . . . . . . . . . . A . 18 ILE H . . . . . . . . . c30057_5j6t 1 . 6 . 1776 . 1 1 18 ILE HA H 28.120 2.228 -3.886 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HA . . . . . . . . . c30057_5j6t 1 . 6 . 1777 . 1 1 18 ILE HB H 27.853 3.288 -1.633 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HB . . . . . . . . . c30057_5j6t 1 . 6 . 1778 . 1 1 18 ILE HD11 H 25.628 2.403 0.981 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HD11 . . . . . . . . . c30057_5j6t 1 . 6 . 1779 . 1 1 18 ILE HD12 H 27.341 2.593 0.539 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HD12 . . . . . . . . . c30057_5j6t 1 . 6 . 1780 . 1 1 18 ILE HD13 H 26.191 3.918 0.236 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HD13 . . . . . . . . . c30057_5j6t 1 . 6 . 1781 . 1 1 18 ILE HG12 H 24.999 2.504 -1.417 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HG12 . . . . . . . . . c30057_5j6t 1 . 6 . 1782 . 1 1 18 ILE HG13 H 26.149 1.179 -1.113 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HG13 . . . . . . . . . c30057_5j6t 1 . 6 . 1783 . 1 1 18 ILE HG21 H 26.969 4.415 -3.658 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HG21 . . . . . . . . . c30057_5j6t 1 . 6 . 1784 . 1 1 18 ILE HG22 H 25.418 3.566 -3.450 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HG22 . . . . . . . . . c30057_5j6t 1 . 6 . 1785 . 1 1 18 ILE HG23 H 25.951 4.754 -2.237 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HG23 . . . . . . . . . c30057_5j6t 1 . 6 . 1786 . 1 1 18 ILE N N 26.224 1.268 -3.765 . . . 1.0 . . . . . . . . . . . . A . 18 ILE N . . . . . . . . . c30057_5j6t 1 . 6 . 1787 . 1 1 18 ILE O O 29.376 0.779 -2.088 . . . 1.0 . . . . . . . . . . . . A . 18 ILE O . . . . . . . . . c30057_5j6t 1 . 6 . 1788 . 1 1 19 LYS C C 27.597 -2.868 -1.806 . . . 1.0 . . . . . . . . . . . . A . 19 LYS C . . . . . . . . . c30057_5j6t 1 . 6 . 1789 . 1 1 19 LYS CA C 28.183 -1.527 -1.355 . . . 1.0 . . . . . . . . . . . . A . 19 LYS CA . . . . . . . . . c30057_5j6t 1 . 6 . 1790 . 1 1 19 LYS CB C 27.878 -1.276 0.124 . . . 1.0 . . . . . . . . . . . . A . 19 LYS CB . . . . . . . . . c30057_5j6t 1 . 6 . 1791 . 1 1 19 LYS CD C 28.653 -3.248 1.452 . . . 1.0 . . . . . . . . . . . . A . 19 LYS CD . . . . . . . . . c30057_5j6t 1 . 6 . 1792 . 1 1 19 LYS CE C 29.328 -3.529 2.796 . . . 1.0 . . . . . . . . . . . . A . 19 LYS CE . . . . . . . . . c30057_5j6t 1 . 6 . 1793 . 1 1 19 LYS CG C 29.014 -1.836 0.982 . . . 1.0 . . . . . . . . . . . . A . 19 LYS CG . . . . . . . . . c30057_5j6t 1 . 6 . 1794 . 1 1 19 LYS H H 26.549 -0.476 -2.338 . . . 1.0 . . . . . . . . . . . . A . 19 LYS H . . . . . . . . . c30057_5j6t 1 . 6 . 1795 . 1 1 19 LYS HA H 29.259 -1.508 -1.527 . . . 1.0 . . . . . . . . . . . . A . 19 LYS HA . . . . . . . . . c30057_5j6t 1 . 6 . 1796 . 1 1 19 LYS HB2 H 27.785 -0.205 0.298 . . . 1.0 . . . . . . . . . . . . A . 19 LYS HB2 . . . . . . . . . c30057_5j6t 1 . 6 . 1797 . 1 1 19 LYS HB3 H 26.944 -1.771 0.390 . . . 1.0 . . . . . . . . . . . . A . 19 LYS HB3 . . . . . . . . . c30057_5j6t 1 . 6 . 1798 . 1 1 19 LYS HD2 H 27.571 -3.327 1.565 . . . 1.0 . . . . . . . . . . . . A . 19 LYS HD2 . . . . . . . . . c30057_5j6t 1 . 6 . 1799 . 1 1 19 LYS HD3 H 28.995 -3.974 0.715 . . . 1.0 . . . . . . . . . . . . A . 19 LYS HD3 . . . . . . . . . c30057_5j6t 1 . 6 . 1800 . 1 1 19 LYS HE2 H 30.201 -4.166 2.653 . . . 1.0 . . . . . . . . . . . . A . 19 LYS HE2 . . . . . . . . . c30057_5j6t 1 . 6 . 1801 . 1 1 19 LYS HE3 H 29.617 -2.597 3.282 . . . 1.0 . . . . . . . . . . . . A . 19 LYS HE3 . . . . . . . . . c30057_5j6t 1 . 6 . 1802 . 1 1 19 LYS HG2 H 29.930 -1.873 0.393 . . . 1.0 . . . . . . . . . . . . A . 19 LYS HG2 . . . . . . . . . c30057_5j6t 1 . 6 . 1803 . 1 1 19 LYS HG3 H 29.165 -1.193 1.849 . . . 1.0 . . . . . . . . . . . . A . 19 LYS HG3 . . . . . . . . . c30057_5j6t 1 . 6 . 1804 . 1 1 19 LYS HZ1 H 28.675 -4.462 4.513 . . . 1.0 . . . . . . . . . . . . A . 19 LYS HZ1 . . . . . . . . . c30057_5j6t 1 . 6 . 1805 . 1 1 19 LYS HZ2 H 27.486 -3.651 3.709 . . . 1.0 . . . . . . . . . . . . A . 19 LYS HZ2 . . . . . . . . . c30057_5j6t 1 . 6 . 1806 . 1 1 19 LYS HZ3 H 28.033 -5.095 3.132 . . . 1.0 . . . . . . . . . . . . A . 19 LYS HZ3 . . . . . . . . . c30057_5j6t 1 . 6 . 1807 . 1 1 19 LYS N N 27.523 -0.405 -2.081 . . . 1.0 . . . . . . . . . . . . A . 19 LYS N . . . . . . . . . c30057_5j6t 1 . 6 . 1808 . 1 1 19 LYS NZ N 28.297 -4.242 3.602 . . . 1.0 . . . . . . . . . . . . A . 19 LYS NZ . . . . . . . . . c30057_5j6t 1 . 6 . 1809 . 1 1 19 LYS O O 27.305 -3.725 -0.995 . . . 1.0 . . . . . . . . . . . . A . 19 LYS O . . . . . . . . . c30057_5j6t 1 . 6 . 1810 . 1 1 20 NH2 HN1 H 27.653 -2.374 -3.754 . . . 1.0 . . . . . . . . . . . . A . 20 NH2 HN1 . . . . . . . . . c30057_5j6t 1 . 6 . 1811 . 1 1 20 NH2 HN2 H 27.025 -3.966 -3.390 . . . 1.0 . . . . . . . . . . . . A . 20 NH2 HN2 . . . . . . . . . c30057_5j6t 1 . 6 . 1812 . 1 1 20 NH2 N N 27.411 -3.086 -3.079 . . . 1.0 . . . . . . . . . . . . A . 20 NH2 N . . . . . . . . . c30057_5j6t 1 . 7 . 1813 . 1 1 1 ACE C C 0.471 -1.028 1.195 . . . 1.0 . . . . . . . . . . . . A . 1 ACE C . . . . . . . . . c30057_5j6t 1 . 7 . 1814 . 1 1 1 ACE CH3 C -0.942 -0.449 1.118 . . . 1.0 . . . . . . . . . . . . A . 1 ACE CH3 . . . . . . . . . c30057_5j6t 1 . 7 . 1815 . 1 1 1 ACE H1 H -1.096 0.007 0.140 . . . 1.0 . . . . . . . . . . . . A . 1 ACE H1 . . . . . . . . . c30057_5j6t 1 . 7 . 1816 . 1 1 1 ACE H2 H -1.670 -1.247 1.266 . . . 1.0 . . . . . . . . . . . . A . 1 ACE H2 . . . . . . . . . c30057_5j6t 1 . 7 . 1817 . 1 1 1 ACE H3 H -1.068 0.306 1.894 . . . 1.0 . . . . . . . . . . . . A . 1 ACE H3 . . . . . . . . . c30057_5j6t 1 . 7 . 1818 . 1 1 1 ACE O O 1.239 -0.947 0.256 . . . 1.0 . . . . . . . . . . . . A . 1 ACE O . . . . . . . . . c30057_5j6t 1 . 7 . 1819 . 1 1 2 ILE C C 3.262 -1.166 2.116 . . . 1.0 . . . . . . . . . . . . A . 2 ILE C . . . . . . . . . c30057_5j6t 1 . 7 . 1820 . 1 1 2 ILE CA C 2.189 -2.205 2.459 . . . 1.0 . . . . . . . . . . . . A . 2 ILE CA . . . . . . . . . c30057_5j6t 1 . 7 . 1821 . 1 1 2 ILE CB C 2.234 -3.374 1.470 . . . 1.0 . . . . . . . . . . . . A . 2 ILE CB . . . . . . . . . c30057_5j6t 1 . 7 . 1822 . 1 1 2 ILE CD1 C 1.018 -5.414 0.679 . . . 1.0 . . . . . . . . . . . . A . 2 ILE CD1 . . . . . . . . . c30057_5j6t 1 . 7 . 1823 . 1 1 2 ILE CG1 C 1.093 -4.349 1.777 . . . 1.0 . . . . . . . . . . . . A . 2 ILE CG1 . . . . . . . . . c30057_5j6t 1 . 7 . 1824 . 1 1 2 ILE CG2 C 3.572 -4.104 1.601 . . . 1.0 . . . . . . . . . . . . A . 2 ILE CG2 . . . . . . . . . c30057_5j6t 1 . 7 . 1825 . 1 1 2 ILE H H 0.165 -1.670 3.077 . . . 1.0 . . . . . . . . . . . . A . 2 ILE H . . . . . . . . . c30057_5j6t 1 . 7 . 1826 . 1 1 2 ILE HA H 2.331 -2.570 3.477 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HA . . . . . . . . . c30057_5j6t 1 . 7 . 1827 . 1 1 2 ILE HB H 2.125 -2.995 0.454 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HB . . . . . . . . . c30057_5j6t 1 . 7 . 1828 . 1 1 2 ILE HD11 H 0.206 -6.107 0.899 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HD11 . . . . . . . . . c30057_5j6t 1 . 7 . 1829 . 1 1 2 ILE HD12 H 1.961 -5.961 0.639 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HD12 . . . . . . . . . c30057_5j6t 1 . 7 . 1830 . 1 1 2 ILE HD13 H 0.836 -4.934 -0.281 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HD13 . . . . . . . . . c30057_5j6t 1 . 7 . 1831 . 1 1 2 ILE HG12 H 1.276 -4.830 2.738 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HG12 . . . . . . . . . c30057_5j6t 1 . 7 . 1832 . 1 1 2 ILE HG13 H 0.150 -3.804 1.818 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HG13 . . . . . . . . . c30057_5j6t 1 . 7 . 1833 . 1 1 2 ILE HG21 H 3.404 -5.181 1.564 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HG21 . . . . . . . . . c30057_5j6t 1 . 7 . 1834 . 1 1 2 ILE HG22 H 4.228 -3.810 0.782 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HG22 . . . . . . . . . c30057_5j6t 1 . 7 . 1835 . 1 1 2 ILE HG23 H 4.037 -3.842 2.552 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HG23 . . . . . . . . . c30057_5j6t 1 . 7 . 1836 . 1 1 2 ILE N N 0.821 -1.615 2.311 . . . 1.0 . . . . . . . . . . . . A . 2 ILE N . . . . . . . . . c30057_5j6t 1 . 7 . 1837 . 1 1 2 ILE O O 4.366 -1.502 1.734 . . . 1.0 . . . . . . . . . . . . A . 2 ILE O . . . . . . . . . c30057_5j6t 1 . 7 . 1838 . 1 1 3 PHE C C 5.118 1.083 2.922 . . . 1.0 . . . . . . . . . . . . A . 3 PHE C . . . . . . . . . c30057_5j6t 1 . 7 . 1839 . 1 1 3 PHE CA C 3.949 1.155 1.937 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CA . . . . . . . . . c30057_5j6t 1 . 7 . 1840 . 1 1 3 PHE CB C 3.196 2.477 2.095 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CB . . . . . . . . . c30057_5j6t 1 . 7 . 1841 . 1 1 3 PHE CD1 C 4.674 3.724 0.479 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CD1 . . . . . . . . . c30057_5j6t 1 . 7 . 1842 . 1 1 3 PHE CD2 C 4.408 4.593 2.726 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CD2 . . . . . . . . . c30057_5j6t 1 . 7 . 1843 . 1 1 3 PHE CE1 C 5.528 4.789 0.166 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CE1 . . . . . . . . . c30057_5j6t 1 . 7 . 1844 . 1 1 3 PHE CE2 C 5.262 5.660 2.415 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CE2 . . . . . . . . . c30057_5j6t 1 . 7 . 1845 . 1 1 3 PHE CG C 4.115 3.627 1.758 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CG . . . . . . . . . c30057_5j6t 1 . 7 . 1846 . 1 1 3 PHE CZ C 5.821 5.758 1.135 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CZ . . . . . . . . . c30057_5j6t 1 . 7 . 1847 . 1 1 3 PHE H H 2.023 0.353 2.571 . . . 1.0 . . . . . . . . . . . . A . 3 PHE H . . . . . . . . . c30057_5j6t 1 . 7 . 1848 . 1 1 3 PHE HA H 4.309 1.044 0.914 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HA . . . . . . . . . c30057_5j6t 1 . 7 . 1849 . 1 1 3 PHE HB2 H 2.338 2.489 1.422 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HB2 . . . . . . . . . c30057_5j6t 1 . 7 . 1850 . 1 1 3 PHE HB3 H 2.851 2.578 3.124 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HB3 . . . . . . . . . c30057_5j6t 1 . 7 . 1851 . 1 1 3 PHE HD1 H 4.447 2.977 -0.268 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HD1 . . . . . . . . . c30057_5j6t 1 . 7 . 1852 . 1 1 3 PHE HD2 H 3.976 4.517 3.713 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HD2 . . . . . . . . . c30057_5j6t 1 . 7 . 1853 . 1 1 3 PHE HE1 H 5.960 4.863 -0.821 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HE1 . . . . . . . . . c30057_5j6t 1 . 7 . 1854 . 1 1 3 PHE HE2 H 5.489 6.406 3.162 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HE2 . . . . . . . . . c30057_5j6t 1 . 7 . 1855 . 1 1 3 PHE HZ H 6.478 6.580 0.894 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HZ . . . . . . . . . c30057_5j6t 1 . 7 . 1856 . 1 1 3 PHE N N 2.946 0.095 2.252 . . . 1.0 . . . . . . . . . . . . A . 3 PHE N . . . . . . . . . c30057_5j6t 1 . 7 . 1857 . 1 1 3 PHE O O 6.261 1.271 2.558 . . . 1.0 . . . . . . . . . . . . A . 3 PHE O . . . . . . . . . c30057_5j6t 1 . 7 . 1858 . 1 1 4 GLY C C 6.900 -0.392 4.802 . . . 1.0 . . . . . . . . . . . . A . 4 GLY C . . . . . . . . . c30057_5j6t 1 . 7 . 1859 . 1 1 4 GLY CA C 5.924 0.724 5.182 . . . 1.0 . . . . . . . . . . . . A . 4 GLY CA . . . . . . . . . c30057_5j6t 1 . 7 . 1860 . 1 1 4 GLY H H 3.876 0.661 4.446 . . . 1.0 . . . . . . . . . . . . A . 4 GLY H . . . . . . . . . c30057_5j6t 1 . 7 . 1861 . 1 1 4 GLY HA2 H 6.458 1.674 5.222 . . . 1.0 . . . . . . . . . . . . A . 4 GLY HA2 . . . . . . . . . c30057_5j6t 1 . 7 . 1862 . 1 1 4 GLY HA3 H 5.492 0.510 6.160 . . . 1.0 . . . . . . . . . . . . A . 4 GLY HA3 . . . . . . . . . c30057_5j6t 1 . 7 . 1863 . 1 1 4 GLY N N 4.835 0.812 4.168 . . . 1.0 . . . . . . . . . . . . A . 4 GLY N . . . . . . . . . c30057_5j6t 1 . 7 . 1864 . 1 1 4 GLY O O 8.023 -0.428 5.264 . . . 1.0 . . . . . . . . . . . . A . 4 GLY O . . . . . . . . . c30057_5j6t 1 . 7 . 1865 . 1 1 5 ALA C C 8.191 -2.018 2.307 . . . 1.0 . . . . . . . . . . . . A . 5 ALA C . . . . . . . . . c30057_5j6t 1 . 7 . 1866 . 1 1 5 ALA CA C 7.389 -2.415 3.551 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CA . . . . . . . . . c30057_5j6t 1 . 7 . 1867 . 1 1 5 ALA CB C 6.460 -3.588 3.237 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CB . . . . . . . . . c30057_5j6t 1 . 7 . 1868 . 1 1 5 ALA H H 5.545 -1.254 3.588 . . . 1.0 . . . . . . . . . . . . A . 5 ALA H . . . . . . . . . c30057_5j6t 1 . 7 . 1869 . 1 1 5 ALA HA H 8.063 -2.675 4.368 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HA . . . . . . . . . c30057_5j6t 1 . 7 . 1870 . 1 1 5 ALA HB1 H 6.865 -4.501 3.674 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB1 . . . . . . . . . c30057_5j6t 1 . 7 . 1871 . 1 1 5 ALA HB2 H 5.473 -3.392 3.656 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB2 . . . . . . . . . c30057_5j6t 1 . 7 . 1872 . 1 1 5 ALA HB3 H 6.378 -3.708 2.156 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB3 . . . . . . . . . c30057_5j6t 1 . 7 . 1873 . 1 1 5 ALA N N 6.482 -1.304 3.960 . . . 1.0 . . . . . . . . . . . . A . 5 ALA N . . . . . . . . . c30057_5j6t 1 . 7 . 1874 . 1 1 5 ALA O O 9.241 -2.567 2.033 . . . 1.0 . . . . . . . . . . . . A . 5 ALA O . . . . . . . . . c30057_5j6t 1 . 7 . 1875 . 1 1 6 ILE C C 9.521 0.386 0.684 . . . 1.0 . . . . . . . . . . . . A . 6 ILE C . . . . . . . . . c30057_5j6t 1 . 7 . 1876 . 1 1 6 ILE CA C 8.439 -0.636 0.327 . . . 1.0 . . . . . . . . . . . . A . 6 ILE CA . . . . . . . . . c30057_5j6t 1 . 7 . 1877 . 1 1 6 ILE CB C 7.375 0.001 -0.570 . . . 1.0 . . . . . . . . . . . . A . 6 ILE CB . . . . . . . . . c30057_5j6t 1 . 7 . 1878 . 1 1 6 ILE CD1 C 5.063 -0.321 -1.461 . . . 1.0 . . . . . . . . . . . . A . 6 ILE CD1 . . . . . . . . . c30057_5j6t 1 . 7 . 1879 . 1 1 6 ILE CG1 C 6.292 -1.031 -0.892 . . . 1.0 . . . . . . . . . . . . A . 6 ILE CG1 . . . . . . . . . c30057_5j6t 1 . 7 . 1880 . 1 1 6 ILE CG2 C 8.022 0.479 -1.872 . . . 1.0 . . . . . . . . . . . . A . 6 ILE CG2 . . . . . . . . . c30057_5j6t 1 . 7 . 1881 . 1 1 6 ILE H H 6.832 -0.623 1.799 . . . 1.0 . . . . . . . . . . . . A . 6 ILE H . . . . . . . . . c30057_5j6t 1 . 7 . 1882 . 1 1 6 ILE HA H 8.884 -1.499 -0.169 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HA . . . . . . . . . c30057_5j6t 1 . 7 . 1883 . 1 1 6 ILE HB H 6.926 0.850 -0.055 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HB . . . . . . . . . c30057_5j6t 1 . 7 . 1884 . 1 1 6 ILE HD11 H 4.291 -1.056 -1.690 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HD11 . . . . . . . . . c30057_5j6t 1 . 7 . 1885 . 1 1 6 ILE HD12 H 5.340 0.210 -2.372 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HD12 . . . . . . . . . c30057_5j6t 1 . 7 . 1886 . 1 1 6 ILE HD13 H 4.682 0.389 -0.728 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HD13 . . . . . . . . . c30057_5j6t 1 . 7 . 1887 . 1 1 6 ILE HG12 H 6.673 -1.742 -1.625 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HG12 . . . . . . . . . c30057_5j6t 1 . 7 . 1888 . 1 1 6 ILE HG13 H 6.015 -1.562 0.019 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HG13 . . . . . . . . . c30057_5j6t 1 . 7 . 1889 . 1 1 6 ILE HG21 H 8.794 1.214 -1.646 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HG21 . . . . . . . . . c30057_5j6t 1 . 7 . 1890 . 1 1 6 ILE HG22 H 8.470 -0.370 -2.388 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HG22 . . . . . . . . . c30057_5j6t 1 . 7 . 1891 . 1 1 6 ILE HG23 H 7.264 0.933 -2.510 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HG23 . . . . . . . . . c30057_5j6t 1 . 7 . 1892 . 1 1 6 ILE N N 7.705 -1.067 1.553 . . . 1.0 . . . . . . . . . . . . A . 6 ILE N . . . . . . . . . c30057_5j6t 1 . 7 . 1893 . 1 1 6 ILE O O 10.532 0.491 0.016 . . . 1.0 . . . . . . . . . . . . A . 6 ILE O . . . . . . . . . c30057_5j6t 1 . 7 . 1894 . 1 1 7 TRP C C 11.644 1.466 2.543 . . . 1.0 . . . . . . . . . . . . A . 7 TRP C . . . . . . . . . c30057_5j6t 1 . 7 . 1895 . 1 1 7 TRP CA C 10.338 2.158 2.126 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CA . . . . . . . . . c30057_5j6t 1 . 7 . 1896 . 1 1 7 TRP CB C 9.722 2.920 3.301 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CB . . . . . . . . . c30057_5j6t 1 . 7 . 1897 . 1 1 7 TRP CD1 C 8.465 5.076 2.900 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CD1 . . . . . . . . . c30057_5j6t 1 . 7 . 1898 . 1 1 7 TRP CD2 C 10.683 5.298 2.596 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CD2 . . . . . . . . . c30057_5j6t 1 . 7 . 1899 . 1 1 7 TRP CE2 C 10.110 6.566 2.342 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CE2 . . . . . . . . . c30057_5j6t 1 . 7 . 1900 . 1 1 7 TRP CE3 C 12.078 5.164 2.473 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CE3 . . . . . . . . . c30057_5j6t 1 . 7 . 1901 . 1 1 7 TRP CG C 9.617 4.369 2.951 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CG . . . . . . . . . c30057_5j6t 1 . 7 . 1902 . 1 1 7 TRP CH2 C 12.277 7.511 1.860 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CH2 . . . . . . . . . c30057_5j6t 1 . 7 . 1903 . 1 1 7 TRP CZ2 C 10.892 7.662 1.978 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CZ2 . . . . . . . . . c30057_5j6t 1 . 7 . 1904 . 1 1 7 TRP CZ3 C 12.869 6.264 2.108 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CZ3 . . . . . . . . . c30057_5j6t 1 . 7 . 1905 . 1 1 7 TRP H H 8.473 1.036 2.273 . . . 1.0 . . . . . . . . . . . . A . 7 TRP H . . . . . . . . . c30057_5j6t 1 . 7 . 1906 . 1 1 7 TRP HA H 10.525 2.840 1.296 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HA . . . . . . . . . c30057_5j6t 1 . 7 . 1907 . 1 1 7 TRP HB2 H 8.729 2.524 3.512 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HB2 . . . . . . . . . c30057_5j6t 1 . 7 . 1908 . 1 1 7 TRP HB3 H 10.355 2.804 4.181 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HB3 . . . . . . . . . c30057_5j6t 1 . 7 . 1909 . 1 1 7 TRP HD1 H 7.479 4.686 3.107 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HD1 . . . . . . . . . c30057_5j6t 1 . 7 . 1910 . 1 1 7 TRP HE1 H 8.062 7.107 2.437 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HE1 . . . . . . . . . c30057_5j6t 1 . 7 . 1911 . 1 1 7 TRP HE3 H 12.543 4.207 2.662 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HE3 . . . . . . . . . c30057_5j6t 1 . 7 . 1912 . 1 1 7 TRP HH2 H 12.891 8.354 1.578 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HH2 . . . . . . . . . c30057_5j6t 1 . 7 . 1913 . 1 1 7 TRP HZ2 H 10.431 8.620 1.788 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HZ2 . . . . . . . . . c30057_5j6t 1 . 7 . 1914 . 1 1 7 TRP HZ3 H 13.939 6.150 2.017 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HZ3 . . . . . . . . . c30057_5j6t 1 . 7 . 1915 . 1 1 7 TRP N N 9.319 1.141 1.731 . . . 1.0 . . . . . . . . . . . . A . 7 TRP N . . . . . . . . . c30057_5j6t 1 . 7 . 1916 . 1 1 7 TRP NE1 N 8.756 6.380 2.541 . . . 1.0 . . . . . . . . . . . . A . 7 TRP NE1 . . . . . . . . . c30057_5j6t 1 . 7 . 1917 . 1 1 7 TRP O O 12.697 1.789 2.030 . . . 1.0 . . . . . . . . . . . . A . 7 TRP O . . . . . . . . . c30057_5j6t 1 . 7 . 1918 . 1 1 8 PRO C C 13.504 -0.780 2.721 . . . 1.0 . . . . . . . . . . . . A . 8 PRO C . . . . . . . . . c30057_5j6t 1 . 7 . 1919 . 1 1 8 PRO CA C 12.745 -0.205 3.920 . . . 1.0 . . . . . . . . . . . . A . 8 PRO CA . . . . . . . . . c30057_5j6t 1 . 7 . 1920 . 1 1 8 PRO CB C 12.189 -1.323 4.797 . . . 1.0 . . . . . . . . . . . . A . 8 PRO CB . . . . . . . . . c30057_5j6t 1 . 7 . 1921 . 1 1 8 PRO CD C 10.322 0.072 4.130 . . . 1.0 . . . . . . . . . . . . A . 8 PRO CD . . . . . . . . . c30057_5j6t 1 . 7 . 1922 . 1 1 8 PRO CG C 10.814 -0.881 5.188 . . . 1.0 . . . . . . . . . . . . A . 8 PRO CG . . . . . . . . . c30057_5j6t 1 . 7 . 1923 . 1 1 8 PRO HA H 13.391 0.452 4.502 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HA . . . . . . . . . c30057_5j6t 1 . 7 . 1924 . 1 1 8 PRO HB2 H 12.136 -2.253 4.230 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HB2 . . . . . . . . . c30057_5j6t 1 . 7 . 1925 . 1 1 8 PRO HB3 H 12.811 -1.459 5.681 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HB3 . . . . . . . . . c30057_5j6t 1 . 7 . 1926 . 1 1 8 PRO HD2 H 9.661 -0.438 3.429 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HD2 . . . . . . . . . c30057_5j6t 1 . 7 . 1927 . 1 1 8 PRO HD3 H 9.806 0.914 4.592 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HD3 . . . . . . . . . c30057_5j6t 1 . 7 . 1928 . 1 1 8 PRO HG2 H 10.150 -1.744 5.248 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HG2 . . . . . . . . . c30057_5j6t 1 . 7 . 1929 . 1 1 8 PRO HG3 H 10.850 -0.376 6.152 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HG3 . . . . . . . . . c30057_5j6t 1 . 7 . 1930 . 1 1 8 PRO N N 11.539 0.529 3.456 . . . 1.0 . . . . . . . . . . . . A . 8 PRO N . . . . . . . . . c30057_5j6t 1 . 7 . 1931 . 1 1 8 PRO O O 14.715 -0.890 2.734 . . . 1.0 . . . . . . . . . . . . A . 8 PRO O . . . . . . . . . c30057_5j6t 1 . 7 . 1932 . 1 1 9 LEU C C 14.087 -0.572 -0.352 . . . 1.0 . . . . . . . . . . . . A . 9 LEU C . . . . . . . . . c30057_5j6t 1 . 7 . 1933 . 1 1 9 LEU CA C 13.474 -1.703 0.478 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CA . . . . . . . . . c30057_5j6t 1 . 7 . 1934 . 1 1 9 LEU CB C 12.363 -2.407 -0.309 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CB . . . . . . . . . c30057_5j6t 1 . 7 . 1935 . 1 1 9 LEU CD1 C 13.794 -4.441 -0.596 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CD1 . . . . . . . . . c30057_5j6t 1 . 7 . 1936 . 1 1 9 LEU CD2 C 12.307 -4.235 1.401 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CD2 . . . . . . . . . c30057_5j6t 1 . 7 . 1937 . 1 1 9 LEU CG C 12.447 -3.921 -0.091 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CG . . . . . . . . . c30057_5j6t 1 . 7 . 1938 . 1 1 9 LEU H H 11.794 -1.038 1.698 . . . 1.0 . . . . . . . . . . . . A . 9 LEU H . . . . . . . . . c30057_5j6t 1 . 7 . 1939 . 1 1 9 LEU HA H 14.242 -2.418 0.772 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HA . . . . . . . . . c30057_5j6t 1 . 7 . 1940 . 1 1 9 LEU HB2 H 11.393 -2.046 0.034 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HB2 . . . . . . . . . c30057_5j6t 1 . 7 . 1941 . 1 1 9 LEU HB3 H 12.476 -2.187 -1.371 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HB3 . . . . . . . . . c30057_5j6t 1 . 7 . 1942 . 1 1 9 LEU HD11 H 13.681 -5.468 -0.944 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD11 . . . . . . . . . c30057_5j6t 1 . 7 . 1943 . 1 1 9 LEU HD12 H 14.522 -4.411 0.215 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD12 . . . . . . . . . c30057_5j6t 1 . 7 . 1944 . 1 1 9 LEU HD13 H 14.141 -3.815 -1.419 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD13 . . . . . . . . . c30057_5j6t 1 . 7 . 1945 . 1 1 9 LEU HD21 H 11.853 -5.219 1.524 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD21 . . . . . . . . . c30057_5j6t 1 . 7 . 1946 . 1 1 9 LEU HD22 H 11.676 -3.482 1.873 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD22 . . . . . . . . . c30057_5j6t 1 . 7 . 1947 . 1 1 9 LEU HD23 H 13.292 -4.229 1.867 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD23 . . . . . . . . . c30057_5j6t 1 . 7 . 1948 . 1 1 9 LEU HG H 11.642 -4.410 -0.640 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HG . . . . . . . . . c30057_5j6t 1 . 7 . 1949 . 1 1 9 LEU N N 12.799 -1.140 1.684 . . . 1.0 . . . . . . . . . . . . A . 9 LEU N . . . . . . . . . c30057_5j6t 1 . 7 . 1950 . 1 1 9 LEU O O 15.059 -0.764 -1.057 . . . 1.0 . . . . . . . . . . . . A . 9 LEU O . . . . . . . . . c30057_5j6t 1 . 7 . 1951 . 1 1 10 ALA C C 15.480 2.103 -0.553 . . . 1.0 . . . . . . . . . . . . A . 10 ALA C . . . . . . . . . c30057_5j6t 1 . 7 . 1952 . 1 1 10 ALA CA C 14.078 1.753 -1.052 . . . 1.0 . . . . . . . . . . . . A . 10 ALA CA . . . . . . . . . c30057_5j6t 1 . 7 . 1953 . 1 1 10 ALA CB C 13.112 2.911 -0.796 . . . 1.0 . . . . . . . . . . . . A . 10 ALA CB . . . . . . . . . c30057_5j6t 1 . 7 . 1954 . 1 1 10 ALA H H 12.721 0.742 0.322 . . . 1.0 . . . . . . . . . . . . A . 10 ALA H . . . . . . . . . c30057_5j6t 1 . 7 . 1955 . 1 1 10 ALA HA H 14.104 1.509 -2.114 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HA . . . . . . . . . c30057_5j6t 1 . 7 . 1956 . 1 1 10 ALA HB1 H 13.046 3.533 -1.689 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HB1 . . . . . . . . . c30057_5j6t 1 . 7 . 1957 . 1 1 10 ALA HB2 H 12.126 2.515 -0.556 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HB2 . . . . . . . . . c30057_5j6t 1 . 7 . 1958 . 1 1 10 ALA HB3 H 13.476 3.511 0.038 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HB3 . . . . . . . . . c30057_5j6t 1 . 7 . 1959 . 1 1 10 ALA N N 13.527 0.606 -0.270 . . . 1.0 . . . . . . . . . . . . A . 10 ALA N . . . . . . . . . c30057_5j6t 1 . 7 . 1960 . 1 1 10 ALA O O 16.385 2.346 -1.330 . . . 1.0 . . . . . . . . . . . . A . 10 ALA O . . . . . . . . . c30057_5j6t 1 . 7 . 1961 . 1 1 11 LEU C C 18.006 1.347 0.963 . . . 1.0 . . . . . . . . . . . . A . 11 LEU C . . . . . . . . . c30057_5j6t 1 . 7 . 1962 . 1 1 11 LEU CA C 17.009 2.459 1.295 . . . 1.0 . . . . . . . . . . . . A . 11 LEU CA . . . . . . . . . c30057_5j6t 1 . 7 . 1963 . 1 1 11 LEU CB C 16.800 2.558 2.807 . . . 1.0 . . . . . . . . . . . . A . 11 LEU CB . . . . . . . . . c30057_5j6t 1 . 7 . 1964 . 1 1 11 LEU CD1 C 15.081 3.529 4.340 . . . 1.0 . . . . . . . . . . . . A . 11 LEU CD1 . . . . . . . . . c30057_5j6t 1 . 7 . 1965 . 1 1 11 LEU CD2 C 16.909 4.972 3.438 . . . 1.0 . . . . . . . . . . . . A . 11 LEU CD2 . . . . . . . . . c30057_5j6t 1 . 7 . 1966 . 1 1 11 LEU CG C 15.971 3.804 3.128 . . . 1.0 . . . . . . . . . . . . A . 11 LEU CG . . . . . . . . . c30057_5j6t 1 . 7 . 1967 . 1 1 11 LEU H H 14.897 1.924 1.359 . . . 1.0 . . . . . . . . . . . . A . 11 LEU H . . . . . . . . . c30057_5j6t 1 . 7 . 1968 . 1 1 11 LEU HA H 17.360 3.412 0.898 . . . 1.0 . . . . . . . . . . . . A . 11 LEU HA . . . . . . . . . c30057_5j6t 1 . 7 . 1969 . 1 1 11 LEU HB2 H 16.273 1.671 3.160 . . . 1.0 . . . . . . . . . . . . A . 11 LEU HB2 . . . . . . . . . c30057_5j6t 1 . 7 . 1970 . 1 1 11 LEU HB3 H 17.767 2.627 3.304 . . . 1.0 . . . . . . . . . . . . A . 11 LEU HB3 . . . . . . . . . c30057_5j6t 1 . 7 . 1971 . 1 1 11 LEU HD11 H 14.412 2.697 4.119 . . . 1.0 . . . . . . . . . . . . A . 11 LEU HD11 . . . . . . . . . c30057_5j6t 1 . 7 . 1972 . 1 1 11 LEU HD12 H 15.704 3.276 5.198 . . . 1.0 . . . . . . . . . . . . A . 11 LEU HD12 . . . . . . . . . c30057_5j6t 1 . 7 . 1973 . 1 1 11 LEU HD13 H 14.492 4.418 4.567 . . . 1.0 . . . . . . . . . . . . A . 11 LEU HD13 . . . . . . . . . c30057_5j6t 1 . 7 . 1974 . 1 1 11 LEU HD21 H 16.321 5.861 3.667 . . . 1.0 . . . . . . . . . . . . A . 11 LEU HD21 . . . . . . . . . c30057_5j6t 1 . 7 . 1975 . 1 1 11 LEU HD22 H 17.543 5.169 2.574 . . . 1.0 . . . . . . . . . . . . A . 11 LEU HD22 . . . . . . . . . c30057_5j6t 1 . 7 . 1976 . 1 1 11 LEU HD23 H 17.533 4.719 4.296 . . . 1.0 . . . . . . . . . . . . A . 11 LEU HD23 . . . . . . . . . c30057_5j6t 1 . 7 . 1977 . 1 1 11 LEU HG H 15.348 4.057 2.270 . . . 1.0 . . . . . . . . . . . . A . 11 LEU HG . . . . . . . . . c30057_5j6t 1 . 7 . 1978 . 1 1 11 LEU N N 15.666 2.129 0.736 . . . 1.0 . . . . . . . . . . . . A . 11 LEU N . . . . . . . . . c30057_5j6t 1 . 7 . 1979 . 1 1 11 LEU O O 19.198 1.573 0.879 . . . 1.0 . . . . . . . . . . . . A . 11 LEU O . . . . . . . . . c30057_5j6t 1 . 7 . 1980 . 1 1 12 GLY C C 18.959 -0.817 -0.989 . . . 1.0 . . . . . . . . . . . . A . 12 GLY C . . . . . . . . . c30057_5j6t 1 . 7 . 1981 . 1 1 12 GLY CA C 18.445 -0.981 0.443 . . . 1.0 . . . . . . . . . . . . A . 12 GLY CA . . . . . . . . . c30057_5j6t 1 . 7 . 1982 . 1 1 12 GLY H H 16.534 -0.018 0.846 . . . 1.0 . . . . . . . . . . . . A . 12 GLY H . . . . . . . . . c30057_5j6t 1 . 7 . 1983 . 1 1 12 GLY HA2 H 19.288 -0.977 1.134 . . . 1.0 . . . . . . . . . . . . A . 12 GLY HA2 . . . . . . . . . c30057_5j6t 1 . 7 . 1984 . 1 1 12 GLY HA3 H 17.907 -1.925 0.531 . . . 1.0 . . . . . . . . . . . . A . 12 GLY HA3 . . . . . . . . . c30057_5j6t 1 . 7 . 1985 . 1 1 12 GLY N N 17.527 0.146 0.771 . . . 1.0 . . . . . . . . . . . . A . 12 GLY N . . . . . . . . . c30057_5j6t 1 . 7 . 1986 . 1 1 12 GLY O O 20.086 -1.157 -1.296 . . . 1.0 . . . . . . . . . . . . A . 12 GLY O . . . . . . . . . c30057_5j6t 1 . 7 . 1987 . 1 1 13 ALA C C 19.821 0.785 -3.337 . . . 1.0 . . . . . . . . . . . . A . 13 ALA C . . . . . . . . . c30057_5j6t 1 . 7 . 1988 . 1 1 13 ALA CA C 18.580 -0.109 -3.280 . . . 1.0 . . . . . . . . . . . . A . 13 ALA CA . . . . . . . . . c30057_5j6t 1 . 7 . 1989 . 1 1 13 ALA CB C 17.400 0.569 -3.977 . . . 1.0 . . . . . . . . . . . . A . 13 ALA CB . . . . . . . . . c30057_5j6t 1 . 7 . 1990 . 1 1 13 ALA H H 17.211 -0.023 -1.586 . . . 1.0 . . . . . . . . . . . . A . 13 ALA H . . . . . . . . . c30057_5j6t 1 . 7 . 1991 . 1 1 13 ALA HA H 18.788 -1.074 -3.743 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HA . . . . . . . . . c30057_5j6t 1 . 7 . 1992 . 1 1 13 ALA HB1 H 17.645 0.741 -5.024 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HB1 . . . . . . . . . c30057_5j6t 1 . 7 . 1993 . 1 1 13 ALA HB2 H 16.521 -0.073 -3.911 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HB2 . . . . . . . . . c30057_5j6t 1 . 7 . 1994 . 1 1 13 ALA HB3 H 17.190 1.522 -3.491 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HB3 . . . . . . . . . c30057_5j6t 1 . 7 . 1995 . 1 1 13 ALA N N 18.142 -0.298 -1.865 . . . 1.0 . . . . . . . . . . . . A . 13 ALA N . . . . . . . . . c30057_5j6t 1 . 7 . 1996 . 1 1 13 ALA O O 20.632 0.683 -4.235 . . . 1.0 . . . . . . . . . . . . A . 13 ALA O . . . . . . . . . c30057_5j6t 1 . 7 . 1997 . 1 1 14 LEU C C 22.386 1.812 -1.844 . . . 1.0 . . . . . . . . . . . . A . 14 LEU C . . . . . . . . . c30057_5j6t 1 . 7 . 1998 . 1 1 14 LEU CA C 21.163 2.564 -2.370 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CA . . . . . . . . . c30057_5j6t 1 . 7 . 1999 . 1 1 14 LEU CB C 20.790 3.702 -1.417 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CB . . . . . . . . . c30057_5j6t 1 . 7 . 2000 . 1 1 14 LEU CD1 C 22.267 5.328 -2.611 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CD1 . . . . . . . . . c30057_5j6t 1 . 7 . 2001 . 1 1 14 LEU CD2 C 21.642 5.725 -0.225 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CD2 . . . . . . . . . c30057_5j6t 1 . 7 . 2002 . 1 1 14 LEU CG C 21.977 4.655 -1.268 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CG . . . . . . . . . c30057_5j6t 1 . 7 . 2003 . 1 1 14 LEU H H 19.286 1.727 -1.642 . . . 1.0 . . . . . . . . . . . . A . 14 LEU H . . . . . . . . . c30057_5j6t 1 . 7 . 2004 . 1 1 14 LEU HA H 21.354 2.951 -3.371 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HA . . . . . . . . . c30057_5j6t 1 . 7 . 2005 . 1 1 14 LEU HB2 H 19.936 4.247 -1.819 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HB2 . . . . . . . . . c30057_5j6t 1 . 7 . 2006 . 1 1 14 LEU HB3 H 20.531 3.289 -0.442 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HB3 . . . . . . . . . c30057_5j6t 1 . 7 . 2007 . 1 1 14 LEU HD11 H 22.505 4.568 -3.355 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD11 . . . . . . . . . c30057_5j6t 1 . 7 . 2008 . 1 1 14 LEU HD12 H 23.113 6.007 -2.502 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD12 . . . . . . . . . c30057_5j6t 1 . 7 . 2009 . 1 1 14 LEU HD13 H 21.390 5.890 -2.933 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD13 . . . . . . . . . c30057_5j6t 1 . 7 . 2010 . 1 1 14 LEU HD21 H 21.435 5.247 0.733 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD21 . . . . . . . . . c30057_5j6t 1 . 7 . 2011 . 1 1 14 LEU HD22 H 22.489 6.403 -0.117 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD22 . . . . . . . . . c30057_5j6t 1 . 7 . 2012 . 1 1 14 LEU HD23 H 20.766 6.286 -0.549 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD23 . . . . . . . . . c30057_5j6t 1 . 7 . 2013 . 1 1 14 LEU HG H 22.854 4.095 -0.945 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HG . . . . . . . . . c30057_5j6t 1 . 7 . 2014 . 1 1 14 LEU N N 19.974 1.661 -2.378 . . . 1.0 . . . . . . . . . . . . A . 14 LEU N . . . . . . . . . c30057_5j6t 1 . 7 . 2015 . 1 1 14 LEU O O 23.461 1.879 -2.410 . . . 1.0 . . . . . . . . . . . . A . 14 LEU O . . . . . . . . . c30057_5j6t 1 . 7 . 2016 . 1 1 15 LYS C C 23.881 -0.688 -1.193 . . . 1.0 . . . . . . . . . . . . A . 15 LYS C . . . . . . . . . c30057_5j6t 1 . 7 . 2017 . 1 1 15 LYS CA C 23.383 0.350 -0.185 . . . 1.0 . . . . . . . . . . . . A . 15 LYS CA . . . . . . . . . c30057_5j6t 1 . 7 . 2018 . 1 1 15 LYS CB C 22.846 -0.343 1.074 . . . 1.0 . . . . . . . . . . . . A . 15 LYS CB . . . . . . . . . c30057_5j6t 1 . 7 . 2019 . 1 1 15 LYS CD C 23.187 1.258 2.965 . . . 1.0 . . . . . . . . . . . . A . 15 LYS CD . . . . . . . . . c30057_5j6t 1 . 7 . 2020 . 1 1 15 LYS CE C 24.082 2.236 2.208 . . . 1.0 . . . . . . . . . . . . A . 15 LYS CE . . . . . . . . . c30057_5j6t 1 . 7 . 2021 . 1 1 15 LYS CG C 22.160 0.673 1.999 . . . 1.0 . . . . . . . . . . . . A . 15 LYS CG . . . . . . . . . c30057_5j6t 1 . 7 . 2022 . 1 1 15 LYS H H 21.328 1.065 -0.308 . . . 1.0 . . . . . . . . . . . . A . 15 LYS H . . . . . . . . . c30057_5j6t 1 . 7 . 2023 . 1 1 15 LYS HA H 24.189 1.036 0.077 . . . 1.0 . . . . . . . . . . . . A . 15 LYS HA . . . . . . . . . c30057_5j6t 1 . 7 . 2024 . 1 1 15 LYS HB2 H 22.127 -1.109 0.785 . . . 1.0 . . . . . . . . . . . . A . 15 LYS HB2 . . . . . . . . . c30057_5j6t 1 . 7 . 2025 . 1 1 15 LYS HB3 H 23.674 -0.810 1.607 . . . 1.0 . . . . . . . . . . . . A . 15 LYS HB3 . . . . . . . . . c30057_5j6t 1 . 7 . 2026 . 1 1 15 LYS HD2 H 22.674 1.781 3.772 . . . 1.0 . . . . . . . . . . . . A . 15 LYS HD2 . . . . . . . . . c30057_5j6t 1 . 7 . 2027 . 1 1 15 LYS HD3 H 23.796 0.454 3.381 . . . 1.0 . . . . . . . . . . . . A . 15 LYS HD3 . . . . . . . . . c30057_5j6t 1 . 7 . 2028 . 1 1 15 LYS HE2 H 24.910 1.704 1.739 . . . 1.0 . . . . . . . . . . . . A . 15 LYS HE2 . . . . . . . . . c30057_5j6t 1 . 7 . 2029 . 1 1 15 LYS HE3 H 23.507 2.775 1.454 . . . 1.0 . . . . . . . . . . . . A . 15 LYS HE3 . . . . . . . . . c30057_5j6t 1 . 7 . 2030 . 1 1 15 LYS HG2 H 21.726 1.474 1.401 . . . 1.0 . . . . . . . . . . . . A . 15 LYS HG2 . . . . . . . . . c30057_5j6t 1 . 7 . 2031 . 1 1 15 LYS HG3 H 21.372 0.175 2.565 . . . 1.0 . . . . . . . . . . . . A . 15 LYS HG3 . . . . . . . . . c30057_5j6t 1 . 7 . 2032 . 1 1 15 LYS HZ1 H 25.201 3.857 2.811 . . . 1.0 . . . . . . . . . . . . A . 15 LYS HZ1 . . . . . . . . . c30057_5j6t 1 . 7 . 2033 . 1 1 15 LYS HZ2 H 25.115 2.657 3.939 . . . 1.0 . . . . . . . . . . . . A . 15 LYS HZ2 . . . . . . . . . c30057_5j6t 1 . 7 . 2034 . 1 1 15 LYS HZ3 H 23.819 3.645 3.686 . . . 1.0 . . . . . . . . . . . . A . 15 LYS HZ3 . . . . . . . . . c30057_5j6t 1 . 7 . 2035 . 1 1 15 LYS N N 22.231 1.104 -0.759 . . . 1.0 . . . . . . . . . . . . A . 15 LYS N . . . . . . . . . c30057_5j6t 1 . 7 . 2036 . 1 1 15 LYS NZ N 24.595 3.174 3.244 . . . 1.0 . . . . . . . . . . . . A . 15 LYS NZ . . . . . . . . . c30057_5j6t 1 . 7 . 2037 . 1 1 15 LYS O O 25.050 -1.016 -1.236 . . . 1.0 . . . . . . . . . . . . A . 15 LYS O . . . . . . . . . c30057_5j6t 1 . 7 . 2038 . 1 1 16 ASN C C 24.145 -1.525 -4.175 . . . 1.0 . . . . . . . . . . . . A . 16 ASN C . . . . . . . . . c30057_5j6t 1 . 7 . 2039 . 1 1 16 ASN CA C 23.420 -2.216 -3.020 . . . 1.0 . . . . . . . . . . . . A . 16 ASN CA . . . . . . . . . c30057_5j6t 1 . 7 . 2040 . 1 1 16 ASN CB C 22.119 -2.851 -3.508 . . . 1.0 . . . . . . . . . . . . A . 16 ASN CB . . . . . . . . . c30057_5j6t 1 . 7 . 2041 . 1 1 16 ASN CG C 21.578 -3.797 -2.436 . . . 1.0 . . . . . . . . . . . . A . 16 ASN CG . . . . . . . . . c30057_5j6t 1 . 7 . 2042 . 1 1 16 ASN H H 22.033 -0.915 -1.954 . . . 1.0 . . . . . . . . . . . . A . 16 ASN H . . . . . . . . . c30057_5j6t 1 . 7 . 2043 . 1 1 16 ASN HA H 24.062 -2.968 -2.562 . . . 1.0 . . . . . . . . . . . . A . 16 ASN HA . . . . . . . . . c30057_5j6t 1 . 7 . 2044 . 1 1 16 ASN HB2 H 21.386 -2.069 -3.706 . . . 1.0 . . . . . . . . . . . . A . 16 ASN HB2 . . . . . . . . . c30057_5j6t 1 . 7 . 2045 . 1 1 16 ASN HB3 H 22.310 -3.410 -4.424 . . . 1.0 . . . . . . . . . . . . A . 16 ASN HB3 . . . . . . . . . c30057_5j6t 1 . 7 . 2046 . 1 1 16 ASN HD21 H 19.784 -2.894 -2.363 . . . 1.0 . . . . . . . . . . . . A . 16 ASN HD21 . . . . . . . . . c30057_5j6t 1 . 7 . 2047 . 1 1 16 ASN HD22 H 19.995 -4.257 -1.286 . . . 1.0 . . . . . . . . . . . . A . 16 ASN HD22 . . . . . . . . . c30057_5j6t 1 . 7 . 2048 . 1 1 16 ASN N N 22.999 -1.203 -2.008 . . . 1.0 . . . . . . . . . . . . A . 16 ASN N . . . . . . . . . c30057_5j6t 1 . 7 . 2049 . 1 1 16 ASN ND2 N 20.360 -3.637 -1.995 . . . 1.0 . . . . . . . . . . . . A . 16 ASN ND2 . . . . . . . . . c30057_5j6t 1 . 7 . 2050 . 1 1 16 ASN O O 25.019 -2.092 -4.802 . . . 1.0 . . . . . . . . . . . . A . 16 ASN O . . . . . . . . . c30057_5j6t 1 . 7 . 2051 . 1 1 16 ASN OD1 O 22.270 -4.691 -1.992 . . . 1.0 . . . . . . . . . . . . A . 16 ASN OD1 . . . . . . . . . c30057_5j6t 1 . 7 . 2052 . 1 1 17 LEU C C 25.879 0.813 -5.176 . . . 1.0 . . . . . . . . . . . . A . 17 LEU C . . . . . . . . . c30057_5j6t 1 . 7 . 2053 . 1 1 17 LEU CA C 24.452 0.434 -5.574 . . . 1.0 . . . . . . . . . . . . A . 17 LEU CA . . . . . . . . . c30057_5j6t 1 . 7 . 2054 . 1 1 17 LEU CB C 23.604 1.688 -5.788 . . . 1.0 . . . . . . . . . . . . A . 17 LEU CB . . . . . . . . . c30057_5j6t 1 . 7 . 2055 . 1 1 17 LEU CD1 C 22.954 2.935 -7.858 . . . 1.0 . . . . . . . . . . . . A . 17 LEU CD1 . . . . . . . . . c30057_5j6t 1 . 7 . 2056 . 1 1 17 LEU CD2 C 24.933 3.673 -6.525 . . . 1.0 . . . . . . . . . . . . A . 17 LEU CD2 . . . . . . . . . c30057_5j6t 1 . 7 . 2057 . 1 1 17 LEU CG C 24.130 2.460 -7.002 . . . 1.0 . . . . . . . . . . . . A . 17 LEU CG . . . . . . . . . c30057_5j6t 1 . 7 . 2058 . 1 1 17 LEU H H 23.058 0.147 -3.925 . . . 1.0 . . . . . . . . . . . . A . 17 LEU H . . . . . . . . . c30057_5j6t 1 . 7 . 2059 . 1 1 17 LEU HA H 24.460 -0.176 -6.478 . . . 1.0 . . . . . . . . . . . . A . 17 LEU HA . . . . . . . . . c30057_5j6t 1 . 7 . 2060 . 1 1 17 LEU HB2 H 22.567 1.401 -5.962 . . . 1.0 . . . . . . . . . . . . A . 17 LEU HB2 . . . . . . . . . c30057_5j6t 1 . 7 . 2061 . 1 1 17 LEU HB3 H 23.662 2.321 -4.902 . . . 1.0 . . . . . . . . . . . . A . 17 LEU HB3 . . . . . . . . . c30057_5j6t 1 . 7 . 2062 . 1 1 17 LEU HD11 H 22.381 2.073 -8.199 . . . 1.0 . . . . . . . . . . . . A . 17 LEU HD11 . . . . . . . . . c30057_5j6t 1 . 7 . 2063 . 1 1 17 LEU HD12 H 23.332 3.484 -8.721 . . . 1.0 . . . . . . . . . . . . A . 17 LEU HD12 . . . . . . . . . c30057_5j6t 1 . 7 . 2064 . 1 1 17 LEU HD13 H 22.313 3.586 -7.265 . . . 1.0 . . . . . . . . . . . . A . 17 LEU HD13 . . . . . . . . . c30057_5j6t 1 . 7 . 2065 . 1 1 17 LEU HD21 H 25.772 3.338 -5.914 . . . 1.0 . . . . . . . . . . . . A . 17 LEU HD21 . . . . . . . . . c30057_5j6t 1 . 7 . 2066 . 1 1 17 LEU HD22 H 25.309 4.222 -7.388 . . . 1.0 . . . . . . . . . . . . A . 17 LEU HD22 . . . . . . . . . c30057_5j6t 1 . 7 . 2067 . 1 1 17 LEU HD23 H 24.290 4.324 -5.933 . . . 1.0 . . . . . . . . . . . . A . 17 LEU HD23 . . . . . . . . . c30057_5j6t 1 . 7 . 2068 . 1 1 17 LEU HG H 24.773 1.809 -7.595 . . . 1.0 . . . . . . . . . . . . A . 17 LEU HG . . . . . . . . . c30057_5j6t 1 . 7 . 2069 . 1 1 17 LEU N N 23.787 -0.302 -4.460 . . . 1.0 . . . . . . . . . . . . A . 17 LEU N . . . . . . . . . c30057_5j6t 1 . 7 . 2070 . 1 1 17 LEU O O 26.760 0.903 -6.008 . . . 1.0 . . . . . . . . . . . . A . 17 LEU O . . . . . . . . . c30057_5j6t 1 . 7 . 2071 . 1 1 18 ILE C C 28.339 0.154 -3.250 . . . 1.0 . . . . . . . . . . . . A . 18 ILE C . . . . . . . . . c30057_5j6t 1 . 7 . 2072 . 1 1 18 ILE CA C 27.485 1.408 -3.460 . . . 1.0 . . . . . . . . . . . . A . 18 ILE CA . . . . . . . . . c30057_5j6t 1 . 7 . 2073 . 1 1 18 ILE CB C 27.284 2.158 -2.142 . . . 1.0 . . . . . . . . . . . . A . 18 ILE CB . . . . . . . . . c30057_5j6t 1 . 7 . 2074 . 1 1 18 ILE CD1 C 26.895 1.727 0.288 . . . 1.0 . . . . . . . . . . . . A . 18 ILE CD1 . . . . . . . . . c30057_5j6t 1 . 7 . 2075 . 1 1 18 ILE CG1 C 26.574 1.254 -1.130 . . . 1.0 . . . . . . . . . . . . A . 18 ILE CG1 . . . . . . . . . c30057_5j6t 1 . 7 . 2076 . 1 1 18 ILE CG2 C 26.435 3.406 -2.388 . . . 1.0 . . . . . . . . . . . . A . 18 ILE CG2 . . . . . . . . . c30057_5j6t 1 . 7 . 2077 . 1 1 18 ILE H H 25.364 0.953 -3.238 . . . 1.0 . . . . . . . . . . . . A . 18 ILE H . . . . . . . . . c30057_5j6t 1 . 7 . 2078 . 1 1 18 ILE HA H 27.954 2.062 -4.195 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HA . . . . . . . . . c30057_5j6t 1 . 7 . 2079 . 1 1 18 ILE HB H 28.254 2.454 -1.744 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HB . . . . . . . . . c30057_5j6t 1 . 7 . 2080 . 1 1 18 ILE HD11 H 27.953 1.978 0.357 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HD11 . . . . . . . . . c30057_5j6t 1 . 7 . 2081 . 1 1 18 ILE HD12 H 26.664 0.932 0.997 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HD12 . . . . . . . . . c30057_5j6t 1 . 7 . 2082 . 1 1 18 ILE HD13 H 26.296 2.607 0.521 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HD13 . . . . . . . . . c30057_5j6t 1 . 7 . 2083 . 1 1 18 ILE HG12 H 25.497 1.300 -1.293 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HG12 . . . . . . . . . c30057_5j6t 1 . 7 . 2084 . 1 1 18 ILE HG13 H 26.916 0.227 -1.257 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HG13 . . . . . . . . . c30057_5j6t 1 . 7 . 2085 . 1 1 18 ILE HG21 H 26.937 4.052 -3.108 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HG21 . . . . . . . . . c30057_5j6t 1 . 7 . 2086 . 1 1 18 ILE HG22 H 25.461 3.112 -2.781 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HG22 . . . . . . . . . c30057_5j6t 1 . 7 . 2087 . 1 1 18 ILE HG23 H 26.300 3.944 -1.450 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HG23 . . . . . . . . . c30057_5j6t 1 . 7 . 2088 . 1 1 18 ILE N N 26.112 1.034 -3.911 . . . 1.0 . . . . . . . . . . . . A . 18 ILE N . . . . . . . . . c30057_5j6t 1 . 7 . 2089 . 1 1 18 ILE O O 29.553 0.208 -3.270 . . . 1.0 . . . . . . . . . . . . A . 18 ILE O . . . . . . . . . c30057_5j6t 1 . 7 . 2090 . 1 1 19 LYS C C 28.454 -3.093 -4.106 . . . 1.0 . . . . . . . . . . . . A . 19 LYS C . . . . . . . . . c30057_5j6t 1 . 7 . 2091 . 1 1 19 LYS CA C 28.487 -2.234 -2.840 . . . 1.0 . . . . . . . . . . . . A . 19 LYS CA . . . . . . . . . c30057_5j6t 1 . 7 . 2092 . 1 1 19 LYS CB C 27.779 -2.949 -1.689 . . . 1.0 . . . . . . . . . . . . A . 19 LYS CB . . . . . . . . . c30057_5j6t 1 . 7 . 2093 . 1 1 19 LYS CD C 27.931 -5.428 -1.979 . . . 1.0 . . . . . . . . . . . . A . 19 LYS CD . . . . . . . . . c30057_5j6t 1 . 7 . 2094 . 1 1 19 LYS CE C 28.669 -6.693 -1.536 . . . 1.0 . . . . . . . . . . . . A . 19 LYS CE . . . . . . . . . c30057_5j6t 1 . 7 . 2095 . 1 1 19 LYS CG C 28.563 -4.207 -1.307 . . . 1.0 . . . . . . . . . . . . A . 19 LYS CG . . . . . . . . . c30057_5j6t 1 . 7 . 2096 . 1 1 19 LYS H H 26.704 -1.000 -3.040 . . . 1.0 . . . . . . . . . . . . A . 19 LYS H . . . . . . . . . c30057_5j6t 1 . 7 . 2097 . 1 1 19 LYS HA H 29.517 -2.003 -2.566 . . . 1.0 . . . . . . . . . . . . A . 19 LYS HA . . . . . . . . . c30057_5j6t 1 . 7 . 2098 . 1 1 19 LYS HB2 H 27.722 -2.282 -0.829 . . . 1.0 . . . . . . . . . . . . A . 19 LYS HB2 . . . . . . . . . c30057_5j6t 1 . 7 . 2099 . 1 1 19 LYS HB3 H 26.772 -3.228 -2.000 . . . 1.0 . . . . . . . . . . . . A . 19 LYS HB3 . . . . . . . . . c30057_5j6t 1 . 7 . 2100 . 1 1 19 LYS HD2 H 26.882 -5.499 -1.691 . . . 1.0 . . . . . . . . . . . . A . 19 LYS HD2 . . . . . . . . . c30057_5j6t 1 . 7 . 2101 . 1 1 19 LYS HD3 H 28.003 -5.325 -3.062 . . . 1.0 . . . . . . . . . . . . A . 19 LYS HD3 . . . . . . . . . c30057_5j6t 1 . 7 . 2102 . 1 1 19 LYS HE2 H 29.369 -7.010 -2.309 . . . 1.0 . . . . . . . . . . . . A . 19 LYS HE2 . . . . . . . . . c30057_5j6t 1 . 7 . 2103 . 1 1 19 LYS HE3 H 29.196 -6.521 -0.598 . . . 1.0 . . . . . . . . . . . . A . 19 LYS HE3 . . . . . . . . . c30057_5j6t 1 . 7 . 2104 . 1 1 19 LYS HG2 H 29.596 -4.105 -1.638 . . . 1.0 . . . . . . . . . . . . A . 19 LYS HG2 . . . . . . . . . c30057_5j6t 1 . 7 . 2105 . 1 1 19 LYS HG3 H 28.539 -4.335 -0.225 . . . 1.0 . . . . . . . . . . . . A . 19 LYS HG3 . . . . . . . . . c30057_5j6t 1 . 7 . 2106 . 1 1 19 LYS HZ1 H 28.017 -8.589 -1.063 . . . 1.0 . . . . . . . . . . . . A . 19 LYS HZ1 . . . . . . . . . c30057_5j6t 1 . 7 . 2107 . 1 1 19 LYS HZ2 H 26.947 -7.401 -0.656 . . . 1.0 . . . . . . . . . . . . A . 19 LYS HZ2 . . . . . . . . . c30057_5j6t 1 . 7 . 2108 . 1 1 19 LYS HZ3 H 27.117 -7.854 -2.233 . . . 1.0 . . . . . . . . . . . . A . 19 LYS HZ3 . . . . . . . . . c30057_5j6t 1 . 7 . 2109 . 1 1 19 LYS N N 27.713 -0.978 -3.051 . . . 1.0 . . . . . . . . . . . . A . 19 LYS N . . . . . . . . . c30057_5j6t 1 . 7 . 2110 . 1 1 19 LYS NZ N 27.602 -7.716 -1.358 . . . 1.0 . . . . . . . . . . . . A . 19 LYS NZ . . . . . . . . . c30057_5j6t 1 . 7 . 2111 . 1 1 19 LYS O O 27.434 -3.207 -4.756 . . . 1.0 . . . . . . . . . . . . A . 19 LYS O . . . . . . . . . c30057_5j6t 1 . 7 . 2112 . 1 1 20 NH2 HN1 H 30.388 -3.617 -3.948 . . . 1.0 . . . . . . . . . . . . A . 20 NH2 HN1 . . . . . . . . . c30057_5j6t 1 . 7 . 2113 . 1 1 20 NH2 HN2 H 29.529 -4.280 -5.321 . . . 1.0 . . . . . . . . . . . . A . 20 NH2 HN2 . . . . . . . . . c30057_5j6t 1 . 7 . 2114 . 1 1 20 NH2 N N 29.538 -3.710 -4.487 . . . 1.0 . . . . . . . . . . . . A . 20 NH2 N . . . . . . . . . c30057_5j6t 1 . 8 . 2115 . 1 1 1 ACE C C 0.266 -1.755 4.086 . . . 1.0 . . . . . . . . . . . . A . 1 ACE C . . . . . . . . . c30057_5j6t 1 . 8 . 2116 . 1 1 1 ACE CH3 C -1.121 -1.112 4.147 . . . 1.0 . . . . . . . . . . . . A . 1 ACE CH3 . . . . . . . . . c30057_5j6t 1 . 8 . 2117 . 1 1 1 ACE H1 H -1.507 -1.176 5.164 . . . 1.0 . . . . . . . . . . . . A . 1 ACE H1 . . . . . . . . . c30057_5j6t 1 . 8 . 2118 . 1 1 1 ACE H2 H -1.049 -0.066 3.850 . . . 1.0 . . . . . . . . . . . . A . 1 ACE H2 . . . . . . . . . c30057_5j6t 1 . 8 . 2119 . 1 1 1 ACE H3 H -1.794 -1.636 3.469 . . . 1.0 . . . . . . . . . . . . A . 1 ACE H3 . . . . . . . . . c30057_5j6t 1 . 8 . 2120 . 1 1 1 ACE O O 0.779 -2.239 5.076 . . . 1.0 . . . . . . . . . . . . A . 1 ACE O . . . . . . . . . c30057_5j6t 1 . 8 . 2121 . 1 1 2 ILE C C 3.257 -1.323 2.371 . . . 1.0 . . . . . . . . . . . . A . 2 ILE C . . . . . . . . . c30057_5j6t 1 . 8 . 2122 . 1 1 2 ILE CA C 2.232 -2.376 2.806 . . . 1.0 . . . . . . . . . . . . A . 2 ILE CA . . . . . . . . . c30057_5j6t 1 . 8 . 2123 . 1 1 2 ILE CB C 2.083 -3.459 1.734 . . . 1.0 . . . . . . . . . . . . A . 2 ILE CB . . . . . . . . . c30057_5j6t 1 . 8 . 2124 . 1 1 2 ILE CD1 C -0.244 -4.274 1.292 . . . 1.0 . . . . . . . . . . . . A . 2 ILE CD1 . . . . . . . . . c30057_5j6t 1 . 8 . 2125 . 1 1 2 ILE CG1 C 1.002 -4.461 2.160 . . . 1.0 . . . . . . . . . . . . A . 2 ILE CG1 . . . . . . . . . c30057_5j6t 1 . 8 . 2126 . 1 1 2 ILE CG2 C 3.415 -4.192 1.560 . . . 1.0 . . . . . . . . . . . . A . 2 ILE CG2 . . . . . . . . . c30057_5j6t 1 . 8 . 2127 . 1 1 2 ILE H H 0.430 -1.356 2.123 . . . 1.0 . . . . . . . . . . . . A . 2 ILE H . . . . . . . . . c30057_5j6t 1 . 8 . 2128 . 1 1 2 ILE HA H 2.532 -2.824 3.753 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HA . . . . . . . . . c30057_5j6t 1 . 8 . 2129 . 1 1 2 ILE HB H 1.797 -2.997 0.789 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HB . . . . . . . . . c30057_5j6t 1 . 8 . 2130 . 1 1 2 ILE HD11 H -1.010 -4.987 1.596 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HD11 . . . . . . . . . c30057_5j6t 1 . 8 . 2131 . 1 1 2 ILE HD12 H -0.623 -3.259 1.414 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HD12 . . . . . . . . . c30057_5j6t 1 . 8 . 2132 . 1 1 2 ILE HD13 H 0.013 -4.442 0.246 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HD13 . . . . . . . . . c30057_5j6t 1 . 8 . 2133 . 1 1 2 ILE HG12 H 1.380 -5.476 2.037 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HG12 . . . . . . . . . c30057_5j6t 1 . 8 . 2134 . 1 1 2 ILE HG13 H 0.744 -4.293 3.206 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HG13 . . . . . . . . . c30057_5j6t 1 . 8 . 2135 . 1 1 2 ILE HG21 H 3.227 -5.251 1.385 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HG21 . . . . . . . . . c30057_5j6t 1 . 8 . 2136 . 1 1 2 ILE HG22 H 3.952 -3.772 0.709 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HG22 . . . . . . . . . c30057_5j6t 1 . 8 . 2137 . 1 1 2 ILE HG23 H 4.015 -4.074 2.463 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HG23 . . . . . . . . . c30057_5j6t 1 . 8 . 2138 . 1 1 2 ILE N N 0.876 -1.764 2.932 . . . 1.0 . . . . . . . . . . . . A . 2 ILE N . . . . . . . . . c30057_5j6t 1 . 8 . 2139 . 1 1 2 ILE O O 4.356 -1.647 1.965 . . . 1.0 . . . . . . . . . . . . A . 2 ILE O . . . . . . . . . c30057_5j6t 1 . 8 . 2140 . 1 1 3 PHE C C 5.099 0.969 2.965 . . . 1.0 . . . . . . . . . . . . A . 3 PHE C . . . . . . . . . c30057_5j6t 1 . 8 . 2141 . 1 1 3 PHE CA C 3.873 1.001 2.051 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CA . . . . . . . . . c30057_5j6t 1 . 8 . 2142 . 1 1 3 PHE CB C 3.112 2.316 2.221 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CB . . . . . . . . . c30057_5j6t 1 . 8 . 2143 . 1 1 3 PHE CD1 C 4.502 4.400 2.491 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CD1 . . . . . . . . . c30057_5j6t 1 . 8 . 2144 . 1 1 3 PHE CD2 C 4.113 3.538 0.257 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CD2 . . . . . . . . . c30057_5j6t 1 . 8 . 2145 . 1 1 3 PHE CE1 C 5.261 5.449 1.953 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CE1 . . . . . . . . . c30057_5j6t 1 . 8 . 2146 . 1 1 3 PHE CE2 C 4.871 4.586 -0.278 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CE2 . . . . . . . . . c30057_5j6t 1 . 8 . 2147 . 1 1 3 PHE CG C 3.929 3.446 1.644 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CG . . . . . . . . . c30057_5j6t 1 . 8 . 2148 . 1 1 3 PHE CZ C 5.445 5.541 0.569 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CZ . . . . . . . . . c30057_5j6t 1 . 8 . 2149 . 1 1 3 PHE H H 1.993 0.187 2.796 . . . 1.0 . . . . . . . . . . . . A . 3 PHE H . . . . . . . . . c30057_5j6t 1 . 8 . 2150 . 1 1 3 PHE HA H 4.171 0.868 1.011 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HA . . . . . . . . . c30057_5j6t 1 . 8 . 2151 . 1 1 3 PHE HB2 H 2.157 2.254 1.700 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HB2 . . . . . . . . . c30057_5j6t 1 . 8 . 2152 . 1 1 3 PHE HB3 H 2.936 2.499 3.281 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HB3 . . . . . . . . . c30057_5j6t 1 . 8 . 2153 . 1 1 3 PHE HD1 H 4.360 4.328 3.559 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HD1 . . . . . . . . . c30057_5j6t 1 . 8 . 2154 . 1 1 3 PHE HD2 H 3.670 2.801 -0.397 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HD2 . . . . . . . . . c30057_5j6t 1 . 8 . 2155 . 1 1 3 PHE HE1 H 5.703 6.185 2.608 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HE1 . . . . . . . . . c30057_5j6t 1 . 8 . 2156 . 1 1 3 PHE HE2 H 5.014 4.657 -1.347 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HE2 . . . . . . . . . c30057_5j6t 1 . 8 . 2157 . 1 1 3 PHE HZ H 6.029 6.350 0.155 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HZ . . . . . . . . . c30057_5j6t 1 . 8 . 2158 . 1 1 3 PHE N N 2.911 -0.063 2.456 . . . 1.0 . . . . . . . . . . . . A . 3 PHE N . . . . . . . . . c30057_5j6t 1 . 8 . 2159 . 1 1 3 PHE O O 6.204 1.252 2.547 . . . 1.0 . . . . . . . . . . . . A . 3 PHE O . . . . . . . . . c30057_5j6t 1 . 8 . 2160 . 1 1 4 GLY C C 7.048 -0.514 4.685 . . . 1.0 . . . . . . . . . . . . A . 4 GLY C . . . . . . . . . c30057_5j6t 1 . 8 . 2161 . 1 1 4 GLY CA C 6.060 0.557 5.152 . . . 1.0 . . . . . . . . . . . . A . 4 GLY CA . . . . . . . . . c30057_5j6t 1 . 8 . 2162 . 1 1 4 GLY H H 3.979 0.388 4.531 . . . 1.0 . . . . . . . . . . . . A . 4 GLY H . . . . . . . . . c30057_5j6t 1 . 8 . 2163 . 1 1 4 GLY HA2 H 6.559 1.526 5.178 . . . 1.0 . . . . . . . . . . . . A . 4 GLY HA2 . . . . . . . . . c30057_5j6t 1 . 8 . 2164 . 1 1 4 GLY HA3 H 5.699 0.308 6.150 . . . 1.0 . . . . . . . . . . . . A . 4 GLY HA3 . . . . . . . . . c30057_5j6t 1 . 8 . 2165 . 1 1 4 GLY N N 4.908 0.618 4.208 . . . 1.0 . . . . . . . . . . . . A . 4 GLY N . . . . . . . . . c30057_5j6t 1 . 8 . 2166 . 1 1 4 GLY O O 8.185 -0.546 5.112 . . . 1.0 . . . . . . . . . . . . A . 4 GLY O . . . . . . . . . c30057_5j6t 1 . 8 . 2167 . 1 1 5 ALA C C 8.300 -1.978 2.075 . . . 1.0 . . . . . . . . . . . . A . 5 ALA C . . . . . . . . . c30057_5j6t 1 . 8 . 2168 . 1 1 5 ALA CA C 7.545 -2.460 3.318 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CA . . . . . . . . . c30057_5j6t 1 . 8 . 2169 . 1 1 5 ALA CB C 6.632 -3.636 2.970 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CB . . . . . . . . . c30057_5j6t 1 . 8 . 2170 . 1 1 5 ALA H H 5.677 -1.349 3.470 . . . 1.0 . . . . . . . . . . . . A . 5 ALA H . . . . . . . . . c30057_5j6t 1 . 8 . 2171 . 1 1 5 ALA HA H 8.248 -2.745 4.100 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HA . . . . . . . . . c30057_5j6t 1 . 8 . 2172 . 1 1 5 ALA HB1 H 7.233 -4.466 2.598 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB1 . . . . . . . . . c30057_5j6t 1 . 8 . 2173 . 1 1 5 ALA HB2 H 5.921 -3.329 2.203 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB2 . . . . . . . . . c30057_5j6t 1 . 8 . 2174 . 1 1 5 ALA HB3 H 6.090 -3.951 3.862 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB3 . . . . . . . . . c30057_5j6t 1 . 8 . 2175 . 1 1 5 ALA N N 6.626 -1.393 3.811 . . . 1.0 . . . . . . . . . . . . A . 5 ALA N . . . . . . . . . c30057_5j6t 1 . 8 . 2176 . 1 1 5 ALA O O 9.354 -2.485 1.742 . . . 1.0 . . . . . . . . . . . . A . 5 ALA O . . . . . . . . . c30057_5j6t 1 . 8 . 2177 . 1 1 6 ILE C C 9.538 0.526 0.548 . . . 1.0 . . . . . . . . . . . . A . 6 ILE C . . . . . . . . . c30057_5j6t 1 . 8 . 2178 . 1 1 6 ILE CA C 8.458 -0.489 0.166 . . . 1.0 . . . . . . . . . . . . A . 6 ILE CA . . . . . . . . . c30057_5j6t 1 . 8 . 2179 . 1 1 6 ILE CB C 7.357 0.184 -0.657 . . . 1.0 . . . . . . . . . . . . A . 6 ILE CB . . . . . . . . . c30057_5j6t 1 . 8 . 2180 . 1 1 6 ILE CD1 C 5.036 -0.121 -1.534 . . . 1.0 . . . . . . . . . . . . A . 6 ILE CD1 . . . . . . . . . c30057_5j6t 1 . 8 . 2181 . 1 1 6 ILE CG1 C 6.274 -0.842 -1.000 . . . 1.0 . . . . . . . . . . . . A . 6 ILE CG1 . . . . . . . . . c30057_5j6t 1 . 8 . 2182 . 1 1 6 ILE CG2 C 7.952 0.745 -1.952 . . . 1.0 . . . . . . . . . . . . A . 6 ILE CG2 . . . . . . . . . c30057_5j6t 1 . 8 . 2183 . 1 1 6 ILE H H 6.895 -0.594 1.682 . . . 1.0 . . . . . . . . . . . . A . 6 ILE H . . . . . . . . . c30057_5j6t 1 . 8 . 2184 . 1 1 6 ILE HA H 8.897 -1.314 -0.395 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HA . . . . . . . . . c30057_5j6t 1 . 8 . 2185 . 1 1 6 ILE HB H 6.917 0.997 -0.079 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HB . . . . . . . . . c30057_5j6t 1 . 8 . 2186 . 1 1 6 ILE HD11 H 4.266 -0.852 -1.778 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HD11 . . . . . . . . . c30057_5j6t 1 . 8 . 2187 . 1 1 6 ILE HD12 H 4.660 0.564 -0.775 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HD12 . . . . . . . . . c30057_5j6t 1 . 8 . 2188 . 1 1 6 ILE HD13 H 5.302 0.439 -2.431 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HD13 . . . . . . . . . c30057_5j6t 1 . 8 . 2189 . 1 1 6 ILE HG12 H 6.650 -1.528 -1.759 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HG12 . . . . . . . . . c30057_5j6t 1 . 8 . 2190 . 1 1 6 ILE HG13 H 6.008 -1.403 -0.103 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HG13 . . . . . . . . . c30057_5j6t 1 . 8 . 2191 . 1 1 6 ILE HG21 H 8.723 1.476 -1.711 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HG21 . . . . . . . . . c30057_5j6t 1 . 8 . 2192 . 1 1 6 ILE HG22 H 8.390 -0.068 -2.531 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HG22 . . . . . . . . . c30057_5j6t 1 . 8 . 2193 . 1 1 6 ILE HG23 H 7.166 1.224 -2.535 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HG23 . . . . . . . . . c30057_5j6t 1 . 8 . 2194 . 1 1 6 ILE N N 7.771 -1.002 1.387 . . . 1.0 . . . . . . . . . . . . A . 6 ILE N . . . . . . . . . c30057_5j6t 1 . 8 . 2195 . 1 1 6 ILE O O 10.539 0.664 -0.128 . . . 1.0 . . . . . . . . . . . . A . 6 ILE O . . . . . . . . . c30057_5j6t 1 . 8 . 2196 . 1 1 7 TRP C C 11.689 1.552 2.387 . . . 1.0 . . . . . . . . . . . . A . 7 TRP C . . . . . . . . . c30057_5j6t 1 . 8 . 2197 . 1 1 7 TRP CA C 10.364 2.245 2.045 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CA . . . . . . . . . c30057_5j6t 1 . 8 . 2198 . 1 1 7 TRP CB C 9.773 2.936 3.279 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CB . . . . . . . . . c30057_5j6t 1 . 8 . 2199 . 1 1 7 TRP CD1 C 8.550 5.131 3.014 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CD1 . . . . . . . . . c30057_5j6t 1 . 8 . 2200 . 1 1 7 TRP CD2 C 10.775 5.345 2.765 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CD2 . . . . . . . . . c30057_5j6t 1 . 8 . 2201 . 1 1 7 TRP CE2 C 10.221 6.636 2.593 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CE2 . . . . . . . . . c30057_5j6t 1 . 8 . 2202 . 1 1 7 TRP CE3 C 12.170 5.203 2.658 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CE3 . . . . . . . . . c30057_5j6t 1 . 8 . 2203 . 1 1 7 TRP CG C 9.692 4.408 3.031 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CG . . . . . . . . . c30057_5j6t 1 . 8 . 2204 . 1 1 7 TRP CH2 C 12.408 7.585 2.218 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CH2 . . . . . . . . . c30057_5j6t 1 . 8 . 2205 . 1 1 7 TRP CZ2 C 11.024 7.745 2.323 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CZ2 . . . . . . . . . c30057_5j6t 1 . 8 . 2206 . 1 1 7 TRP CZ3 C 12.981 6.316 2.386 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CZ3 . . . . . . . . . c30057_5j6t 1 . 8 . 2207 . 1 1 7 TRP H H 8.506 1.107 2.175 . . . 1.0 . . . . . . . . . . . . A . 7 TRP H . . . . . . . . . c30057_5j6t 1 . 8 . 2208 . 1 1 7 TRP HA H 10.519 2.973 1.249 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HA . . . . . . . . . c30057_5j6t 1 . 8 . 2209 . 1 1 7 TRP HB2 H 8.775 2.544 3.471 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HB2 . . . . . . . . . c30057_5j6t 1 . 8 . 2210 . 1 1 7 TRP HB3 H 10.411 2.746 4.142 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HB3 . . . . . . . . . c30057_5j6t 1 . 8 . 2211 . 1 1 7 TRP HD1 H 7.556 4.741 3.176 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HD1 . . . . . . . . . c30057_5j6t 1 . 8 . 2212 . 1 1 7 TRP HE1 H 8.180 7.196 2.687 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HE1 . . . . . . . . . c30057_5j6t 1 . 8 . 2213 . 1 1 7 TRP HE3 H 12.621 4.230 2.786 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HE3 . . . . . . . . . c30057_5j6t 1 . 8 . 2214 . 1 1 7 TRP HH2 H 13.037 8.438 2.007 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HH2 . . . . . . . . . c30057_5j6t 1 . 8 . 2215 . 1 1 7 TRP HZ2 H 10.578 8.721 2.196 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HZ2 . . . . . . . . . c30057_5j6t 1 . 8 . 2216 . 1 1 7 TRP HZ3 H 14.051 6.194 2.305 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HZ3 . . . . . . . . . c30057_5j6t 1 . 8 . 2217 . 1 1 7 TRP N N 9.344 1.238 1.626 . . . 1.0 . . . . . . . . . . . . A . 7 TRP N . . . . . . . . . c30057_5j6t 1 . 8 . 2218 . 1 1 7 TRP NE1 N 8.862 6.455 2.753 . . . 1.0 . . . . . . . . . . . . A . 7 TRP NE1 . . . . . . . . . c30057_5j6t 1 . 8 . 2219 . 1 1 7 TRP O O 12.725 1.918 1.865 . . . 1.0 . . . . . . . . . . . . A . 7 TRP O . . . . . . . . . c30057_5j6t 1 . 8 . 2220 . 1 1 8 PRO C C 13.590 -0.673 2.392 . . . 1.0 . . . . . . . . . . . . A . 8 PRO C . . . . . . . . . c30057_5j6t 1 . 8 . 2221 . 1 1 8 PRO CA C 12.852 -0.175 3.638 . . . 1.0 . . . . . . . . . . . . A . 8 PRO CA . . . . . . . . . c30057_5j6t 1 . 8 . 2222 . 1 1 8 PRO CB C 12.336 -1.351 4.464 . . . 1.0 . . . . . . . . . . . . A . 8 PRO CB . . . . . . . . . c30057_5j6t 1 . 8 . 2223 . 1 1 8 PRO CD C 10.432 0.050 3.930 . . . 1.0 . . . . . . . . . . . . A . 8 PRO CD . . . . . . . . . c30057_5j6t 1 . 8 . 2224 . 1 1 8 PRO CG C 10.967 -0.954 4.917 . . . 1.0 . . . . . . . . . . . . A . 8 PRO CG . . . . . . . . . c30057_5j6t 1 . 8 . 2225 . 1 1 8 PRO HA H 13.504 0.458 4.240 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HA . . . . . . . . . c30057_5j6t 1 . 8 . 2226 . 1 1 8 PRO HB2 H 12.288 -2.253 3.854 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HB2 . . . . . . . . . c30057_5j6t 1 . 8 . 2227 . 1 1 8 PRO HB3 H 12.983 -1.516 5.326 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HB3 . . . . . . . . . c30057_5j6t 1 . 8 . 2228 . 1 1 8 PRO HD2 H 9.759 -0.429 3.219 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HD2 . . . . . . . . . c30057_5j6t 1 . 8 . 2229 . 1 1 8 PRO HD3 H 9.918 0.857 4.452 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HD3 . . . . . . . . . c30057_5j6t 1 . 8 . 2230 . 1 1 8 PRO HG2 H 10.318 -1.829 4.941 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HG2 . . . . . . . . . c30057_5j6t 1 . 8 . 2231 . 1 1 8 PRO HG3 H 11.019 -0.506 5.910 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HG3 . . . . . . . . . c30057_5j6t 1 . 8 . 2232 . 1 1 8 PRO N N 11.625 0.563 3.250 . . . 1.0 . . . . . . . . . . . . A . 8 PRO N . . . . . . . . . c30057_5j6t 1 . 8 . 2233 . 1 1 8 PRO O O 14.801 -0.775 2.374 . . . 1.0 . . . . . . . . . . . . A . 8 PRO O . . . . . . . . . c30057_5j6t 1 . 8 . 2234 . 1 1 9 LEU C C 14.148 -0.285 -0.653 . . . 1.0 . . . . . . . . . . . . A . 9 LEU C . . . . . . . . . c30057_5j6t 1 . 8 . 2235 . 1 1 9 LEU CA C 13.521 -1.463 0.100 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CA . . . . . . . . . c30057_5j6t 1 . 8 . 2236 . 1 1 9 LEU CB C 12.396 -2.091 -0.724 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CB . . . . . . . . . c30057_5j6t 1 . 8 . 2237 . 1 1 9 LEU CD1 C 11.839 -4.188 -1.965 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CD1 . . . . . . . . . c30057_5j6t 1 . 8 . 2238 . 1 1 9 LEU CD2 C 13.585 -2.636 -2.852 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CD2 . . . . . . . . . c30057_5j6t 1 . 8 . 2239 . 1 1 9 LEU CG C 12.963 -3.222 -1.582 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CG . . . . . . . . . c30057_5j6t 1 . 8 . 2240 . 1 1 9 LEU H H 11.860 -0.884 1.387 . . . 1.0 . . . . . . . . . . . . A . 9 LEU H . . . . . . . . . c30057_5j6t 1 . 8 . 2241 . 1 1 9 LEU HA H 14.280 -2.209 0.336 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HA . . . . . . . . . c30057_5j6t 1 . 8 . 2242 . 1 1 9 LEU HB2 H 11.634 -2.489 -0.055 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HB2 . . . . . . . . . c30057_5j6t 1 . 8 . 2243 . 1 1 9 LEU HB3 H 11.952 -1.333 -1.370 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HB3 . . . . . . . . . c30057_5j6t 1 . 8 . 2244 . 1 1 9 LEU HD11 H 11.395 -4.606 -1.061 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD11 . . . . . . . . . c30057_5j6t 1 . 8 . 2245 . 1 1 9 LEU HD12 H 11.076 -3.651 -2.529 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD12 . . . . . . . . . c30057_5j6t 1 . 8 . 2246 . 1 1 9 LEU HD13 H 12.244 -4.993 -2.577 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD13 . . . . . . . . . c30057_5j6t 1 . 8 . 2247 . 1 1 9 LEU HD21 H 13.989 -3.442 -3.464 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD21 . . . . . . . . . c30057_5j6t 1 . 8 . 2248 . 1 1 9 LEU HD22 H 14.386 -1.949 -2.580 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD22 . . . . . . . . . c30057_5j6t 1 . 8 . 2249 . 1 1 9 LEU HD23 H 12.822 -2.099 -3.416 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD23 . . . . . . . . . c30057_5j6t 1 . 8 . 2250 . 1 1 9 LEU HG H 13.726 -3.759 -1.018 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HG . . . . . . . . . c30057_5j6t 1 . 8 . 2251 . 1 1 9 LEU N N 12.865 -0.977 1.348 . . . 1.0 . . . . . . . . . . . . A . 9 LEU N . . . . . . . . . c30057_5j6t 1 . 8 . 2252 . 1 1 9 LEU O O 15.107 -0.444 -1.381 . . . 1.0 . . . . . . . . . . . . A . 9 LEU O . . . . . . . . . c30057_5j6t 1 . 8 . 2253 . 1 1 10 ALA C C 15.588 2.372 -0.671 . . . 1.0 . . . . . . . . . . . . A . 10 ALA C . . . . . . . . . c30057_5j6t 1 . 8 . 2254 . 1 1 10 ALA CA C 14.175 2.084 -1.182 . . . 1.0 . . . . . . . . . . . . A . 10 ALA CA . . . . . . . . . c30057_5j6t 1 . 8 . 2255 . 1 1 10 ALA CB C 13.233 3.236 -0.832 . . . 1.0 . . . . . . . . . . . . A . 10 ALA CB . . . . . . . . . c30057_5j6t 1 . 8 . 2256 . 1 1 10 ALA H H 12.814 0.999 0.131 . . . 1.0 . . . . . . . . . . . . A . 10 ALA H . . . . . . . . . c30057_5j6t 1 . 8 . 2257 . 1 1 10 ALA HA H 14.187 1.919 -2.259 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HA . . . . . . . . . c30057_5j6t 1 . 8 . 2258 . 1 1 10 ALA HB1 H 13.194 3.939 -1.664 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HB1 . . . . . . . . . c30057_5j6t 1 . 8 . 2259 . 1 1 10 ALA HB2 H 12.235 2.843 -0.641 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HB2 . . . . . . . . . c30057_5j6t 1 . 8 . 2260 . 1 1 10 ALA HB3 H 13.599 3.747 0.059 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HB3 . . . . . . . . . c30057_5j6t 1 . 8 . 2261 . 1 1 10 ALA N N 13.612 0.894 -0.480 . . . 1.0 . . . . . . . . . . . . A . 10 ALA N . . . . . . . . . c30057_5j6t 1 . 8 . 2262 . 1 1 10 ALA O O 16.484 2.683 -1.431 . . . 1.0 . . . . . . . . . . . . A . 10 ALA O . . . . . . . . . c30057_5j6t 1 . 8 . 2263 . 1 1 11 LEU C C 18.077 1.354 0.881 . . . 1.0 . . . . . . . . . . . . A . 11 LEU C . . . . . . . . . c30057_5j6t 1 . 8 . 2264 . 1 1 11 LEU CA C 17.143 2.528 1.184 . . . 1.0 . . . . . . . . . . . . A . 11 LEU CA . . . . . . . . . c30057_5j6t 1 . 8 . 2265 . 1 1 11 LEU CB C 16.922 2.664 2.690 . . . 1.0 . . . . . . . . . . . . A . 11 LEU CB . . . . . . . . . c30057_5j6t 1 . 8 . 2266 . 1 1 11 LEU CD1 C 15.746 4.045 4.410 . . . 1.0 . . . . . . . . . . . . A . 11 LEU CD1 . . . . . . . . . c30057_5j6t 1 . 8 . 2267 . 1 1 11 LEU CD2 C 17.448 5.094 2.913 . . . 1.0 . . . . . . . . . . . . A . 11 LEU CD2 . . . . . . . . . c30057_5j6t 1 . 8 . 2268 . 1 1 11 LEU CG C 16.339 4.043 2.999 . . . 1.0 . . . . . . . . . . . . A . 11 LEU CG . . . . . . . . . c30057_5j6t 1 . 8 . 2269 . 1 1 11 LEU H H 15.027 2.004 1.223 . . . 1.0 . . . . . . . . . . . . A . 11 LEU H . . . . . . . . . c30057_5j6t 1 . 8 . 2270 . 1 1 11 LEU HA H 17.553 3.453 0.777 . . . 1.0 . . . . . . . . . . . . A . 11 LEU HA . . . . . . . . . c30057_5j6t 1 . 8 . 2271 . 1 1 11 LEU HB2 H 16.228 1.893 3.026 . . . 1.0 . . . . . . . . . . . . A . 11 LEU HB2 . . . . . . . . . c30057_5j6t 1 . 8 . 2272 . 1 1 11 LEU HB3 H 17.873 2.547 3.209 . . . 1.0 . . . . . . . . . . . . A . 11 LEU HB3 . . . . . . . . . c30057_5j6t 1 . 8 . 2273 . 1 1 11 LEU HD11 H 14.956 3.296 4.474 . . . 1.0 . . . . . . . . . . . . A . 11 LEU HD11 . . . . . . . . . c30057_5j6t 1 . 8 . 2274 . 1 1 11 LEU HD12 H 15.333 5.029 4.629 . . . 1.0 . . . . . . . . . . . . A . 11 LEU HD12 . . . . . . . . . c30057_5j6t 1 . 8 . 2275 . 1 1 11 LEU HD13 H 16.528 3.810 5.133 . . . 1.0 . . . . . . . . . . . . A . 11 LEU HD13 . . . . . . . . . c30057_5j6t 1 . 8 . 2276 . 1 1 11 LEU HD21 H 17.034 6.078 3.132 . . . 1.0 . . . . . . . . . . . . A . 11 LEU HD21 . . . . . . . . . c30057_5j6t 1 . 8 . 2277 . 1 1 11 LEU HD22 H 17.870 5.094 1.908 . . . 1.0 . . . . . . . . . . . . A . 11 LEU HD22 . . . . . . . . . c30057_5j6t 1 . 8 . 2278 . 1 1 11 LEU HD23 H 18.229 4.859 3.635 . . . 1.0 . . . . . . . . . . . . A . 11 LEU HD23 . . . . . . . . . c30057_5j6t 1 . 8 . 2279 . 1 1 11 LEU HG H 15.557 4.278 2.276 . . . 1.0 . . . . . . . . . . . . A . 11 LEU HG . . . . . . . . . c30057_5j6t 1 . 8 . 2280 . 1 1 11 LEU N N 15.789 2.265 0.614 . . . 1.0 . . . . . . . . . . . . A . 11 LEU N . . . . . . . . . c30057_5j6t 1 . 8 . 2281 . 1 1 11 LEU O O 19.275 1.516 0.762 . . . 1.0 . . . . . . . . . . . . A . 11 LEU O . . . . . . . . . c30057_5j6t 1 . 8 . 2282 . 1 1 12 GLY C C 18.939 -0.897 -0.961 . . . 1.0 . . . . . . . . . . . . A . 12 GLY C . . . . . . . . . c30057_5j6t 1 . 8 . 2283 . 1 1 12 GLY CA C 18.383 -1.014 0.458 . . . 1.0 . . . . . . . . . . . . A . 12 GLY CA . . . . . . . . . c30057_5j6t 1 . 8 . 2284 . 1 1 12 GLY H H 16.534 0.066 0.860 . . . 1.0 . . . . . . . . . . . . A . 12 GLY H . . . . . . . . . c30057_5j6t 1 . 8 . 2285 . 1 1 12 GLY HA2 H 19.208 -1.058 1.169 . . . 1.0 . . . . . . . . . . . . A . 12 GLY HA2 . . . . . . . . . c30057_5j6t 1 . 8 . 2286 . 1 1 12 GLY HA3 H 17.783 -1.920 0.540 . . . 1.0 . . . . . . . . . . . . A . 12 GLY HA3 . . . . . . . . . c30057_5j6t 1 . 8 . 2287 . 1 1 12 GLY N N 17.533 0.174 0.756 . . . 1.0 . . . . . . . . . . . . A . 12 GLY N . . . . . . . . . c30057_5j6t 1 . 8 . 2288 . 1 1 12 GLY O O 20.031 -1.345 -1.249 . . . 1.0 . . . . . . . . . . . . A . 12 GLY O . . . . . . . . . c30057_5j6t 1 . 8 . 2289 . 1 1 13 ALA C C 19.903 0.791 -3.284 . . . 1.0 . . . . . . . . . . . . A . 13 ALA C . . . . . . . . . c30057_5j6t 1 . 8 . 2290 . 1 1 13 ALA CA C 18.687 -0.139 -3.252 . . . 1.0 . . . . . . . . . . . . A . 13 ALA CA . . . . . . . . . c30057_5j6t 1 . 8 . 2291 . 1 1 13 ALA CB C 17.518 0.480 -4.017 . . . 1.0 . . . . . . . . . . . . A . 13 ALA CB . . . . . . . . . c30057_5j6t 1 . 8 . 2292 . 1 1 13 ALA H H 17.293 0.072 -1.589 . . . 1.0 . . . . . . . . . . . . A . 13 ALA H . . . . . . . . . c30057_5j6t 1 . 8 . 2293 . 1 1 13 ALA HA H 18.942 -1.112 -3.673 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HA . . . . . . . . . c30057_5j6t 1 . 8 . 2294 . 1 1 13 ALA HB1 H 17.801 0.624 -5.060 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HB1 . . . . . . . . . c30057_5j6t 1 . 8 . 2295 . 1 1 13 ALA HB2 H 17.263 1.443 -3.574 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HB2 . . . . . . . . . c30057_5j6t 1 . 8 . 2296 . 1 1 13 ALA HB3 H 16.655 -0.184 -3.963 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HB3 . . . . . . . . . c30057_5j6t 1 . 8 . 2297 . 1 1 13 ALA N N 18.198 -0.292 -1.850 . . . 1.0 . . . . . . . . . . . . A . 13 ALA N . . . . . . . . . c30057_5j6t 1 . 8 . 2298 . 1 1 13 ALA O O 20.737 0.710 -4.164 . . . 1.0 . . . . . . . . . . . . A . 13 ALA O . . . . . . . . . c30057_5j6t 1 . 8 . 2299 . 1 1 14 LEU C C 22.397 1.914 -1.705 . . . 1.0 . . . . . . . . . . . . A . 14 LEU C . . . . . . . . . c30057_5j6t 1 . 8 . 2300 . 1 1 14 LEU CA C 21.167 2.611 -2.292 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CA . . . . . . . . . c30057_5j6t 1 . 8 . 2301 . 1 1 14 LEU CB C 20.718 3.759 -1.383 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CB . . . . . . . . . c30057_5j6t 1 . 8 . 2302 . 1 1 14 LEU CD1 C 22.220 5.389 -2.542 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CD1 . . . . . . . . . c30057_5j6t 1 . 8 . 2303 . 1 1 14 LEU CD2 C 21.445 5.841 -0.210 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CD2 . . . . . . . . . c30057_5j6t 1 . 8 . 2304 . 1 1 14 LEU CG C 21.869 4.749 -1.196 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CG . . . . . . . . . c30057_5j6t 1 . 8 . 2305 . 1 1 14 LEU H H 19.302 1.720 -1.604 . . . 1.0 . . . . . . . . . . . . A . 14 LEU H . . . . . . . . . c30057_5j6t 1 . 8 . 2306 . 1 1 14 LEU HA H 21.383 2.982 -3.293 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HA . . . . . . . . . c30057_5j6t 1 . 8 . 2307 . 1 1 14 LEU HB2 H 19.869 4.270 -1.837 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HB2 . . . . . . . . . c30057_5j6t 1 . 8 . 2308 . 1 1 14 LEU HB3 H 20.424 3.359 -0.413 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HB3 . . . . . . . . . c30057_5j6t 1 . 8 . 2309 . 1 1 14 LEU HD11 H 22.522 4.613 -3.246 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD11 . . . . . . . . . c30057_5j6t 1 . 8 . 2310 . 1 1 14 LEU HD12 H 21.349 5.914 -2.933 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD12 . . . . . . . . . c30057_5j6t 1 . 8 . 2311 . 1 1 14 LEU HD13 H 23.040 6.094 -2.406 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD13 . . . . . . . . . c30057_5j6t 1 . 8 . 2312 . 1 1 14 LEU HD21 H 22.264 6.548 -0.076 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD21 . . . . . . . . . c30057_5j6t 1 . 8 . 2313 . 1 1 14 LEU HD22 H 20.573 6.366 -0.602 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD22 . . . . . . . . . c30057_5j6t 1 . 8 . 2314 . 1 1 14 LEU HD23 H 21.196 5.388 0.749 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD23 . . . . . . . . . c30057_5j6t 1 . 8 . 2315 . 1 1 14 LEU HG H 22.740 4.224 -0.805 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HG . . . . . . . . . c30057_5j6t 1 . 8 . 2316 . 1 1 14 LEU N N 20.008 1.673 -2.325 . . . 1.0 . . . . . . . . . . . . A . 14 LEU N . . . . . . . . . c30057_5j6t 1 . 8 . 2317 . 1 1 14 LEU O O 23.489 2.015 -2.230 . . . 1.0 . . . . . . . . . . . . A . 14 LEU O . . . . . . . . . c30057_5j6t 1 . 8 . 2318 . 1 1 15 LYS C C 23.860 -0.632 -0.890 . . . 1.0 . . . . . . . . . . . . A . 15 LYS C . . . . . . . . . c30057_5j6t 1 . 8 . 2319 . 1 1 15 LYS CA C 23.392 0.515 0.009 . . . 1.0 . . . . . . . . . . . . A . 15 LYS CA . . . . . . . . . c30057_5j6t 1 . 8 . 2320 . 1 1 15 LYS CB C 22.881 -0.030 1.349 . . . 1.0 . . . . . . . . . . . . A . 15 LYS CB . . . . . . . . . c30057_5j6t 1 . 8 . 2321 . 1 1 15 LYS CD C 23.291 1.793 3.012 . . . 1.0 . . . . . . . . . . . . A . 15 LYS CD . . . . . . . . . c30057_5j6t 1 . 8 . 2322 . 1 1 15 LYS CE C 24.141 2.679 2.105 . . . 1.0 . . . . . . . . . . . . A . 15 LYS CE . . . . . . . . . c30057_5j6t 1 . 8 . 2323 . 1 1 15 LYS CG C 22.228 1.089 2.169 . . . 1.0 . . . . . . . . . . . . A . 15 LYS CG . . . . . . . . . c30057_5j6t 1 . 8 . 2324 . 1 1 15 LYS H H 21.313 1.143 -0.198 . . . 1.0 . . . . . . . . . . . . A . 15 LYS H . . . . . . . . . c30057_5j6t 1 . 8 . 2325 . 1 1 15 LYS HA H 24.207 1.218 0.175 . . . 1.0 . . . . . . . . . . . . A . 15 LYS HA . . . . . . . . . c30057_5j6t 1 . 8 . 2326 . 1 1 15 LYS HB2 H 22.146 -0.813 1.161 . . . 1.0 . . . . . . . . . . . . A . 15 LYS HB2 . . . . . . . . . c30057_5j6t 1 . 8 . 2327 . 1 1 15 LYS HB3 H 23.717 -0.447 1.910 . . . 1.0 . . . . . . . . . . . . A . 15 LYS HB3 . . . . . . . . . c30057_5j6t 1 . 8 . 2328 . 1 1 15 LYS HD2 H 22.807 2.407 3.771 . . . 1.0 . . . . . . . . . . . . A . 15 LYS HD2 . . . . . . . . . c30057_5j6t 1 . 8 . 2329 . 1 1 15 LYS HD3 H 23.926 1.050 3.494 . . . 1.0 . . . . . . . . . . . . A . 15 LYS HD3 . . . . . . . . . c30057_5j6t 1 . 8 . 2330 . 1 1 15 LYS HE2 H 24.994 2.123 1.716 . . . 1.0 . . . . . . . . . . . . A . 15 LYS HE2 . . . . . . . . . c30057_5j6t 1 . 8 . 2331 . 1 1 15 LYS HE3 H 23.537 3.064 1.283 . . . 1.0 . . . . . . . . . . . . A . 15 LYS HE3 . . . . . . . . . c30057_5j6t 1 . 8 . 2332 . 1 1 15 LYS HG2 H 21.763 1.809 1.496 . . . 1.0 . . . . . . . . . . . . A . 15 LYS HG2 . . . . . . . . . c30057_5j6t 1 . 8 . 2333 . 1 1 15 LYS HG3 H 21.469 0.662 2.825 . . . 1.0 . . . . . . . . . . . . A . 15 LYS HG3 . . . . . . . . . c30057_5j6t 1 . 8 . 2334 . 1 1 15 LYS HZ1 H 25.173 4.431 2.436 . . . 1.0 . . . . . . . . . . . . A . 15 LYS HZ1 . . . . . . . . . c30057_5j6t 1 . 8 . 2335 . 1 1 15 LYS HZ2 H 25.138 3.428 3.744 . . . 1.0 . . . . . . . . . . . . A . 15 LYS HZ2 . . . . . . . . . c30057_5j6t 1 . 8 . 2336 . 1 1 15 LYS HZ3 H 23.797 4.295 3.335 . . . 1.0 . . . . . . . . . . . . A . 15 LYS HZ3 . . . . . . . . . c30057_5j6t 1 . 8 . 2337 . 1 1 15 LYS N N 22.229 1.213 -0.617 . . . 1.0 . . . . . . . . . . . . A . 15 LYS N . . . . . . . . . c30057_5j6t 1 . 8 . 2338 . 1 1 15 LYS NZ N 24.599 3.798 2.975 . . . 1.0 . . . . . . . . . . . . A . 15 LYS NZ . . . . . . . . . c30057_5j6t 1 . 8 . 2339 . 1 1 15 LYS O O 25.013 -1.019 -0.867 . . . 1.0 . . . . . . . . . . . . A . 15 LYS O . . . . . . . . . c30057_5j6t 1 . 8 . 2340 . 1 1 16 ASN C C 24.051 -1.723 -3.841 . . . 1.0 . . . . . . . . . . . . A . 16 ASN C . . . . . . . . . c30057_5j6t 1 . 8 . 2341 . 1 1 16 ASN CA C 23.376 -2.290 -2.590 . . . 1.0 . . . . . . . . . . . . A . 16 ASN CA . . . . . . . . . c30057_5j6t 1 . 8 . 2342 . 1 1 16 ASN CB C 22.067 -2.986 -2.958 . . . 1.0 . . . . . . . . . . . . A . 16 ASN CB . . . . . . . . . c30057_5j6t 1 . 8 . 2343 . 1 1 16 ASN CG C 21.492 -3.682 -1.724 . . . 1.0 . . . . . . . . . . . . A . 16 ASN CG . . . . . . . . . c30057_5j6t 1 . 8 . 2344 . 1 1 16 ASN H H 22.026 -0.838 -1.686 . . . 1.0 . . . . . . . . . . . . A . 16 ASN H . . . . . . . . . c30057_5j6t 1 . 8 . 2345 . 1 1 16 ASN HA H 24.044 -2.980 -2.075 . . . 1.0 . . . . . . . . . . . . A . 16 ASN HA . . . . . . . . . c30057_5j6t 1 . 8 . 2346 . 1 1 16 ASN HB2 H 21.353 -2.247 -3.323 . . . 1.0 . . . . . . . . . . . . A . 16 ASN HB2 . . . . . . . . . c30057_5j6t 1 . 8 . 2347 . 1 1 16 ASN HB3 H 22.255 -3.725 -3.737 . . . 1.0 . . . . . . . . . . . . A . 16 ASN HB3 . . . . . . . . . c30057_5j6t 1 . 8 . 2348 . 1 1 16 ASN HD21 H 20.670 -5.175 -2.791 . . . 1.0 . . . . . . . . . . . . A . 16 ASN HD21 . . . . . . . . . c30057_5j6t 1 . 8 . 2349 . 1 1 16 ASN HD22 H 20.429 -5.254 -1.060 . . . 1.0 . . . . . . . . . . . . A . 16 ASN HD22 . . . . . . . . . c30057_5j6t 1 . 8 . 2350 . 1 1 16 ASN N N 22.979 -1.174 -1.685 . . . 1.0 . . . . . . . . . . . . A . 16 ASN N . . . . . . . . . c30057_5j6t 1 . 8 . 2351 . 1 1 16 ASN ND2 N 20.813 -4.787 -1.869 . . . 1.0 . . . . . . . . . . . . A . 16 ASN ND2 . . . . . . . . . c30057_5j6t 1 . 8 . 2352 . 1 1 16 ASN O O 24.860 -2.375 -4.472 . . . 1.0 . . . . . . . . . . . . A . 16 ASN O . . . . . . . . . c30057_5j6t 1 . 8 . 2353 . 1 1 16 ASN OD1 O 21.663 -3.216 -0.613 . . . 1.0 . . . . . . . . . . . . A . 16 ASN OD1 . . . . . . . . . c30057_5j6t 1 . 8 . 2354 . 1 1 17 LEU C C 25.761 0.578 -5.092 . . . 1.0 . . . . . . . . . . . . A . 17 LEU C . . . . . . . . . c30057_5j6t 1 . 8 . 2355 . 1 1 17 LEU CA C 24.341 0.107 -5.408 . . . 1.0 . . . . . . . . . . . . A . 17 LEU CA . . . . . . . . . c30057_5j6t 1 . 8 . 2356 . 1 1 17 LEU CB C 23.442 1.296 -5.749 . . . 1.0 . . . . . . . . . . . . A . 17 LEU CB . . . . . . . . . c30057_5j6t 1 . 8 . 2357 . 1 1 17 LEU CD1 C 22.725 2.426 -7.859 . . . 1.0 . . . . . . . . . . . . A . 17 LEU CD1 . . . . . . . . . c30057_5j6t 1 . 8 . 2358 . 1 1 17 LEU CD2 C 24.816 3.152 -6.706 . . . 1.0 . . . . . . . . . . . . A . 17 LEU CD2 . . . . . . . . . c30057_5j6t 1 . 8 . 2359 . 1 1 17 LEU CG C 23.928 1.951 -7.043 . . . 1.0 . . . . . . . . . . . . A . 17 LEU CG . . . . . . . . . c30057_5j6t 1 . 8 . 2360 . 1 1 17 LEU H H 23.046 0.009 -3.659 . . . 1.0 . . . . . . . . . . . . A . 17 LEU H . . . . . . . . . c30057_5j6t 1 . 8 . 2361 . 1 1 17 LEU HA H 24.354 -0.605 -6.233 . . . 1.0 . . . . . . . . . . . . A . 17 LEU HA . . . . . . . . . c30057_5j6t 1 . 8 . 2362 . 1 1 17 LEU HB2 H 22.417 0.951 -5.880 . . . 1.0 . . . . . . . . . . . . A . 17 LEU HB2 . . . . . . . . . c30057_5j6t 1 . 8 . 2363 . 1 1 17 LEU HB3 H 23.479 2.024 -4.937 . . . 1.0 . . . . . . . . . . . . A . 17 LEU HB3 . . . . . . . . . c30057_5j6t 1 . 8 . 2364 . 1 1 17 LEU HD11 H 22.090 1.574 -8.101 . . . 1.0 . . . . . . . . . . . . A . 17 LEU HD11 . . . . . . . . . c30057_5j6t 1 . 8 . 2365 . 1 1 17 LEU HD12 H 23.073 2.893 -8.781 . . . 1.0 . . . . . . . . . . . . A . 17 LEU HD12 . . . . . . . . . c30057_5j6t 1 . 8 . 2366 . 1 1 17 LEU HD13 H 22.154 3.151 -7.278 . . . 1.0 . . . . . . . . . . . . A . 17 LEU HD13 . . . . . . . . . c30057_5j6t 1 . 8 . 2367 . 1 1 17 LEU HD21 H 25.675 2.817 -6.124 . . . 1.0 . . . . . . . . . . . . A . 17 LEU HD21 . . . . . . . . . c30057_5j6t 1 . 8 . 2368 . 1 1 17 LEU HD22 H 24.244 3.876 -6.125 . . . 1.0 . . . . . . . . . . . . A . 17 LEU HD22 . . . . . . . . . c30057_5j6t 1 . 8 . 2369 . 1 1 17 LEU HD23 H 25.162 3.618 -7.628 . . . 1.0 . . . . . . . . . . . . A . 17 LEU HD23 . . . . . . . . . c30057_5j6t 1 . 8 . 2370 . 1 1 17 LEU HG H 24.499 1.228 -7.624 . . . 1.0 . . . . . . . . . . . . A . 17 LEU HG . . . . . . . . . c30057_5j6t 1 . 8 . 2371 . 1 1 17 LEU N N 23.722 -0.511 -4.201 . . . 1.0 . . . . . . . . . . . . A . 17 LEU N . . . . . . . . . c30057_5j6t 1 . 8 . 2372 . 1 1 17 LEU O O 26.606 0.652 -5.961 . . . 1.0 . . . . . . . . . . . . A . 17 LEU O . . . . . . . . . c30057_5j6t 1 . 8 . 2373 . 1 1 18 ILE C C 28.347 0.169 -3.337 . . . 1.0 . . . . . . . . . . . . A . 18 ILE C . . . . . . . . . c30057_5j6t 1 . 8 . 2374 . 1 1 18 ILE CA C 27.400 1.365 -3.487 . . . 1.0 . . . . . . . . . . . . A . 18 ILE CA . . . . . . . . . c30057_5j6t 1 . 8 . 2375 . 1 1 18 ILE CB C 27.235 2.098 -2.155 . . . 1.0 . . . . . . . . . . . . A . 18 ILE CB . . . . . . . . . c30057_5j6t 1 . 8 . 2376 . 1 1 18 ILE CD1 C 27.002 1.658 0.295 . . . 1.0 . . . . . . . . . . . . A . 18 ILE CD1 . . . . . . . . . c30057_5j6t 1 . 8 . 2377 . 1 1 18 ILE CG1 C 26.647 1.152 -1.105 . . . 1.0 . . . . . . . . . . . . A . 18 ILE CG1 . . . . . . . . . c30057_5j6t 1 . 8 . 2378 . 1 1 18 ILE CG2 C 26.295 3.292 -2.341 . . . 1.0 . . . . . . . . . . . . A . 18 ILE CG2 . . . . . . . . . c30057_5j6t 1 . 8 . 2379 . 1 1 18 ILE H H 25.313 0.831 -3.145 . . . 1.0 . . . . . . . . . . . . A . 18 ILE H . . . . . . . . . c30057_5j6t 1 . 8 . 2380 . 1 1 18 ILE HA H 27.778 2.049 -4.247 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HA . . . . . . . . . c30057_5j6t 1 . 8 . 2381 . 1 1 18 ILE HB H 28.208 2.454 -1.816 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HB . . . . . . . . . c30057_5j6t 1 . 8 . 2382 . 1 1 18 ILE HD11 H 28.086 1.717 0.397 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HD11 . . . . . . . . . c30057_5j6t 1 . 8 . 2383 . 1 1 18 ILE HD12 H 26.604 0.971 1.042 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HD12 . . . . . . . . . c30057_5j6t 1 . 8 . 2384 . 1 1 18 ILE HD13 H 26.569 2.647 0.445 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HD13 . . . . . . . . . c30057_5j6t 1 . 8 . 2385 . 1 1 18 ILE HG12 H 25.563 1.117 -1.214 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HG12 . . . . . . . . . c30057_5j6t 1 . 8 . 2386 . 1 1 18 ILE HG13 H 27.059 0.153 -1.245 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HG13 . . . . . . . . . c30057_5j6t 1 . 8 . 2387 . 1 1 18 ILE HG21 H 26.710 3.968 -3.088 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HG21 . . . . . . . . . c30057_5j6t 1 . 8 . 2388 . 1 1 18 ILE HG22 H 26.186 3.819 -1.394 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HG22 . . . . . . . . . c30057_5j6t 1 . 8 . 2389 . 1 1 18 ILE HG23 H 25.320 2.937 -2.674 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HG23 . . . . . . . . . c30057_5j6t 1 . 8 . 2390 . 1 1 18 ILE N N 26.030 0.899 -3.853 . . . 1.0 . . . . . . . . . . . . A . 18 ILE N . . . . . . . . . c30057_5j6t 1 . 8 . 2391 . 1 1 18 ILE O O 29.551 0.305 -3.436 . . . 1.0 . . . . . . . . . . . . A . 18 ILE O . . . . . . . . . c30057_5j6t 1 . 8 . 2392 . 1 1 19 LYS C C 27.831 -3.476 -2.929 . . . 1.0 . . . . . . . . . . . . A . 19 LYS C . . . . . . . . . c30057_5j6t 1 . 8 . 2393 . 1 1 19 LYS CA C 28.684 -2.204 -2.948 . . . 1.0 . . . . . . . . . . . . A . 19 LYS CA . . . . . . . . . c30057_5j6t 1 . 8 . 2394 . 1 1 19 LYS CB C 29.396 -2.013 -1.605 . . . 1.0 . . . . . . . . . . . . A . 19 LYS CB . . . . . . . . . c30057_5j6t 1 . 8 . 2395 . 1 1 19 LYS CD C 31.062 -0.195 -1.170 . . . 1.0 . . . . . . . . . . . . A . 19 LYS CD . . . . . . . . . c30057_5j6t 1 . 8 . 2396 . 1 1 19 LYS CE C 32.047 0.632 -2.001 . . . 1.0 . . . . . . . . . . . . A . 19 LYS CE . . . . . . . . . c30057_5j6t 1 . 8 . 2397 . 1 1 19 LYS CG C 30.837 -1.550 -1.844 . . . 1.0 . . . . . . . . . . . . A . 19 LYS CG . . . . . . . . . c30057_5j6t 1 . 8 . 2398 . 1 1 19 LYS H H 26.811 -1.091 -3.023 . . . 1.0 . . . . . . . . . . . . A . 19 LYS H . . . . . . . . . c30057_5j6t 1 . 8 . 2399 . 1 1 19 LYS HA H 29.412 -2.250 -3.758 . . . 1.0 . . . . . . . . . . . . A . 19 LYS HA . . . . . . . . . c30057_5j6t 1 . 8 . 2400 . 1 1 19 LYS HB2 H 28.867 -1.261 -1.019 . . . 1.0 . . . . . . . . . . . . A . 19 LYS HB2 . . . . . . . . . c30057_5j6t 1 . 8 . 2401 . 1 1 19 LYS HB3 H 29.403 -2.957 -1.061 . . . 1.0 . . . . . . . . . . . . A . 19 LYS HB3 . . . . . . . . . c30057_5j6t 1 . 8 . 2402 . 1 1 19 LYS HD2 H 30.113 0.337 -1.096 . . . 1.0 . . . . . . . . . . . . A . 19 LYS HD2 . . . . . . . . . c30057_5j6t 1 . 8 . 2403 . 1 1 19 LYS HD3 H 31.470 -0.349 -0.171 . . . 1.0 . . . . . . . . . . . . A . 19 LYS HD3 . . . . . . . . . c30057_5j6t 1 . 8 . 2404 . 1 1 19 LYS HE2 H 33.064 0.273 -1.845 . . . 1.0 . . . . . . . . . . . . A . 19 LYS HE2 . . . . . . . . . c30057_5j6t 1 . 8 . 2405 . 1 1 19 LYS HE3 H 31.788 0.586 -3.059 . . . 1.0 . . . . . . . . . . . . A . 19 LYS HE3 . . . . . . . . . c30057_5j6t 1 . 8 . 2406 . 1 1 19 LYS HG2 H 31.527 -2.283 -1.425 . . . 1.0 . . . . . . . . . . . . A . 19 LYS HG2 . . . . . . . . . c30057_5j6t 1 . 8 . 2407 . 1 1 19 LYS HG3 H 31.014 -1.456 -2.915 . . . 1.0 . . . . . . . . . . . . A . 19 LYS HG3 . . . . . . . . . c30057_5j6t 1 . 8 . 2408 . 1 1 19 LYS HZ1 H 32.534 2.634 -1.993 . . . 1.0 . . . . . . . . . . . . A . 19 LYS HZ1 . . . . . . . . . c30057_5j6t 1 . 8 . 2409 . 1 1 19 LYS HZ2 H 32.139 2.044 -0.504 . . . 1.0 . . . . . . . . . . . . A . 19 LYS HZ2 . . . . . . . . . c30057_5j6t 1 . 8 . 2410 . 1 1 19 LYS HZ3 H 30.956 2.336 -1.616 . . . 1.0 . . . . . . . . . . . . A . 19 LYS HZ3 . . . . . . . . . c30057_5j6t 1 . 8 . 2411 . 1 1 19 LYS N N 27.814 -1.001 -3.101 . . . 1.0 . . . . . . . . . . . . A . 19 LYS N . . . . . . . . . c30057_5j6t 1 . 8 . 2412 . 1 1 19 LYS NZ N 31.908 2.023 -1.487 . . . 1.0 . . . . . . . . . . . . A . 19 LYS NZ . . . . . . . . . c30057_5j6t 1 . 8 . 2413 . 1 1 19 LYS O O 27.657 -4.097 -1.898 . . . 1.0 . . . . . . . . . . . . A . 19 LYS O . . . . . . . . . c30057_5j6t 1 . 8 . 2414 . 1 1 20 NH2 HN1 H 27.424 -3.376 -4.895 . . . 1.0 . . . . . . . . . . . . A . 20 NH2 HN1 . . . . . . . . . c30057_5j6t 1 . 8 . 2415 . 1 1 20 NH2 HN2 H 26.716 -4.728 -4.038 . . . 1.0 . . . . . . . . . . . . A . 20 NH2 HN2 . . . . . . . . . c30057_5j6t 1 . 8 . 2416 . 1 1 20 NH2 N N 27.282 -3.891 -4.038 . . . 1.0 . . . . . . . . . . . . A . 20 NH2 N . . . . . . . . . c30057_5j6t 1 . 9 . 2417 . 1 1 1 ACE C C 0.096 -1.221 3.561 . . . 1.0 . . . . . . . . . . . . A . 1 ACE C . . . . . . . . . c30057_5j6t 1 . 9 . 2418 . 1 1 1 ACE CH3 C -1.273 -0.547 3.457 . . . 1.0 . . . . . . . . . . . . A . 1 ACE CH3 . . . . . . . . . c30057_5j6t 1 . 9 . 2419 . 1 1 1 ACE H1 H -1.728 -0.492 4.447 . . . 1.0 . . . . . . . . . . . . A . 1 ACE H1 . . . . . . . . . c30057_5j6t 1 . 9 . 2420 . 1 1 1 ACE H2 H -1.153 0.460 3.057 . . . 1.0 . . . . . . . . . . . . A . 1 ACE H2 . . . . . . . . . c30057_5j6t 1 . 9 . 2421 . 1 1 1 ACE H3 H -1.915 -1.127 2.794 . . . 1.0 . . . . . . . . . . . . A . 1 ACE H3 . . . . . . . . . c30057_5j6t 1 . 9 . 2422 . 1 1 1 ACE O O 0.529 -1.606 4.630 . . . 1.0 . . . . . . . . . . . . A . 1 ACE O . . . . . . . . . c30057_5j6t 1 . 9 . 2423 . 1 1 2 ILE C C 3.214 -0.990 2.163 . . . 1.0 . . . . . . . . . . . . A . 2 ILE C . . . . . . . . . c30057_5j6t 1 . 9 . 2424 . 1 1 2 ILE CA C 2.123 -2.017 2.491 . . . 1.0 . . . . . . . . . . . . A . 2 ILE CA . . . . . . . . . c30057_5j6t 1 . 9 . 2425 . 1 1 2 ILE CB C 2.067 -3.105 1.416 . . . 1.0 . . . . . . . . . . . . A . 2 ILE CB . . . . . . . . . c30057_5j6t 1 . 9 . 2426 . 1 1 2 ILE CD1 C 0.540 -4.842 0.464 . . . 1.0 . . . . . . . . . . . . A . 2 ILE CD1 . . . . . . . . . c30057_5j6t 1 . 9 . 2427 . 1 1 2 ILE CG1 C 0.930 -4.082 1.733 . . . 1.0 . . . . . . . . . . . . A . 2 ILE CG1 . . . . . . . . . c30057_5j6t 1 . 9 . 2428 . 1 1 2 ILE CG2 C 3.393 -3.868 1.389 . . . 1.0 . . . . . . . . . . . . A . 2 ILE CG2 . . . . . . . . . c30057_5j6t 1 . 9 . 2429 . 1 1 2 ILE H H 0.401 -1.040 1.582 . . . 1.0 . . . . . . . . . . . . A . 2 ILE H . . . . . . . . . c30057_5j6t 1 . 9 . 2430 . 1 1 2 ILE HA H 2.305 -2.461 3.470 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HA . . . . . . . . . c30057_5j6t 1 . 9 . 2431 . 1 1 2 ILE HB H 1.891 -2.646 0.443 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HB . . . . . . . . . c30057_5j6t 1 . 9 . 2432 . 1 1 2 ILE HD11 H -0.269 -5.537 0.690 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HD11 . . . . . . . . . c30057_5j6t 1 . 9 . 2433 . 1 1 2 ILE HD12 H 0.209 -4.134 -0.296 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HD12 . . . . . . . . . c30057_5j6t 1 . 9 . 2434 . 1 1 2 ILE HD13 H 1.402 -5.396 0.093 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HD13 . . . . . . . . . c30057_5j6t 1 . 9 . 2435 . 1 1 2 ILE HG12 H 1.260 -4.789 2.493 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HG12 . . . . . . . . . c30057_5j6t 1 . 9 . 2436 . 1 1 2 ILE HG13 H 0.068 -3.527 2.103 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HG13 . . . . . . . . . c30057_5j6t 1 . 9 . 2437 . 1 1 2 ILE HG21 H 3.199 -4.930 1.237 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HG21 . . . . . . . . . c30057_5j6t 1 . 9 . 2438 . 1 1 2 ILE HG22 H 3.913 -3.726 2.336 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HG22 . . . . . . . . . c30057_5j6t 1 . 9 . 2439 . 1 1 2 ILE HG23 H 4.012 -3.492 0.574 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HG23 . . . . . . . . . c30057_5j6t 1 . 9 . 2440 . 1 1 2 ILE N N 0.781 -1.367 2.459 . . . 1.0 . . . . . . . . . . . . A . 2 ILE N . . . . . . . . . c30057_5j6t 1 . 9 . 2441 . 1 1 2 ILE O O 4.312 -1.342 1.774 . . . 1.0 . . . . . . . . . . . . A . 2 ILE O . . . . . . . . . c30057_5j6t 1 . 9 . 2442 . 1 1 3 PHE C C 5.125 1.191 2.986 . . . 1.0 . . . . . . . . . . . . A . 3 PHE C . . . . . . . . . c30057_5j6t 1 . 9 . 2443 . 1 1 3 PHE CA C 3.948 1.317 2.017 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CA . . . . . . . . . c30057_5j6t 1 . 9 . 2444 . 1 1 3 PHE CB C 3.232 2.653 2.216 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CB . . . . . . . . . c30057_5j6t 1 . 9 . 2445 . 1 1 3 PHE CD1 C 4.598 3.852 0.474 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CD1 . . . . . . . . . c30057_5j6t 1 . 9 . 2446 . 1 1 3 PHE CD2 C 4.545 4.740 2.730 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CD2 . . . . . . . . . c30057_5j6t 1 . 9 . 2447 . 1 1 3 PHE CE1 C 5.448 4.894 0.083 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CE1 . . . . . . . . . c30057_5j6t 1 . 9 . 2448 . 1 1 3 PHE CE2 C 5.395 5.782 2.338 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CE2 . . . . . . . . . c30057_5j6t 1 . 9 . 2449 . 1 1 3 PHE CG C 4.147 3.775 1.797 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CG . . . . . . . . . c30057_5j6t 1 . 9 . 2450 . 1 1 3 PHE CZ C 5.846 5.860 1.016 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CZ . . . . . . . . . c30057_5j6t 1 . 9 . 2451 . 1 1 3 PHE H H 2.007 0.544 2.644 . . . 1.0 . . . . . . . . . . . . A . 3 PHE H . . . . . . . . . c30057_5j6t 1 . 9 . 2452 . 1 1 3 PHE HA H 4.293 1.222 0.988 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HA . . . . . . . . . c30057_5j6t 1 . 9 . 2453 . 1 1 3 PHE HB2 H 2.327 2.675 1.610 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HB2 . . . . . . . . . c30057_5j6t 1 . 9 . 2454 . 1 1 3 PHE HB3 H 2.969 2.771 3.268 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HB3 . . . . . . . . . c30057_5j6t 1 . 9 . 2455 . 1 1 3 PHE HD1 H 4.291 3.108 -0.245 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HD1 . . . . . . . . . c30057_5j6t 1 . 9 . 2456 . 1 1 3 PHE HD2 H 4.197 4.681 3.750 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HD2 . . . . . . . . . c30057_5j6t 1 . 9 . 2457 . 1 1 3 PHE HE1 H 5.796 4.953 -0.938 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HE1 . . . . . . . . . c30057_5j6t 1 . 9 . 2458 . 1 1 3 PHE HE2 H 5.703 6.527 3.058 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HE2 . . . . . . . . . c30057_5j6t 1 . 9 . 2459 . 1 1 3 PHE HZ H 6.501 6.664 0.715 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HZ . . . . . . . . . c30057_5j6t 1 . 9 . 2460 . 1 1 3 PHE N N 2.924 0.273 2.319 . . . 1.0 . . . . . . . . . . . . A . 3 PHE N . . . . . . . . . c30057_5j6t 1 . 9 . 2461 . 1 1 3 PHE O O 6.267 1.398 2.622 . . . 1.0 . . . . . . . . . . . . A . 3 PHE O . . . . . . . . . c30057_5j6t 1 . 9 . 2462 . 1 1 4 GLY C C 6.909 -0.405 4.772 . . . 1.0 . . . . . . . . . . . . A . 4 GLY C . . . . . . . . . c30057_5j6t 1 . 9 . 2463 . 1 1 4 GLY CA C 5.954 0.707 5.215 . . . 1.0 . . . . . . . . . . . . A . 4 GLY CA . . . . . . . . . c30057_5j6t 1 . 9 . 2464 . 1 1 4 GLY H H 3.898 0.684 4.497 . . . 1.0 . . . . . . . . . . . . A . 4 GLY H . . . . . . . . . c30057_5j6t 1 . 9 . 2465 . 1 1 4 GLY HA2 H 6.502 1.647 5.289 . . . 1.0 . . . . . . . . . . . . A . 4 GLY HA2 . . . . . . . . . c30057_5j6t 1 . 9 . 2466 . 1 1 4 GLY HA3 H 5.532 0.456 6.188 . . . 1.0 . . . . . . . . . . . . A . 4 GLY HA3 . . . . . . . . . c30057_5j6t 1 . 9 . 2467 . 1 1 4 GLY N N 4.854 0.851 4.219 . . . 1.0 . . . . . . . . . . . . A . 4 GLY N . . . . . . . . . c30057_5j6t 1 . 9 . 2468 . 1 1 4 GLY O O 8.031 -0.488 5.232 . . . 1.0 . . . . . . . . . . . . A . 4 GLY O . . . . . . . . . c30057_5j6t 1 . 9 . 2469 . 1 1 5 ALA C C 8.166 -1.918 2.188 . . . 1.0 . . . . . . . . . . . . A . 5 ALA C . . . . . . . . . c30057_5j6t 1 . 9 . 2470 . 1 1 5 ALA CA C 7.359 -2.367 3.412 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CA . . . . . . . . . c30057_5j6t 1 . 9 . 2471 . 1 1 5 ALA CB C 6.408 -3.505 3.040 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CB . . . . . . . . . c30057_5j6t 1 . 9 . 2472 . 1 1 5 ALA H H 5.538 -1.172 3.515 . . . 1.0 . . . . . . . . . . . . A . 5 ALA H . . . . . . . . . c30057_5j6t 1 . 9 . 2473 . 1 1 5 ALA HA H 8.030 -2.681 4.212 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HA . . . . . . . . . c30057_5j6t 1 . 9 . 2474 . 1 1 5 ALA HB1 H 6.811 -4.450 3.405 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB1 . . . . . . . . . c30057_5j6t 1 . 9 . 2475 . 1 1 5 ALA HB2 H 6.302 -3.550 1.956 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB2 . . . . . . . . . c30057_5j6t 1 . 9 . 2476 . 1 1 5 ALA HB3 H 5.433 -3.327 3.493 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB3 . . . . . . . . . c30057_5j6t 1 . 9 . 2477 . 1 1 5 ALA N N 6.474 -1.260 3.883 . . . 1.0 . . . . . . . . . . . . A . 5 ALA N . . . . . . . . . c30057_5j6t 1 . 9 . 2478 . 1 1 5 ALA O O 9.197 -2.480 1.874 . . . 1.0 . . . . . . . . . . . . A . 5 ALA O . . . . . . . . . c30057_5j6t 1 . 9 . 2479 . 1 1 6 ILE C C 9.565 0.530 0.707 . . . 1.0 . . . . . . . . . . . . A . 6 ILE C . . . . . . . . . c30057_5j6t 1 . 9 . 2480 . 1 1 6 ILE CA C 8.444 -0.426 0.295 . . . 1.0 . . . . . . . . . . . . A . 6 ILE CA . . . . . . . . . c30057_5j6t 1 . 9 . 2481 . 1 1 6 ILE CB C 7.399 0.306 -0.550 . . . 1.0 . . . . . . . . . . . . A . 6 ILE CB . . . . . . . . . c30057_5j6t 1 . 9 . 2482 . 1 1 6 ILE CD1 C 5.113 0.123 -1.546 . . . 1.0 . . . . . . . . . . . . A . 6 ILE CD1 . . . . . . . . . c30057_5j6t 1 . 9 . 2483 . 1 1 6 ILE CG1 C 6.267 -0.659 -0.915 . . . 1.0 . . . . . . . . . . . . A . 6 ILE CG1 . . . . . . . . . c30057_5j6t 1 . 9 . 2484 . 1 1 6 ILE CG2 C 8.050 0.830 -1.832 . . . 1.0 . . . . . . . . . . . . A . 6 ILE CG2 . . . . . . . . . c30057_5j6t 1 . 9 . 2485 . 1 1 6 ILE H H 6.845 -0.456 1.775 . . . 1.0 . . . . . . . . . . . . A . 6 ILE H . . . . . . . . . c30057_5j6t 1 . 9 . 2486 . 1 1 6 ILE HA H 8.854 -1.270 -0.260 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HA . . . . . . . . . c30057_5j6t 1 . 9 . 2487 . 1 1 6 ILE HB H 6.993 1.143 0.019 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HB . . . . . . . . . c30057_5j6t 1 . 9 . 2488 . 1 1 6 ILE HD11 H 4.307 -0.564 -1.805 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HD11 . . . . . . . . . c30057_5j6t 1 . 9 . 2489 . 1 1 6 ILE HD12 H 4.744 0.862 -0.835 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HD12 . . . . . . . . . c30057_5j6t 1 . 9 . 2490 . 1 1 6 ILE HD13 H 5.465 0.627 -2.445 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HD13 . . . . . . . . . c30057_5j6t 1 . 9 . 2491 . 1 1 6 ILE HG12 H 6.636 -1.399 -1.626 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HG12 . . . . . . . . . c30057_5j6t 1 . 9 . 2492 . 1 1 6 ILE HG13 H 5.915 -1.164 -0.015 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HG13 . . . . . . . . . c30057_5j6t 1 . 9 . 2493 . 1 1 6 ILE HG21 H 8.856 1.518 -1.575 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HG21 . . . . . . . . . c30057_5j6t 1 . 9 . 2494 . 1 1 6 ILE HG22 H 7.304 1.353 -2.431 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HG22 . . . . . . . . . c30057_5j6t 1 . 9 . 2495 . 1 1 6 ILE HG23 H 8.454 -0.006 -2.402 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HG23 . . . . . . . . . c30057_5j6t 1 . 9 . 2496 . 1 1 6 ILE N N 7.704 -0.909 1.496 . . . 1.0 . . . . . . . . . . . . A . 6 ILE N . . . . . . . . . c30057_5j6t 1 . 9 . 2497 . 1 1 6 ILE O O 10.581 0.632 0.047 . . . 1.0 . . . . . . . . . . . . A . 6 ILE O . . . . . . . . . c30057_5j6t 1 . 9 . 2498 . 1 1 7 TRP C C 11.725 1.423 2.617 . . . 1.0 . . . . . . . . . . . . A . 7 TRP C . . . . . . . . . c30057_5j6t 1 . 9 . 2499 . 1 1 7 TRP CA C 10.448 2.187 2.242 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CA . . . . . . . . . c30057_5j6t 1 . 9 . 2500 . 1 1 7 TRP CB C 9.863 2.908 3.460 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CB . . . . . . . . . c30057_5j6t 1 . 9 . 2501 . 1 1 7 TRP CD1 C 8.789 5.177 3.166 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CD1 . . . . . . . . . c30057_5j6t 1 . 9 . 2502 . 1 1 7 TRP CD2 C 11.030 5.251 2.991 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CD2 . . . . . . . . . c30057_5j6t 1 . 9 . 2503 . 1 1 7 TRP CE2 C 10.565 6.574 2.809 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CE2 . . . . . . . . . c30057_5j6t 1 . 9 . 2504 . 1 1 7 TRP CE3 C 12.415 5.019 2.929 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CE3 . . . . . . . . . c30057_5j6t 1 . 9 . 2505 . 1 1 7 TRP CG C 9.882 4.382 3.218 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CG . . . . . . . . . c30057_5j6t 1 . 9 . 2506 . 1 1 7 TRP CH2 C 12.819 7.384 2.512 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CH2 . . . . . . . . . c30057_5j6t 1 . 9 . 2507 . 1 1 7 TRP CZ2 C 11.444 7.631 2.572 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CZ2 . . . . . . . . . c30057_5j6t 1 . 9 . 2508 . 1 1 7 TRP CZ3 C 13.303 6.079 2.691 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CZ3 . . . . . . . . . c30057_5j6t 1 . 9 . 2509 . 1 1 7 TRP H H 8.538 1.138 2.326 . . . 1.0 . . . . . . . . . . . . A . 7 TRP H . . . . . . . . . c30057_5j6t 1 . 9 . 2510 . 1 1 7 TRP HA H 10.663 2.906 1.452 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HA . . . . . . . . . c30057_5j6t 1 . 9 . 2511 . 1 1 7 TRP HB2 H 8.837 2.579 3.620 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HB2 . . . . . . . . . c30057_5j6t 1 . 9 . 2512 . 1 1 7 TRP HB3 H 10.461 2.677 4.342 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HB3 . . . . . . . . . c30057_5j6t 1 . 9 . 2513 . 1 1 7 TRP HD1 H 7.767 4.849 3.293 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HD1 . . . . . . . . . c30057_5j6t 1 . 9 . 2514 . 1 1 7 TRP HE1 H 8.560 7.261 2.841 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HE1 . . . . . . . . . c30057_5j6t 1 . 9 . 2515 . 1 1 7 TRP HE3 H 12.799 4.019 3.066 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HE3 . . . . . . . . . c30057_5j6t 1 . 9 . 2516 . 1 1 7 TRP HH2 H 13.507 8.196 2.328 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HH2 . . . . . . . . . c30057_5j6t 1 . 9 . 2517 . 1 1 7 TRP HZ2 H 11.066 8.633 2.435 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HZ2 . . . . . . . . . c30057_5j6t 1 . 9 . 2518 . 1 1 7 TRP HZ3 H 14.366 5.890 2.646 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HZ3 . . . . . . . . . c30057_5j6t 1 . 9 . 2519 . 1 1 7 TRP N N 9.389 1.236 1.792 . . . 1.0 . . . . . . . . . . . . A . 7 TRP N . . . . . . . . . c30057_5j6t 1 . 9 . 2520 . 1 1 7 TRP NE1 N 9.192 6.478 2.924 . . . 1.0 . . . . . . . . . . . . A . 7 TRP NE1 . . . . . . . . . c30057_5j6t 1 . 9 . 2521 . 1 1 7 TRP O O 12.790 1.733 2.124 . . . 1.0 . . . . . . . . . . . . A . 7 TRP O . . . . . . . . . c30057_5j6t 1 . 9 . 2522 . 1 1 8 PRO C C 13.503 -0.892 2.656 . . . 1.0 . . . . . . . . . . . . A . 8 PRO C . . . . . . . . . c30057_5j6t 1 . 9 . 2523 . 1 1 8 PRO CA C 12.757 -0.370 3.889 . . . 1.0 . . . . . . . . . . . . A . 8 PRO CA . . . . . . . . . c30057_5j6t 1 . 9 . 2524 . 1 1 8 PRO CB C 12.154 -1.526 4.683 . . . 1.0 . . . . . . . . . . . . A . 8 PRO CB . . . . . . . . . c30057_5j6t 1 . 9 . 2525 . 1 1 8 PRO CD C 10.346 -0.014 4.119 . . . 1.0 . . . . . . . . . . . . A . 8 PRO CD . . . . . . . . . c30057_5j6t 1 . 9 . 2526 . 1 1 8 PRO CG C 10.800 -1.056 5.109 . . . 1.0 . . . . . . . . . . . . A . 8 PRO CG . . . . . . . . . c30057_5j6t 1 . 9 . 2527 . 1 1 8 PRO HA H 13.423 0.220 4.518 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HA . . . . . . . . . c30057_5j6t 1 . 9 . 2528 . 1 1 8 PRO HB2 H 12.069 -2.415 4.057 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HB2 . . . . . . . . . c30057_5j6t 1 . 9 . 2529 . 1 1 8 PRO HB3 H 12.769 -1.740 5.557 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HB3 . . . . . . . . . c30057_5j6t 1 . 9 . 2530 . 1 1 8 PRO HD2 H 9.674 -0.457 3.385 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HD2 . . . . . . . . . c30057_5j6t 1 . 9 . 2531 . 1 1 8 PRO HD3 H 9.855 0.815 4.629 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HD3 . . . . . . . . . c30057_5j6t 1 . 9 . 2532 . 1 1 8 PRO HG2 H 10.102 -1.893 5.109 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HG2 . . . . . . . . . c30057_5j6t 1 . 9 . 2533 . 1 1 8 PRO HG3 H 10.855 -0.621 6.107 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HG3 . . . . . . . . . c30057_5j6t 1 . 9 . 2534 . 1 1 8 PRO N N 11.582 0.436 3.471 . . . 1.0 . . . . . . . . . . . . A . 8 PRO N . . . . . . . . . c30057_5j6t 1 . 9 . 2535 . 1 1 8 PRO O O 14.709 -1.048 2.667 . . . 1.0 . . . . . . . . . . . . A . 8 PRO O . . . . . . . . . c30057_5j6t 1 . 9 . 2536 . 1 1 9 LEU C C 14.110 -0.496 -0.400 . . . 1.0 . . . . . . . . . . . . A . 9 LEU C . . . . . . . . . c30057_5j6t 1 . 9 . 2537 . 1 1 9 LEU CA C 13.453 -1.657 0.355 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CA . . . . . . . . . c30057_5j6t 1 . 9 . 2538 . 1 1 9 LEU CB C 12.325 -2.268 -0.478 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CB . . . . . . . . . c30057_5j6t 1 . 9 . 2539 . 1 1 9 LEU CD1 C 11.634 -4.367 -1.644 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CD1 . . . . . . . . . c30057_5j6t 1 . 9 . 2540 . 1 1 9 LEU CD2 C 13.699 -3.161 -2.364 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CD2 . . . . . . . . . c30057_5j6t 1 . 9 . 2541 . 1 1 9 LEU CG C 12.827 -3.540 -1.164 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CG . . . . . . . . . c30057_5j6t 1 . 9 . 2542 . 1 1 9 LEU H H 11.792 -1.014 1.609 . . . 1.0 . . . . . . . . . . . . A . 9 LEU H . . . . . . . . . c30057_5j6t 1 . 9 . 2543 . 1 1 9 LEU HA H 14.195 -2.415 0.603 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HA . . . . . . . . . c30057_5j6t 1 . 9 . 2544 . 1 1 9 LEU HB2 H 11.486 -2.514 0.173 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HB2 . . . . . . . . . c30057_5j6t 1 . 9 . 2545 . 1 1 9 LEU HB3 H 12.001 -1.552 -1.233 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HB3 . . . . . . . . . c30057_5j6t 1 . 9 . 2546 . 1 1 9 LEU HD11 H 11.012 -4.638 -0.791 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD11 . . . . . . . . . c30057_5j6t 1 . 9 . 2547 . 1 1 9 LEU HD12 H 11.993 -5.272 -2.134 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD12 . . . . . . . . . c30057_5j6t 1 . 9 . 2548 . 1 1 9 LEU HD13 H 11.046 -3.781 -2.351 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD13 . . . . . . . . . c30057_5j6t 1 . 9 . 2549 . 1 1 9 LEU HD21 H 14.550 -2.571 -2.023 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD21 . . . . . . . . . c30057_5j6t 1 . 9 . 2550 . 1 1 9 LEU HD22 H 13.111 -2.574 -3.070 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD22 . . . . . . . . . c30057_5j6t 1 . 9 . 2551 . 1 1 9 LEU HD23 H 14.058 -4.066 -2.854 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD23 . . . . . . . . . c30057_5j6t 1 . 9 . 2552 . 1 1 9 LEU HG H 13.415 -4.126 -0.458 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HG . . . . . . . . . c30057_5j6t 1 . 9 . 2553 . 1 1 9 LEU N N 12.793 -1.153 1.593 . . . 1.0 . . . . . . . . . . . . A . 9 LEU N . . . . . . . . . c30057_5j6t 1 . 9 . 2554 . 1 1 9 LEU O O 15.032 -0.685 -1.168 . . . 1.0 . . . . . . . . . . . . A . 9 LEU O . . . . . . . . . c30057_5j6t 1 . 9 . 2555 . 1 1 10 ALA C C 15.625 2.182 -0.330 . . . 1.0 . . . . . . . . . . . . A . 10 ALA C . . . . . . . . . c30057_5j6t 1 . 9 . 2556 . 1 1 10 ALA CA C 14.233 1.881 -0.889 . . . 1.0 . . . . . . . . . . . . A . 10 ALA CA . . . . . . . . . c30057_5j6t 1 . 9 . 2557 . 1 1 10 ALA CB C 13.279 3.042 -0.603 . . . 1.0 . . . . . . . . . . . . A . 10 ALA CB . . . . . . . . . c30057_5j6t 1 . 9 . 2558 . 1 1 10 ALA H H 12.870 0.838 0.455 . . . 1.0 . . . . . . . . . . . . A . 10 ALA H . . . . . . . . . c30057_5j6t 1 . 9 . 2559 . 1 1 10 ALA HA H 14.289 1.692 -1.961 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HA . . . . . . . . . c30057_5j6t 1 . 9 . 2560 . 1 1 10 ALA HB1 H 13.649 3.945 -1.088 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HB1 . . . . . . . . . c30057_5j6t 1 . 9 . 2561 . 1 1 10 ALA HB2 H 12.288 2.803 -0.990 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HB2 . . . . . . . . . c30057_5j6t 1 . 9 . 2562 . 1 1 10 ALA HB3 H 13.218 3.206 0.473 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HB3 . . . . . . . . . c30057_5j6t 1 . 9 . 2563 . 1 1 10 ALA N N 13.638 0.705 -0.187 . . . 1.0 . . . . . . . . . . . . A . 10 ALA N . . . . . . . . . c30057_5j6t 1 . 9 . 2564 . 1 1 10 ALA O O 16.489 2.685 -1.022 . . . 1.0 . . . . . . . . . . . . A . 10 ALA O . . . . . . . . . c30057_5j6t 1 . 9 . 2565 . 1 1 11 LEU C C 18.160 1.019 1.182 . . . 1.0 . . . . . . . . . . . . A . 11 LEU C . . . . . . . . . c30057_5j6t 1 . 9 . 2566 . 1 1 11 LEU CA C 17.183 2.145 1.530 . . . 1.0 . . . . . . . . . . . . A . 11 LEU CA . . . . . . . . . c30057_5j6t 1 . 9 . 2567 . 1 1 11 LEU CB C 16.930 2.188 3.037 . . . 1.0 . . . . . . . . . . . . A . 11 LEU CB . . . . . . . . . c30057_5j6t 1 . 9 . 2568 . 1 1 11 LEU CD1 C 15.778 3.440 4.868 . . . 1.0 . . . . . . . . . . . . A . 11 LEU CD1 . . . . . . . . . c30057_5j6t 1 . 9 . 2569 . 1 1 11 LEU CD2 C 17.090 4.679 3.140 . . . 1.0 . . . . . . . . . . . . A . 11 LEU CD2 . . . . . . . . . c30057_5j6t 1 . 9 . 2570 . 1 1 11 LEU CG C 16.179 3.473 3.391 . . . 1.0 . . . . . . . . . . . . A . 11 LEU CG . . . . . . . . . c30057_5j6t 1 . 9 . 2571 . 1 1 11 LEU H H 15.115 1.459 1.475 . . . 1.0 . . . . . . . . . . . . A . 11 LEU H . . . . . . . . . c30057_5j6t 1 . 9 . 2572 . 1 1 11 LEU HA H 17.572 3.103 1.185 . . . 1.0 . . . . . . . . . . . . A . 11 LEU HA . . . . . . . . . c30057_5j6t 1 . 9 . 2573 . 1 1 11 LEU HB2 H 16.331 1.325 3.329 . . . 1.0 . . . . . . . . . . . . A . 11 LEU HB2 . . . . . . . . . c30057_5j6t 1 . 9 . 2574 . 1 1 11 LEU HB3 H 17.882 2.166 3.567 . . . 1.0 . . . . . . . . . . . . A . 11 LEU HB3 . . . . . . . . . c30057_5j6t 1 . 9 . 2575 . 1 1 11 LEU HD11 H 15.130 2.582 5.050 . . . 1.0 . . . . . . . . . . . . A . 11 LEU HD11 . . . . . . . . . c30057_5j6t 1 . 9 . 2576 . 1 1 11 LEU HD12 H 16.672 3.356 5.485 . . . 1.0 . . . . . . . . . . . . A . 11 LEU HD12 . . . . . . . . . c30057_5j6t 1 . 9 . 2577 . 1 1 11 LEU HD13 H 15.246 4.357 5.121 . . . 1.0 . . . . . . . . . . . . A . 11 LEU HD13 . . . . . . . . . c30057_5j6t 1 . 9 . 2578 . 1 1 11 LEU HD21 H 17.377 4.706 2.089 . . . 1.0 . . . . . . . . . . . . A . 11 LEU HD21 . . . . . . . . . c30057_5j6t 1 . 9 . 2579 . 1 1 11 LEU HD22 H 16.557 5.595 3.394 . . . 1.0 . . . . . . . . . . . . A . 11 LEU HD22 . . . . . . . . . c30057_5j6t 1 . 9 . 2580 . 1 1 11 LEU HD23 H 17.983 4.595 3.760 . . . 1.0 . . . . . . . . . . . . A . 11 LEU HD23 . . . . . . . . . c30057_5j6t 1 . 9 . 2581 . 1 1 11 LEU HG H 15.286 3.556 2.772 . . . 1.0 . . . . . . . . . . . . A . 11 LEU HG . . . . . . . . . c30057_5j6t 1 . 9 . 2582 . 1 1 11 LEU N N 15.848 1.878 0.920 . . . 1.0 . . . . . . . . . . . . A . 11 LEU N . . . . . . . . . c30057_5j6t 1 . 9 . 2583 . 1 1 11 LEU O O 19.357 1.221 1.116 . . . 1.0 . . . . . . . . . . . . A . 11 LEU O . . . . . . . . . c30057_5j6t 1 . 9 . 2584 . 1 1 12 GLY C C 18.970 -1.199 -0.857 . . . 1.0 . . . . . . . . . . . . A . 12 GLY C . . . . . . . . . c30057_5j6t 1 . 9 . 2585 . 1 1 12 GLY CA C 18.553 -1.305 0.611 . . . 1.0 . . . . . . . . . . . . A . 12 GLY CA . . . . . . . . . c30057_5j6t 1 . 9 . 2586 . 1 1 12 GLY H H 16.659 -0.309 1.017 . . . 1.0 . . . . . . . . . . . . A . 12 GLY H . . . . . . . . . c30057_5j6t 1 . 9 . 2587 . 1 1 12 GLY HA2 H 19.440 -1.274 1.243 . . . 1.0 . . . . . . . . . . . . A . 12 GLY HA2 . . . . . . . . . c30057_5j6t 1 . 9 . 2588 . 1 1 12 GLY HA3 H 18.025 -2.245 0.772 . . . 1.0 . . . . . . . . . . . . A . 12 GLY HA3 . . . . . . . . . c30057_5j6t 1 . 9 . 2589 . 1 1 12 GLY N N 17.657 -0.166 0.957 . . . 1.0 . . . . . . . . . . . . A . 12 GLY N . . . . . . . . . c30057_5j6t 1 . 9 . 2590 . 1 1 12 GLY O O 20.073 -1.549 -1.225 . . . 1.0 . . . . . . . . . . . . A . 12 GLY O . . . . . . . . . c30057_5j6t 1 . 9 . 2591 . 1 1 13 ALA C C 19.575 0.419 -3.326 . . . 1.0 . . . . . . . . . . . . A . 13 ALA C . . . . . . . . . c30057_5j6t 1 . 9 . 2592 . 1 1 13 ALA CA C 18.435 -0.587 -3.143 . . . 1.0 . . . . . . . . . . . . A . 13 ALA CA . . . . . . . . . c30057_5j6t 1 . 9 . 2593 . 1 1 13 ALA CB C 17.158 -0.079 -3.813 . . . 1.0 . . . . . . . . . . . . A . 13 ALA CB . . . . . . . . . c30057_5j6t 1 . 9 . 2594 . 1 1 13 ALA H H 17.181 -0.434 -1.367 . . . 1.0 . . . . . . . . . . . . A . 13 ALA H . . . . . . . . . c30057_5j6t 1 . 9 . 2595 . 1 1 13 ALA HA H 18.718 -1.556 -3.554 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HA . . . . . . . . . c30057_5j6t 1 . 9 . 2596 . 1 1 13 ALA HB1 H 17.332 0.042 -4.883 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HB1 . . . . . . . . . c30057_5j6t 1 . 9 . 2597 . 1 1 13 ALA HB2 H 16.355 -0.799 -3.655 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HB2 . . . . . . . . . c30057_5j6t 1 . 9 . 2598 . 1 1 13 ALA HB3 H 16.877 0.881 -3.380 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HB3 . . . . . . . . . c30057_5j6t 1 . 9 . 2599 . 1 1 13 ALA N N 18.093 -0.718 -1.697 . . . 1.0 . . . . . . . . . . . . A . 13 ALA N . . . . . . . . . c30057_5j6t 1 . 9 . 2600 . 1 1 13 ALA O O 20.317 0.360 -4.287 . . . 1.0 . . . . . . . . . . . . A . 13 ALA O . . . . . . . . . c30057_5j6t 1 . 9 . 2601 . 1 1 14 LEU C C 22.110 1.785 -1.941 . . . 1.0 . . . . . . . . . . . . A . 14 LEU C . . . . . . . . . c30057_5j6t 1 . 9 . 2602 . 1 1 14 LEU CA C 20.814 2.346 -2.529 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CA . . . . . . . . . c30057_5j6t 1 . 9 . 2603 . 1 1 14 LEU CB C 20.335 3.548 -1.712 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CB . . . . . . . . . c30057_5j6t 1 . 9 . 2604 . 1 1 14 LEU CD1 C 21.648 5.152 -3.109 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CD1 . . . . . . . . . c30057_5j6t 1 . 9 . 2605 . 1 1 14 LEU CD2 C 20.984 5.775 -0.783 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CD2 . . . . . . . . . c30057_5j6t 1 . 9 . 2606 . 1 1 14 LEU CG C 21.423 4.624 -1.692 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CG . . . . . . . . . c30057_5j6t 1 . 9 . 2607 . 1 1 14 LEU H H 19.092 1.367 -1.621 . . . 1.0 . . . . . . . . . . . . A . 14 LEU H . . . . . . . . . c30057_5j6t 1 . 9 . 2608 . 1 1 14 LEU HA H 20.960 2.628 -3.572 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HA . . . . . . . . . c30057_5j6t 1 . 9 . 2609 . 1 1 14 LEU HB2 H 19.430 3.955 -2.163 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HB2 . . . . . . . . . c30057_5j6t 1 . 9 . 2610 . 1 1 14 LEU HB3 H 20.121 3.230 -0.691 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HB3 . . . . . . . . . c30057_5j6t 1 . 9 . 2611 . 1 1 14 LEU HD11 H 21.960 4.333 -3.757 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD11 . . . . . . . . . c30057_5j6t 1 . 9 . 2612 . 1 1 14 LEU HD12 H 22.423 5.918 -3.093 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD12 . . . . . . . . . c30057_5j6t 1 . 9 . 2613 . 1 1 14 LEU HD13 H 20.721 5.582 -3.489 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD13 . . . . . . . . . c30057_5j6t 1 . 9 . 2614 . 1 1 14 LEU HD21 H 20.823 5.400 0.227 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD21 . . . . . . . . . c30057_5j6t 1 . 9 . 2615 . 1 1 14 LEU HD22 H 21.759 6.541 -0.767 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD22 . . . . . . . . . c30057_5j6t 1 . 9 . 2616 . 1 1 14 LEU HD23 H 20.057 6.205 -1.163 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD23 . . . . . . . . . c30057_5j6t 1 . 9 . 2617 . 1 1 14 LEU HG H 22.350 4.196 -1.313 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HG . . . . . . . . . c30057_5j6t 1 . 9 . 2618 . 1 1 14 LEU N N 19.721 1.338 -2.411 . . . 1.0 . . . . . . . . . . . . A . 14 LEU N . . . . . . . . . c30057_5j6t 1 . 9 . 2619 . 1 1 14 LEU O O 23.168 1.887 -2.531 . . . 1.0 . . . . . . . . . . . . A . 14 LEU O . . . . . . . . . c30057_5j6t 1 . 9 . 2620 . 1 1 15 LYS C C 23.807 -0.516 -0.994 . . . 1.0 . . . . . . . . . . . . A . 15 LYS C . . . . . . . . . c30057_5j6t 1 . 9 . 2621 . 1 1 15 LYS CA C 23.256 0.631 -0.142 . . . 1.0 . . . . . . . . . . . . A . 15 LYS CA . . . . . . . . . c30057_5j6t 1 . 9 . 2622 . 1 1 15 LYS CB C 22.808 0.110 1.230 . . . 1.0 . . . . . . . . . . . . A . 15 LYS CB . . . . . . . . . c30057_5j6t 1 . 9 . 2623 . 1 1 15 LYS CD C 23.073 2.023 2.817 . . . 1.0 . . . . . . . . . . . . A . 15 LYS CD . . . . . . . . . c30057_5j6t 1 . 9 . 2624 . 1 1 15 LYS CE C 23.852 2.936 1.871 . . . 1.0 . . . . . . . . . . . . A . 15 LYS CE . . . . . . . . . c30057_5j6t 1 . 9 . 2625 . 1 1 15 LYS CG C 22.069 1.205 2.009 . . . 1.0 . . . . . . . . . . . . A . 15 LYS CG . . . . . . . . . c30057_5j6t 1 . 9 . 2626 . 1 1 15 LYS H H 21.140 1.128 -0.308 . . . 1.0 . . . . . . . . . . . . A . 15 LYS H . . . . . . . . . c30057_5j6t 1 . 9 . 2627 . 1 1 15 LYS HA H 24.012 1.407 -0.022 . . . 1.0 . . . . . . . . . . . . A . 15 LYS HA . . . . . . . . . c30057_5j6t 1 . 9 . 2628 . 1 1 15 LYS HB2 H 22.145 -0.744 1.092 . . . 1.0 . . . . . . . . . . . . A . 15 LYS HB2 . . . . . . . . . c30057_5j6t 1 . 9 . 2629 . 1 1 15 LYS HB3 H 23.684 -0.203 1.798 . . . 1.0 . . . . . . . . . . . . A . 15 LYS HB3 . . . . . . . . . c30057_5j6t 1 . 9 . 2630 . 1 1 15 LYS HD2 H 22.544 2.627 3.553 . . . 1.0 . . . . . . . . . . . . A . 15 LYS HD2 . . . . . . . . . c30057_5j6t 1 . 9 . 2631 . 1 1 15 LYS HD3 H 23.764 1.351 3.326 . . . 1.0 . . . . . . . . . . . . A . 15 LYS HD3 . . . . . . . . . c30057_5j6t 1 . 9 . 2632 . 1 1 15 LYS HE2 H 24.729 2.422 1.479 . . . 1.0 . . . . . . . . . . . . A . 15 LYS HE2 . . . . . . . . . c30057_5j6t 1 . 9 . 2633 . 1 1 15 LYS HE3 H 23.211 3.264 1.053 . . . 1.0 . . . . . . . . . . . . A . 15 LYS HE3 . . . . . . . . . c30057_5j6t 1 . 9 . 2634 . 1 1 15 LYS HG2 H 21.547 1.859 1.310 . . . 1.0 . . . . . . . . . . . . A . 15 LYS HG2 . . . . . . . . . c30057_5j6t 1 . 9 . 2635 . 1 1 15 LYS HG3 H 21.347 0.747 2.684 . . . 1.0 . . . . . . . . . . . . A . 15 LYS HG3 . . . . . . . . . c30057_5j6t 1 . 9 . 2636 . 1 1 15 LYS HZ1 H 24.783 4.753 2.140 . . . 1.0 . . . . . . . . . . . . A . 15 LYS HZ1 . . . . . . . . . c30057_5j6t 1 . 9 . 2637 . 1 1 15 LYS HZ2 H 23.434 4.558 3.069 . . . 1.0 . . . . . . . . . . . . A . 15 LYS HZ2 . . . . . . . . . c30057_5j6t 1 . 9 . 2638 . 1 1 15 LYS HZ3 H 24.833 3.782 3.472 . . . 1.0 . . . . . . . . . . . . A . 15 LYS HZ3 . . . . . . . . . c30057_5j6t 1 . 9 . 2639 . 1 1 15 LYS N N 22.031 1.198 -0.778 . . . 1.0 . . . . . . . . . . . . A . 15 LYS N . . . . . . . . . c30057_5j6t 1 . 9 . 2640 . 1 1 15 LYS NZ N 24.258 4.101 2.705 . . . 1.0 . . . . . . . . . . . . A . 15 LYS NZ . . . . . . . . . c30057_5j6t 1 . 9 . 2641 . 1 1 15 LYS O O 24.967 -0.868 -0.899 . . . 1.0 . . . . . . . . . . . . A . 15 LYS O . . . . . . . . . c30057_5j6t 1 . 9 . 2642 . 1 1 16 ASN C C 24.293 -1.690 -3.846 . . . 1.0 . . . . . . . . . . . . A . 16 ASN C . . . . . . . . . c30057_5j6t 1 . 9 . 2643 . 1 1 16 ASN CA C 23.461 -2.228 -2.679 . . . 1.0 . . . . . . . . . . . . A . 16 ASN CA . . . . . . . . . c30057_5j6t 1 . 9 . 2644 . 1 1 16 ASN CB C 22.187 -2.895 -3.197 . . . 1.0 . . . . . . . . . . . . A . 16 ASN CB . . . . . . . . . c30057_5j6t 1 . 9 . 2645 . 1 1 16 ASN CG C 21.734 -3.975 -2.212 . . . 1.0 . . . . . . . . . . . . A . 16 ASN CG . . . . . . . . . c30057_5j6t 1 . 9 . 2646 . 1 1 16 ASN H H 22.026 -0.791 -1.886 . . . 1.0 . . . . . . . . . . . . A . 16 ASN H . . . . . . . . . c30057_5j6t 1 . 9 . 2647 . 1 1 16 ASN HA H 24.046 -2.932 -2.088 . . . 1.0 . . . . . . . . . . . . A . 16 ASN HA . . . . . . . . . c30057_5j6t 1 . 9 . 2648 . 1 1 16 ASN HB2 H 21.402 -2.147 -3.300 . . . 1.0 . . . . . . . . . . . . A . 16 ASN HB2 . . . . . . . . . c30057_5j6t 1 . 9 . 2649 . 1 1 16 ASN HB3 H 22.385 -3.350 -4.168 . . . 1.0 . . . . . . . . . . . . A . 16 ASN HB3 . . . . . . . . . c30057_5j6t 1 . 9 . 2650 . 1 1 16 ASN HD21 H 22.181 -2.873 -0.591 . . . 1.0 . . . . . . . . . . . . A . 16 ASN HD21 . . . . . . . . . c30057_5j6t 1 . 9 . 2651 . 1 1 16 ASN HD22 H 21.521 -4.461 -0.272 . . . 1.0 . . . . . . . . . . . . A . 16 ASN HD22 . . . . . . . . . c30057_5j6t 1 . 9 . 2652 . 1 1 16 ASN N N 22.985 -1.102 -1.824 . . . 1.0 . . . . . . . . . . . . A . 16 ASN N . . . . . . . . . c30057_5j6t 1 . 9 . 2653 . 1 1 16 ASN ND2 N 21.819 -3.753 -0.928 . . . 1.0 . . . . . . . . . . . . A . 16 ASN ND2 . . . . . . . . . c30057_5j6t 1 . 9 . 2654 . 1 1 16 ASN O O 25.266 -2.293 -4.255 . . . 1.0 . . . . . . . . . . . . A . 16 ASN O . . . . . . . . . c30057_5j6t 1 . 9 . 2655 . 1 1 16 ASN OD1 O 21.297 -5.036 -2.614 . . . 1.0 . . . . . . . . . . . . A . 16 ASN OD1 . . . . . . . . . c30057_5j6t 1 . 9 . 2656 . 1 1 17 LEU C C 26.008 0.592 -5.033 . . . 1.0 . . . . . . . . . . . . A . 17 LEU C . . . . . . . . . c30057_5j6t 1 . 9 . 2657 . 1 1 17 LEU CA C 24.683 0.014 -5.529 . . . 1.0 . . . . . . . . . . . . A . 17 LEU CA . . . . . . . . . c30057_5j6t 1 . 9 . 2658 . 1 1 17 LEU CB C 23.791 1.125 -6.090 . . . 1.0 . . . . . . . . . . . . A . 17 LEU CB . . . . . . . . . c30057_5j6t 1 . 9 . 2659 . 1 1 17 LEU CD1 C 23.751 0.056 -8.358 . . . 1.0 . . . . . . . . . . . . A . 17 LEU CD1 . . . . . . . . . c30057_5j6t 1 . 9 . 2660 . 1 1 17 LEU CD2 C 22.056 -0.595 -6.635 . . . 1.0 . . . . . . . . . . . . A . 17 LEU CD2 . . . . . . . . . c30057_5j6t 1 . 9 . 2661 . 1 1 17 LEU CG C 22.890 0.561 -7.196 . . . 1.0 . . . . . . . . . . . . A . 17 LEU CG . . . . . . . . . c30057_5j6t 1 . 9 . 2662 . 1 1 17 LEU H H 23.102 -0.080 -4.031 . . . 1.0 . . . . . . . . . . . . A . 17 LEU H . . . . . . . . . c30057_5j6t 1 . 9 . 2663 . 1 1 17 LEU HA H 24.863 -0.747 -6.288 . . . 1.0 . . . . . . . . . . . . A . 17 LEU HA . . . . . . . . . c30057_5j6t 1 . 9 . 2664 . 1 1 17 LEU HB2 H 23.172 1.531 -5.290 . . . 1.0 . . . . . . . . . . . . A . 17 LEU HB2 . . . . . . . . . c30057_5j6t 1 . 9 . 2665 . 1 1 17 LEU HB3 H 24.417 1.917 -6.502 . . . 1.0 . . . . . . . . . . . . A . 17 LEU HB3 . . . . . . . . . c30057_5j6t 1 . 9 . 2666 . 1 1 17 LEU HD11 H 24.344 0.879 -8.757 . . . 1.0 . . . . . . . . . . . . A . 17 LEU HD11 . . . . . . . . . c30057_5j6t 1 . 9 . 2667 . 1 1 17 LEU HD12 H 23.105 -0.340 -9.143 . . . 1.0 . . . . . . . . . . . . A . 17 LEU HD12 . . . . . . . . . c30057_5j6t 1 . 9 . 2668 . 1 1 17 LEU HD13 H 24.415 -0.732 -8.003 . . . 1.0 . . . . . . . . . . . . A . 17 LEU HD13 . . . . . . . . . c30057_5j6t 1 . 9 . 2669 . 1 1 17 LEU HD21 H 21.242 -0.823 -7.323 . . . 1.0 . . . . . . . . . . . . A . 17 LEU HD21 . . . . . . . . . c30057_5j6t 1 . 9 . 2670 . 1 1 17 LEU HD22 H 21.644 -0.309 -5.667 . . . 1.0 . . . . . . . . . . . . A . 17 LEU HD22 . . . . . . . . . c30057_5j6t 1 . 9 . 2671 . 1 1 17 LEU HD23 H 22.688 -1.474 -6.515 . . . 1.0 . . . . . . . . . . . . A . 17 LEU HD23 . . . . . . . . . c30057_5j6t 1 . 9 . 2672 . 1 1 17 LEU HG H 22.224 1.347 -7.554 . . . 1.0 . . . . . . . . . . . . A . 17 LEU HG . . . . . . . . . c30057_5j6t 1 . 9 . 2673 . 1 1 17 LEU N N 23.915 -0.563 -4.387 . . . 1.0 . . . . . . . . . . . . A . 17 LEU N . . . . . . . . . c30057_5j6t 1 . 9 . 2674 . 1 1 17 LEU O O 27.013 0.545 -5.717 . . . 1.0 . . . . . . . . . . . . A . 17 LEU O . . . . . . . . . c30057_5j6t 1 . 9 . 2675 . 1 1 18 ILE C C 28.049 0.666 -2.505 . . . 1.0 . . . . . . . . . . . . A . 18 ILE C . . . . . . . . . c30057_5j6t 1 . 9 . 2676 . 1 1 18 ILE CA C 27.272 1.720 -3.301 . . . 1.0 . . . . . . . . . . . . A . 18 ILE CA . . . . . . . . . c30057_5j6t 1 . 9 . 2677 . 1 1 18 ILE CB C 26.814 2.861 -2.389 . . . 1.0 . . . . . . . . . . . . A . 18 ILE CB . . . . . . . . . c30057_5j6t 1 . 9 . 2678 . 1 1 18 ILE CD1 C 26.760 2.360 0.063 . . . 1.0 . . . . . . . . . . . . A . 18 ILE CD1 . . . . . . . . . c30057_5j6t 1 . 9 . 2679 . 1 1 18 ILE CG1 C 25.962 2.302 -1.242 . . . 1.0 . . . . . . . . . . . . A . 18 ILE CG1 . . . . . . . . . c30057_5j6t 1 . 9 . 2680 . 1 1 18 ILE CG2 C 25.988 3.863 -3.197 . . . 1.0 . . . . . . . . . . . . A . 18 ILE CG2 . . . . . . . . . c30057_5j6t 1 . 9 . 2681 . 1 1 18 ILE H H 25.167 1.160 -3.301 . . . 1.0 . . . . . . . . . . . . A . 18 ILE H . . . . . . . . . c30057_5j6t 1 . 9 . 2682 . 1 1 18 ILE HA H 27.889 2.110 -4.111 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HA . . . . . . . . . c30057_5j6t 1 . 9 . 2683 . 1 1 18 ILE HB H 27.689 3.364 -1.976 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HB . . . . . . . . . c30057_5j6t 1 . 9 . 2684 . 1 1 18 ILE HD11 H 27.827 2.351 -0.162 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HD11 . . . . . . . . . c30057_5j6t 1 . 9 . 2685 . 1 1 18 ILE HD12 H 26.511 3.275 0.600 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HD12 . . . . . . . . . c30057_5j6t 1 . 9 . 2686 . 1 1 18 ILE HD13 H 26.512 1.497 0.680 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HD13 . . . . . . . . . c30057_5j6t 1 . 9 . 2687 . 1 1 18 ILE HG12 H 25.055 2.897 -1.140 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HG12 . . . . . . . . . c30057_5j6t 1 . 9 . 2688 . 1 1 18 ILE HG13 H 25.696 1.267 -1.458 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HG13 . . . . . . . . . c30057_5j6t 1 . 9 . 2689 . 1 1 18 ILE HG21 H 25.663 4.675 -2.546 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HG21 . . . . . . . . . c30057_5j6t 1 . 9 . 2690 . 1 1 18 ILE HG22 H 25.115 3.361 -3.615 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HG22 . . . . . . . . . c30057_5j6t 1 . 9 . 2691 . 1 1 18 ILE HG23 H 26.597 4.268 -4.006 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HG23 . . . . . . . . . c30057_5j6t 1 . 9 . 2692 . 1 1 18 ILE N N 26.015 1.135 -3.849 . . . 1.0 . . . . . . . . . . . . A . 18 ILE N . . . . . . . . . c30057_5j6t 1 . 9 . 2693 . 1 1 18 ILE O O 29.245 0.775 -2.317 . . . 1.0 . . . . . . . . . . . . A . 18 ILE O . . . . . . . . . c30057_5j6t 1 . 9 . 2694 . 1 1 19 LYS C C 27.582 -2.798 -1.676 . . . 1.0 . . . . . . . . . . . . A . 19 LYS C . . . . . . . . . c30057_5j6t 1 . 9 . 2695 . 1 1 19 LYS CA C 28.079 -1.413 -1.252 . . . 1.0 . . . . . . . . . . . . A . 19 LYS CA . . . . . . . . . c30057_5j6t 1 . 9 . 2696 . 1 1 19 LYS CB C 27.714 -1.135 0.209 . . . 1.0 . . . . . . . . . . . . A . 19 LYS CB . . . . . . . . . c30057_5j6t 1 . 9 . 2697 . 1 1 19 LYS CD C 29.744 -2.232 1.169 . . . 1.0 . . . . . . . . . . . . A . 19 LYS CD . . . . . . . . . c30057_5j6t 1 . 9 . 2698 . 1 1 19 LYS CE C 30.509 -2.243 2.495 . . . 1.0 . . . . . . . . . . . . A . 19 LYS CE . . . . . . . . . c30057_5j6t 1 . 9 . 2699 . 1 1 19 LYS CG C 28.990 -0.909 1.023 . . . 1.0 . . . . . . . . . . . . A . 19 LYS CG . . . . . . . . . c30057_5j6t 1 . 9 . 2700 . 1 1 19 LYS H H 26.387 -0.426 -2.204 . . . 1.0 . . . . . . . . . . . . A . 19 LYS H . . . . . . . . . c30057_5j6t 1 . 9 . 2701 . 1 1 19 LYS HA H 29.157 -1.338 -1.393 . . . 1.0 . . . . . . . . . . . . A . 19 LYS HA . . . . . . . . . c30057_5j6t 1 . 9 . 2702 . 1 1 19 LYS HB2 H 27.087 -0.245 0.263 . . . 1.0 . . . . . . . . . . . . A . 19 LYS HB2 . . . . . . . . . c30057_5j6t 1 . 9 . 2703 . 1 1 19 LYS HB3 H 27.170 -1.987 0.616 . . . 1.0 . . . . . . . . . . . . A . 19 LYS HB3 . . . . . . . . . c30057_5j6t 1 . 9 . 2704 . 1 1 19 LYS HD2 H 29.033 -3.058 1.153 . . . 1.0 . . . . . . . . . . . . A . 19 LYS HD2 . . . . . . . . . c30057_5j6t 1 . 9 . 2705 . 1 1 19 LYS HD3 H 30.447 -2.342 0.343 . . . 1.0 . . . . . . . . . . . . A . 19 LYS HD3 . . . . . . . . . c30057_5j6t 1 . 9 . 2706 . 1 1 19 LYS HE2 H 31.209 -1.408 2.541 . . . 1.0 . . . . . . . . . . . . A . 19 LYS HE2 . . . . . . . . . c30057_5j6t 1 . 9 . 2707 . 1 1 19 LYS HE3 H 29.812 -2.196 3.332 . . . 1.0 . . . . . . . . . . . . A . 19 LYS HE3 . . . . . . . . . c30057_5j6t 1 . 9 . 2708 . 1 1 19 LYS HG2 H 29.624 -0.184 0.511 . . . 1.0 . . . . . . . . . . . . A . 19 LYS HG2 . . . . . . . . . c30057_5j6t 1 . 9 . 2709 . 1 1 19 LYS HG3 H 28.729 -0.529 2.010 . . . 1.0 . . . . . . . . . . . . A . 19 LYS HG3 . . . . . . . . . c30057_5j6t 1 . 9 . 2710 . 1 1 19 LYS HZ1 H 31.773 -3.620 3.360 . . . 1.0 . . . . . . . . . . . . A . 19 LYS HZ1 . . . . . . . . . c30057_5j6t 1 . 9 . 2711 . 1 1 19 LYS HZ2 H 30.577 -4.300 2.451 . . . 1.0 . . . . . . . . . . . . A . 19 LYS HZ2 . . . . . . . . . c30057_5j6t 1 . 9 . 2712 . 1 1 19 LYS HZ3 H 31.865 -3.581 1.714 . . . 1.0 . . . . . . . . . . . . A . 19 LYS HZ3 . . . . . . . . . c30057_5j6t 1 . 9 . 2713 . 1 1 19 LYS N N 27.380 -0.354 -2.036 . . . 1.0 . . . . . . . . . . . . A . 19 LYS N . . . . . . . . . c30057_5j6t 1 . 9 . 2714 . 1 1 19 LYS NZ N 31.240 -3.540 2.506 . . . 1.0 . . . . . . . . . . . . A . 19 LYS NZ . . . . . . . . . c30057_5j6t 1 . 9 . 2715 . 1 1 19 LYS O O 26.555 -3.259 -1.221 . . . 1.0 . . . . . . . . . . . . A . 19 LYS O . . . . . . . . . c30057_5j6t 1 . 9 . 2716 . 1 1 20 NH2 HN1 H 29.131 -3.108 -2.920 . . . 1.0 . . . . . . . . . . . . A . 20 NH2 HN1 . . . . . . . . . c30057_5j6t 1 . 9 . 2717 . 1 1 20 NH2 HN2 H 27.960 -4.403 -2.827 . . . 1.0 . . . . . . . . . . . . A . 20 NH2 HN2 . . . . . . . . . c30057_5j6t 1 . 9 . 2718 . 1 1 20 NH2 N N 28.277 -3.489 -2.540 . . . 1.0 . . . . . . . . . . . . A . 20 NH2 N . . . . . . . . . c30057_5j6t 1 . 10 . 2719 . 1 1 1 ACE C C 0.424 -2.226 3.019 . . . 1.0 . . . . . . . . . . . . A . 1 ACE C . . . . . . . . . c30057_5j6t 1 . 10 . 2720 . 1 1 1 ACE CH3 C -1.037 -1.773 3.046 . . . 1.0 . . . . . . . . . . . . A . 1 ACE CH3 . . . . . . . . . c30057_5j6t 1 . 10 . 2721 . 1 1 1 ACE H1 H -1.495 -2.080 3.986 . . . 1.0 . . . . . . . . . . . . A . 1 ACE H1 . . . . . . . . . c30057_5j6t 1 . 10 . 2722 . 1 1 1 ACE H2 H -1.574 -2.229 2.215 . . . 1.0 . . . . . . . . . . . . A . 1 ACE H2 . . . . . . . . . c30057_5j6t 1 . 10 . 2723 . 1 1 1 ACE H3 H -1.082 -0.688 2.958 . . . 1.0 . . . . . . . . . . . . A . 1 ACE H3 . . . . . . . . . c30057_5j6t 1 . 10 . 2724 . 1 1 1 ACE O O 0.914 -2.831 3.951 . . . 1.0 . . . . . . . . . . . . A . 1 ACE O . . . . . . . . . c30057_5j6t 1 . 10 . 2725 . 1 1 2 ILE C C 3.450 -1.124 1.656 . . . 1.0 . . . . . . . . . . . . A . 2 ILE C . . . . . . . . . c30057_5j6t 1 . 10 . 2726 . 1 1 2 ILE CA C 2.555 -2.350 1.861 . . . 1.0 . . . . . . . . . . . . A . 2 ILE CA . . . . . . . . . c30057_5j6t 1 . 10 . 2727 . 1 1 2 ILE CB C 2.625 -3.277 0.646 . . . 1.0 . . . . . . . . . . . . A . 2 ILE CB . . . . . . . . . c30057_5j6t 1 . 10 . 2728 . 1 1 2 ILE CD1 C 2.507 -3.323 -1.852 . . . 1.0 . . . . . . . . . . . . A . 2 ILE CD1 . . . . . . . . . c30057_5j6t 1 . 10 . 2729 . 1 1 2 ILE CG1 C 2.122 -2.536 -0.597 . . . 1.0 . . . . . . . . . . . . A . 2 ILE CG1 . . . . . . . . . c30057_5j6t 1 . 10 . 2730 . 1 1 2 ILE CG2 C 1.751 -4.508 0.892 . . . 1.0 . . . . . . . . . . . . A . 2 ILE CG2 . . . . . . . . . c30057_5j6t 1 . 10 . 2731 . 1 1 2 ILE H H 0.696 -1.431 1.191 . . . 1.0 . . . . . . . . . . . . A . 2 ILE H . . . . . . . . . c30057_5j6t 1 . 10 . 2732 . 1 1 2 ILE HA H 2.851 -2.887 2.762 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HA . . . . . . . . . c30057_5j6t 1 . 10 . 2733 . 1 1 2 ILE HB H 3.657 -3.590 0.489 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HB . . . . . . . . . c30057_5j6t 1 . 10 . 2734 . 1 1 2 ILE HD11 H 2.149 -2.795 -2.736 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HD11 . . . . . . . . . c30057_5j6t 1 . 10 . 2735 . 1 1 2 ILE HD12 H 2.055 -4.314 -1.812 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HD12 . . . . . . . . . c30057_5j6t 1 . 10 . 2736 . 1 1 2 ILE HD13 H 3.592 -3.420 -1.901 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HD13 . . . . . . . . . c30057_5j6t 1 . 10 . 2737 . 1 1 2 ILE HG12 H 1.038 -2.439 -0.548 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HG12 . . . . . . . . . c30057_5j6t 1 . 10 . 2738 . 1 1 2 ILE HG13 H 2.574 -1.545 -0.637 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HG13 . . . . . . . . . c30057_5j6t 1 . 10 . 2739 . 1 1 2 ILE HG21 H 2.107 -5.036 1.776 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HG21 . . . . . . . . . c30057_5j6t 1 . 10 . 2740 . 1 1 2 ILE HG22 H 0.719 -4.195 1.047 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HG22 . . . . . . . . . c30057_5j6t 1 . 10 . 2741 . 1 1 2 ILE HG23 H 1.804 -5.169 0.027 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HG23 . . . . . . . . . c30057_5j6t 1 . 10 . 2742 . 1 1 2 ILE N N 1.124 -1.936 1.953 . . . 1.0 . . . . . . . . . . . . A . 2 ILE N . . . . . . . . . c30057_5j6t 1 . 10 . 2743 . 1 1 2 ILE O O 4.539 -1.222 1.125 . . . 1.0 . . . . . . . . . . . . A . 2 ILE O . . . . . . . . . c30057_5j6t 1 . 10 . 2744 . 1 1 3 PHE C C 5.041 1.205 2.829 . . . 1.0 . . . . . . . . . . . . A . 3 PHE C . . . . . . . . . c30057_5j6t 1 . 10 . 2745 . 1 1 3 PHE CA C 3.829 1.263 1.906 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CA . . . . . . . . . c30057_5j6t 1 . 10 . 2746 . 1 1 3 PHE CB C 2.909 2.419 2.300 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CB . . . . . . . . . c30057_5j6t 1 . 10 . 2747 . 1 1 3 PHE CD1 C 0.398 2.280 2.215 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CD1 . . . . . . . . . c30057_5j6t 1 . 10 . 2748 . 1 1 3 PHE CD2 C 1.639 2.258 0.133 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CD2 . . . . . . . . . c30057_5j6t 1 . 10 . 2749 . 1 1 3 PHE CE1 C -0.803 2.185 1.502 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CE1 . . . . . . . . . c30057_5j6t 1 . 10 . 2750 . 1 1 3 PHE CE2 C 0.440 2.163 -0.583 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CE2 . . . . . . . . . c30057_5j6t 1 . 10 . 2751 . 1 1 3 PHE CG C 1.617 2.317 1.530 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CG . . . . . . . . . c30057_5j6t 1 . 10 . 2752 . 1 1 3 PHE CZ C -0.781 2.127 0.101 . . . 1.0 . . . . . . . . . . . . A . 3 PHE CZ . . . . . . . . . c30057_5j6t 1 . 10 . 2753 . 1 1 3 PHE H H 2.094 0.086 2.514 . . . 1.0 . . . . . . . . . . . . A . 3 PHE H . . . . . . . . . c30057_5j6t 1 . 10 . 2754 . 1 1 3 PHE HA H 4.146 1.368 0.868 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HA . . . . . . . . . c30057_5j6t 1 . 10 . 2755 . 1 1 3 PHE HB2 H 2.700 2.368 3.368 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HB2 . . . . . . . . . c30057_5j6t 1 . 10 . 2756 . 1 1 3 PHE HB3 H 3.396 3.366 2.069 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HB3 . . . . . . . . . c30057_5j6t 1 . 10 . 2757 . 1 1 3 PHE HD1 H 0.383 2.326 3.294 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HD1 . . . . . . . . . c30057_5j6t 1 . 10 . 2758 . 1 1 3 PHE HD2 H 2.581 2.286 -0.394 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HD2 . . . . . . . . . c30057_5j6t 1 . 10 . 2759 . 1 1 3 PHE HE1 H -1.745 2.156 2.029 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HE1 . . . . . . . . . c30057_5j6t 1 . 10 . 2760 . 1 1 3 PHE HE2 H 0.456 2.117 -1.661 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HE2 . . . . . . . . . c30057_5j6t 1 . 10 . 2761 . 1 1 3 PHE HZ H -1.707 2.054 -0.451 . . . 1.0 . . . . . . . . . . . . A . 3 PHE HZ . . . . . . . . . c30057_5j6t 1 . 10 . 2762 . 1 1 3 PHE N N 3.002 0.029 2.075 . . . 1.0 . . . . . . . . . . . . A . 3 PHE N . . . . . . . . . c30057_5j6t 1 . 10 . 2763 . 1 1 3 PHE O O 6.154 1.489 2.428 . . . 1.0 . . . . . . . . . . . . A . 3 PHE O . . . . . . . . . c30057_5j6t 1 . 10 . 2764 . 1 1 4 GLY C C 6.903 -0.411 4.583 . . . 1.0 . . . . . . . . . . . . A . 4 GLY C . . . . . . . . . c30057_5j6t 1 . 10 . 2765 . 1 1 4 GLY CA C 5.979 0.734 5.010 . . . 1.0 . . . . . . . . . . . . A . 4 GLY CA . . . . . . . . . c30057_5j6t 1 . 10 . 2766 . 1 1 4 GLY H H 3.904 0.599 4.372 . . . 1.0 . . . . . . . . . . . . A . 4 GLY H . . . . . . . . . c30057_5j6t 1 . 10 . 2767 . 1 1 4 GLY HA2 H 6.535 1.672 5.003 . . . 1.0 . . . . . . . . . . . . A . 4 GLY HA2 . . . . . . . . . c30057_5j6t 1 . 10 . 2768 . 1 1 4 GLY HA3 H 5.602 0.542 6.015 . . . 1.0 . . . . . . . . . . . . A . 4 GLY HA3 . . . . . . . . . c30057_5j6t 1 . 10 . 2769 . 1 1 4 GLY N N 4.838 0.828 4.062 . . . 1.0 . . . . . . . . . . . . A . 4 GLY N . . . . . . . . . c30057_5j6t 1 . 10 . 2770 . 1 1 4 GLY O O 7.983 -0.574 5.112 . . . 1.0 . . . . . . . . . . . . A . 4 GLY O . . . . . . . . . c30057_5j6t 1 . 10 . 2771 . 1 1 5 ALA C C 8.235 -1.896 2.010 . . . 1.0 . . . . . . . . . . . . A . 5 ALA C . . . . . . . . . c30057_5j6t 1 . 10 . 2772 . 1 1 5 ALA CA C 7.343 -2.341 3.173 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CA . . . . . . . . . c30057_5j6t 1 . 10 . 2773 . 1 1 5 ALA CB C 6.362 -3.420 2.717 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CB . . . . . . . . . c30057_5j6t 1 . 10 . 2774 . 1 1 5 ALA H H 5.583 -1.053 3.202 . . . 1.0 . . . . . . . . . . . . A . 5 ALA H . . . . . . . . . c30057_5j6t 1 . 10 . 2775 . 1 1 5 ALA HA H 7.953 -2.709 3.998 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HA . . . . . . . . . c30057_5j6t 1 . 10 . 2776 . 1 1 5 ALA HB1 H 6.916 -4.290 2.366 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB1 . . . . . . . . . c30057_5j6t 1 . 10 . 2777 . 1 1 5 ALA HB2 H 5.724 -3.707 3.553 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB2 . . . . . . . . . c30057_5j6t 1 . 10 . 2778 . 1 1 5 ALA HB3 H 5.745 -3.030 1.907 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB3 . . . . . . . . . c30057_5j6t 1 . 10 . 2779 . 1 1 5 ALA N N 6.485 -1.207 3.629 . . . 1.0 . . . . . . . . . . . . A . 5 ALA N . . . . . . . . . c30057_5j6t 1 . 10 . 2780 . 1 1 5 ALA O O 9.312 -2.425 1.802 . . . 1.0 . . . . . . . . . . . . A . 5 ALA O . . . . . . . . . c30057_5j6t 1 . 10 . 2781 . 1 1 6 ILE C C 9.672 0.551 0.576 . . . 1.0 . . . . . . . . . . . . A . 6 ILE C . . . . . . . . . c30057_5j6t 1 . 10 . 2782 . 1 1 6 ILE CA C 8.617 -0.450 0.099 . . . 1.0 . . . . . . . . . . . . A . 6 ILE CA . . . . . . . . . c30057_5j6t 1 . 10 . 2783 . 1 1 6 ILE CB C 7.620 0.228 -0.843 . . . 1.0 . . . . . . . . . . . . A . 6 ILE CB . . . . . . . . . c30057_5j6t 1 . 10 . 2784 . 1 1 6 ILE CD1 C 7.291 -1.930 -2.084 . . . 1.0 . . . . . . . . . . . . A . 6 ILE CD1 . . . . . . . . . c30057_5j6t 1 . 10 . 2785 . 1 1 6 ILE CG1 C 6.589 -0.798 -1.326 . . . 1.0 . . . . . . . . . . . . A . 6 ILE CG1 . . . . . . . . . c30057_5j6t 1 . 10 . 2786 . 1 1 6 ILE CG2 C 8.363 0.813 -2.048 . . . 1.0 . . . . . . . . . . . . A . 6 ILE CG2 . . . . . . . . . c30057_5j6t 1 . 10 . 2787 . 1 1 6 ILE H H 6.901 -0.505 1.442 . . . 1.0 . . . . . . . . . . . . A . 6 ILE H . . . . . . . . . c30057_5j6t 1 . 10 . 2788 . 1 1 6 ILE HA H 9.095 -1.293 -0.401 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HA . . . . . . . . . c30057_5j6t 1 . 10 . 2789 . 1 1 6 ILE HB H 7.109 1.030 -0.310 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HB . . . . . . . . . c30057_5j6t 1 . 10 . 2790 . 1 1 6 ILE HD11 H 6.726 -2.855 -1.963 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HD11 . . . . . . . . . c30057_5j6t 1 . 10 . 2791 . 1 1 6 ILE HD12 H 7.351 -1.677 -3.142 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HD12 . . . . . . . . . c30057_5j6t 1 . 10 . 2792 . 1 1 6 ILE HD13 H 8.297 -2.065 -1.685 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HD13 . . . . . . . . . c30057_5j6t 1 . 10 . 2793 . 1 1 6 ILE HG12 H 6.059 -1.211 -0.468 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HG12 . . . . . . . . . c30057_5j6t 1 . 10 . 2794 . 1 1 6 ILE HG13 H 5.876 -0.309 -1.989 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HG13 . . . . . . . . . c30057_5j6t 1 . 10 . 2795 . 1 1 6 ILE HG21 H 8.672 1.834 -1.824 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HG21 . . . . . . . . . c30057_5j6t 1 . 10 . 2796 . 1 1 6 ILE HG22 H 7.703 0.816 -2.915 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HG22 . . . . . . . . . c30057_5j6t 1 . 10 . 2797 . 1 1 6 ILE HG23 H 9.243 0.206 -2.263 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HG23 . . . . . . . . . c30057_5j6t 1 . 10 . 2798 . 1 1 6 ILE N N 7.797 -0.930 1.250 . . . 1.0 . . . . . . . . . . . . A . 6 ILE N . . . . . . . . . c30057_5j6t 1 . 10 . 2799 . 1 1 6 ILE O O 10.744 0.651 0.013 . . . 1.0 . . . . . . . . . . . . A . 6 ILE O . . . . . . . . . c30057_5j6t 1 . 10 . 2800 . 1 1 7 TRP C C 11.645 1.600 2.573 . . . 1.0 . . . . . . . . . . . . A . 7 TRP C . . . . . . . . . c30057_5j6t 1 . 10 . 2801 . 1 1 7 TRP CA C 10.361 2.298 2.108 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CA . . . . . . . . . c30057_5j6t 1 . 10 . 2802 . 1 1 7 TRP CB C 9.668 3.007 3.275 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CB . . . . . . . . . c30057_5j6t 1 . 10 . 2803 . 1 1 7 TRP CD1 C 8.573 5.245 2.846 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CD1 . . . . . . . . . c30057_5j6t 1 . 10 . 2804 . 1 1 7 TRP CD2 C 10.816 5.378 2.933 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CD2 . . . . . . . . . c30057_5j6t 1 . 10 . 2805 . 1 1 7 TRP CE2 C 10.342 6.688 2.690 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CE2 . . . . . . . . . c30057_5j6t 1 . 10 . 2806 . 1 1 7 TRP CE3 C 12.205 5.182 3.034 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CE3 . . . . . . . . . c30057_5j6t 1 . 10 . 2807 . 1 1 7 TRP CG C 9.674 4.481 3.030 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CG . . . . . . . . . c30057_5j6t 1 . 10 . 2808 . 1 1 7 TRP CH2 C 12.594 7.555 2.652 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CH2 . . . . . . . . . c30057_5j6t 1 . 10 . 2809 . 1 1 7 TRP CZ2 C 11.216 7.767 2.550 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CZ2 . . . . . . . . . c30057_5j6t 1 . 10 . 2810 . 1 1 7 TRP CZ3 C 13.089 6.265 2.893 . . . 1.0 . . . . . . . . . . . . A . 7 TRP CZ3 . . . . . . . . . c30057_5j6t 1 . 10 . 2811 . 1 1 7 TRP H H 8.475 1.201 2.056 . . . 1.0 . . . . . . . . . . . . A . 7 TRP H . . . . . . . . . c30057_5j6t 1 . 10 . 2812 . 1 1 7 TRP HA H 10.594 3.018 1.323 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HA . . . . . . . . . c30057_5j6t 1 . 10 . 2813 . 1 1 7 TRP HB2 H 8.639 2.656 3.354 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HB2 . . . . . . . . . c30057_5j6t 1 . 10 . 2814 . 1 1 7 TRP HB3 H 10.200 2.789 4.201 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HB3 . . . . . . . . . c30057_5j6t 1 . 10 . 2815 . 1 1 7 TRP HD1 H 7.553 4.890 2.855 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HD1 . . . . . . . . . c30057_5j6t 1 . 10 . 2816 . 1 1 7 TRP HE1 H 8.330 7.320 2.484 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HE1 . . . . . . . . . c30057_5j6t 1 . 10 . 2817 . 1 1 7 TRP HE3 H 12.596 4.193 3.220 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HE3 . . . . . . . . . c30057_5j6t 1 . 10 . 2818 . 1 1 7 TRP HH2 H 13.278 8.384 2.545 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HH2 . . . . . . . . . c30057_5j6t 1 . 10 . 2819 . 1 1 7 TRP HZ2 H 10.830 8.759 2.364 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HZ2 . . . . . . . . . c30057_5j6t 1 . 10 . 2820 . 1 1 7 TRP HZ3 H 14.154 6.104 2.971 . . . 1.0 . . . . . . . . . . . . A . 7 TRP HZ3 . . . . . . . . . c30057_5j6t 1 . 10 . 2821 . 1 1 7 TRP N N 9.373 1.299 1.603 . . . 1.0 . . . . . . . . . . . . A . 7 TRP N . . . . . . . . . c30057_5j6t 1 . 10 . 2822 . 1 1 7 TRP NE1 N 8.968 6.554 2.644 . . . 1.0 . . . . . . . . . . . . A . 7 TRP NE1 . . . . . . . . . c30057_5j6t 1 . 10 . 2823 . 1 1 7 TRP O O 12.725 1.958 2.147 . . . 1.0 . . . . . . . . . . . . A . 7 TRP O . . . . . . . . . c30057_5j6t 1 . 10 . 2824 . 1 1 8 PRO C C 13.529 -0.625 2.758 . . . 1.0 . . . . . . . . . . . . A . 8 PRO C . . . . . . . . . c30057_5j6t 1 . 10 . 2825 . 1 1 8 PRO CA C 12.683 -0.127 3.931 . . . 1.0 . . . . . . . . . . . . A . 8 PRO CA . . . . . . . . . c30057_5j6t 1 . 10 . 2826 . 1 1 8 PRO CB C 12.089 -1.300 4.707 . . . 1.0 . . . . . . . . . . . . A . 8 PRO CB . . . . . . . . . c30057_5j6t 1 . 10 . 2827 . 1 1 8 PRO CD C 10.246 0.111 4.004 . . . 1.0 . . . . . . . . . . . . A . 8 PRO CD . . . . . . . . . c30057_5j6t 1 . 10 . 2828 . 1 1 8 PRO CG C 10.687 -0.894 5.036 . . . 1.0 . . . . . . . . . . . . A . 8 PRO CG . . . . . . . . . c30057_5j6t 1 . 10 . 2829 . 1 1 8 PRO HA H 13.279 0.504 4.591 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HA . . . . . . . . . c30057_5j6t 1 . 10 . 2830 . 1 1 8 PRO HB2 H 12.084 -2.196 4.086 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HB2 . . . . . . . . . c30057_5j6t 1 . 10 . 2831 . 1 1 8 PRO HB3 H 12.657 -1.479 5.619 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HB3 . . . . . . . . . c30057_5j6t 1 . 10 . 2832 . 1 1 8 PRO HD2 H 9.648 -0.375 3.234 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HD2 . . . . . . . . . c30057_5j6t 1 . 10 . 2833 . 1 1 8 PRO HD3 H 9.681 0.919 4.469 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HD3 . . . . . . . . . c30057_5j6t 1 . 10 . 2834 . 1 1 8 PRO HG2 H 10.032 -1.766 5.008 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HG2 . . . . . . . . . c30057_5j6t 1 . 10 . 2835 . 1 1 8 PRO HG3 H 10.657 -0.442 6.027 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HG3 . . . . . . . . . c30057_5j6t 1 . 10 . 2836 . 1 1 8 PRO N N 11.497 0.616 3.432 . . . 1.0 . . . . . . . . . . . . A . 8 PRO N . . . . . . . . . c30057_5j6t 1 . 10 . 2837 . 1 1 8 PRO O O 14.740 -0.696 2.837 . . . 1.0 . . . . . . . . . . . . A . 8 PRO O . . . . . . . . . c30057_5j6t 1 . 10 . 2838 . 1 1 9 LEU C C 14.296 -0.275 -0.257 . . . 1.0 . . . . . . . . . . . . A . 9 LEU C . . . . . . . . . c30057_5j6t 1 . 10 . 2839 . 1 1 9 LEU CA C 13.654 -1.454 0.482 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CA . . . . . . . . . c30057_5j6t 1 . 10 . 2840 . 1 1 9 LEU CB C 12.613 -2.140 -0.403 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CB . . . . . . . . . c30057_5j6t 1 . 10 . 2841 . 1 1 9 LEU CD1 C 12.602 -4.053 -2.012 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CD1 . . . . . . . . . c30057_5j6t 1 . 10 . 2842 . 1 1 9 LEU CD2 C 13.214 -1.763 -2.798 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CD2 . . . . . . . . . c30057_5j6t 1 . 10 . 2843 . 1 1 9 LEU CG C 13.299 -2.746 -1.628 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CG . . . . . . . . . c30057_5j6t 1 . 10 . 2844 . 1 1 9 LEU H H 11.887 -0.900 1.631 . . . 1.0 . . . . . . . . . . . . A . 9 LEU H . . . . . . . . . c30057_5j6t 1 . 10 . 2845 . 1 1 9 LEU HA H 14.418 -2.169 0.790 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HA . . . . . . . . . c30057_5j6t 1 . 10 . 2846 . 1 1 9 LEU HB2 H 12.119 -2.930 0.164 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HB2 . . . . . . . . . c30057_5j6t 1 . 10 . 2847 . 1 1 9 LEU HB3 H 11.872 -1.409 -0.726 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HB3 . . . . . . . . . c30057_5j6t 1 . 10 . 2848 . 1 1 9 LEU HD11 H 12.661 -4.755 -1.179 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD11 . . . . . . . . . c30057_5j6t 1 . 10 . 2849 . 1 1 9 LEU HD12 H 11.556 -3.853 -2.244 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD12 . . . . . . . . . c30057_5j6t 1 . 10 . 2850 . 1 1 9 LEU HD13 H 13.092 -4.483 -2.885 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD13 . . . . . . . . . c30057_5j6t 1 . 10 . 2851 . 1 1 9 LEU HD21 H 13.710 -0.831 -2.527 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD21 . . . . . . . . . c30057_5j6t 1 . 10 . 2852 . 1 1 9 LEU HD22 H 13.704 -2.195 -3.671 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD22 . . . . . . . . . c30057_5j6t 1 . 10 . 2853 . 1 1 9 LEU HD23 H 12.168 -1.565 -3.031 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD23 . . . . . . . . . c30057_5j6t 1 . 10 . 2854 . 1 1 9 LEU HG H 14.345 -2.946 -1.397 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HG . . . . . . . . . c30057_5j6t 1 . 10 . 2855 . 1 1 9 LEU N N 12.894 -0.966 1.669 . . . 1.0 . . . . . . . . . . . . A . 9 LEU N . . . . . . . . . c30057_5j6t 1 . 10 . 2856 . 1 1 9 LEU O O 15.235 -0.441 -1.010 . . . 1.0 . . . . . . . . . . . . A . 9 LEU O . . . . . . . . . c30057_5j6t 1 . 10 . 2857 . 1 1 10 ALA C C 15.756 2.426 -0.163 . . . 1.0 . . . . . . . . . . . . A . 10 ALA C . . . . . . . . . c30057_5j6t 1 . 10 . 2858 . 1 1 10 ALA CA C 14.375 2.104 -0.736 . . . 1.0 . . . . . . . . . . . . A . 10 ALA CA . . . . . . . . . c30057_5j6t 1 . 10 . 2859 . 1 1 10 ALA CB C 13.397 3.245 -0.452 . . . 1.0 . . . . . . . . . . . . A . 10 ALA CB . . . . . . . . . c30057_5j6t 1 . 10 . 2860 . 1 1 10 ALA H H 13.013 1.028 0.583 . . . 1.0 . . . . . . . . . . . . A . 10 ALA H . . . . . . . . . c30057_5j6t 1 . 10 . 2861 . 1 1 10 ALA HA H 14.443 1.923 -1.809 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HA . . . . . . . . . c30057_5j6t 1 . 10 . 2862 . 1 1 10 ALA HB1 H 13.407 3.949 -1.284 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HB1 . . . . . . . . . c30057_5j6t 1 . 10 . 2863 . 1 1 10 ALA HB2 H 13.695 3.759 0.462 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HB2 . . . . . . . . . c30057_5j6t 1 . 10 . 2864 . 1 1 10 ALA HB3 H 12.392 2.841 -0.330 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HB3 . . . . . . . . . c30057_5j6t 1 . 10 . 2865 . 1 1 10 ALA N N 13.794 0.914 -0.047 . . . 1.0 . . . . . . . . . . . . A . 10 ALA N . . . . . . . . . c30057_5j6t 1 . 10 . 2866 . 1 1 10 ALA O O 16.624 2.924 -0.852 . . . 1.0 . . . . . . . . . . . . A . 10 ALA O . . . . . . . . . c30057_5j6t 1 . 10 . 2867 . 1 1 11 LEU C C 18.281 1.309 1.406 . . . 1.0 . . . . . . . . . . . . A . 11 LEU C . . . . . . . . . c30057_5j6t 1 . 10 . 2868 . 1 1 11 LEU CA C 17.290 2.435 1.719 . . . 1.0 . . . . . . . . . . . . A . 11 LEU CA . . . . . . . . . c30057_5j6t 1 . 10 . 2869 . 1 1 11 LEU CB C 17.014 2.503 3.221 . . . 1.0 . . . . . . . . . . . . A . 11 LEU CB . . . . . . . . . c30057_5j6t 1 . 10 . 2870 . 1 1 11 LEU CD1 C 15.203 3.350 4.720 . . . 1.0 . . . . . . . . . . . . A . 11 LEU CD1 . . . . . . . . . c30057_5j6t 1 . 10 . 2871 . 1 1 11 LEU CD2 C 16.936 4.920 3.842 . . . 1.0 . . . . . . . . . . . . A . 11 LEU CD2 . . . . . . . . . c30057_5j6t 1 . 10 . 2872 . 1 1 11 LEU CG C 16.092 3.684 3.520 . . . 1.0 . . . . . . . . . . . . A . 11 LEU CG . . . . . . . . . c30057_5j6t 1 . 10 . 2873 . 1 1 11 LEU H H 15.229 1.729 1.647 . . . 1.0 . . . . . . . . . . . . A . 11 LEU H . . . . . . . . . c30057_5j6t 1 . 10 . 2874 . 1 1 11 LEU HA H 17.676 3.389 1.361 . . . 1.0 . . . . . . . . . . . . A . 11 LEU HA . . . . . . . . . c30057_5j6t 1 . 10 . 2875 . 1 1 11 LEU HB2 H 16.536 1.578 3.545 . . . 1.0 . . . . . . . . . . . . A . 11 LEU HB2 . . . . . . . . . c30057_5j6t 1 . 10 . 2876 . 1 1 11 LEU HB3 H 17.955 2.631 3.757 . . . 1.0 . . . . . . . . . . . . A . 11 LEU HB3 . . . . . . . . . c30057_5j6t 1 . 10 . 2877 . 1 1 11 LEU HD11 H 14.601 2.470 4.493 . . . 1.0 . . . . . . . . . . . . A . 11 LEU HD11 . . . . . . . . . c30057_5j6t 1 . 10 . 2878 . 1 1 11 LEU HD12 H 14.547 4.194 4.933 . . . 1.0 . . . . . . . . . . . . A . 11 LEU HD12 . . . . . . . . . c30057_5j6t 1 . 10 . 2879 . 1 1 11 LEU HD13 H 15.828 3.147 5.590 . . . 1.0 . . . . . . . . . . . . A . 11 LEU HD13 . . . . . . . . . c30057_5j6t 1 . 10 . 2880 . 1 1 11 LEU HD21 H 16.280 5.764 4.055 . . . 1.0 . . . . . . . . . . . . A . 11 LEU HD21 . . . . . . . . . c30057_5j6t 1 . 10 . 2881 . 1 1 11 LEU HD22 H 17.569 5.159 2.988 . . . 1.0 . . . . . . . . . . . . A . 11 LEU HD22 . . . . . . . . . c30057_5j6t 1 . 10 . 2882 . 1 1 11 LEU HD23 H 17.561 4.716 4.711 . . . 1.0 . . . . . . . . . . . . A . 11 LEU HD23 . . . . . . . . . c30057_5j6t 1 . 10 . 2883 . 1 1 11 LEU HG H 15.467 3.887 2.651 . . . 1.0 . . . . . . . . . . . . A . 11 LEU HG . . . . . . . . . c30057_5j6t 1 . 10 . 2884 . 1 1 11 LEU N N 15.965 2.144 1.095 . . . 1.0 . . . . . . . . . . . . A . 11 LEU N . . . . . . . . . c30057_5j6t 1 . 10 . 2885 . 1 1 11 LEU O O 19.478 1.515 1.385 . . . 1.0 . . . . . . . . . . . . A . 11 LEU O . . . . . . . . . c30057_5j6t 1 . 10 . 2886 . 1 1 12 GLY C C 19.082 -0.985 -0.622 . . . 1.0 . . . . . . . . . . . . A . 12 GLY C . . . . . . . . . c30057_5j6t 1 . 10 . 2887 . 1 1 12 GLY CA C 18.705 -1.015 0.860 . . . 1.0 . . . . . . . . . . . . A . 12 GLY CA . . . . . . . . . c30057_5j6t 1 . 10 . 2888 . 1 1 12 GLY H H 16.792 -0.024 1.192 . . . 1.0 . . . . . . . . . . . . A . 12 GLY H . . . . . . . . . c30057_5j6t 1 . 10 . 2889 . 1 1 12 GLY HA2 H 19.607 -0.931 1.466 . . . 1.0 . . . . . . . . . . . . A . 12 GLY HA2 . . . . . . . . . c30057_5j6t 1 . 10 . 2890 . 1 1 12 GLY HA3 H 18.202 -1.955 1.087 . . . 1.0 . . . . . . . . . . . . A . 12 GLY HA3 . . . . . . . . . c30057_5j6t 1 . 10 . 2891 . 1 1 12 GLY N N 17.791 0.123 1.168 . . . 1.0 . . . . . . . . . . . . A . 12 GLY N . . . . . . . . . c30057_5j6t 1 . 10 . 2892 . 1 1 12 GLY O O 20.169 -1.374 -1.004 . . . 1.0 . . . . . . . . . . . . A . 12 GLY O . . . . . . . . . c30057_5j6t 1 . 10 . 2893 . 1 1 13 ALA C C 19.691 0.451 -3.177 . . . 1.0 . . . . . . . . . . . . A . 13 ALA C . . . . . . . . . c30057_5j6t 1 . 10 . 2894 . 1 1 13 ALA CA C 18.499 -0.471 -2.923 . . . 1.0 . . . . . . . . . . . . A . 13 ALA CA . . . . . . . . . c30057_5j6t 1 . 10 . 2895 . 1 1 13 ALA CB C 17.235 0.089 -3.576 . . . 1.0 . . . . . . . . . . . . A . 13 ALA CB . . . . . . . . . c30057_5j6t 1 . 10 . 2896 . 1 1 13 ALA H H 17.294 -0.210 -1.124 . . . 1.0 . . . . . . . . . . . . A . 13 ALA H . . . . . . . . . c30057_5j6t 1 . 10 . 2897 . 1 1 13 ALA HA H 18.708 -1.472 -3.302 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HA . . . . . . . . . c30057_5j6t 1 . 10 . 2898 . 1 1 13 ALA HB1 H 17.384 0.160 -4.654 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HB1 . . . . . . . . . c30057_5j6t 1 . 10 . 2899 . 1 1 13 ALA HB2 H 16.395 -0.573 -3.368 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HB2 . . . . . . . . . c30057_5j6t 1 . 10 . 2900 . 1 1 13 ALA HB3 H 17.026 1.079 -3.172 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HB3 . . . . . . . . . c30057_5j6t 1 . 10 . 2901 . 1 1 13 ALA N N 18.191 -0.527 -1.463 . . . 1.0 . . . . . . . . . . . . A . 13 ALA N . . . . . . . . . c30057_5j6t 1 . 10 . 2902 . 1 1 13 ALA O O 20.465 0.247 -4.093 . . . 1.0 . . . . . . . . . . . . A . 13 ALA O . . . . . . . . . c30057_5j6t 1 . 10 . 2903 . 1 1 14 LEU C C 22.281 1.776 -2.030 . . . 1.0 . . . . . . . . . . . . A . 14 LEU C . . . . . . . . . c30057_5j6t 1 . 10 . 2904 . 1 1 14 LEU CA C 20.988 2.405 -2.559 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CA . . . . . . . . . c30057_5j6t 1 . 10 . 2905 . 1 1 14 LEU CB C 20.617 3.646 -1.743 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CB . . . . . . . . . c30057_5j6t 1 . 10 . 2906 . 1 1 14 LEU CD1 C 21.924 5.162 -3.243 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CD1 . . . . . . . . . c30057_5j6t 1 . 10 . 2907 . 1 1 14 LEU CD2 C 21.433 5.849 -0.891 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CD2 . . . . . . . . . c30057_5j6t 1 . 10 . 2908 . 1 1 14 LEU CG C 21.758 4.665 -1.805 . . . 1.0 . . . . . . . . . . . . A . 14 LEU CG . . . . . . . . . c30057_5j6t 1 . 10 . 2909 . 1 1 14 LEU H H 19.190 1.613 -1.617 . . . 1.0 . . . . . . . . . . . . A . 14 LEU H . . . . . . . . . c30057_5j6t 1 . 10 . 2910 . 1 1 14 LEU HA H 21.097 2.663 -3.612 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HA . . . . . . . . . c30057_5j6t 1 . 10 . 2911 . 1 1 14 LEU HB2 H 19.711 4.092 -2.153 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HB2 . . . . . . . . . c30057_5j6t 1 . 10 . 2912 . 1 1 14 LEU HB3 H 20.444 3.360 -0.705 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HB3 . . . . . . . . . c30057_5j6t 1 . 10 . 2913 . 1 1 14 LEU HD11 H 22.156 4.320 -3.895 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD11 . . . . . . . . . c30057_5j6t 1 . 10 . 2914 . 1 1 14 LEU HD12 H 22.737 5.887 -3.285 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD12 . . . . . . . . . c30057_5j6t 1 . 10 . 2915 . 1 1 14 LEU HD13 H 20.999 5.634 -3.574 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD13 . . . . . . . . . c30057_5j6t 1 . 10 . 2916 . 1 1 14 LEU HD21 H 22.245 6.575 -0.935 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD21 . . . . . . . . . c30057_5j6t 1 . 10 . 2917 . 1 1 14 LEU HD22 H 20.507 6.319 -1.221 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD22 . . . . . . . . . c30057_5j6t 1 . 10 . 2918 . 1 1 14 LEU HD23 H 21.317 5.495 0.133 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HD23 . . . . . . . . . c30057_5j6t 1 . 10 . 2919 . 1 1 14 LEU HG H 22.684 4.194 -1.475 . . . 1.0 . . . . . . . . . . . . A . 14 LEU HG . . . . . . . . . c30057_5j6t 1 . 10 . 2920 . 1 1 14 LEU N N 19.846 1.465 -2.371 . . . 1.0 . . . . . . . . . . . . A . 14 LEU N . . . . . . . . . c30057_5j6t 1 . 10 . 2921 . 1 1 14 LEU O O 23.301 1.782 -2.691 . . . 1.0 . . . . . . . . . . . . A . 14 LEU O . . . . . . . . . c30057_5j6t 1 . 10 . 2922 . 1 1 15 LYS C C 23.994 -0.491 -1.201 . . . 1.0 . . . . . . . . . . . . A . 15 LYS C . . . . . . . . . c30057_5j6t 1 . 10 . 2923 . 1 1 15 LYS CA C 23.469 0.602 -0.265 . . . 1.0 . . . . . . . . . . . . A . 15 LYS CA . . . . . . . . . c30057_5j6t 1 . 10 . 2924 . 1 1 15 LYS CB C 23.019 -0.003 1.069 . . . 1.0 . . . . . . . . . . . . A . 15 LYS CB . . . . . . . . . c30057_5j6t 1 . 10 . 2925 . 1 1 15 LYS CD C 23.372 1.310 3.172 . . . 1.0 . . . . . . . . . . . . A . 15 LYS CD . . . . . . . . . c30057_5j6t 1 . 10 . 2926 . 1 1 15 LYS CE C 23.046 2.638 2.483 . . . 1.0 . . . . . . . . . . . . A . 15 LYS CE . . . . . . . . . c30057_5j6t 1 . 10 . 2927 . 1 1 15 LYS CG C 24.026 0.359 2.166 . . . 1.0 . . . . . . . . . . . . A . 15 LYS CG . . . . . . . . . c30057_5j6t 1 . 10 . 2928 . 1 1 15 LYS H H 21.383 1.242 -0.311 . . . 1.0 . . . . . . . . . . . . A . 15 LYS H . . . . . . . . . c30057_5j6t 1 . 10 . 2929 . 1 1 15 LYS HA H 24.238 1.356 -0.096 . . . 1.0 . . . . . . . . . . . . A . 15 LYS HA . . . . . . . . . c30057_5j6t 1 . 10 . 2930 . 1 1 15 LYS HB2 H 22.037 0.390 1.333 . . . 1.0 . . . . . . . . . . . . A . 15 LYS HB2 . . . . . . . . . c30057_5j6t 1 . 10 . 2931 . 1 1 15 LYS HB3 H 22.962 -1.088 0.973 . . . 1.0 . . . . . . . . . . . . A . 15 LYS HB3 . . . . . . . . . c30057_5j6t 1 . 10 . 2932 . 1 1 15 LYS HD2 H 22.453 0.863 3.550 . . . 1.0 . . . . . . . . . . . . A . 15 LYS HD2 . . . . . . . . . c30057_5j6t 1 . 10 . 2933 . 1 1 15 LYS HD3 H 24.057 1.489 4.001 . . . 1.0 . . . . . . . . . . . . A . 15 LYS HD3 . . . . . . . . . c30057_5j6t 1 . 10 . 2934 . 1 1 15 LYS HE2 H 23.004 2.501 1.402 . . . 1.0 . . . . . . . . . . . . A . 15 LYS HE2 . . . . . . . . . c30057_5j6t 1 . 10 . 2935 . 1 1 15 LYS HE3 H 22.101 3.038 2.849 . . . 1.0 . . . . . . . . . . . . A . 15 LYS HE3 . . . . . . . . . c30057_5j6t 1 . 10 . 2936 . 1 1 15 LYS HG2 H 24.345 -0.548 2.680 . . . 1.0 . . . . . . . . . . . . A . 15 LYS HG2 . . . . . . . . . c30057_5j6t 1 . 10 . 2937 . 1 1 15 LYS HG3 H 24.891 0.846 1.717 . . . 1.0 . . . . . . . . . . . . A . 15 LYS HG3 . . . . . . . . . c30057_5j6t 1 . 10 . 2938 . 1 1 15 LYS HZ1 H 24.025 4.449 2.419 . . . 1.0 . . . . . . . . . . . . A . 15 LYS HZ1 . . . . . . . . . c30057_5j6t 1 . 10 . 2939 . 1 1 15 LYS HZ2 H 25.040 3.153 2.506 . . . 1.0 . . . . . . . . . . . . A . 15 LYS HZ2 . . . . . . . . . c30057_5j6t 1 . 10 . 2940 . 1 1 15 LYS HZ3 H 24.215 3.646 3.847 . . . 1.0 . . . . . . . . . . . . A . 15 LYS HZ3 . . . . . . . . . c30057_5j6t 1 . 10 . 2941 . 1 1 15 LYS N N 22.243 1.234 -0.841 . . . 1.0 . . . . . . . . . . . . A . 15 LYS N . . . . . . . . . c30057_5j6t 1 . 10 . 2942 . 1 1 15 LYS NZ N 24.172 3.544 2.843 . . . 1.0 . . . . . . . . . . . . A . 15 LYS NZ . . . . . . . . . c30057_5j6t 1 . 10 . 2943 . 1 1 15 LYS O O 25.185 -0.705 -1.312 . . . 1.0 . . . . . . . . . . . . A . 15 LYS O . . . . . . . . . c30057_5j6t 1 . 10 . 2944 . 1 1 16 ASN C C 24.216 -1.638 -4.046 . . . 1.0 . . . . . . . . . . . . A . 16 ASN C . . . . . . . . . c30057_5j6t 1 . 10 . 2945 . 1 1 16 ASN CA C 23.561 -2.256 -2.808 . . . 1.0 . . . . . . . . . . . . A . 16 ASN CA . . . . . . . . . c30057_5j6t 1 . 10 . 2946 . 1 1 16 ASN CB C 22.286 -3.004 -3.195 . . . 1.0 . . . . . . . . . . . . A . 16 ASN CB . . . . . . . . . c30057_5j6t 1 . 10 . 2947 . 1 1 16 ASN CG C 21.952 -4.038 -2.118 . . . 1.0 . . . . . . . . . . . . A . 16 ASN CG . . . . . . . . . c30057_5j6t 1 . 10 . 2948 . 1 1 16 ASN H H 22.128 -0.982 -1.768 . . . 1.0 . . . . . . . . . . . . A . 16 ASN H . . . . . . . . . c30057_5j6t 1 . 10 . 2949 . 1 1 16 ASN HA H 24.258 -2.927 -2.305 . . . 1.0 . . . . . . . . . . . . A . 16 ASN HA . . . . . . . . . c30057_5j6t 1 . 10 . 2950 . 1 1 16 ASN HB2 H 21.462 -2.296 -3.286 . . . 1.0 . . . . . . . . . . . . A . 16 ASN HB2 . . . . . . . . . c30057_5j6t 1 . 10 . 2951 . 1 1 16 ASN HB3 H 22.437 -3.510 -4.148 . . . 1.0 . . . . . . . . . . . . A . 16 ASN HB3 . . . . . . . . . c30057_5j6t 1 . 10 . 2952 . 1 1 16 ASN HD21 H 21.473 -2.645 -0.751 . . . 1.0 . . . . . . . . . . . . A . 16 ASN HD21 . . . . . . . . . c30057_5j6t 1 . 10 . 2953 . 1 1 16 ASN HD22 H 21.333 -4.307 -0.225 . . . 1.0 . . . . . . . . . . . . A . 16 ASN HD22 . . . . . . . . . c30057_5j6t 1 . 10 . 2954 . 1 1 16 ASN N N 23.113 -1.179 -1.876 . . . 1.0 . . . . . . . . . . . . A . 16 ASN N . . . . . . . . . c30057_5j6t 1 . 10 . 2955 . 1 1 16 ASN ND2 N 21.556 -3.633 -0.943 . . . 1.0 . . . . . . . . . . . . A . 16 ASN ND2 . . . . . . . . . c30057_5j6t 1 . 10 . 2956 . 1 1 16 ASN O O 25.149 -2.184 -4.604 . . . 1.0 . . . . . . . . . . . . A . 16 ASN O . . . . . . . . . c30057_5j6t 1 . 10 . 2957 . 1 1 16 ASN OD1 O 22.052 -5.226 -2.350 . . . 1.0 . . . . . . . . . . . . A . 16 ASN OD1 . . . . . . . . . c30057_5j6t 1 . 10 . 2958 . 1 1 17 LEU C C 25.724 0.689 -5.353 . . . 1.0 . . . . . . . . . . . . A . 17 LEU C . . . . . . . . . c30057_5j6t 1 . 10 . 2959 . 1 1 17 LEU CA C 24.328 0.156 -5.678 . . . 1.0 . . . . . . . . . . . . A . 17 LEU CA . . . . . . . . . c30057_5j6t 1 . 10 . 2960 . 1 1 17 LEU CB C 23.379 1.306 -6.013 . . . 1.0 . . . . . . . . . . . . A . 17 LEU CB . . . . . . . . . c30057_5j6t 1 . 10 . 2961 . 1 1 17 LEU CD1 C 23.095 1.440 -8.492 . . . 1.0 . . . . . . . . . . . . A . 17 LEU CD1 . . . . . . . . . c30057_5j6t 1 . 10 . 2962 . 1 1 17 LEU CD2 C 23.579 3.507 -7.178 . . . 1.0 . . . . . . . . . . . . A . 17 LEU CD2 . . . . . . . . . c30057_5j6t 1 . 10 . 2963 . 1 1 17 LEU CG C 23.851 2.006 -7.289 . . . 1.0 . . . . . . . . . . . . A . 17 LEU CG . . . . . . . . . c30057_5j6t 1 . 10 . 2964 . 1 1 17 LEU H H 22.960 -0.069 -3.996 . . . 1.0 . . . . . . . . . . . . A . 17 LEU H . . . . . . . . . c30057_5j6t 1 . 10 . 2965 . 1 1 17 LEU HA H 24.377 -0.548 -6.509 . . . 1.0 . . . . . . . . . . . . A . 17 LEU HA . . . . . . . . . c30057_5j6t 1 . 10 . 2966 . 1 1 17 LEU HB2 H 22.373 0.914 -6.165 . . . 1.0 . . . . . . . . . . . . A . 17 LEU HB2 . . . . . . . . . c30057_5j6t 1 . 10 . 2967 . 1 1 17 LEU HB3 H 23.370 2.020 -5.189 . . . 1.0 . . . . . . . . . . . . A . 17 LEU HB3 . . . . . . . . . c30057_5j6t 1 . 10 . 2968 . 1 1 17 LEU HD11 H 23.288 0.370 -8.572 . . . 1.0 . . . . . . . . . . . . A . 17 LEU HD11 . . . . . . . . . c30057_5j6t 1 . 10 . 2969 . 1 1 17 LEU HD12 H 22.026 1.607 -8.362 . . . 1.0 . . . . . . . . . . . . A . 17 LEU HD12 . . . . . . . . . c30057_5j6t 1 . 10 . 2970 . 1 1 17 LEU HD13 H 23.433 1.939 -9.401 . . . 1.0 . . . . . . . . . . . . A . 17 LEU HD13 . . . . . . . . . c30057_5j6t 1 . 10 . 2971 . 1 1 17 LEU HD21 H 24.116 3.912 -6.321 . . . 1.0 . . . . . . . . . . . . A . 17 LEU HD21 . . . . . . . . . c30057_5j6t 1 . 10 . 2972 . 1 1 17 LEU HD22 H 23.917 4.005 -8.087 . . . 1.0 . . . . . . . . . . . . A . 17 LEU HD22 . . . . . . . . . c30057_5j6t 1 . 10 . 2973 . 1 1 17 LEU HD23 H 22.509 3.674 -7.048 . . . 1.0 . . . . . . . . . . . . A . 17 LEU HD23 . . . . . . . . . c30057_5j6t 1 . 10 . 2974 . 1 1 17 LEU HG H 24.920 1.840 -7.420 . . . 1.0 . . . . . . . . . . . . A . 17 LEU HG . . . . . . . . . c30057_5j6t 1 . 10 . 2975 . 1 1 17 LEU N N 23.735 -0.503 -4.477 . . . 1.0 . . . . . . . . . . . . A . 17 LEU N . . . . . . . . . c30057_5j6t 1 . 10 . 2976 . 1 1 17 LEU O O 26.585 0.765 -6.209 . . . 1.0 . . . . . . . . . . . . A . 17 LEU O . . . . . . . . . c30057_5j6t 1 . 10 . 2977 . 1 1 18 ILE C C 28.204 0.452 -3.265 . . . 1.0 . . . . . . . . . . . . A . 18 ILE C . . . . . . . . . c30057_5j6t 1 . 10 . 2978 . 1 1 18 ILE CA C 27.294 1.590 -3.740 . . . 1.0 . . . . . . . . . . . . A . 18 ILE CA . . . . . . . . . c30057_5j6t 1 . 10 . 2979 . 1 1 18 ILE CB C 27.021 2.577 -2.602 . . . 1.0 . . . . . . . . . . . . A . 18 ILE CB . . . . . . . . . c30057_5j6t 1 . 10 . 2980 . 1 1 18 ILE CD1 C 26.489 2.683 -0.158 . . . 1.0 . . . . . . . . . . . . A . 18 ILE CD1 . . . . . . . . . c30057_5j6t 1 . 10 . 2981 . 1 1 18 ILE CG1 C 26.334 1.857 -1.437 . . . 1.0 . . . . . . . . . . . . A . 18 ILE CG1 . . . . . . . . . c30057_5j6t 1 . 10 . 2982 . 1 1 18 ILE CG2 C 26.115 3.701 -3.108 . . . 1.0 . . . . . . . . . . . . A . 18 ILE CG2 . . . . . . . . . c30057_5j6t 1 . 10 . 2983 . 1 1 18 ILE H H 25.225 0.986 -3.429 . . . 1.0 . . . . . . . . . . . . A . 18 ILE H . . . . . . . . . c30057_5j6t 1 . 10 . 2984 . 1 1 18 ILE HA H 27.748 2.107 -4.585 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HA . . . . . . . . . c30057_5j6t 1 . 10 . 2985 . 1 1 18 ILE HB H 27.965 3.001 -2.257 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HB . . . . . . . . . c30057_5j6t 1 . 10 . 2986 . 1 1 18 ILE HD11 H 25.999 2.168 0.669 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HD11 . . . . . . . . . c30057_5j6t 1 . 10 . 2987 . 1 1 18 ILE HD12 H 27.549 2.806 0.068 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HD12 . . . . . . . . . c30057_5j6t 1 . 10 . 2988 . 1 1 18 ILE HD13 H 26.032 3.662 -0.299 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HD13 . . . . . . . . . c30057_5j6t 1 . 10 . 2989 . 1 1 18 ILE HG12 H 25.274 1.734 -1.662 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HG12 . . . . . . . . . c30057_5j6t 1 . 10 . 2990 . 1 1 18 ILE HG13 H 26.791 0.878 -1.295 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HG13 . . . . . . . . . c30057_5j6t 1 . 10 . 2991 . 1 1 18 ILE HG21 H 26.601 4.216 -3.937 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HG21 . . . . . . . . . c30057_5j6t 1 . 10 . 2992 . 1 1 18 ILE HG22 H 25.929 4.409 -2.300 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HG22 . . . . . . . . . c30057_5j6t 1 . 10 . 2993 . 1 1 18 ILE HG23 H 25.168 3.280 -3.447 . . . 1.0 . . . . . . . . . . . . A . 18 ILE HG23 . . . . . . . . . c30057_5j6t 1 . 10 . 2994 . 1 1 18 ILE N N 25.955 1.059 -4.123 . . . 1.0 . . . . . . . . . . . . A . 18 ILE N . . . . . . . . . c30057_5j6t 1 . 10 . 2995 . 1 1 18 ILE O O 29.414 0.565 -3.284 . . . 1.0 . . . . . . . . . . . . A . 18 ILE O . . . . . . . . . c30057_5j6t 1 . 10 . 2996 . 1 1 19 LYS C C 28.941 -2.625 -3.557 . . . 1.0 . . . . . . . . . . . . A . 19 LYS C . . . . . . . . . c30057_5j6t 1 . 10 . 2997 . 1 1 19 LYS CA C 28.464 -1.788 -2.367 . . . 1.0 . . . . . . . . . . . . A . 19 LYS CA . . . . . . . . . c30057_5j6t 1 . 10 . 2998 . 1 1 19 LYS CB C 27.536 -2.609 -1.471 . . . 1.0 . . . . . . . . . . . . A . 19 LYS CB . . . . . . . . . c30057_5j6t 1 . 10 . 2999 . 1 1 19 LYS CD C 28.418 -2.572 0.868 . . . 1.0 . . . . . . . . . . . . A . 19 LYS CD . . . . . . . . . c30057_5j6t 1 . 10 . 3000 . 1 1 19 LYS CE C 28.092 -2.136 2.298 . . . 1.0 . . . . . . . . . . . . A . 19 LYS CE . . . . . . . . . c30057_5j6t 1 . 10 . 3001 . 1 1 19 LYS CG C 27.418 -1.938 -0.102 . . . 1.0 . . . . . . . . . . . . A . 19 LYS CG . . . . . . . . . c30057_5j6t 1 . 10 . 3002 . 1 1 19 LYS H H 26.624 -0.717 -2.834 . . . 1.0 . . . . . . . . . . . . A . 19 LYS H . . . . . . . . . c30057_5j6t 1 . 10 . 3003 . 1 1 19 LYS HA H 29.317 -1.423 -1.795 . . . 1.0 . . . . . . . . . . . . A . 19 LYS HA . . . . . . . . . c30057_5j6t 1 . 10 . 3004 . 1 1 19 LYS HB2 H 26.549 -2.672 -1.930 . . . 1.0 . . . . . . . . . . . . A . 19 LYS HB2 . . . . . . . . . c30057_5j6t 1 . 10 . 3005 . 1 1 19 LYS HB3 H 27.943 -3.613 -1.349 . . . 1.0 . . . . . . . . . . . . A . 19 LYS HB3 . . . . . . . . . c30057_5j6t 1 . 10 . 3006 . 1 1 19 LYS HD2 H 28.355 -3.657 0.796 . . . 1.0 . . . . . . . . . . . . A . 19 LYS HD2 . . . . . . . . . c30057_5j6t 1 . 10 . 3007 . 1 1 19 LYS HD3 H 29.427 -2.249 0.611 . . . 1.0 . . . . . . . . . . . . A . 19 LYS HD3 . . . . . . . . . c30057_5j6t 1 . 10 . 3008 . 1 1 19 LYS HE2 H 27.073 -1.754 2.359 . . . 1.0 . . . . . . . . . . . . A . 19 LYS HE2 . . . . . . . . . c30057_5j6t 1 . 10 . 3009 . 1 1 19 LYS HE3 H 28.222 -2.972 2.985 . . . 1.0 . . . . . . . . . . . . A . 19 LYS HE3 . . . . . . . . . c30057_5j6t 1 . 10 . 3010 . 1 1 19 LYS HG2 H 27.631 -0.873 -0.200 . . . 1.0 . . . . . . . . . . . . A . 19 LYS HG2 . . . . . . . . . c30057_5j6t 1 . 10 . 3011 . 1 1 19 LYS HG3 H 26.406 -2.072 0.282 . . . 1.0 . . . . . . . . . . . . A . 19 LYS HG3 . . . . . . . . . c30057_5j6t 1 . 10 . 3012 . 1 1 19 LYS HZ1 H 28.919 -0.719 3.544 . . . 1.0 . . . . . . . . . . . . A . 19 LYS HZ1 . . . . . . . . . c30057_5j6t 1 . 10 . 3013 . 1 1 19 LYS HZ2 H 30.012 -1.428 2.533 . . . 1.0 . . . . . . . . . . . . A . 19 LYS HZ2 . . . . . . . . . c30057_5j6t 1 . 10 . 3014 . 1 1 19 LYS HZ3 H 28.959 -0.300 1.949 . . . 1.0 . . . . . . . . . . . . A . 19 LYS HZ3 . . . . . . . . . c30057_5j6t 1 . 10 . 3015 . 1 1 19 LYS N N 27.631 -0.644 -2.841 . . . 1.0 . . . . . . . . . . . . A . 19 LYS N . . . . . . . . . c30057_5j6t 1 . 10 . 3016 . 1 1 19 LYS NZ N 29.074 -1.059 2.606 . . . 1.0 . . . . . . . . . . . . A . 19 LYS NZ . . . . . . . . . c30057_5j6t 1 . 10 . 3017 . 1 1 19 LYS O O 28.746 -2.254 -4.697 . . . 1.0 . . . . . . . . . . . . A . 19 LYS O . . . . . . . . . c30057_5j6t 1 . 10 . 3018 . 1 1 20 NH2 HN1 H 29.725 -4.061 -2.390 . . . 1.0 . . . . . . . . . . . . A . 20 NH2 HN1 . . . . . . . . . c30057_5j6t 1 . 10 . 3019 . 1 1 20 NH2 HN2 H 29.882 -4.312 -4.114 . . . 1.0 . . . . . . . . . . . . A . 20 NH2 HN2 . . . . . . . . . c30057_5j6t 1 . 10 . 3020 . 1 1 20 NH2 N N 29.563 -3.751 -3.337 . . . 1.0 . . . . . . . . . . . . A . 20 NH2 N . . . . . . . . . c30057_5j6t 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 c30057_5j6t _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 5j6t.mr . . 'MR format' 1 comment 'Not applicable' 'Not applicable' 0 c30057_5j6t 1 1 5j6t.mr . . XPLOR/CNS 2 distance NOE simple 152 c30057_5j6t 1 1 5j6t.mr . . 'MR format' 3 'nomenclature mapping' 'Not applicable' 'Not applicable' 0 c30057_5j6t 1 stop_ save_ save_CNS/XPLOR_distance_constraints_2 _Gen_dist_constraint_list.Sf_category general_distance_constraints _Gen_dist_constraint_list.Sf_framecode CNS/XPLOR_distance_constraints_2 _Gen_dist_constraint_list.Entry_ID c30057_5j6t _Gen_dist_constraint_list.ID 1 _Gen_dist_constraint_list.Constraint_type NOE _Gen_dist_constraint_list.Details 'Generated by Wattos' _Gen_dist_constraint_list.Constraint_file_ID 1 _Gen_dist_constraint_list.Block_ID 2 loop_ _Gen_dist_constraint_software.Software_ID _Gen_dist_constraint_software.Software_label _Gen_dist_constraint_software.Method_ID _Gen_dist_constraint_software.Method_label _Gen_dist_constraint_software.Entry_ID _Gen_dist_constraint_software.Gen_dist_constraint_list_ID . . . . c30057_5j6t 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 2 2 ILE HA H . . . 1 1 2 2 ILE HB H . . . . . 4.0 1.8 4.0 . . . . . A . 2 ILE HA . . A . 2 ILE HB . . . 2 . HA . . . . . 2 . HB . . c30057_5j6t 1 2 1 OR . 1 1 2 2 ILE HA H . . . 1 1 2 2 ILE HG12 H . . . . . 4.0 1.8 4.0 . . . . . A . 2 ILE HA . . A . 2 ILE HG12 . . . 2 . HA . . . . . 2 . HG1# . . c30057_5j6t 1 2 2 OR . 1 1 2 2 ILE HA H . . . 1 1 2 2 ILE HG13 H . . . . . 4.0 1.8 4.0 . . . . . A . 2 ILE HA . . A . 2 ILE HG13 . . . 2 . HA . . . . . 2 . HG1# . . c30057_5j6t 1 3 1 . . 1 1 2 2 ILE HA H . . . 1 1 2 2 ILE MG H . . . . . 5.0 1.8 5.0 . . . . . A . 2 ILE HA . . A . 2 ILE MG . . . 2 . HA . . . . . 2 . HG2# . . c30057_5j6t 1 4 1 . . 1 1 2 2 ILE HB H . . . 1 1 2 2 ILE MG H . . . . . 3.5 1.8 3.5 . . . . . A . 2 ILE HB . . A . 2 ILE MG . . . 2 . HB . . . . . 2 . HG2# . . c30057_5j6t 1 5 1 . . 1 1 2 2 ILE H H . . . 1 1 2 2 ILE HA H . . . . . 5.0 1.8 5.0 . . . . . A . 2 ILE H . . A . 2 ILE HA . . . 2 . HN . . . . . 2 . HA . . c30057_5j6t 1 6 1 . . 1 1 2 2 ILE H H . . . 1 1 2 2 ILE HB H . . . . . 4.0 1.8 4.0 . . . . . A . 2 ILE H . . A . 2 ILE HB . . . 2 . HN . . . . . 2 . HB . . c30057_5j6t 1 7 1 OR . 1 1 2 2 ILE H H . . . 1 1 2 2 ILE HG12 H . . . . . 5.0 1.8 5.0 . . . . . A . 2 ILE H . . A . 2 ILE HG12 . . . 2 . HN . . . . . 2 . HG1# . . c30057_5j6t 1 7 2 OR . 1 1 2 2 ILE H H . . . 1 1 2 2 ILE HG13 H . . . . . 5.0 1.8 5.0 . . . . . A . 2 ILE H . . A . 2 ILE HG13 . . . 2 . HN . . . . . 2 . HG1# . . c30057_5j6t 1 8 1 . . 1 1 2 2 ILE H H . . . 1 1 2 2 ILE MG H . . . . . 5.0 1.8 5.0 . . . . . A . 2 ILE H . . A . 2 ILE MG . . . 2 . HN . . . . . 2 . HG2# . . c30057_5j6t 1 9 1 . . 1 1 2 2 ILE HA H . . . 1 1 2 2 ILE MD H . . . . . 5.0 1.8 5.0 . . . . . A . 2 ILE HA . . A . 2 ILE MD . . . 2 . HA . . . . . 2 . HD1# . . c30057_5j6t 1 10 1 . . 1 1 2 2 ILE H H . . . 1 1 2 2 ILE MD H . . . . . 5.0 1.8 5.0 . . . . . A . 2 ILE H . . A . 2 ILE MD . . . 2 . HN . . . . . 2 . HD1# . . c30057_5j6t 1 11 1 . . 1 1 3 3 PHE H H . . . 1 1 2 2 ILE HA H . . . . . 3.4 1.8 3.4 . . . . . A . 3 PHE H . . A . 2 ILE HA . . . 3 . HN . . . . . 2 . HA . . c30057_5j6t 1 12 1 . . 1 1 3 3 PHE H H . . . 1 1 2 2 ILE HB H . . . . . 5.0 1.8 5.0 . . . . . A . 3 PHE H . . A . 2 ILE HB . . . 3 . HN . . . . . 2 . HB . . c30057_5j6t 1 13 1 . . 1 1 3 3 PHE H H . . . 1 1 3 3 PHE HA H . . . . . 4.0 1.8 4.0 . . . . . A . 3 PHE H . . A . 3 PHE HA . . . 3 . HN . . . . . 3 . HA . . c30057_5j6t 1 14 1 . . 1 1 3 3 PHE HA H . . . 1 1 3 3 PHE QE H . . . . . 5.0 1.8 5.0 . . . . . A . 3 PHE HA . . A . 3 PHE QE . . . 3 . HA . . . . . 3 . HE# . . c30057_5j6t 1 15 1 OR . 1 1 3 3 PHE H H . . . 1 1 3 3 PHE HB2 H . . . . . 5.0 1.8 5.0 . . . . . A . 3 PHE H . . A . 3 PHE HB2 . . . 3 . HN . . . . . 3 . HB# . . c30057_5j6t 1 15 2 OR . 1 1 3 3 PHE H H . . . 1 1 3 3 PHE HB3 H . . . . . 5.0 1.8 5.0 . . . . . A . 3 PHE H . . A . 3 PHE HB3 . . . 3 . HN . . . . . 3 . HB# . . c30057_5j6t 1 16 1 . . 1 1 3 3 PHE HZ H . . . 1 1 3 3 PHE QD H . . . . . 3.5 1.8 4.0 . . . . . A . 3 PHE HZ . . A . 3 PHE QD . . . 3 . HZ . . . . . 3 . HD# . . c30057_5j6t 1 17 1 OR . 1 1 3 3 PHE QD H . . . 1 1 3 3 PHE HB2 H . . . . . 3.5 1.8 4.0 . . . . . A . 3 PHE QD . . A . 3 PHE HB2 . . . 3 . HD# . . . . . 3 . HB# . . c30057_5j6t 1 17 2 OR . 1 1 3 3 PHE HB3 H . . . 1 1 3 3 PHE QD H . . . . . 3.5 1.8 4.0 . . . . . A . 3 PHE HB3 . . A . 3 PHE QD . . . 3 . HB# . . . . . 3 . HD# . . c30057_5j6t 1 18 1 . . 1 1 3 3 PHE HA H . . . 1 1 4 4 GLY H H . . . . . 4.0 1.8 4.0 . . . . . A . 3 PHE HA . . A . 4 GLY H . . . 3 . HA . . . . . 4 . HN . . c30057_5j6t 1 19 1 OR . 1 1 4 4 GLY H H . . . 1 1 4 4 GLY HA2 H . . . . . 3.5 1.8 3.5 . . . . . A . 4 GLY H . . A . 4 GLY HA2 . . . 4 . HN . . . . . 4 . HA# . . c30057_5j6t 1 19 2 OR . 1 1 4 4 GLY H H . . . 1 1 4 4 GLY HA3 H . . . . . 3.5 1.8 3.5 . . . . . A . 4 GLY H . . A . 4 GLY HA3 . . . 4 . HN . . . . . 4 . HA# . . c30057_5j6t 1 20 1 OR . 1 1 3 3 PHE HB3 H . . . 1 1 4 4 GLY HA2 H . . . . . 5.0 1.8 5.0 . . . . . A . 3 PHE HB3 . . A . 4 GLY HA2 . . . 3 . HB# . . . . . 4 . HA# . . c30057_5j6t 1 20 2 OR . 1 1 3 3 PHE HB2 H . . . 1 1 4 4 GLY HA2 H . . . . . 5.0 1.8 5.0 . . . . . A . 3 PHE HB2 . . A . 4 GLY HA2 . . . 3 . HB# . . . . . 4 . HA# . . c30057_5j6t 1 20 3 OR . 1 1 4 4 GLY HA3 H . . . 1 1 3 3 PHE HB2 H . . . . . 5.0 1.8 5.0 . . . . . A . 4 GLY HA3 . . A . 3 PHE HB2 . . . 4 . HA# . . . . . 3 . HB# . . c30057_5j6t 1 20 4 OR . 1 1 3 3 PHE HB3 H . . . 1 1 4 4 GLY HA3 H . . . . . 5.0 1.8 5.0 . . . . . A . 3 PHE HB3 . . A . 4 GLY HA3 . . . 3 . HB# . . . . . 4 . HA# . . c30057_5j6t 1 21 1 OR . 1 1 4 4 GLY H H . . . 1 1 3 3 PHE HB2 H . . . . . 5.0 1.8 5.0 . . . . . A . 4 GLY H . . A . 3 PHE HB2 . . . 4 . HN . . . . . 3 . HB# . . c30057_5j6t 1 21 2 OR . 1 1 3 3 PHE HB3 H . . . 1 1 4 4 GLY H H . . . . . 5.0 1.8 5.0 . . . . . A . 3 PHE HB3 . . A . 4 GLY H . . . 3 . HB# . . . . . 4 . HN . . c30057_5j6t 1 22 1 . . 1 1 2 2 ILE HA H . . . 1 1 4 4 GLY H H . . . . . 4.0 1.8 4.0 . . . . . A . 2 ILE HA . . A . 4 GLY H . . . 2 . HA . . . . . 4 . HN . . c30057_5j6t 1 23 1 OR . 1 1 5 5 ALA H H . . . 1 1 4 4 GLY HA2 H . . . . . 3.4 1.8 3.4 . . . . . A . 5 ALA H . . A . 4 GLY HA2 . . . 5 . HN . . . . . 4 . HA# . . c30057_5j6t 1 23 2 OR . 1 1 4 4 GLY HA3 H . . . 1 1 5 5 ALA H H . . . . . 3.4 1.8 3.4 . . . . . A . 4 GLY HA3 . . A . 5 ALA H . . . 4 . HA# . . . . . 5 . HN . . c30057_5j6t 1 24 1 . . 1 1 3 3 PHE HA H . . . 1 1 5 5 ALA H H . . . . . 4.5 1.8 4.5 . . . . . A . 3 PHE HA . . A . 5 ALA H . . . 3 . HA . . . . . 5 . HN . . c30057_5j6t 1 25 1 . . 1 1 5 5 ALA HA H . . . 1 1 5 5 ALA MB H . . . . . 4.0 1.8 4.0 . . . . . A . 5 ALA HA . . A . 5 ALA MB . . . 5 . HA . . . . . 5 . HB# . . c30057_5j6t 1 26 1 . . 1 1 5 5 ALA H H . . . 1 1 5 5 ALA HA H . . . . . 3.5 1.8 3.5 . . . . . A . 5 ALA H . . A . 5 ALA HA . . . 5 . HN . . . . . 5 . HA . . c30057_5j6t 1 27 1 . . 1 1 5 5 ALA H H . . . 1 1 5 5 ALA MB H . . . . . 4.3 1.8 4.3 . . . . . A . 5 ALA H . . A . 5 ALA MB . . . 5 . HN . . . . . 5 . HB# . . c30057_5j6t 1 28 1 . . 1 1 2 2 ILE HA H . . . 1 1 5 5 ALA H H . . . . . 3.5 1.8 3.5 . . . . . A . 2 ILE HA . . A . 5 ALA H . . . 2 . HA . . . . . 5 . HN . . c30057_5j6t 1 29 1 . . 1 1 2 2 ILE HB H . . . 1 1 5 5 ALA H H . . . . . 5.0 1.8 5.0 . . . . . A . 2 ILE HB . . A . 5 ALA H . . . 2 . HB . . . . . 5 . HN . . c30057_5j6t 1 30 1 . . 1 1 2 2 ILE HA H . . . 1 1 5 5 ALA MB H . . . . . 5.0 1.8 5.5 . . . . . A . 2 ILE HA . . A . 5 ALA MB . . . 2 . HA . . . . . 5 . HB# . . c30057_5j6t 1 31 1 OR . 1 1 5 5 ALA H H . . . 1 1 3 3 PHE HB2 H . . . . . 5.0 1.8 5.5 . . . . . A . 5 ALA H . . A . 3 PHE HB2 . . . 5 . HN . . . . . 3 . HB# . . c30057_5j6t 1 31 2 OR . 1 1 3 3 PHE HB3 H . . . 1 1 5 5 ALA H H . . . . . 5.0 1.8 5.5 . . . . . A . 3 PHE HB3 . . A . 5 ALA H . . . 3 . HB# . . . . . 5 . HN . . c30057_5j6t 1 32 1 . . 1 1 3 3 PHE QD H . . . 1 1 5 5 ALA H H . . . . . 5.0 1.8 5.5 . . . . . A . 3 PHE QD . . A . 5 ALA H . . . 3 . HD# . . . . . 5 . HN . . c30057_5j6t 1 33 1 . . 1 1 5 5 ALA HA H . . . 1 1 6 6 ILE H H . . . . . 3.5 1.8 3.5 . . . . . A . 5 ALA HA . . A . 6 ILE H . . . 5 . HA . . . . . 6 . HN . . c30057_5j6t 1 34 1 OR . 1 1 6 6 ILE H H . . . 1 1 4 4 GLY HA2 H . . . . . 5.0 1.8 5.0 . . . . . A . 6 ILE H . . A . 4 GLY HA2 . . . 6 . HN . . . . . 4 . HA# . . c30057_5j6t 1 34 2 OR . 1 1 4 4 GLY HA3 H . . . 1 1 6 6 ILE H H . . . . . 5.0 1.8 5.0 . . . . . A . 4 GLY HA3 . . A . 6 ILE H . . . 4 . HA# . . . . . 6 . HN . . c30057_5j6t 1 35 1 . . 1 1 3 3 PHE HA H . . . 1 1 6 6 ILE H H . . . . . 3.5 1.8 3.5 . . . . . A . 3 PHE HA . . A . 6 ILE H . . . 3 . HA . . . . . 6 . HN . . c30057_5j6t 1 36 1 OR . 1 1 6 6 ILE HA H . . . 1 1 6 6 ILE HG12 H . . . . . 4.0 1.8 4.0 . . . . . A . 6 ILE HA . . A . 6 ILE HG12 . . . 6 . HA . . . . . 6 . HG1# . . c30057_5j6t 1 36 2 OR . 1 1 6 6 ILE HA H . . . 1 1 6 6 ILE HG13 H . . . . . 4.0 1.8 4.0 . . . . . A . 6 ILE HA . . A . 6 ILE HG13 . . . 6 . HA . . . . . 6 . HG1# . . c30057_5j6t 1 37 1 OR . 1 1 6 6 ILE HB H . . . 1 1 6 6 ILE HG12 H . . . . . 4.0 1.8 4.0 . . . . . A . 6 ILE HB . . A . 6 ILE HG12 . . . 6 . HB . . . . . 6 . HG1# . . c30057_5j6t 1 37 2 OR . 1 1 6 6 ILE HG13 H . . . 1 1 6 6 ILE HB H . . . . . 4.0 1.8 4.0 . . . . . A . 6 ILE HG13 . . A . 6 ILE HB . . . 6 . HG1# . . . . . 6 . HB . . c30057_5j6t 1 38 1 . . 1 1 6 6 ILE H H . . . 1 1 6 6 ILE HA H . . . . . 4.0 1.8 4.0 . . . . . A . 6 ILE H . . A . 6 ILE HA . . . 6 . HN . . . . . 6 . HA . . c30057_5j6t 1 39 1 . . 1 1 6 6 ILE H H . . . 1 1 6 6 ILE HB H . . . . . 4.0 1.8 4.0 . . . . . A . 6 ILE H . . A . 6 ILE HB . . . 6 . HN . . . . . 6 . HB . . c30057_5j6t 1 40 1 OR . 1 1 6 6 ILE H H . . . 1 1 6 6 ILE HG12 H . . . . . 4.0 1.8 4.0 . . . . . A . 6 ILE H . . A . 6 ILE HG12 . . . 6 . HN . . . . . 6 . HG1# . . c30057_5j6t 1 40 2 OR . 1 1 6 6 ILE H H . . . 1 1 6 6 ILE HG13 H . . . . . 4.0 1.8 4.0 . . . . . A . 6 ILE H . . A . 6 ILE HG13 . . . 6 . HN . . . . . 6 . HG1# . . c30057_5j6t 1 41 1 . . 1 1 6 6 ILE HA H . . . 1 1 6 6 ILE HB H . . . . . 4.0 1.8 4.5 . . . . . A . 6 ILE HA . . A . 6 ILE HB . . . 6 . HA . . . . . 6 . HB . . c30057_5j6t 1 42 1 . . 1 1 5 5 ALA MB H . . . 1 1 6 6 ILE H H . . . . . 4.2 1.8 4.7 . . . . . A . 5 ALA MB . . A . 6 ILE H . . . 5 . HB# . . . . . 6 . HN . . c30057_5j6t 1 43 1 . . 1 1 6 6 ILE HB H . . . 1 1 7 7 TRP HD1 H . . . . . 5.0 1.8 5.0 . . . . . A . 6 ILE HB . . A . 7 TRP HD1 . . . 6 . HB . . . . . 7 . HD# . . c30057_5j6t 1 44 1 . . 1 1 6 6 ILE HA H . . . 1 1 7 7 TRP H H . . . . . 3.5 1.8 3.5 . . . . . A . 6 ILE HA . . A . 7 TRP H . . . 6 . HA . . . . . 7 . HN . . c30057_5j6t 1 45 1 . . 1 1 6 6 ILE H H . . . 1 1 7 7 TRP H H . . . . . 4.0 1.8 4.0 . . . . . A . 6 ILE H . . A . 7 TRP H . . . 6 . HN . . . . . 7 . HN . . c30057_5j6t 1 46 1 . . 1 1 7 7 TRP H H . . . 1 1 7 7 TRP HA H . . . . . 3.4 1.8 3.4 . . . . . A . 7 TRP H . . A . 7 TRP HA . . . 7 . HN . . . . . 7 . HA . . c30057_5j6t 1 47 1 OR . 1 1 7 7 TRP H H . . . 1 1 7 7 TRP HB2 H . . . . . 3.4 1.8 3.4 . . . . . A . 7 TRP H . . A . 7 TRP HB2 . . . 7 . HN . . . . . 7 . HB# . . c30057_5j6t 1 47 2 OR . 1 1 7 7 TRP H H . . . 1 1 7 7 TRP HB3 H . . . . . 3.4 1.8 3.4 . . . . . A . 7 TRP H . . A . 7 TRP HB3 . . . 7 . HN . . . . . 7 . HB# . . c30057_5j6t 1 48 1 . . 1 1 7 7 TRP HD1 H . . . 1 1 7 7 TRP H H . . . . . 5.0 1.8 5.0 . . . . . A . 7 TRP HD1 . . A . 7 TRP H . . . 7 . HD# . . . . . 7 . HN . . c30057_5j6t 1 49 1 OR . 1 1 7 7 TRP H H . . . 1 1 7 7 TRP HB2 H . . . . . 5.0 1.8 5.0 . . . . . A . 7 TRP H . . A . 7 TRP HB2 . . . 7 . HN . . . . . 7 . HB# . . c30057_5j6t 1 49 2 OR . 1 1 7 7 TRP H H . . . 1 1 7 7 TRP HB3 H . . . . . 5.0 1.8 5.0 . . . . . A . 7 TRP H . . A . 7 TRP HB3 . . . 7 . HN . . . . . 7 . HB# . . c30057_5j6t 1 50 1 OR . 1 1 7 7 TRP H H . . . 1 1 4 4 GLY HA2 H . . . . . 4.5 1.8 4.5 . . . . . A . 7 TRP H . . A . 4 GLY HA2 . . . 7 . HN . . . . . 4 . HA# . . c30057_5j6t 1 50 2 OR . 1 1 4 4 GLY HA3 H . . . 1 1 7 7 TRP H H . . . . . 4.5 1.8 4.5 . . . . . A . 4 GLY HA3 . . A . 7 TRP H . . . 4 . HA# . . . . . 7 . HN . . c30057_5j6t 1 51 1 . . 1 1 3 3 PHE HA H . . . 1 1 7 7 TRP H H . . . . . 4.5 1.8 4.5 . . . . . A . 3 PHE HA . . A . 7 TRP H . . . 3 . HA . . . . . 7 . HN . . c30057_5j6t 1 52 1 OR . 1 1 7 7 TRP H H . . . 1 1 6 6 ILE HG12 H . . . . . 5.0 1.8 5.0 . . . . . A . 7 TRP H . . A . 6 ILE HG12 . . . 7 . HN . . . . . 6 . HG1# . . c30057_5j6t 1 52 2 OR . 1 1 6 6 ILE HG13 H . . . 1 1 7 7 TRP H H . . . . . 5.0 1.8 5.0 . . . . . A . 6 ILE HG13 . . A . 7 TRP H . . . 6 . HG1# . . . . . 7 . HN . . c30057_5j6t 1 53 1 OR . 1 1 10 10 ALA MB H . . . 1 1 7 7 TRP HZ3 H . . . . . 5.0 1.8 5.0 . . . . . A . 10 ALA MB . . A . 7 TRP HZ3 . . . 10 . HB# . . . . . 7 . HZ# . . c30057_5j6t 1 53 2 OR . 1 1 7 7 TRP HZ2 H . . . 1 1 10 10 ALA MB H . . . . . 5.0 1.8 5.0 . . . . . A . 7 TRP HZ2 . . A . 10 ALA MB . . . 7 . HZ# . . . . . 10 . HB# . . c30057_5j6t 1 54 1 . . 1 1 7 7 TRP HH2 H . . . 1 1 11 11 LEU HG H . . . . . 5.0 1.8 5.0 . . . . . A . 7 TRP HH2 . . A . 11 LEU HG . . . 7 . HH2 . . . . . 11 . HG# . . c30057_5j6t 1 55 1 . . 1 1 9 9 LEU H H . . . 1 1 8 8 PRO HA H . . . . . 3.5 1.8 3.5 . . . . . A . 9 LEU H . . A . 8 PRO HA . . . 9 . HN . . . . . 8 . HA . . c30057_5j6t 1 56 1 OR . 1 1 9 9 LEU HA H . . . 1 1 9 9 LEU HB2 H . . . . . 3.4 1.8 3.4 . . . . . A . 9 LEU HA . . A . 9 LEU HB2 . . . 9 . HA . . . . . 9 . HB# . . c30057_5j6t 1 56 2 OR . 1 1 9 9 LEU HA H . . . 1 1 9 9 LEU HB3 H . . . . . 3.4 1.8 3.4 . . . . . A . 9 LEU HA . . A . 9 LEU HB3 . . . 9 . HA . . . . . 9 . HB# . . c30057_5j6t 1 57 1 . . 1 1 9 9 LEU HA H . . . 1 1 9 9 LEU HG H . . . . . 5.0 1.8 5.0 . . . . . A . 9 LEU HA . . A . 9 LEU HG . . . 9 . HA . . . . . 9 . HG . . c30057_5j6t 1 58 1 . . 1 1 9 9 LEU H H . . . 1 1 9 9 LEU HA H . . . . . 3.4 1.8 3.4 . . . . . A . 9 LEU H . . A . 9 LEU HA . . . 9 . HN . . . . . 9 . HA . . c30057_5j6t 1 59 1 OR . 1 1 9 9 LEU H H . . . 1 1 9 9 LEU HB2 H . . . . . 3.4 1.8 3.4 . . . . . A . 9 LEU H . . A . 9 LEU HB2 . . . 9 . HN . . . . . 9 . HB# . . c30057_5j6t 1 59 2 OR . 1 1 9 9 LEU H H . . . 1 1 9 9 LEU HB3 H . . . . . 3.4 1.8 3.4 . . . . . A . 9 LEU H . . A . 9 LEU HB3 . . . 9 . HN . . . . . 9 . HB# . . c30057_5j6t 1 60 1 . . 1 1 9 9 LEU H H . . . 1 1 9 9 LEU HG H . . . . . 5.0 1.8 5.0 . . . . . A . 9 LEU H . . A . 9 LEU HG . . . 9 . HN . . . . . 9 . HG . . c30057_5j6t 1 61 1 . . 1 1 10 10 ALA MB H . . . 1 1 9 9 LEU H H . . . . . 5.0 1.8 5.0 . . . . . A . 10 ALA MB . . A . 9 LEU H . . . 10 . HB# . . . . . 9 . HN . . c30057_5j6t 1 62 1 OR . 1 1 9 9 LEU HG H . . . 1 1 9 9 LEU HB2 H . . . . . 5.0 1.8 5.0 . . . . . A . 9 LEU HG . . A . 9 LEU HB2 . . . 9 . HG . . . . . 9 . HB# . . c30057_5j6t 1 62 2 OR . 1 1 9 9 LEU HB3 H . . . 1 1 9 9 LEU HG H . . . . . 5.0 1.8 5.0 . . . . . A . 9 LEU HB3 . . A . 9 LEU HG . . . 9 . HB# . . . . . 9 . HG . . c30057_5j6t 1 63 1 . . 1 1 6 6 ILE HA H . . . 1 1 9 9 LEU H H . . . . . 3.5 1.8 3.5 . . . . . A . 6 ILE HA . . A . 9 LEU H . . . 6 . HA . . . . . 9 . HN . . c30057_5j6t 1 64 1 . . 1 1 7 7 TRP HA H . . . 1 1 10 10 ALA H H . . . . . 3.5 1.8 3.5 . . . . . A . 7 TRP HA . . A . 10 ALA H . . . 7 . HA . . . . . 10 . HN . . c30057_5j6t 1 65 1 . . 1 1 9 9 LEU HA H . . . 1 1 10 10 ALA H H . . . . . 4.5 1.8 4.5 . . . . . A . 9 LEU HA . . A . 10 ALA H . . . 9 . HA . . . . . 10 . HN . . c30057_5j6t 1 66 1 OR . 1 1 10 10 ALA H H . . . 1 1 9 9 LEU HB2 H . . . . . 5.0 1.8 5.0 . . . . . A . 10 ALA H . . A . 9 LEU HB2 . . . 10 . HN . . . . . 9 . HB# . . c30057_5j6t 1 66 2 OR . 1 1 9 9 LEU HB3 H . . . 1 1 10 10 ALA H H . . . . . 5.0 1.8 5.0 . . . . . A . 9 LEU HB3 . . A . 10 ALA H . . . 9 . HB# . . . . . 10 . HN . . c30057_5j6t 1 67 1 . . 1 1 9 9 LEU H H . . . 1 1 10 10 ALA H H . . . . . 4.5 1.8 4.5 . . . . . A . 9 LEU H . . A . 10 ALA H . . . 9 . HN . . . . . 10 . HN . . c30057_5j6t 1 68 1 . . 1 1 10 10 ALA MB H . . . 1 1 10 10 ALA HA H . . . . . 4.0 1.8 4.0 . . . . . A . 10 ALA MB . . A . 10 ALA HA . . . 10 . HB# . . . . . 10 . HA . . c30057_5j6t 1 69 1 . . 1 1 10 10 ALA H H . . . 1 1 10 10 ALA HA H . . . . . 3.4 1.8 3.4 . . . . . A . 10 ALA H . . A . 10 ALA HA . . . 10 . HN . . . . . 10 . HA . . c30057_5j6t 1 70 1 . . 1 1 10 10 ALA MB H . . . 1 1 10 10 ALA H H . . . . . 3.4 1.8 3.4 . . . . . A . 10 ALA MB . . A . 10 ALA H . . . 10 . HB# . . . . . 10 . HN . . c30057_5j6t 1 71 1 . . 1 1 6 6 ILE HA H . . . 1 1 10 10 ALA H H . . . . . 5.0 1.8 5.0 . . . . . A . 6 ILE HA . . A . 10 ALA H . . . 6 . HA . . . . . 10 . HN . . c30057_5j6t 1 72 1 . . 1 1 10 10 ALA HA H . . . 1 1 11 11 LEU H H . . . . . 3.5 1.8 3.5 . . . . . A . 10 ALA HA . . A . 11 LEU H . . . 10 . HA . . . . . 11 . HN . . c30057_5j6t 1 73 1 . . 1 1 10 10 ALA H H . . . 1 1 11 11 LEU H H . . . . . 3.5 1.8 3.5 . . . . . A . 10 ALA H . . A . 11 LEU H . . . 10 . HN . . . . . 11 . HN . . c30057_5j6t 1 74 1 . . 1 1 10 10 ALA MB H . . . 1 1 11 11 LEU H H . . . . . 4.0 1.8 4.0 . . . . . A . 10 ALA MB . . A . 11 LEU H . . . 10 . HB# . . . . . 11 . HN . . c30057_5j6t 1 75 1 . . 1 1 11 11 LEU HA H . . . 1 1 11 11 LEU HG H . . . . . 5.0 1.8 5.0 . . . . . A . 11 LEU HA . . A . 11 LEU HG . . . 11 . HA . . . . . 11 . HG . . c30057_5j6t 1 76 1 . . 1 1 11 11 LEU H H . . . 1 1 11 11 LEU HA H . . . . . 3.4 1.8 3.4 . . . . . A . 11 LEU H . . A . 11 LEU HA . . . 11 . HN . . . . . 11 . HA . . c30057_5j6t 1 77 1 OR . 1 1 11 11 LEU H H . . . 1 1 11 11 LEU HB2 H . . . . . 5.0 1.8 5.0 . . . . . A . 11 LEU H . . A . 11 LEU HB2 . . . 11 . HN . . . . . 11 . HB# . . c30057_5j6t 1 77 2 OR . 1 1 11 11 LEU H H . . . 1 1 11 11 LEU HB3 H . . . . . 5.0 1.8 5.0 . . . . . A . 11 LEU H . . A . 11 LEU HB3 . . . 11 . HN . . . . . 11 . HB# . . c30057_5j6t 1 78 1 . . 1 1 11 11 LEU H H . . . 1 1 11 11 LEU HG H . . . . . 5.0 1.8 5.0 . . . . . A . 11 LEU H . . A . 11 LEU HG . . . 11 . HN . . . . . 11 . HG . . c30057_5j6t 1 79 1 . . 1 1 10 10 ALA MB H . . . 1 1 11 11 LEU HA H . . . . . 5.0 1.8 5.0 . . . . . A . 10 ALA MB . . A . 11 LEU HA . . . 10 . HB# . . . . . 11 . HA . . c30057_5j6t 1 80 1 . . 1 1 9 9 LEU HA H . . . 1 1 11 11 LEU H H . . . . . 4.5 -0.2 4.5 . . . . . A . 9 LEU HA . . A . 11 LEU H . . . 9 . HA . . . . . 11 . HN . . c30057_5j6t 1 81 1 . . 1 1 9 9 LEU HA H . . . 1 1 12 12 GLY H H . . . . . 3.4 1.8 3.4 . . . . . A . 9 LEU HA . . A . 12 GLY H . . . 9 . HA . . . . . 12 . HN . . c30057_5j6t 1 82 1 . . 1 1 10 10 ALA HA H . . . 1 1 12 12 GLY H H . . . . . 5.0 1.8 5.0 . . . . . A . 10 ALA HA . . A . 12 GLY H . . . 10 . HA . . . . . 12 . HN . . c30057_5j6t 1 83 1 . . 1 1 11 11 LEU HA H . . . 1 1 12 12 GLY H H . . . . . 3.5 1.8 3.5 . . . . . A . 11 LEU HA . . A . 12 GLY H . . . 11 . HA . . . . . 12 . HN . . c30057_5j6t 1 84 1 . . 1 1 11 11 LEU HG H . . . 1 1 12 12 GLY H H . . . . . 5.0 1.8 5.0 . . . . . A . 11 LEU HG . . A . 12 GLY H . . . 11 . HG . . . . . 12 . HN . . c30057_5j6t 1 85 1 OR . 1 1 12 12 GLY H H . . . 1 1 12 12 GLY HA2 H . . . . . 4.4 1.8 4.4 . . . . . A . 12 GLY H . . A . 12 GLY HA2 . . . 12 . HN . . . . . 12 . HA# . . c30057_5j6t 1 85 2 OR . 1 1 12 12 GLY H H . . . 1 1 12 12 GLY HA3 H . . . . . 4.4 1.8 4.4 . . . . . A . 12 GLY H . . A . 12 GLY HA3 . . . 12 . HN . . . . . 12 . HA# . . c30057_5j6t 1 86 1 OR . 1 1 12 12 GLY H H . . . 1 1 11 11 LEU HB2 H . . . . . 5.0 1.8 5.0 . . . . . A . 12 GLY H . . A . 11 LEU HB2 . . . 12 . HN . . . . . 11 . HB# . . c30057_5j6t 1 86 2 OR . 1 1 11 11 LEU HB3 H . . . 1 1 12 12 GLY H H . . . . . 5.0 1.8 5.0 . . . . . A . 11 LEU HB3 . . A . 12 GLY H . . . 11 . HB# . . . . . 12 . HN . . c30057_5j6t 1 87 1 . . 1 1 13 13 ALA HA H . . . 1 1 13 13 ALA MB H . . . . . 4.0 1.8 4.0 . . . . . A . 13 ALA HA . . A . 13 ALA MB . . . 13 . HA . . . . . 13 . HB# . . c30057_5j6t 1 88 1 . . 1 1 13 13 ALA HA H . . . 1 1 13 13 ALA H H . . . . . 3.0 1.8 3.0 . . . . . A . 13 ALA HA . . A . 13 ALA H . . . 13 . HA . . . . . 13 . HN . . c30057_5j6t 1 89 1 . . 1 1 13 13 ALA MB H . . . 1 1 13 13 ALA H H . . . . . 3.5 1.8 3.5 . . . . . A . 13 ALA MB . . A . 13 ALA H . . . 13 . HB# . . . . . 13 . HN . . c30057_5j6t 1 90 1 . . 1 1 10 10 ALA HA H . . . 1 1 13 13 ALA H H . . . . . 3.7 1.8 3.7 . . . . . A . 10 ALA HA . . A . 13 ALA H . . . 10 . HA . . . . . 13 . HN . . c30057_5j6t 1 91 1 . . 1 1 11 11 LEU HA H . . . 1 1 13 13 ALA H H . . . . . 4.5 1.8 4.5 . . . . . A . 11 LEU HA . . A . 13 ALA H . . . 11 . HA . . . . . 13 . HN . . c30057_5j6t 1 92 1 . . 1 1 9 9 LEU HA H . . . 1 1 13 13 ALA H H . . . . . 4.5 1.8 4.5 . . . . . A . 9 LEU HA . . A . 13 ALA H . . . 9 . HA . . . . . 13 . HN . . c30057_5j6t 1 93 1 OR . 1 1 13 13 ALA H H . . . 1 1 12 12 GLY HA2 H . . . . . 3.5 1.8 3.5 . . . . . A . 13 ALA H . . A . 12 GLY HA2 . . . 13 . HN . . . . . 12 . HA# . . c30057_5j6t 1 93 2 OR . 1 1 12 12 GLY HA3 H . . . 1 1 13 13 ALA H H . . . . . 3.5 1.8 3.5 . . . . . A . 12 GLY HA3 . . A . 13 ALA H . . . 12 . HA# . . . . . 13 . HN . . c30057_5j6t 1 94 1 . . 1 1 13 13 ALA HA H . . . 1 1 14 14 LEU H H . . . . . 3.5 1.8 3.5 . . . . . A . 13 ALA HA . . A . 14 LEU H . . . 13 . HA . . . . . 14 . HN . . c30057_5j6t 1 95 1 . . 1 1 13 13 ALA MB H . . . 1 1 14 14 LEU H H . . . . . 5.0 1.8 5.0 . . . . . A . 13 ALA MB . . A . 14 LEU H . . . 13 . HB# . . . . . 14 . HN . . c30057_5j6t 1 96 1 . . 1 1 13 13 ALA H H . . . 1 1 14 14 LEU H H . . . . . 4.2 1.8 4.2 . . . . . A . 13 ALA H . . A . 14 LEU H . . . 13 . HN . . . . . 14 . HN . . c30057_5j6t 1 97 1 . . 1 1 14 14 LEU HA H . . . 1 1 14 14 LEU HG H . . . . . 4.0 1.8 4.0 . . . . . A . 14 LEU HA . . A . 14 LEU HG . . . 14 . HA . . . . . 14 . HG . . c30057_5j6t 1 98 1 . . 1 1 14 14 LEU HG H . . . 1 1 14 14 LEU HB3 H . . . . . 3.0 1.8 3.0 . . . . . A . 14 LEU HG . . A . 14 LEU HB3 . . . 14 . HG . . . . . 14 . HB1 . . c30057_5j6t 1 99 1 . . 1 1 14 14 LEU H H . . . 1 1 14 14 LEU HA H . . . . . 3.4 1.8 3.4 . . . . . A . 14 LEU H . . A . 14 LEU HA . . . 14 . HN . . . . . 14 . HA . . c30057_5j6t 1 100 1 . . 1 1 14 14 LEU H H . . . 1 1 14 14 LEU HG H . . . . . 5.0 1.8 5.0 . . . . . A . 14 LEU H . . A . 14 LEU HG . . . 14 . HN . . . . . 14 . HG . . c30057_5j6t 1 101 1 . . 1 1 14 14 LEU HA H . . . 1 1 17 17 LEU MD2 H . . . . . 5.0 1.8 5.0 . . . . . A . 14 LEU HA . . A . 17 LEU MD2 . . . 14 . HA . . . . . 17 . HD2# . . c30057_5j6t 1 102 1 OR . 1 1 15 15 LYS H H . . . 1 1 12 12 GLY HA2 H . . . . . 4.0 1.8 4.0 . . . . . A . 15 LYS H . . A . 12 GLY HA2 . . . 15 . HN . . . . . 12 . HA# . . c30057_5j6t 1 102 2 OR . 1 1 12 12 GLY HA3 H . . . 1 1 15 15 LYS H H . . . . . 4.0 1.8 4.0 . . . . . A . 12 GLY HA3 . . A . 15 LYS H . . . 12 . HA# . . . . . 15 . HN . . c30057_5j6t 1 103 1 OR . 1 1 14 14 LEU HB2 H . . . 1 1 15 15 LYS HE2 H . . . . . 5.0 1.8 5.0 . . . . . A . 14 LEU HB2 . . A . 15 LYS HE2 . . . 14 . HB# . . . . . 15 . HE# . . c30057_5j6t 1 103 2 OR . 1 1 14 14 LEU HB3 H . . . 1 1 15 15 LYS HE2 H . . . . . 5.0 1.8 5.0 . . . . . A . 14 LEU HB3 . . A . 15 LYS HE2 . . . 14 . HB# . . . . . 15 . HE# . . c30057_5j6t 1 103 3 OR . 1 1 15 15 LYS HE3 H . . . 1 1 14 14 LEU HB3 H . . . . . 5.0 1.8 5.0 . . . . . A . 15 LYS HE3 . . A . 14 LEU HB3 . . . 15 . HE# . . . . . 14 . HB# . . c30057_5j6t 1 103 4 OR . 1 1 15 15 LYS HE3 H . . . 1 1 14 14 LEU HB2 H . . . . . 5.0 1.8 5.0 . . . . . A . 15 LYS HE3 . . A . 14 LEU HB2 . . . 15 . HE# . . . . . 14 . HB# . . c30057_5j6t 1 104 1 . . 1 1 14 14 LEU HA H . . . 1 1 15 15 LYS H H . . . . . 4.5 1.8 4.5 . . . . . A . 14 LEU HA . . A . 15 LYS H . . . 14 . HA . . . . . 15 . HN . . c30057_5j6t 1 105 1 . . 1 1 13 13 ALA HA H . . . 1 1 15 15 LYS H H . . . . . 5.0 1.8 5.0 . . . . . A . 13 ALA HA . . A . 15 LYS H . . . 13 . HA . . . . . 15 . HN . . c30057_5j6t 1 106 1 OR . 1 1 15 15 LYS HA H . . . 1 1 15 15 LYS HB2 H . . . . . 3.4 1.8 3.4 . . . . . A . 15 LYS HA . . A . 15 LYS HB2 . . . 15 . HA . . . . . 15 . HB# . . c30057_5j6t 1 106 2 OR . 1 1 15 15 LYS HA H . . . 1 1 15 15 LYS HB3 H . . . . . 3.4 1.8 3.4 . . . . . A . 15 LYS HA . . A . 15 LYS HB3 . . . 15 . HA . . . . . 15 . HB# . . c30057_5j6t 1 107 1 OR . 1 1 15 15 LYS HB3 H . . . 1 1 15 15 LYS HE2 H . . . . . 3.4 1.8 3.4 . . . . . A . 15 LYS HB3 . . A . 15 LYS HE2 . . . 15 . HB# . . . . . 15 . HE# . . c30057_5j6t 1 107 2 OR . 1 1 15 15 LYS HB2 H . . . 1 1 15 15 LYS HE2 H . . . . . 3.4 1.8 3.4 . . . . . A . 15 LYS HB2 . . A . 15 LYS HE2 . . . 15 . HB# . . . . . 15 . HE# . . c30057_5j6t 1 107 3 OR . 1 1 15 15 LYS HE3 H . . . 1 1 15 15 LYS HB2 H . . . . . 3.4 1.8 3.4 . . . . . A . 15 LYS HE3 . . A . 15 LYS HB2 . . . 15 . HE# . . . . . 15 . HB# . . c30057_5j6t 1 107 4 OR . 1 1 15 15 LYS HE3 H . . . 1 1 15 15 LYS HB3 H . . . . . 3.4 1.8 3.4 . . . . . A . 15 LYS HE3 . . A . 15 LYS HB3 . . . 15 . HE# . . . . . 15 . HB# . . c30057_5j6t 1 108 1 OR . 1 1 15 15 LYS HD2 H . . . 1 1 15 15 LYS HE2 H . . . . . 3.4 1.8 3.4 . . . . . A . 15 LYS HD2 . . A . 15 LYS HE2 . . . 15 . HD# . . . . . 15 . HE# . . c30057_5j6t 1 108 2 OR . 1 1 15 15 LYS HD3 H . . . 1 1 15 15 LYS HE2 H . . . . . 3.4 1.8 3.4 . . . . . A . 15 LYS HD3 . . A . 15 LYS HE2 . . . 15 . HD# . . . . . 15 . HE# . . c30057_5j6t 1 108 3 OR . 1 1 15 15 LYS HE3 H . . . 1 1 15 15 LYS HD2 H . . . . . 3.4 1.8 3.4 . . . . . A . 15 LYS HE3 . . A . 15 LYS HD2 . . . 15 . HE# . . . . . 15 . HD# . . c30057_5j6t 1 108 4 OR . 1 1 15 15 LYS HE3 H . . . 1 1 15 15 LYS HD3 H . . . . . 3.4 1.8 3.4 . . . . . A . 15 LYS HE3 . . A . 15 LYS HD3 . . . 15 . HE# . . . . . 15 . HD# . . c30057_5j6t 1 109 1 OR . 1 1 15 15 LYS HA H . . . 1 1 15 15 LYS HG2 H . . . . . 5.0 1.8 5.0 . . . . . A . 15 LYS HA . . A . 15 LYS HG2 . . . 15 . HA . . . . . 15 . HG# . . c30057_5j6t 1 109 2 OR . 1 1 15 15 LYS HA H . . . 1 1 15 15 LYS HG3 H . . . . . 5.0 1.8 5.0 . . . . . A . 15 LYS HA . . A . 15 LYS HG3 . . . 15 . HA . . . . . 15 . HG# . . c30057_5j6t 1 110 1 . . 1 1 15 15 LYS H H . . . 1 1 15 15 LYS HA H . . . . . 3.0 1.8 3.0 . . . . . A . 15 LYS H . . A . 15 LYS HA . . . 15 . HN . . . . . 15 . HA . . c30057_5j6t 1 111 1 OR . 1 1 15 15 LYS H H . . . 1 1 15 15 LYS HB2 H . . . . . 5.0 1.8 5.0 . . . . . A . 15 LYS H . . A . 15 LYS HB2 . . . 15 . HN . . . . . 15 . HB# . . c30057_5j6t 1 111 2 OR . 1 1 15 15 LYS H H . . . 1 1 15 15 LYS HB3 H . . . . . 5.0 1.8 5.0 . . . . . A . 15 LYS H . . A . 15 LYS HB3 . . . 15 . HN . . . . . 15 . HB# . . c30057_5j6t 1 112 1 OR . 1 1 15 15 LYS H H . . . 1 1 15 15 LYS HD2 H . . . . . 5.0 1.8 5.0 . . . . . A . 15 LYS H . . A . 15 LYS HD2 . . . 15 . HN . . . . . 15 . HD# . . c30057_5j6t 1 112 2 OR . 1 1 15 15 LYS H H . . . 1 1 15 15 LYS HD3 H . . . . . 5.0 1.8 5.0 . . . . . A . 15 LYS H . . A . 15 LYS HD3 . . . 15 . HN . . . . . 15 . HD# . . c30057_5j6t 1 113 1 . . 1 1 14 14 LEU H H . . . 1 1 15 15 LYS H H . . . . . 3.4 1.8 3.4 . . . . . A . 14 LEU H . . A . 15 LYS H . . . 14 . HN . . . . . 15 . HN . . c30057_5j6t 1 114 1 . . 1 1 13 13 ALA H H . . . 1 1 15 15 LYS H H . . . . . 4.5 1.8 4.5 . . . . . A . 13 ALA H . . A . 15 LYS H . . . 13 . HN . . . . . 15 . HN . . c30057_5j6t 1 115 1 . . 1 1 14 14 LEU HG H . . . 1 1 15 15 LYS H H . . . . . 3.4 1.8 3.4 . . . . . A . 14 LEU HG . . A . 15 LYS H . . . 14 . HG . . . . . 15 . HN . . c30057_5j6t 1 116 1 . . 1 1 13 13 ALA HA H . . . 1 1 16 16 ASN H H . . . . . 3.8 1.8 3.8 . . . . . A . 13 ALA HA . . A . 16 ASN H . . . 13 . HA . . . . . 16 . HN . . c30057_5j6t 1 117 1 . . 1 1 16 16 ASN H H . . . 1 1 16 16 ASN HA H . . . . . 3.5 1.8 3.5 . . . . . A . 16 ASN H . . A . 16 ASN HA . . . 16 . HN . . . . . 16 . HA . . c30057_5j6t 1 118 1 OR . 1 1 16 16 ASN H H . . . 1 1 16 16 ASN HB3 H . . . . . 3.4 1.8 3.4 . . . . . A . 16 ASN H . . A . 16 ASN HB3 . . . 16 . HN . . . . . 16 . HB# . . c30057_5j6t 1 118 2 OR . 1 1 16 16 ASN H H . . . 1 1 16 16 ASN HB2 H . . . . . 3.4 1.8 3.4 . . . . . A . 16 ASN H . . A . 16 ASN HB2 . . . 16 . HN . . . . . 16 . HB# . . c30057_5j6t 1 119 1 OR . 1 1 16 16 ASN H H . . . 1 1 15 15 LYS HB2 H . . . . . 5.0 1.8 5.0 . . . . . A . 16 ASN H . . A . 15 LYS HB2 . . . 16 . HN . . . . . 15 . HB# . . c30057_5j6t 1 119 2 OR . 1 1 15 15 LYS HB3 H . . . 1 1 16 16 ASN H H . . . . . 5.0 1.8 5.0 . . . . . A . 15 LYS HB3 . . A . 16 ASN H . . . 15 . HB# . . . . . 16 . HN . . c30057_5j6t 1 120 1 OR . 1 1 16 16 ASN H H . . . 1 1 12 12 GLY HA2 H . . . . . 4.5 1.8 4.5 . . . . . A . 16 ASN H . . A . 12 GLY HA2 . . . 16 . HN . . . . . 12 . HA# . . c30057_5j6t 1 120 2 OR . 1 1 12 12 GLY HA3 H . . . 1 1 16 16 ASN H H . . . . . 4.5 1.8 4.5 . . . . . A . 12 GLY HA3 . . A . 16 ASN H . . . 12 . HA# . . . . . 16 . HN . . c30057_5j6t 1 121 1 OR . 1 1 17 17 LEU HA H . . . 1 1 17 17 LEU HB2 H . . . . . 3.4 1.8 3.4 . . . . . A . 17 LEU HA . . A . 17 LEU HB2 . . . 17 . HA . . . . . 17 . HB# . . c30057_5j6t 1 121 2 OR . 1 1 17 17 LEU HA H . . . 1 1 17 17 LEU HB3 H . . . . . 3.4 1.8 3.4 . . . . . A . 17 LEU HA . . A . 17 LEU HB3 . . . 17 . HA . . . . . 17 . HB# . . c30057_5j6t 1 122 1 OR . 1 1 17 17 LEU MD2 H . . . 1 1 17 17 LEU HB2 H . . . . . 5.0 1.8 5.0 . . . . . A . 17 LEU MD2 . . A . 17 LEU HB2 . . . 17 . HD2# . . . . . 17 . HB# . . c30057_5j6t 1 122 2 OR . 1 1 17 17 LEU MD2 H . . . 1 1 17 17 LEU HB3 H . . . . . 5.0 1.8 5.0 . . . . . A . 17 LEU MD2 . . A . 17 LEU HB3 . . . 17 . HD2# . . . . . 17 . HB# . . c30057_5j6t 1 123 1 . . 1 1 17 17 LEU HA H . . . 1 1 17 17 LEU H H . . . . . 3.5 1.8 3.5 . . . . . A . 17 LEU HA . . A . 17 LEU H . . . 17 . HA . . . . . 17 . HN . . c30057_5j6t 1 124 1 . . 1 1 17 17 LEU MD2 H . . . 1 1 17 17 LEU HA H . . . . . 5.0 1.8 5.0 . . . . . A . 17 LEU MD2 . . A . 17 LEU HA . . . 17 . HD2# . . . . . 17 . HA . . c30057_5j6t 1 125 1 . . 1 1 14 14 LEU HA H . . . 1 1 17 17 LEU H H . . . . . 3.5 1.8 3.5 . . . . . A . 14 LEU HA . . A . 17 LEU H . . . 14 . HA . . . . . 17 . HN . . c30057_5j6t 1 126 1 . . 1 1 17 17 LEU H H . . . 1 1 17 17 LEU HG H . . . . . 4.5 1.8 4.5 . . . . . A . 17 LEU H . . A . 17 LEU HG . . . 17 . HN . . . . . 17 . HG . . c30057_5j6t 1 127 1 . . 1 1 16 16 ASN H H . . . 1 1 17 17 LEU H H . . . . . 4.0 1.8 4.0 . . . . . A . 16 ASN H . . A . 17 LEU H . . . 16 . HN . . . . . 17 . HN . . c30057_5j6t 1 128 1 . . 1 1 17 17 LEU HA H . . . 1 1 17 17 LEU HG H . . . . . 4.0 1.8 4.5 . . . . . A . 17 LEU HA . . A . 17 LEU HG . . . 17 . HA . . . . . 17 . HG . . c30057_5j6t 1 129 1 OR . 1 1 17 17 LEU HG H . . . 1 1 17 17 LEU HB2 H . . . . . 3.4 1.8 3.9 . . . . . A . 17 LEU HG . . A . 17 LEU HB2 . . . 17 . HG . . . . . 17 . HB# . . c30057_5j6t 1 129 2 OR . 1 1 17 17 LEU HB3 H . . . 1 1 17 17 LEU HG H . . . . . 3.4 1.8 3.9 . . . . . A . 17 LEU HB3 . . A . 17 LEU HG . . . 17 . HB# . . . . . 17 . HG . . c30057_5j6t 1 130 1 OR . 1 1 17 17 LEU H H . . . 1 1 17 17 LEU HB2 H . . . . . 3.4 1.8 3.9 . . . . . A . 17 LEU H . . A . 17 LEU HB2 . . . 17 . HN . . . . . 17 . HB# . . c30057_5j6t 1 130 2 OR . 1 1 17 17 LEU HB3 H . . . 1 1 17 17 LEU H H . . . . . 3.4 1.8 3.9 . . . . . A . 17 LEU HB3 . . A . 17 LEU H . . . 17 . HB# . . . . . 17 . HN . . c30057_5j6t 1 131 1 . . 1 1 14 14 LEU HA H . . . 1 1 18 18 ILE H H . . . . . 4.5 1.8 4.5 . . . . . A . 14 LEU HA . . A . 18 ILE H . . . 14 . HA . . . . . 18 . HN . . c30057_5j6t 1 132 1 . . 1 1 16 16 ASN HA H . . . 1 1 18 18 ILE H H . . . . . 4.5 1.8 4.5 . . . . . A . 16 ASN HA . . A . 18 ILE H . . . 16 . HA . . . . . 18 . HN . . c30057_5j6t 1 133 1 . . 1 1 15 15 LYS HA H . . . 1 1 18 18 ILE H H . . . . . 3.5 1.8 3.5 . . . . . A . 15 LYS HA . . A . 18 ILE H . . . 15 . HA . . . . . 18 . HN . . c30057_5j6t 1 134 1 . . 1 1 17 17 LEU HA H . . . 1 1 18 18 ILE H H . . . . . 3.5 1.8 3.5 . . . . . A . 17 LEU HA . . A . 18 ILE H . . . 17 . HA . . . . . 18 . HN . . c30057_5j6t 1 135 1 . . 1 1 17 17 LEU H H . . . 1 1 18 18 ILE H H . . . . . 4.0 1.8 4.0 . . . . . A . 17 LEU H . . A . 18 ILE H . . . 17 . HN . . . . . 18 . HN . . c30057_5j6t 1 136 1 . . 1 1 18 18 ILE H H . . . 1 1 18 18 ILE HA H . . . . . 3.4 1.8 3.4 . . . . . A . 18 ILE H . . A . 18 ILE HA . . . 18 . HN . . . . . 18 . HA . . c30057_5j6t 1 137 1 . . 1 1 16 16 ASN HB2 H . . . 1 1 18 18 ILE H H . . . . . 5.0 1.8 5.0 . . . . . A . 16 ASN HB2 . . A . 18 ILE H . . . 16 . HB2 . . . . . 18 . HN . . c30057_5j6t 1 138 1 OR . 1 1 18 18 ILE HA H . . . 1 1 18 18 ILE HG12 H . . . . . 5.0 1.8 5.0 . . . . . A . 18 ILE HA . . A . 18 ILE HG12 . . . 18 . HA . . . . . 18 . HG1# . . c30057_5j6t 1 138 2 OR . 1 1 18 18 ILE HA H . . . 1 1 18 18 ILE HG13 H . . . . . 5.0 1.8 5.0 . . . . . A . 18 ILE HA . . A . 18 ILE HG13 . . . 18 . HA . . . . . 18 . HG1# . . c30057_5j6t 1 139 1 . . 1 1 17 17 LEU MD2 H . . . 1 1 18 18 ILE H H . . . . . 5.0 1.8 5.0 . . . . . A . 17 LEU MD2 . . A . 18 ILE H . . . 17 . HD2# . . . . . 18 . HN . . c30057_5j6t 1 140 1 . . 1 1 18 18 ILE H H . . . 1 1 18 18 ILE HB H . . . . . 3.5 1.8 3.5 . . . . . A . 18 ILE H . . A . 18 ILE HB . . . 18 . HN . . . . . 18 . HB . . c30057_5j6t 1 141 1 . . 1 1 15 15 LYS HA H . . . 1 1 19 19 LYS H H . . . . . 5.0 1.8 5.0 . . . . . A . 15 LYS HA . . A . 19 LYS H . . . 15 . HA . . . . . 19 . HN . . c30057_5j6t 1 142 1 . . 1 1 18 18 ILE HA H . . . 1 1 19 19 LYS H H . . . . . 3.6 1.8 3.6 . . . . . A . 18 ILE HA . . A . 19 LYS H . . . 18 . HA . . . . . 19 . HN . . c30057_5j6t 1 143 1 . . 1 1 19 19 LYS H H . . . 1 1 18 18 ILE MD H . . . . . 5.0 1.8 5.0 . . . . . A . 19 LYS H . . A . 18 ILE MD . . . 19 . HN . . . . . 18 . HD1# . . c30057_5j6t 1 144 1 OR . 1 1 19 19 LYS H H . . . 1 1 18 18 ILE HG12 H . . . . . 5.0 1.8 5.0 . . . . . A . 19 LYS H . . A . 18 ILE HG12 . . . 19 . HN . . . . . 18 . HG1# . . c30057_5j6t 1 144 2 OR . 1 1 18 18 ILE HG13 H . . . 1 1 19 19 LYS H H . . . . . 5.0 1.8 5.0 . . . . . A . 18 ILE HG13 . . A . 19 LYS H . . . 18 . HG1# . . . . . 19 . HN . . c30057_5j6t 1 145 1 . . 1 1 19 19 LYS H H . . . 1 1 19 19 LYS HA H . . . . . 3.0 1.8 3.0 . . . . . A . 19 LYS H . . A . 19 LYS HA . . . 19 . HN . . . . . 19 . HA . . c30057_5j6t 1 146 1 OR . 1 1 19 19 LYS H H . . . 1 1 19 19 LYS HD2 H . . . . . 5.0 1.8 5.0 . . . . . A . 19 LYS H . . A . 19 LYS HD2 . . . 19 . HN . . . . . 19 . HD# . . c30057_5j6t 1 146 2 OR . 1 1 19 19 LYS H H . . . 1 1 19 19 LYS HD3 H . . . . . 5.0 1.8 5.0 . . . . . A . 19 LYS H . . A . 19 LYS HD3 . . . 19 . HN . . . . . 19 . HD# . . c30057_5j6t 1 147 1 OR . 1 1 19 19 LYS H H . . . 1 1 19 19 LYS HG2 H . . . . . 5.0 1.8 5.0 . . . . . A . 19 LYS H . . A . 19 LYS HG2 . . . 19 . HN . . . . . 19 . HG# . . c30057_5j6t 1 147 2 OR . 1 1 19 19 LYS H H . . . 1 1 19 19 LYS HG3 H . . . . . 5.0 1.8 5.0 . . . . . A . 19 LYS H . . A . 19 LYS HG3 . . . 19 . HN . . . . . 19 . HG# . . c30057_5j6t 1 148 1 OR . 1 1 19 19 LYS HE3 H . . . 1 1 19 19 LYS HG2 H . . . . . 3.4 1.8 3.4 . . . . . A . 19 LYS HE3 . . A . 19 LYS HG2 . . . 19 . HE# . . . . . 19 . HG# . . c30057_5j6t 1 148 2 OR . 1 1 19 19 LYS HG3 H . . . 1 1 19 19 LYS HE2 H . . . . . 3.4 1.8 3.4 . . . . . A . 19 LYS HG3 . . A . 19 LYS HE2 . . . 19 . HG# . . . . . 19 . HE# . . c30057_5j6t 1 148 3 OR . 1 1 19 19 LYS HG3 H . . . 1 1 19 19 LYS HE3 H . . . . . 3.4 1.8 3.4 . . . . . A . 19 LYS HG3 . . A . 19 LYS HE3 . . . 19 . HG# . . . . . 19 . HE# . . c30057_5j6t 1 148 4 OR . 1 1 19 19 LYS HE2 H . . . 1 1 19 19 LYS HG2 H . . . . . 3.4 1.8 3.4 . . . . . A . 19 LYS HE2 . . A . 19 LYS HG2 . . . 19 . HE# . . . . . 19 . HG# . . c30057_5j6t 1 149 1 . . 1 1 16 16 ASN HA H . . . 1 1 19 19 LYS H H . . . . . 3.5 1.8 3.5 . . . . . A . 16 ASN HA . . A . 19 LYS H . . . 16 . HA . . . . . 19 . HN . . c30057_5j6t 1 150 1 OR . 1 1 18 18 ILE HG13 H . . . 1 1 19 19 LYS HB2 H . . . . . 5.0 1.8 5.0 . . . . . A . 18 ILE HG13 . . A . 19 LYS HB2 . . . 18 . HG1# . . . . . 19 . HB# . . c30057_5j6t 1 150 2 OR . 1 1 18 18 ILE HG12 H . . . 1 1 19 19 LYS HB2 H . . . . . 5.0 1.8 5.0 . . . . . A . 18 ILE HG12 . . A . 19 LYS HB2 . . . 18 . HG1# . . . . . 19 . HB# . . c30057_5j6t 1 150 3 OR . 1 1 19 19 LYS HB3 H . . . 1 1 18 18 ILE HG12 H . . . . . 5.0 1.8 5.0 . . . . . A . 19 LYS HB3 . . A . 18 ILE HG12 . . . 19 . HB# . . . . . 18 . HG1# . . c30057_5j6t 1 150 4 OR . 1 1 18 18 ILE HG13 H . . . 1 1 19 19 LYS HB3 H . . . . . 5.0 1.8 5.0 . . . . . A . 18 ILE HG13 . . A . 19 LYS HB3 . . . 18 . HG1# . . . . . 19 . HB# . . c30057_5j6t 1 stop_ loop_ _Gen_dist_constraint_parse_err.ID _Gen_dist_constraint_parse_err.Content _Gen_dist_constraint_parse_err.Begin_line _Gen_dist_constraint_parse_err.Begin_column _Gen_dist_constraint_parse_err.End_line _Gen_dist_constraint_parse_err.End_column _Gen_dist_constraint_parse_err.Entry_ID _Gen_dist_constraint_parse_err.Gen_dist_constraint_list_ID 1 '# Restraints file 1: noe-hyAc.tbl' 1 1 1 33 c30057_5j6t 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 !aa1 2 1 2 6 c30057_5j6t 1 2 noesy. 3 67 3 80 c30057_5j6t 1 3 ; noesy. !aa2 ; 4 67 5 6 c30057_5j6t 1 4 noesy.132 6 66 6 83 c30057_5j6t 1 5 noesy.141 7 68 7 83 c30057_5j6t 1 6 noesy.154 8 68 8 83 c30057_5j6t 1 7 noesy.202 9 68 9 83 c30057_5j6t 1 8 noesy.0 10 66 10 81 c30057_5j6t 1 9 noesy.67 11 66 11 82 c30057_5j6t 1 10 noesy.68 12 68 12 82 c30057_5j6t 1 11 noesy.103 13 68 13 83 c30057_5j6t 1 12 'noesy.146 carol' 14 68 14 89 c30057_5j6t 1 13 ; noesy.107 carol !aa3 ; 15 68 16 6 c30057_5j6t 1 14 noesy.17 17 66 17 83 c30057_5j6t 1 15 noesy.66 18 65 18 83 c30057_5j6t 1 16 noesy.1 19 66 19 82 c30057_5j6t 1 17 noesy.44 20 67 20 82 c30057_5j6t 1 18 noesy. 21 67 21 80 c30057_5j6t 1 19 'noesy504.194 &' 22 66 22 88 c30057_5j6t 1 20 ; noesy504. & !aa4 ; 23 66 24 6 c30057_5j6t 1 21 noesy.18 25 66 25 82 c30057_5j6t 1 22 noesy.2 26 67 26 81 c30057_5j6t 1 23 noesy.164 27 68 27 83 c30057_5j6t 1 24 noesy.48 28 67 28 82 c30057_5j6t 1 25 ; noesy.18 !aa5 ; 29 66 30 6 c30057_5j6t 1 26 noesy.26 31 67 31 82 c30057_5j6t 1 27 noesy. 32 66 32 80 c30057_5j6t 1 28 noesy.137 33 67 33 83 c30057_5j6t 1 29 noesy.9 34 66 34 81 c30057_5j6t 1 30 noesy.97 35 67 35 82 c30057_5j6t 1 31 noesy.97 36 65 36 82 c30057_5j6t 1 32 noesy.95 37 64 37 82 c30057_5j6t 1 33 'noesy.- ********' 38 65 38 90 c30057_5j6t 1 34 noesy.********** 39 65 39 90 c30057_5j6t 1 35 ; noesy aa6 ; 40 65 41 5 c30057_5j6t 1 36 noesy.16 42 66 42 82 c30057_5j6t 1 37 noesy. 43 67 43 80 c30057_5j6t 1 38 noesy. 44 67 44 80 c30057_5j6t 1 39 noesy.150 45 68 45 83 c30057_5j6t 1 40 noesy.203 46 68 46 83 c30057_5j6t 1 41 noesy.16 47 66 47 82 c30057_5j6t 1 42 noesy.92 48 66 48 82 c30057_5j6t 1 43 noesy.125 49 68 49 83 c30057_5j6t 1 44 noesy504.234 50 66 50 86 c30057_5j6t 1 45 ; noesy504.39** !aa7 ; 51 65 52 6 c30057_5j6t 1 46 noesy.72 53 67 53 82 c30057_5j6t 1 47 noesy.31 54 66 54 82 c30057_5j6t 1 48 noesy.184 55 66 55 83 c30057_5j6t 1 49 noesy.7 56 66 56 81 c30057_5j6t 1 50 noesy.49 57 67 57 82 c30057_5j6t 1 51 noesy.178 58 67 58 83 c30057_5j6t 1 52 noesy.50 59 67 59 82 c30057_5j6t 1 53 noesy.31 60 68 60 82 c30057_5j6t 1 54 noesy. 61 66 61 80 c30057_5j6t 1 55 noesy. 62 67 62 80 c30057_5j6t 1 56 noesy.74 63 69 63 82 c30057_5j6t 1 57 ; noesy.110 !aa8 !assign (resid 8 and name HA) (resid 8 and name HB#) 5.000 3.2 0.0 ! noesy.129 !assign (resid 8 and name HB2) (resid 6 and name HB) 5.00 3.2 0.0 ! noesy.193 !aa9 ; 64 69 68 6 c30057_5j6t 1 58 noesy.38 69 66 69 82 c30057_5j6t 1 59 noesy.136 70 67 70 83 c30057_5j6t 1 60 noesy.130 71 66 71 83 c30057_5j6t 1 61 noesy.12 72 66 72 82 c30057_5j6t 1 62 noesy.69 73 67 73 82 c30057_5j6t 1 63 noesy.70 74 66 74 82 c30057_5j6t 1 64 noesy.75 75 68 75 82 c30057_5j6t 1 65 noesy. 76 67 76 80 c30057_5j6t 1 66 ; noesy. !aa10 ; 77 66 78 7 c30057_5j6t 1 67 noesy.19 79 66 79 82 c30057_5j6t 1 68 noesy.29 80 67 80 82 c30057_5j6t 1 69 noesy.89 81 68 81 82 c30057_5j6t 1 70 noesy.177 82 67 82 83 c30057_5j6t 1 71 noesy.139 83 69 83 83 c30057_5j6t 1 72 noesy.5 84 68 84 81 c30057_5j6t 1 73 noesy.80 85 69 85 82 c30057_5j6t 1 74 ; noesy.19 !aa11 ; 86 67 87 7 c30057_5j6t 1 75 noesy.27 88 68 88 82 c30057_5j6t 1 76 noesy.218 89 68 89 83 c30057_5j6t 1 77 noesy.79 90 69 90 82 c30057_5j6t 1 78 noesy.155 91 68 91 83 c30057_5j6t 1 79 'noesy.3 ok' 92 68 92 86 c30057_5j6t 1 80 'noesy.106 ok' 93 69 93 86 c30057_5j6t 1 81 'noesy.104 ok' 94 68 94 86 c30057_5j6t 1 82 noesy.140 95 69 95 83 c30057_5j6t 1 83 ; noesy. !aa12 ; 96 67 97 7 c30057_5j6t 1 84 noesy.24 98 67 98 82 c30057_5j6t 1 85 noesy.37 99 68 99 82 c30057_5j6t 1 86 noesy.36 100 68 100 82 c30057_5j6t 1 87 'noesy.121 ok' 101 68 101 86 c30057_5j6t 1 88 noesy.13 102 69 102 82 c30057_5j6t 1 89 ; noesy. !aa13 ; 103 69 104 7 c30057_5j6t 1 90 noesy.138 105 69 105 83 c30057_5j6t 1 91 noesy.10 106 68 106 82 c30057_5j6t 1 92 noesy.96 107 69 107 82 c30057_5j6t 1 93 'noesy. ok' 108 68 108 83 c30057_5j6t 1 94 'noesy. ok' 109 68 109 83 c30057_5j6t 1 95 noesy. 110 67 110 80 c30057_5j6t 1 96 ; noesy. !aa14 ; 111 69 112 7 c30057_5j6t 1 97 noesy.20 113 69 113 82 c30057_5j6t 1 98 noesy.82 114 69 114 82 c30057_5j6t 1 99 noesy.182 115 69 115 83 c30057_5j6t 1 100 noesy.149 116 67 116 83 c30057_5j6t 1 101 noesy.208 117 69 117 83 c30057_5j6t 1 102 noesy.6 118 68 118 81 c30057_5j6t 1 103 noesy.105 119 68 119 83 c30057_5j6t 1 104 ; noesy.153 ALINE !aa15 ; 120 70 121 7 c30057_5j6t 1 105 ; noesy.28 !assign (resid 15 and name HN) (resid 13 and name HB#) 5.000 3.2 0.0 ! noesy.81 ok ; 122 70 123 99 c30057_5j6t 1 106 noesy.160 124 70 124 83 c30057_5j6t 1 107 noesy.30 125 68 125 82 c30057_5j6t 1 108 noesy.30 126 67 126 82 c30057_5j6t 1 109 noesy.133 127 69 127 83 c30057_5j6t 1 110 noesy.161 128 70 128 83 c30057_5j6t 1 111 noesy.158 129 70 129 83 c30057_5j6t 1 112 noesy.144 130 69 130 83 c30057_5j6t 1 113 noesy.4 131 68 131 81 c30057_5j6t 1 114 noesy.85 132 69 132 82 c30057_5j6t 1 115 noesy.84 133 69 133 82 c30057_5j6t 1 116 'noesy.210 ###' 134 68 134 87 c30057_5j6t 1 117 noesy.183 135 68 135 83 c30057_5j6t 1 118 ; noesy. !aa16 ; 136 68 137 7 c30057_5j6t 1 119 noesy.22 138 67 138 82 c30057_5j6t 1 120 noesy.8 139 68 139 81 c30057_5j6t 1 121 noesy.56 140 69 140 82 c30057_5j6t 1 122 'noesy.94 ok' 141 69 141 91 c30057_5j6t 1 123 ; noesy. !aa17 ; 142 69 143 7 c30057_5j6t 1 124 noesy.135 144 69 144 83 c30057_5j6t 1 125 noesy.206 145 71 145 84 c30057_5j6t 1 126 noesy.14 146 68 146 82 c30057_5j6t 1 127 noesy.145 147 70 147 83 c30057_5j6t 1 128 noesy.14 148 68 148 82 c30057_5j6t 1 129 noesy. 149 68 149 80 c30057_5j6t 1 130 noesy. 150 68 150 80 c30057_5j6t 1 131 noesy. 151 68 151 80 c30057_5j6t 1 132 noesy. 152 69 152 80 c30057_5j6t 1 133 ; noesy. !aa18 ; 153 69 154 7 c30057_5j6t 1 134 noesy.33 155 68 155 82 c30057_5j6t 1 135 noesy.25 156 68 156 82 c30057_5j6t 1 136 noesy.34 158 68 158 82 c30057_5j6t 1 137 'noesy.173 parei aqui' 159 68 159 94 c30057_5j6t 1 138 noesy.15 160 68 160 82 c30057_5j6t 1 139 'noesy.52 CAROL' 161 69 161 88 c30057_5j6t 1 140 'noesy.151 CAROL' 162 70 162 89 c30057_5j6t 1 141 'noesy.126 CAROL' 163 70 163 89 c30057_5j6t 1 142 ; noesy.91 CAROL !aa19 ; 164 68 165 7 c30057_5j6t 1 143 noesy.23 166 68 166 82 c30057_5j6t 1 144 noesy. 167 68 167 80 c30057_5j6t 1 145 noesy.124 168 70 168 83 c30057_5j6t 1 146 ; noesy.98 assign (resid 19 and name HE#) (resid 19 and name HD#) 5.000 3.2 0.0 ! noesy.159 assign (resid 19 and name HE#) (resid 19 and name HG#) 5.000 3.2 0.0 ! noesy.162 ; 169 70 171 91 c30057_5j6t 1 147 noesy.11 172 68 172 82 c30057_5j6t 1 148 noesy.93 173 69 173 82 c30057_5j6t 1 149 noesy.101 174 69 174 83 c30057_5j6t 1 150 noesy.157 175 70 175 83 c30057_5j6t 1 151 noesy. 176 69 176 80 c30057_5j6t 1 152 noesy. 177 71 177 79 c30057_5j6t 1 stop_ loop_ _Gen_dist_constraint_conv_err.ID _Gen_dist_constraint_conv_err.Gen_dist_constraint_parse_file_ID _Gen_dist_constraint_conv_err.Parse_file_constraint_ID _Gen_dist_constraint_conv_err.Conv_error_type _Gen_dist_constraint_conv_err.Conv_error_note _Gen_dist_constraint_conv_err.Entry_ID _Gen_dist_constraint_conv_err.Gen_dist_constraint_list_ID 1 2 1 1 "Not handling restraint 1, item 1, resonance(s) ' .1.HA#' (nmrStar names) not linked" c30057_5j6t 1 2 2 2 1 "Not handling restraint 2, item 1, resonance(s) ' .1.HA#' (nmrStar names) not linked" c30057_5j6t 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 c30057_5j6t _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 ANTIMICROBIAL PROTEIN 05-APR-16 5J6T *TITLE NMR STRUCTURES OF HYLIN-A1 ANALOGS: HYLIN-AC *COMPND MOL_ID: 1; *COMPND 2 MOLECULE: HYLIN-A1; *COMPND 3 CHAIN: A; *COMPND 4 SYNONYM: HY-A1; *COMPND 5 ENGINEERED: YES *SOURCE MOL_ID: 1; *SOURCE 2 SYNTHETIC: YES; *SOURCE 3 ORGANISM_SCIENTIFIC: HYPSIBOAS ALBOPUNCTATUS; *SOURCE 4 ORGANISM_COMMON: SPOTTED TREE FROG; *SOURCE 5 ORGANISM_TAXID: 279985 *KEYWDS HYLIN-A1 ANALOGUES, ANTIMICROBIAL PEPTIDES, DPC, ANTIMICROBIAL *KEYWDS 2 PROTEIN *EXPDTA SOLUTION NMR *NUMMDL 10 *AUTHOR E.CRUSCA JR.,C.O.MATOS,L.M.LIAO,A.L.OLIVEIRA *REVDAT 1 12-APR-17 5J6T 0' save_